USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=12 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 Set 1.1: A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot -38:sc= 0.057 USER MOD Single : A 44 MET CE :methyl 158:sc= -0.182 (180deg=-0.832) USER MOD Single : A 55 LYS NZ :NH3+ -165:sc= -0.0435 (180deg=-0.326) USER MOD Single : A 58 LYS NZ :NH3+ 165:sc= -0.0426 (180deg=-0.265) USER MOD Single : A 60 ASN : amide:sc= -0.528 K(o=-0.53,f=-0.0088) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 31:sc= 0.309 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : B 43 SER OG : rot -36:sc= 0.0484 USER MOD Single : B 44 MET CE :methyl 162:sc= -0.168 (180deg=-0.797) USER MOD Single : B 55 LYS NZ :NH3+ -164:sc= -0.0607 (180deg=-0.32) USER MOD Single : B 58 LYS NZ :NH3+ 167:sc= -0.0507 (180deg=-0.276) USER MOD Single : B 60 ASN : amide:sc= -0.577 K(o=-0.58,f=-0.0058) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 THR OG1 : rot 41:sc= 0.359 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 581 N SER A 43 13.896 -7.598 7.508 1.00 0.00 N ATOM 582 CA SER A 43 12.743 -8.081 6.757 1.00 0.00 C ATOM 583 C SER A 43 11.524 -8.200 7.664 1.00 0.00 C ATOM 584 O SER A 43 11.650 -8.520 8.846 1.00 0.00 O ATOM 585 CB SER A 43 13.053 -9.435 6.115 1.00 0.00 C ATOM 586 OG SER A 43 13.375 -10.405 7.096 1.00 0.00 O ATOM 0 HA SER A 43 12.522 -7.360 5.969 1.00 0.00 H new ATOM 0 HB2 SER A 43 12.193 -9.771 5.536 1.00 0.00 H new ATOM 0 HB3 SER A 43 13.885 -9.328 5.418 1.00 0.00 H new ATOM 0 HG SER A 43 13.904 -9.988 7.808 1.00 0.00 H new ATOM 592 N MET A 44 10.345 -7.946 7.105 1.00 0.00 N ATOM 593 CA MET A 44 9.111 -8.022 7.874 1.00 0.00 C ATOM 594 C MET A 44 8.058 -8.845 7.142 1.00 0.00 C ATOM 595 O MET A 44 7.652 -8.505 6.031 1.00 0.00 O ATOM 596 CB MET A 44 8.575 -6.617 8.153 1.00 0.00 C ATOM 597 CG MET A 44 9.463 -5.794 9.070 1.00 0.00 C ATOM 598 SD MET A 44 8.782 -4.159 9.414 1.00 0.00 S ATOM 599 CE MET A 44 7.234 -4.594 10.203 1.00 0.00 C ATOM 0 H MET A 44 10.220 -7.687 6.126 1.00 0.00 H new ATOM 0 HA MET A 44 9.333 -8.515 8.820 1.00 0.00 H new ATOM 0 HB2 MET A 44 8.457 -6.089 7.207 1.00 0.00 H new ATOM 0 HB3 MET A 44 7.584 -6.698 8.599 1.00 0.00 H new ATOM 0 HG2 MET A 44 9.604 -6.329 10.009 1.00 0.00 H new ATOM 0 HG3 MET A 44 10.447 -5.685 8.614 1.00 0.00 H new ATOM 0 HE1 MET A 44 6.887 -3.758 10.810 1.00 0.00 H new ATOM 0 HE2 MET A 44 6.489 -4.823 9.441 1.00 0.00 H new ATOM 0 HE3 MET A 44 7.382 -5.467 10.839 1.00 0.00 H new ATOM 609 N GLU A 45 7.623 -9.930 7.773 1.00 0.00 N ATOM 610 CA GLU A 45 6.613 -10.803 7.190 1.00 0.00 C ATOM 611 C GLU A 45 5.258 -10.105 7.146 1.00 0.00 C ATOM 612 O GLU A 45 4.933 -9.310 8.027 1.00 0.00 O ATOM 613 CB GLU A 45 6.506 -12.098 7.997 1.00 0.00 C ATOM 614 CG GLU A 45 7.845 -12.778 8.233 1.00 0.00 C ATOM 615 CD GLU A 45 7.715 -14.064 9.023 1.00 0.00 C ATOM 616 OE1 GLU A 45 7.523 -15.128 8.398 1.00 0.00 O ATOM 617 OE2 GLU A 45 7.806 -14.008 10.268 1.00 0.00 O ATOM 0 H GLU A 45 7.956 -10.226 8.691 1.00 0.00 H new ATOM 0 HA GLU A 45 6.914 -11.042 6.170 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.044 -11.880 8.960 1.00 0.00 H new ATOM 0 HB3 GLU A 45 5.844 -12.789 7.475 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.314 -12.992 7.272 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.506 -12.094 8.765 1.00 0.00 H new ATOM 624 N VAL A 46 4.472 -10.406 6.117 1.00 0.00 N ATOM 625 CA VAL A 46 3.153 -9.802 5.964 1.00 0.00 C ATOM 626 C VAL A 46 2.062 -10.868 5.869 1.00 0.00 C ATOM 627 O VAL A 46 2.253 -11.904 5.232 1.00 0.00 O ATOM 628 CB VAL A 46 3.089 -8.902 4.714 1.00 0.00 C ATOM 629 CG1 VAL A 46 4.066 -7.744 4.842 1.00 0.00 C ATOM 630 CG2 VAL A 46 3.373 -9.709 3.456 1.00 0.00 C ATOM 0 H VAL A 46 4.725 -11.063 5.379 1.00 0.00 H new ATOM 0 HA VAL A 46 2.981 -9.192 6.851 1.00 0.00 H new ATOM 0 HB VAL A 46 2.081 -8.494 4.635 1.00 0.00 H new ATOM 0 HG11 VAL A 46 4.008 -7.119 3.951 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.813 -7.149 5.720 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.079 -8.133 4.947 1.00 0.00 H new ATOM 0 HG21 VAL A 46 3.323 -9.055 2.585 1.00 0.00 H new ATOM 0 HG22 VAL A 46 4.368 -10.149 3.523 1.00 0.00 H new ATOM 0 HG23 VAL A 46 2.632 -10.502 3.357 1.00 0.00 H new ATOM 640 N PRO A 47 0.899 -10.631 6.509 1.00 0.00 N ATOM 641 CA PRO A 47 -0.220 -11.557 6.499 1.00 0.00 C ATOM 642 C PRO A 47 -1.324 -11.133 5.534 1.00 0.00 C ATOM 643 O PRO A 47 -1.335 -10.002 5.046 1.00 0.00 O ATOM 644 CB PRO A 47 -0.708 -11.442 7.939 1.00 0.00 C ATOM 645 CG PRO A 47 -0.447 -10.012 8.319 1.00 0.00 C ATOM 646 CD PRO A 47 0.585 -9.468 7.350 1.00 0.00 C ATOM 0 HA PRO A 47 0.056 -12.561 6.176 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.768 -11.685 8.018 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -0.173 -12.129 8.594 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -1.366 -9.428 8.270 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.083 -9.947 9.344 1.00 0.00 H new ATOM 0 HD2 PRO A 47 0.189 -8.641 6.762 1.00 0.00 H new ATOM 0 HD3 PRO A 47 1.468 -9.096 7.869 1.00 0.00 H new ATOM 654 N ALA A 48 -2.250 -12.047 5.261 1.00 0.00 N ATOM 655 CA ALA A 48 -3.362 -11.760 4.362 1.00 0.00 C ATOM 656 C ALA A 48 -4.502 -11.069 5.107 1.00 0.00 C ATOM 657 O ALA A 48 -4.690 -11.288 6.304 1.00 0.00 O ATOM 658 CB ALA A 48 -3.854 -13.038 3.699 1.00 0.00 C ATOM 0 H ALA A 48 -2.252 -12.991 5.649 1.00 0.00 H new ATOM 0 HA ALA A 48 -3.005 -11.082 3.586 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.684 -12.805 3.032 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -3.042 -13.486 3.126 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -4.189 -13.739 4.464 1.00 0.00 H new ATOM 664 N PRO A 49 -5.281 -10.222 4.407 1.00 0.00 N ATOM 665 CA PRO A 49 -6.400 -9.495 5.016 1.00 0.00 C ATOM 666 C PRO A 49 -7.599 -10.391 5.315 1.00 0.00 C ATOM 667 O PRO A 49 -8.201 -10.298 6.385 1.00 0.00 O ATOM 668 CB PRO A 49 -6.762 -8.455 3.957 1.00 0.00 C ATOM 669 CG PRO A 49 -6.346 -9.071 2.667 1.00 0.00 C ATOM 670 CD PRO A 49 -5.133 -9.904 2.973 1.00 0.00 C ATOM 0 HA PRO A 49 -6.125 -9.070 5.981 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.830 -8.236 3.965 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.242 -7.513 4.132 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.146 -9.685 2.253 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -6.116 -8.305 1.926 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.103 -10.807 2.363 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -4.211 -9.356 2.777 1.00 0.00 H new ATOM 678 N PHE A 50 -7.944 -11.257 4.366 1.00 0.00 N ATOM 679 CA PHE A 50 -9.080 -12.159 4.535 1.00 0.00 C ATOM 680 C PHE A 50 -8.867 -13.461 3.769 1.00 0.00 C ATOM 681 O PHE A 50 -8.076 -13.516 2.827 1.00 0.00 O ATOM 682 CB PHE A 50 -10.367 -11.479 4.062 1.00 0.00 C ATOM 683 CG PHE A 50 -10.287 -10.951 2.656 1.00 0.00 C ATOM 684 CD1 PHE A 50 -9.773 -9.690 2.404 1.00 0.00 C ATOM 685 CD2 PHE A 50 -10.723 -11.718 1.587 1.00 0.00 C ATOM 686 CE1 PHE A 50 -9.694 -9.203 1.113 1.00 0.00 C ATOM 687 CE2 PHE A 50 -10.647 -11.237 0.295 1.00 0.00 C ATOM 688 CZ PHE A 50 -10.131 -9.978 0.057 1.00 0.00 C ATOM 0 H PHE A 50 -7.456 -11.353 3.476 1.00 0.00 H new ATOM 0 HA PHE A 50 -9.168 -12.397 5.595 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.190 -12.191 4.128 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -10.603 -10.657 4.737 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -9.430 -9.080 3.226 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -11.127 -12.703 1.767 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -9.291 -8.218 0.930 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -10.991 -11.845 -0.529 1.00 0.00 H new ATOM 0 HZ PHE A 50 -10.069 -9.601 -0.953 1.00 0.00 H new ATOM 698 N ALA A 51 -9.580 -14.508 4.178 1.00 0.00 N ATOM 699 CA ALA A 51 -9.470 -15.809 3.527 1.00 0.00 C ATOM 700 C ALA A 51 -9.915 -15.724 2.071 1.00 0.00 C ATOM 701 O ALA A 51 -10.675 -14.830 1.700 1.00 0.00 O ATOM 702 CB ALA A 51 -10.292 -16.849 4.275 1.00 0.00 C ATOM 0 H ALA A 51 -10.239 -14.480 4.956 1.00 0.00 H new ATOM 0 HA ALA A 51 -8.424 -16.114 3.547 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.199 -17.814 3.776 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.928 -16.933 5.299 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -11.339 -16.546 4.286 1.00 0.00 H new ATOM 708 N GLY A 52 -9.443 -16.657 1.252 1.00 0.00 N ATOM 709 CA GLY A 52 -9.803 -16.651 -0.155 1.00 0.00 C ATOM 710 C GLY A 52 -9.094 -17.726 -0.950 1.00 0.00 C ATOM 711 O GLY A 52 -8.442 -18.601 -0.384 1.00 0.00 O ATOM 0 H GLY A 52 -8.821 -17.414 1.534 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.880 -16.787 -0.250 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.567 -15.676 -0.581 1.00 0.00 H new ATOM 715 N VAL A 53 -9.232 -17.659 -2.269 1.00 0.00 N ATOM 716 CA VAL A 53 -8.601 -18.628 -3.156 1.00 0.00 C ATOM 717 C VAL A 53 -7.798 -17.922 -4.243 1.00 0.00 C ATOM 718 O VAL A 53 -8.328 -17.083 -4.971 1.00 0.00 O ATOM 719 CB VAL A 53 -9.645 -19.550 -3.818 1.00 0.00 C ATOM 720 CG1 VAL A 53 -8.968 -20.566 -4.727 1.00 0.00 C ATOM 721 CG2 VAL A 53 -10.488 -20.247 -2.761 1.00 0.00 C ATOM 0 H VAL A 53 -9.777 -16.942 -2.748 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.933 -19.235 -2.545 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.305 -18.936 -4.431 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.723 -21.206 -5.183 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.415 -20.044 -5.508 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.281 -21.177 -4.142 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -11.219 -20.893 -3.247 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.843 -20.847 -2.119 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -11.007 -19.501 -2.159 1.00 0.00 H new ATOM 731 N VAL A 54 -6.518 -18.265 -4.347 1.00 0.00 N ATOM 732 CA VAL A 54 -5.648 -17.661 -5.347 1.00 0.00 C ATOM 733 C VAL A 54 -5.954 -18.207 -6.738 1.00 0.00 C ATOM 734 O VAL A 54 -5.564 -19.325 -7.076 1.00 0.00 O ATOM 735 CB VAL A 54 -4.161 -17.905 -5.024 1.00 0.00 C ATOM 736 CG1 VAL A 54 -3.271 -17.308 -6.104 1.00 0.00 C ATOM 737 CG2 VAL A 54 -3.813 -17.329 -3.661 1.00 0.00 C ATOM 0 H VAL A 54 -6.062 -18.957 -3.752 1.00 0.00 H new ATOM 0 HA VAL A 54 -5.840 -16.588 -5.329 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.986 -18.981 -4.998 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.225 -17.491 -5.856 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.503 -17.770 -7.063 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -3.446 -16.234 -6.167 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.759 -17.510 -3.448 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.005 -16.256 -3.660 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.425 -17.808 -2.897 1.00 0.00 H new ATOM 747 N LYS A 55 -6.654 -17.411 -7.538 1.00 0.00 N ATOM 748 CA LYS A 55 -7.012 -17.816 -8.893 1.00 0.00 C ATOM 749 C LYS A 55 -6.508 -16.808 -9.922 1.00 0.00 C ATOM 750 O LYS A 55 -6.611 -17.039 -11.127 1.00 0.00 O ATOM 751 CB LYS A 55 -8.530 -17.969 -9.016 1.00 0.00 C ATOM 752 CG LYS A 55 -9.104 -19.073 -8.143 1.00 0.00 C ATOM 753 CD LYS A 55 -10.604 -19.219 -8.347 1.00 0.00 C ATOM 754 CE LYS A 55 -11.172 -20.351 -7.507 1.00 0.00 C ATOM 755 NZ LYS A 55 -10.542 -21.659 -7.837 1.00 0.00 N ATOM 0 H LYS A 55 -6.985 -16.483 -7.273 1.00 0.00 H new ATOM 0 HA LYS A 55 -6.536 -18.776 -9.092 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -9.004 -17.024 -8.751 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -8.783 -18.172 -10.057 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -8.610 -20.017 -8.376 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -8.897 -18.855 -7.095 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -11.101 -18.285 -8.084 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -10.813 -19.406 -9.400 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -11.019 -20.131 -6.450 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -12.248 -20.416 -7.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -11.116 -22.431 -7.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -10.484 -21.765 -8.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -9.585 -21.696 -7.431 1.00 0.00 H new ATOM 769 N GLU A 56 -5.964 -15.692 -9.445 1.00 0.00 N ATOM 770 CA GLU A 56 -5.451 -14.656 -10.335 1.00 0.00 C ATOM 771 C GLU A 56 -4.530 -13.694 -9.591 1.00 0.00 C ATOM 772 O GLU A 56 -4.978 -12.909 -8.756 1.00 0.00 O ATOM 773 CB GLU A 56 -6.611 -13.885 -10.969 1.00 0.00 C ATOM 774 CG GLU A 56 -6.171 -12.838 -11.978 1.00 0.00 C ATOM 775 CD GLU A 56 -7.341 -12.109 -12.610 1.00 0.00 C ATOM 776 OE1 GLU A 56 -7.868 -12.603 -13.630 1.00 0.00 O ATOM 777 OE2 GLU A 56 -7.734 -11.046 -12.085 1.00 0.00 O ATOM 0 H GLU A 56 -5.867 -15.483 -8.451 1.00 0.00 H new ATOM 0 HA GLU A 56 -4.871 -15.143 -11.119 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.279 -14.592 -11.461 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.186 -13.398 -10.181 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -5.520 -12.115 -11.486 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -5.581 -13.317 -12.759 1.00 0.00 H new ATOM 784 N LEU A 57 -3.239 -13.763 -9.904 1.00 0.00 N ATOM 785 CA LEU A 57 -2.248 -12.898 -9.270 1.00 0.00 C ATOM 786 C LEU A 57 -1.974 -11.668 -10.130 1.00 0.00 C ATOM 787 O LEU A 57 -2.440 -11.576 -11.266 1.00 0.00 O ATOM 788 CB LEU A 57 -0.949 -13.671 -9.025 1.00 0.00 C ATOM 789 CG LEU A 57 -0.250 -14.190 -10.286 1.00 0.00 C ATOM 790 CD1 LEU A 57 0.717 -13.152 -10.837 1.00 0.00 C ATOM 791 CD2 LEU A 57 0.475 -15.494 -9.993 1.00 0.00 C ATOM 0 H LEU A 57 -2.854 -14.409 -10.593 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.647 -12.565 -8.312 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.257 -13.025 -8.485 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.167 -14.518 -8.375 1.00 0.00 H new ATOM 0 HG LEU A 57 -1.010 -14.379 -11.044 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.201 -13.544 -11.732 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.171 -12.243 -11.089 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.473 -12.925 -10.086 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.966 -15.849 -10.899 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.222 -15.329 -9.217 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.243 -16.241 -9.653 1.00 0.00 H new ATOM 803 N LYS A 58 -1.212 -10.727 -9.581 1.00 0.00 N ATOM 804 CA LYS A 58 -0.872 -9.503 -10.298 1.00 0.00 C ATOM 805 C LYS A 58 0.639 -9.259 -10.296 1.00 0.00 C ATOM 806 O LYS A 58 1.153 -8.502 -11.121 1.00 0.00 O ATOM 807 CB LYS A 58 -1.597 -8.312 -9.670 1.00 0.00 C ATOM 808 CG LYS A 58 -1.339 -6.994 -10.380 1.00 0.00 C ATOM 809 CD LYS A 58 -2.036 -5.838 -9.682 1.00 0.00 C ATOM 810 CE LYS A 58 -1.814 -4.528 -10.419 1.00 0.00 C ATOM 811 NZ LYS A 58 -2.367 -4.566 -11.800 1.00 0.00 N ATOM 0 H LYS A 58 -0.818 -10.789 -8.642 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.193 -9.617 -11.333 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.669 -8.510 -9.669 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -1.289 -8.219 -8.628 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -0.266 -6.804 -10.417 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.687 -7.061 -11.411 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.105 -6.043 -9.615 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.664 -5.750 -8.661 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.282 -3.715 -9.863 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -0.746 -4.312 -10.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -2.427 -3.598 -12.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -1.744 -5.136 -12.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.316 -4.990 -11.782 1.00 0.00 H new ATOM 825 N VAL A 59 1.348 -9.908 -9.375 1.00 0.00 N ATOM 826 CA VAL A 59 2.795 -9.747 -9.271 1.00 0.00 C ATOM 827 C VAL A 59 3.516 -11.091 -9.334 1.00 0.00 C ATOM 828 O VAL A 59 3.039 -12.089 -8.793 1.00 0.00 O ATOM 829 CB VAL A 59 3.188 -9.026 -7.966 1.00 0.00 C ATOM 830 CG1 VAL A 59 2.610 -7.620 -7.939 1.00 0.00 C ATOM 831 CG2 VAL A 59 2.728 -9.822 -6.753 1.00 0.00 C ATOM 0 H VAL A 59 0.944 -10.549 -8.692 1.00 0.00 H new ATOM 0 HA VAL A 59 3.102 -9.140 -10.123 1.00 0.00 H new ATOM 0 HB VAL A 59 4.275 -8.950 -7.929 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.898 -7.126 -7.011 1.00 0.00 H new ATOM 0 HG12 VAL A 59 2.994 -7.052 -8.786 1.00 0.00 H new ATOM 0 HG13 VAL A 59 1.523 -7.672 -8.001 1.00 0.00 H new ATOM 0 HG21 VAL A 59 3.015 -9.296 -5.842 1.00 0.00 H new ATOM 0 HG22 VAL A 59 1.644 -9.934 -6.781 1.00 0.00 H new ATOM 0 HG23 VAL A 59 3.195 -10.807 -6.766 1.00 0.00 H new ATOM 841 N ASN A 60 4.669 -11.107 -9.998 1.00 0.00 N ATOM 842 CA ASN A 60 5.462 -12.325 -10.133 1.00 0.00 C ATOM 843 C ASN A 60 6.609 -12.343 -9.124 1.00 0.00 C ATOM 844 O ASN A 60 7.109 -11.292 -8.720 1.00 0.00 O ATOM 845 CB ASN A 60 6.019 -12.443 -11.554 1.00 0.00 C ATOM 846 CG ASN A 60 4.973 -12.176 -12.623 1.00 0.00 C ATOM 847 OD1 ASN A 60 5.289 -11.654 -13.694 1.00 0.00 O ATOM 848 ND2 ASN A 60 3.723 -12.533 -12.345 1.00 0.00 N ATOM 0 H ASN A 60 5.075 -10.289 -10.452 1.00 0.00 H new ATOM 0 HA ASN A 60 4.810 -13.175 -9.933 1.00 0.00 H new ATOM 0 HB2 ASN A 60 6.843 -11.740 -11.675 1.00 0.00 H new ATOM 0 HB3 ASN A 60 6.429 -13.443 -11.696 1.00 0.00 H new ATOM 0 HD21 ASN A 60 2.984 -12.378 -13.030 1.00 0.00 H new ATOM 0 HD22 ASN A 60 3.503 -12.962 -11.446 1.00 0.00 H new ATOM 855 N VAL A 61 7.018 -13.544 -8.722 1.00 0.00 N ATOM 856 CA VAL A 61 8.106 -13.705 -7.762 1.00 0.00 C ATOM 857 C VAL A 61 9.359 -12.961 -8.214 1.00 0.00 C ATOM 858 O VAL A 61 9.842 -13.156 -9.330 1.00 0.00 O ATOM 859 CB VAL A 61 8.456 -15.192 -7.556 1.00 0.00 C ATOM 860 CG1 VAL A 61 9.477 -15.356 -6.439 1.00 0.00 C ATOM 861 CG2 VAL A 61 7.202 -16.003 -7.265 1.00 0.00 C ATOM 0 H VAL A 61 6.611 -14.421 -9.047 1.00 0.00 H new ATOM 0 HA VAL A 61 7.758 -13.283 -6.819 1.00 0.00 H new ATOM 0 HB VAL A 61 8.899 -15.569 -8.478 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.709 -16.413 -6.311 1.00 0.00 H new ATOM 0 HG12 VAL A 61 10.387 -14.813 -6.695 1.00 0.00 H new ATOM 0 HG13 VAL A 61 9.067 -14.959 -5.510 1.00 0.00 H new ATOM 0 HG21 VAL A 61 7.471 -17.050 -7.123 1.00 0.00 H new ATOM 0 HG22 VAL A 61 6.726 -15.624 -6.361 1.00 0.00 H new ATOM 0 HG23 VAL A 61 6.510 -15.917 -8.103 1.00 0.00 H new ATOM 871 N GLY A 62 9.881 -12.107 -7.337 1.00 0.00 N ATOM 872 CA GLY A 62 11.072 -11.343 -7.661 1.00 0.00 C ATOM 873 C GLY A 62 10.748 -9.937 -8.123 1.00 0.00 C ATOM 874 O GLY A 62 11.605 -9.244 -8.675 1.00 0.00 O ATOM 0 H GLY A 62 9.500 -11.931 -6.408 1.00 0.00 H new ATOM 0 HA2 GLY A 62 11.719 -11.295 -6.785 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.631 -11.859 -8.442 1.00 0.00 H new ATOM 878 N ASP A 63 9.509 -9.513 -7.896 1.00 0.00 N ATOM 879 CA ASP A 63 9.070 -8.181 -8.294 1.00 0.00 C ATOM 880 C ASP A 63 8.867 -7.285 -7.077 1.00 0.00 C ATOM 881 O ASP A 63 7.997 -7.537 -6.243 1.00 0.00 O ATOM 882 CB ASP A 63 7.774 -8.269 -9.101 1.00 0.00 C ATOM 883 CG ASP A 63 7.278 -6.908 -9.549 1.00 0.00 C ATOM 884 OD1 ASP A 63 7.697 -6.453 -10.634 1.00 0.00 O ATOM 885 OD2 ASP A 63 6.472 -6.299 -8.816 1.00 0.00 O ATOM 0 H ASP A 63 8.791 -10.074 -7.438 1.00 0.00 H new ATOM 0 HA ASP A 63 9.849 -7.741 -8.917 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.936 -8.899 -9.975 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.006 -8.752 -8.497 1.00 0.00 H new ATOM 890 N LYS A 64 9.684 -6.240 -6.986 1.00 0.00 N ATOM 891 CA LYS A 64 9.610 -5.292 -5.878 1.00 0.00 C ATOM 892 C LYS A 64 8.184 -4.794 -5.668 1.00 0.00 C ATOM 893 O LYS A 64 7.361 -4.822 -6.585 1.00 0.00 O ATOM 894 CB LYS A 64 10.541 -4.105 -6.138 1.00 0.00 C ATOM 895 CG LYS A 64 10.201 -3.327 -7.399 1.00 0.00 C ATOM 896 CD LYS A 64 11.198 -2.208 -7.647 1.00 0.00 C ATOM 897 CE LYS A 64 10.856 -1.427 -8.905 1.00 0.00 C ATOM 898 NZ LYS A 64 11.842 -0.345 -9.174 1.00 0.00 N ATOM 0 H LYS A 64 10.409 -6.027 -7.671 1.00 0.00 H new ATOM 0 HA LYS A 64 9.926 -5.810 -4.973 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.502 -3.430 -5.283 1.00 0.00 H new ATOM 0 HB3 LYS A 64 11.566 -4.468 -6.211 1.00 0.00 H new ATOM 0 HG2 LYS A 64 10.191 -4.003 -8.254 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.198 -2.910 -7.311 1.00 0.00 H new ATOM 0 HD2 LYS A 64 11.210 -1.534 -6.791 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.201 -2.626 -7.738 1.00 0.00 H new ATOM 0 HE2 LYS A 64 10.823 -2.107 -9.756 1.00 0.00 H new ATOM 0 HE3 LYS A 64 9.861 -0.994 -8.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 11.572 0.163 -10.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 11.856 0.319 -8.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 12.788 -0.760 -9.296 1.00 0.00 H new ATOM 912 N VAL A 65 7.901 -4.338 -4.453 1.00 0.00 N ATOM 913 CA VAL A 65 6.577 -3.833 -4.111 1.00 0.00 C ATOM 914 C VAL A 65 6.652 -2.379 -3.654 1.00 0.00 C ATOM 915 O VAL A 65 7.704 -1.912 -3.220 1.00 0.00 O ATOM 916 CB VAL A 65 5.927 -4.683 -3.000 1.00 0.00 C ATOM 917 CG1 VAL A 65 6.631 -4.461 -1.670 1.00 0.00 C ATOM 918 CG2 VAL A 65 4.442 -4.376 -2.884 1.00 0.00 C ATOM 0 H VAL A 65 8.573 -4.308 -3.686 1.00 0.00 H new ATOM 0 HA VAL A 65 5.963 -3.896 -5.010 1.00 0.00 H new ATOM 0 HB VAL A 65 6.035 -5.734 -3.269 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.156 -5.070 -0.901 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.679 -4.745 -1.762 1.00 0.00 H new ATOM 0 HG13 VAL A 65 6.562 -3.409 -1.393 1.00 0.00 H new ATOM 0 HG21 VAL A 65 4.005 -4.987 -2.094 1.00 0.00 H new ATOM 0 HG22 VAL A 65 4.306 -3.321 -2.644 1.00 0.00 H new ATOM 0 HG23 VAL A 65 3.949 -4.599 -3.830 1.00 0.00 H new ATOM 928 N LYS A 66 5.534 -1.670 -3.756 1.00 0.00 N ATOM 929 CA LYS A 66 5.479 -0.271 -3.351 1.00 0.00 C ATOM 930 C LYS A 66 4.161 0.043 -2.653 1.00 0.00 C ATOM 931 O LYS A 66 3.131 -0.565 -2.946 1.00 0.00 O ATOM 932 CB LYS A 66 5.663 0.640 -4.566 1.00 0.00 C ATOM 933 CG LYS A 66 7.034 0.518 -5.214 1.00 0.00 C ATOM 934 CD LYS A 66 7.165 1.422 -6.429 1.00 0.00 C ATOM 935 CE LYS A 66 6.269 0.962 -7.571 1.00 0.00 C ATOM 936 NZ LYS A 66 6.416 1.826 -8.775 1.00 0.00 N ATOM 0 H LYS A 66 4.654 -2.041 -4.115 1.00 0.00 H new ATOM 0 HA LYS A 66 6.290 -0.089 -2.646 1.00 0.00 H new ATOM 0 HB2 LYS A 66 4.898 0.405 -5.306 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.504 1.675 -4.262 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.804 0.773 -4.486 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.205 -0.517 -5.510 1.00 0.00 H new ATOM 0 HD2 LYS A 66 6.906 2.444 -6.152 1.00 0.00 H new ATOM 0 HD3 LYS A 66 8.203 1.435 -6.763 1.00 0.00 H new ATOM 0 HE2 LYS A 66 6.513 -0.068 -7.831 1.00 0.00 H new ATOM 0 HE3 LYS A 66 5.230 0.970 -7.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 5.790 1.480 -9.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.159 2.804 -8.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.402 1.798 -9.104 1.00 0.00 H new ATOM 950 N THR A 67 4.203 0.995 -1.725 1.00 0.00 N ATOM 951 CA THR A 67 3.014 1.395 -0.982 1.00 0.00 C ATOM 952 C THR A 67 1.914 1.881 -1.922 1.00 0.00 C ATOM 953 O THR A 67 2.098 2.849 -2.659 1.00 0.00 O ATOM 954 CB THR A 67 3.333 2.510 0.031 1.00 0.00 C ATOM 955 OG1 THR A 67 3.964 3.612 -0.633 1.00 0.00 O ATOM 956 CG2 THR A 67 4.237 1.993 1.139 1.00 0.00 C ATOM 0 H THR A 67 5.049 1.504 -1.470 1.00 0.00 H new ATOM 0 HA THR A 67 2.667 0.512 -0.445 1.00 0.00 H new ATOM 0 HB THR A 67 2.396 2.844 0.476 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.634 3.671 -1.554 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.448 2.799 1.842 1.00 0.00 H new ATOM 0 HG22 THR A 67 3.740 1.176 1.662 1.00 0.00 H new ATOM 0 HG23 THR A 67 5.171 1.633 0.708 1.00 0.00 H new ATOM 964 N GLY A 68 0.772 1.202 -1.889 1.00 0.00 N ATOM 965 CA GLY A 68 -0.342 1.577 -2.740 1.00 0.00 C ATOM 966 C GLY A 68 -0.475 0.679 -3.955 1.00 0.00 C ATOM 967 O GLY A 68 -1.340 0.896 -4.804 1.00 0.00 O ATOM 0 H GLY A 68 0.598 0.397 -1.287 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.265 1.539 -2.162 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.213 2.609 -3.067 1.00 0.00 H new ATOM 971 N SER A 69 0.383 -0.333 -4.037 1.00 0.00 N ATOM 972 CA SER A 69 0.357 -1.269 -5.155 1.00 0.00 C ATOM 973 C SER A 69 -0.284 -2.588 -4.741 1.00 0.00 C ATOM 974 O SER A 69 -0.137 -3.029 -3.601 1.00 0.00 O ATOM 975 CB SER A 69 1.775 -1.517 -5.675 1.00 0.00 C ATOM 976 OG SER A 69 2.360 -0.317 -6.150 1.00 0.00 O ATOM 0 H SER A 69 1.105 -0.526 -3.343 1.00 0.00 H new ATOM 0 HA SER A 69 -0.241 -0.828 -5.953 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.390 -1.935 -4.878 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.748 -2.255 -6.477 1.00 0.00 H new ATOM 0 HG SER A 69 3.266 -0.501 -6.475 1.00 0.00 H new ATOM 982 N LEU A 70 -0.994 -3.216 -5.673 1.00 0.00 N ATOM 983 CA LEU A 70 -1.660 -4.485 -5.401 1.00 0.00 C ATOM 984 C LEU A 70 -0.683 -5.649 -5.521 1.00 0.00 C ATOM 985 O LEU A 70 0.453 -5.476 -5.961 1.00 0.00 O ATOM 986 CB LEU A 70 -2.836 -4.689 -6.359 1.00 0.00 C ATOM 987 CG LEU A 70 -4.075 -3.837 -6.068 1.00 0.00 C ATOM 988 CD1 LEU A 70 -3.783 -2.361 -6.292 1.00 0.00 C ATOM 989 CD2 LEU A 70 -5.242 -4.286 -6.932 1.00 0.00 C ATOM 0 H LEU A 70 -1.123 -2.867 -6.623 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.037 -4.454 -4.379 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -2.498 -4.474 -7.373 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -3.125 -5.740 -6.335 1.00 0.00 H new ATOM 0 HG LEU A 70 -4.345 -3.974 -5.021 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -4.678 -1.777 -6.079 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -2.977 -2.045 -5.630 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.484 -2.202 -7.328 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -6.115 -3.671 -6.713 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.978 -4.180 -7.984 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.472 -5.330 -6.719 1.00 0.00 H new ATOM 1001 N ILE A 71 -1.134 -6.836 -5.126 1.00 0.00 N ATOM 1002 CA ILE A 71 -0.298 -8.029 -5.191 1.00 0.00 C ATOM 1003 C ILE A 71 -1.041 -9.198 -5.834 1.00 0.00 C ATOM 1004 O ILE A 71 -0.574 -9.774 -6.816 1.00 0.00 O ATOM 1005 CB ILE A 71 0.200 -8.448 -3.792 1.00 0.00 C ATOM 1006 CG1 ILE A 71 -0.943 -8.398 -2.773 1.00 0.00 C ATOM 1007 CG2 ILE A 71 1.350 -7.553 -3.352 1.00 0.00 C ATOM 1008 CD1 ILE A 71 -0.557 -8.900 -1.398 1.00 0.00 C ATOM 0 H ILE A 71 -2.072 -6.997 -4.758 1.00 0.00 H new ATOM 0 HA ILE A 71 0.562 -7.774 -5.810 1.00 0.00 H new ATOM 0 HB ILE A 71 0.561 -9.475 -3.847 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.297 -7.371 -2.688 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.777 -8.993 -3.146 1.00 0.00 H new ATOM 0 HG21 ILE A 71 1.692 -7.859 -2.363 1.00 0.00 H new ATOM 0 HG22 ILE A 71 2.171 -7.640 -4.063 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.011 -6.518 -3.314 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.417 -8.834 -0.732 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -0.231 -9.938 -1.468 1.00 0.00 H new ATOM 0 HD13 ILE A 71 0.256 -8.290 -1.003 1.00 0.00 H new ATOM 1020 N MET A 72 -2.202 -9.543 -5.281 1.00 0.00 N ATOM 1021 CA MET A 72 -3.000 -10.650 -5.801 1.00 0.00 C ATOM 1022 C MET A 72 -4.493 -10.384 -5.627 1.00 0.00 C ATOM 1023 O MET A 72 -4.891 -9.388 -5.023 1.00 0.00 O ATOM 1024 CB MET A 72 -2.622 -11.956 -5.098 1.00 0.00 C ATOM 1025 CG MET A 72 -1.208 -12.425 -5.405 1.00 0.00 C ATOM 1026 SD MET A 72 -0.761 -13.925 -4.510 1.00 0.00 S ATOM 1027 CE MET A 72 0.895 -14.209 -5.132 1.00 0.00 C ATOM 0 H MET A 72 -2.610 -9.072 -4.474 1.00 0.00 H new ATOM 0 HA MET A 72 -2.788 -10.741 -6.866 1.00 0.00 H new ATOM 0 HB2 MET A 72 -2.726 -11.823 -4.021 1.00 0.00 H new ATOM 0 HB3 MET A 72 -3.326 -12.734 -5.392 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.114 -12.605 -6.476 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.504 -11.632 -5.152 1.00 0.00 H new ATOM 0 HE1 MET A 72 1.308 -15.106 -4.670 1.00 0.00 H new ATOM 0 HE2 MET A 72 0.860 -14.341 -6.213 1.00 0.00 H new ATOM 0 HE3 MET A 72 1.526 -13.353 -4.891 1.00 0.00 H new ATOM 1037 N ILE A 73 -5.312 -11.281 -6.169 1.00 0.00 N ATOM 1038 CA ILE A 73 -6.763 -11.153 -6.077 1.00 0.00 C ATOM 1039 C ILE A 73 -7.394 -12.461 -5.610 1.00 0.00 C ATOM 1040 O ILE A 73 -7.111 -13.527 -6.158 1.00 0.00 O ATOM 1041 CB ILE A 73 -7.383 -10.760 -7.432 1.00 0.00 C ATOM 1042 CG1 ILE A 73 -6.640 -9.564 -8.035 1.00 0.00 C ATOM 1043 CG2 ILE A 73 -8.862 -10.442 -7.262 1.00 0.00 C ATOM 1044 CD1 ILE A 73 -7.088 -9.217 -9.439 1.00 0.00 C ATOM 0 H ILE A 73 -4.994 -12.106 -6.678 1.00 0.00 H new ATOM 0 HA ILE A 73 -6.966 -10.366 -5.351 1.00 0.00 H new ATOM 0 HB ILE A 73 -7.287 -11.602 -8.117 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -6.784 -8.696 -7.392 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.571 -9.779 -8.046 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -9.288 -10.166 -8.227 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -9.380 -11.319 -6.874 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -8.978 -9.613 -6.564 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -6.519 -8.361 -9.801 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.919 -10.070 -10.096 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -8.150 -8.970 -9.432 1.00 0.00 H new ATOM 1056 N PHE A 74 -8.248 -12.375 -4.597 1.00 0.00 N ATOM 1057 CA PHE A 74 -8.916 -13.557 -4.062 1.00 0.00 C ATOM 1058 C PHE A 74 -10.381 -13.606 -4.470 1.00 0.00 C ATOM 1059 O PHE A 74 -11.060 -12.580 -4.508 1.00 0.00 O ATOM 1060 CB PHE A 74 -8.820 -13.576 -2.539 1.00 0.00 C ATOM 1061 CG PHE A 74 -7.417 -13.651 -2.030 1.00 0.00 C ATOM 1062 CD1 PHE A 74 -6.718 -14.841 -2.079 1.00 0.00 C ATOM 1063 CD2 PHE A 74 -6.802 -12.533 -1.498 1.00 0.00 C ATOM 1064 CE1 PHE A 74 -5.427 -14.918 -1.606 1.00 0.00 C ATOM 1065 CE2 PHE A 74 -5.508 -12.601 -1.022 1.00 0.00 C ATOM 1066 CZ PHE A 74 -4.817 -13.796 -1.077 1.00 0.00 C ATOM 0 H PHE A 74 -8.494 -11.502 -4.130 1.00 0.00 H new ATOM 0 HA PHE A 74 -8.412 -14.430 -4.476 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -9.294 -12.679 -2.142 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.382 -14.429 -2.158 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.189 -15.721 -2.493 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.339 -11.597 -1.454 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -4.891 -15.855 -1.648 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -5.037 -11.722 -0.608 1.00 0.00 H new ATOM 0 HZ PHE A 74 -3.804 -13.853 -0.708 1.00 0.00 H new ATOM 1076 N GLU A 75 -10.861 -14.807 -4.769 1.00 0.00 N ATOM 1077 CA GLU A 75 -12.252 -14.999 -5.147 1.00 0.00 C ATOM 1078 C GLU A 75 -13.086 -15.280 -3.904 1.00 0.00 C ATOM 1079 O GLU A 75 -13.193 -16.424 -3.460 1.00 0.00 O ATOM 1080 CB GLU A 75 -12.385 -16.151 -6.145 1.00 0.00 C ATOM 1081 CG GLU A 75 -13.802 -16.355 -6.655 1.00 0.00 C ATOM 1082 CD GLU A 75 -13.896 -17.454 -7.694 1.00 0.00 C ATOM 1083 OE1 GLU A 75 -13.711 -17.155 -8.893 1.00 0.00 O ATOM 1084 OE2 GLU A 75 -14.152 -18.615 -7.310 1.00 0.00 O ATOM 0 H GLU A 75 -10.305 -15.662 -4.756 1.00 0.00 H new ATOM 0 HA GLU A 75 -12.616 -14.090 -5.625 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -11.726 -15.964 -6.993 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -12.042 -17.071 -5.672 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -14.455 -16.597 -5.816 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -14.167 -15.422 -7.084 1.00 0.00 H new ATOM 1091 N VAL A 76 -13.669 -14.227 -3.340 1.00 0.00 N ATOM 1092 CA VAL A 76 -14.474 -14.354 -2.135 1.00 0.00 C ATOM 1093 C VAL A 76 -15.939 -14.050 -2.415 1.00 0.00 C ATOM 1094 O VAL A 76 -16.286 -12.938 -2.811 1.00 0.00 O ATOM 1095 CB VAL A 76 -13.957 -13.420 -1.020 1.00 0.00 C ATOM 1096 CG1 VAL A 76 -13.701 -12.024 -1.567 1.00 0.00 C ATOM 1097 CG2 VAL A 76 -14.936 -13.372 0.146 1.00 0.00 C ATOM 0 H VAL A 76 -13.597 -13.276 -3.701 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.388 -15.387 -1.799 1.00 0.00 H new ATOM 0 HB VAL A 76 -13.013 -13.821 -0.651 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -13.337 -11.380 -0.766 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -12.954 -12.075 -2.359 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -14.628 -11.615 -1.968 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.549 -12.707 0.919 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -15.900 -13.001 -0.203 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -15.061 -14.373 0.558 1.00 0.00 H new ATOM 1853 N SER B 43 -14.843 -11.449 -6.304 1.00 0.00 N ATOM 1854 CA SER B 43 -13.422 -11.401 -5.983 1.00 0.00 C ATOM 1855 C SER B 43 -13.022 -10.003 -5.518 1.00 0.00 C ATOM 1856 O SER B 43 -13.488 -9.003 -6.065 1.00 0.00 O ATOM 1857 CB SER B 43 -12.588 -11.803 -7.200 1.00 0.00 C ATOM 1858 OG SER B 43 -12.799 -10.908 -8.279 1.00 0.00 O ATOM 0 HA SER B 43 -13.232 -12.106 -5.174 1.00 0.00 H new ATOM 0 HB2 SER B 43 -11.531 -11.814 -6.933 1.00 0.00 H new ATOM 0 HB3 SER B 43 -12.850 -12.816 -7.506 1.00 0.00 H new ATOM 0 HG SER B 43 -13.737 -10.626 -8.291 1.00 0.00 H new ATOM 1864 N MET B 44 -12.161 -9.940 -4.507 1.00 0.00 N ATOM 1865 CA MET B 44 -11.701 -8.663 -3.972 1.00 0.00 C ATOM 1866 C MET B 44 -10.181 -8.554 -4.040 1.00 0.00 C ATOM 1867 O MET B 44 -9.462 -9.399 -3.505 1.00 0.00 O ATOM 1868 CB MET B 44 -12.170 -8.494 -2.525 1.00 0.00 C ATOM 1869 CG MET B 44 -13.681 -8.396 -2.386 1.00 0.00 C ATOM 1870 SD MET B 44 -14.211 -8.181 -0.675 1.00 0.00 S ATOM 1871 CE MET B 44 -13.411 -6.632 -0.261 1.00 0.00 C ATOM 0 H MET B 44 -11.768 -10.758 -4.042 1.00 0.00 H new ATOM 0 HA MET B 44 -12.130 -7.869 -4.584 1.00 0.00 H new ATOM 0 HB2 MET B 44 -11.812 -9.338 -1.934 1.00 0.00 H new ATOM 0 HB3 MET B 44 -11.715 -7.596 -2.106 1.00 0.00 H new ATOM 0 HG2 MET B 44 -14.043 -7.558 -2.982 1.00 0.00 H new ATOM 0 HG3 MET B 44 -14.138 -9.298 -2.793 1.00 0.00 H new ATOM 0 HE1 MET B 44 -13.882 -6.204 0.624 1.00 0.00 H new ATOM 0 HE2 MET B 44 -12.355 -6.811 -0.059 1.00 0.00 H new ATOM 0 HE3 MET B 44 -13.509 -5.938 -1.095 1.00 0.00 H new ATOM 1881 N GLU B 45 -9.697 -7.508 -4.704 1.00 0.00 N ATOM 1882 CA GLU B 45 -8.263 -7.285 -4.841 1.00 0.00 C ATOM 1883 C GLU B 45 -7.662 -6.829 -3.517 1.00 0.00 C ATOM 1884 O GLU B 45 -8.313 -6.129 -2.739 1.00 0.00 O ATOM 1885 CB GLU B 45 -7.988 -6.243 -5.926 1.00 0.00 C ATOM 1886 CG GLU B 45 -8.626 -6.575 -7.265 1.00 0.00 C ATOM 1887 CD GLU B 45 -8.323 -5.538 -8.329 1.00 0.00 C ATOM 1888 OE1 GLU B 45 -9.076 -4.546 -8.423 1.00 0.00 O ATOM 1889 OE2 GLU B 45 -7.333 -5.718 -9.070 1.00 0.00 O ATOM 0 H GLU B 45 -10.278 -6.802 -5.155 1.00 0.00 H new ATOM 0 HA GLU B 45 -7.797 -8.227 -5.129 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.355 -5.274 -5.588 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -6.911 -6.146 -6.060 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.271 -7.549 -7.601 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -9.706 -6.656 -7.139 1.00 0.00 H new ATOM 1896 N VAL B 46 -6.420 -7.228 -3.265 1.00 0.00 N ATOM 1897 CA VAL B 46 -5.738 -6.861 -2.031 1.00 0.00 C ATOM 1898 C VAL B 46 -4.426 -6.126 -2.315 1.00 0.00 C ATOM 1899 O VAL B 46 -3.693 -6.489 -3.235 1.00 0.00 O ATOM 1900 CB VAL B 46 -5.444 -8.100 -1.162 1.00 0.00 C ATOM 1901 CG1 VAL B 46 -6.741 -8.758 -0.719 1.00 0.00 C ATOM 1902 CG2 VAL B 46 -4.569 -9.090 -1.917 1.00 0.00 C ATOM 0 H VAL B 46 -5.866 -7.805 -3.898 1.00 0.00 H new ATOM 0 HA VAL B 46 -6.409 -6.195 -1.488 1.00 0.00 H new ATOM 0 HB VAL B 46 -4.902 -7.777 -0.273 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -6.515 -9.631 -0.107 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -7.329 -8.048 -0.137 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -7.310 -9.067 -1.596 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -4.373 -9.957 -1.286 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -5.081 -9.410 -2.825 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -3.625 -8.613 -2.182 1.00 0.00 H new ATOM 1912 N PRO B 47 -4.115 -5.075 -1.529 1.00 0.00 N ATOM 1913 CA PRO B 47 -2.901 -4.294 -1.689 1.00 0.00 C ATOM 1914 C PRO B 47 -1.832 -4.658 -0.663 1.00 0.00 C ATOM 1915 O PRO B 47 -2.095 -5.392 0.290 1.00 0.00 O ATOM 1916 CB PRO B 47 -3.420 -2.883 -1.429 1.00 0.00 C ATOM 1917 CG PRO B 47 -4.520 -3.056 -0.419 1.00 0.00 C ATOM 1918 CD PRO B 47 -4.943 -4.512 -0.454 1.00 0.00 C ATOM 0 HA PRO B 47 -2.419 -4.445 -2.655 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -2.631 -2.236 -1.047 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -3.793 -2.424 -2.345 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -4.173 -2.781 0.577 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -5.363 -2.406 -0.654 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -4.758 -5.008 0.499 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -6.007 -4.618 -0.667 1.00 0.00 H new ATOM 1926 N ALA B 48 -0.623 -4.141 -0.866 1.00 0.00 N ATOM 1927 CA ALA B 48 0.486 -4.408 0.041 1.00 0.00 C ATOM 1928 C ALA B 48 0.490 -3.417 1.203 1.00 0.00 C ATOM 1929 O ALA B 48 0.069 -2.270 1.046 1.00 0.00 O ATOM 1930 CB ALA B 48 1.808 -4.350 -0.708 1.00 0.00 C ATOM 0 H ALA B 48 -0.388 -3.535 -1.652 1.00 0.00 H new ATOM 0 HA ALA B 48 0.358 -5.411 0.449 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.627 -4.551 -0.017 1.00 0.00 H new ATOM 0 HB2 ALA B 48 1.810 -5.098 -1.501 1.00 0.00 H new ATOM 0 HB3 ALA B 48 1.936 -3.359 -1.143 1.00 0.00 H new ATOM 1936 N PRO B 49 0.966 -3.843 2.387 1.00 0.00 N ATOM 1937 CA PRO B 49 1.014 -2.980 3.572 1.00 0.00 C ATOM 1938 C PRO B 49 2.094 -1.907 3.474 1.00 0.00 C ATOM 1939 O PRO B 49 1.857 -0.746 3.810 1.00 0.00 O ATOM 1940 CB PRO B 49 1.328 -3.954 4.708 1.00 0.00 C ATOM 1941 CG PRO B 49 2.068 -5.068 4.053 1.00 0.00 C ATOM 1942 CD PRO B 49 1.493 -5.195 2.668 1.00 0.00 C ATOM 0 HA PRO B 49 0.084 -2.429 3.708 1.00 0.00 H new ATOM 0 HB2 PRO B 49 1.930 -3.479 5.482 1.00 0.00 H new ATOM 0 HB3 PRO B 49 0.417 -4.311 5.187 1.00 0.00 H new ATOM 0 HG2 PRO B 49 3.136 -4.856 4.013 1.00 0.00 H new ATOM 0 HG3 PRO B 49 1.948 -5.997 4.611 1.00 0.00 H new ATOM 0 HD2 PRO B 49 2.253 -5.488 1.943 1.00 0.00 H new ATOM 0 HD3 PRO B 49 0.707 -5.949 2.628 1.00 0.00 H new ATOM 1950 N PHE B 50 3.279 -2.299 3.013 1.00 0.00 N ATOM 1951 CA PHE B 50 4.390 -1.361 2.879 1.00 0.00 C ATOM 1952 C PHE B 50 5.316 -1.766 1.738 1.00 0.00 C ATOM 1953 O PHE B 50 5.296 -2.909 1.284 1.00 0.00 O ATOM 1954 CB PHE B 50 5.177 -1.279 4.190 1.00 0.00 C ATOM 1955 CG PHE B 50 5.645 -2.615 4.697 1.00 0.00 C ATOM 1956 CD1 PHE B 50 4.826 -3.390 5.502 1.00 0.00 C ATOM 1957 CD2 PHE B 50 6.902 -3.094 4.367 1.00 0.00 C ATOM 1958 CE1 PHE B 50 5.253 -4.619 5.968 1.00 0.00 C ATOM 1959 CE2 PHE B 50 7.334 -4.323 4.830 1.00 0.00 C ATOM 1960 CZ PHE B 50 6.509 -5.086 5.632 1.00 0.00 C ATOM 0 H PHE B 50 3.494 -3.254 2.727 1.00 0.00 H new ATOM 0 HA PHE B 50 3.976 -0.379 2.650 1.00 0.00 H new ATOM 0 HB2 PHE B 50 6.042 -0.632 4.045 1.00 0.00 H new ATOM 0 HB3 PHE B 50 4.552 -0.810 4.950 1.00 0.00 H new ATOM 0 HD1 PHE B 50 3.843 -3.030 5.768 1.00 0.00 H new ATOM 0 HD2 PHE B 50 7.552 -2.501 3.741 1.00 0.00 H new ATOM 0 HE1 PHE B 50 4.605 -5.214 6.595 1.00 0.00 H new ATOM 0 HE2 PHE B 50 8.316 -4.686 4.565 1.00 0.00 H new ATOM 0 HZ PHE B 50 6.845 -6.046 5.996 1.00 0.00 H new ATOM 1970 N ALA B 51 6.129 -0.818 1.279 1.00 0.00 N ATOM 1971 CA ALA B 51 7.065 -1.073 0.191 1.00 0.00 C ATOM 1972 C ALA B 51 8.189 -1.998 0.640 1.00 0.00 C ATOM 1973 O ALA B 51 8.493 -2.092 1.829 1.00 0.00 O ATOM 1974 CB ALA B 51 7.636 0.237 -0.334 1.00 0.00 C ATOM 0 H ALA B 51 6.157 0.134 1.645 1.00 0.00 H new ATOM 0 HA ALA B 51 6.521 -1.568 -0.614 1.00 0.00 H new ATOM 0 HB1 ALA B 51 8.333 0.031 -1.146 1.00 0.00 H new ATOM 0 HB2 ALA B 51 6.825 0.865 -0.703 1.00 0.00 H new ATOM 0 HB3 ALA B 51 8.159 0.754 0.470 1.00 0.00 H new ATOM 1980 N GLY B 52 8.804 -2.680 -0.321 1.00 0.00 N ATOM 1981 CA GLY B 52 9.890 -3.589 -0.008 1.00 0.00 C ATOM 1982 C GLY B 52 10.342 -4.384 -1.217 1.00 0.00 C ATOM 1983 O GLY B 52 10.028 -4.027 -2.353 1.00 0.00 O ATOM 0 H GLY B 52 8.569 -2.619 -1.312 1.00 0.00 H new ATOM 0 HA2 GLY B 52 10.733 -3.022 0.387 1.00 0.00 H new ATOM 0 HA3 GLY B 52 9.572 -4.275 0.777 1.00 0.00 H new ATOM 1987 N VAL B 53 11.083 -5.461 -0.977 1.00 0.00 N ATOM 1988 CA VAL B 53 11.581 -6.302 -2.061 1.00 0.00 C ATOM 1989 C VAL B 53 11.255 -7.773 -1.821 1.00 0.00 C ATOM 1990 O VAL B 53 11.476 -8.300 -0.730 1.00 0.00 O ATOM 1991 CB VAL B 53 13.104 -6.146 -2.236 1.00 0.00 C ATOM 1992 CG1 VAL B 53 13.605 -7.001 -3.391 1.00 0.00 C ATOM 1993 CG2 VAL B 53 13.468 -4.683 -2.450 1.00 0.00 C ATOM 0 H VAL B 53 11.352 -5.772 -0.044 1.00 0.00 H new ATOM 0 HA VAL B 53 11.080 -5.970 -2.970 1.00 0.00 H new ATOM 0 HB VAL B 53 13.591 -6.491 -1.324 1.00 0.00 H new ATOM 0 HG11 VAL B 53 14.683 -6.875 -3.496 1.00 0.00 H new ATOM 0 HG12 VAL B 53 13.380 -8.049 -3.192 1.00 0.00 H new ATOM 0 HG13 VAL B 53 13.112 -6.692 -4.313 1.00 0.00 H new ATOM 0 HG21 VAL B 53 14.547 -4.591 -2.572 1.00 0.00 H new ATOM 0 HG22 VAL B 53 12.969 -4.311 -3.345 1.00 0.00 H new ATOM 0 HG23 VAL B 53 13.149 -4.099 -1.587 1.00 0.00 H new ATOM 2003 N VAL B 54 10.726 -8.428 -2.850 1.00 0.00 N ATOM 2004 CA VAL B 54 10.374 -9.840 -2.765 1.00 0.00 C ATOM 2005 C VAL B 54 11.611 -10.719 -2.933 1.00 0.00 C ATOM 2006 O VAL B 54 12.111 -10.896 -4.045 1.00 0.00 O ATOM 2007 CB VAL B 54 9.332 -10.221 -3.837 1.00 0.00 C ATOM 2008 CG1 VAL B 54 9.042 -11.716 -3.802 1.00 0.00 C ATOM 2009 CG2 VAL B 54 8.050 -9.425 -3.641 1.00 0.00 C ATOM 0 H VAL B 54 10.531 -8.001 -3.756 1.00 0.00 H new ATOM 0 HA VAL B 54 9.944 -10.007 -1.778 1.00 0.00 H new ATOM 0 HB VAL B 54 9.745 -9.977 -4.816 1.00 0.00 H new ATOM 0 HG11 VAL B 54 8.305 -11.962 -4.566 1.00 0.00 H new ATOM 0 HG12 VAL B 54 9.961 -12.270 -3.993 1.00 0.00 H new ATOM 0 HG13 VAL B 54 8.652 -11.988 -2.821 1.00 0.00 H new ATOM 0 HG21 VAL B 54 7.326 -9.707 -4.406 1.00 0.00 H new ATOM 0 HG22 VAL B 54 7.637 -9.637 -2.655 1.00 0.00 H new ATOM 0 HG23 VAL B 54 8.267 -8.360 -3.722 1.00 0.00 H new ATOM 2019 N LYS B 55 12.104 -11.265 -1.825 1.00 0.00 N ATOM 2020 CA LYS B 55 13.285 -12.121 -1.855 1.00 0.00 C ATOM 2021 C LYS B 55 13.007 -13.474 -1.208 1.00 0.00 C ATOM 2022 O LYS B 55 13.850 -14.371 -1.239 1.00 0.00 O ATOM 2023 CB LYS B 55 14.456 -11.438 -1.144 1.00 0.00 C ATOM 2024 CG LYS B 55 14.897 -10.142 -1.802 1.00 0.00 C ATOM 2025 CD LYS B 55 16.086 -9.529 -1.080 1.00 0.00 C ATOM 2026 CE LYS B 55 16.551 -8.251 -1.757 1.00 0.00 C ATOM 2027 NZ LYS B 55 16.965 -8.488 -3.167 1.00 0.00 N ATOM 0 H LYS B 55 11.704 -11.130 -0.896 1.00 0.00 H new ATOM 0 HA LYS B 55 13.546 -12.289 -2.900 1.00 0.00 H new ATOM 0 HB2 LYS B 55 14.173 -11.233 -0.111 1.00 0.00 H new ATOM 0 HB3 LYS B 55 15.301 -12.125 -1.113 1.00 0.00 H new ATOM 0 HG2 LYS B 55 15.160 -10.332 -2.843 1.00 0.00 H new ATOM 0 HG3 LYS B 55 14.068 -9.434 -1.807 1.00 0.00 H new ATOM 0 HD2 LYS B 55 15.815 -9.316 -0.046 1.00 0.00 H new ATOM 0 HD3 LYS B 55 16.906 -10.247 -1.053 1.00 0.00 H new ATOM 0 HE2 LYS B 55 15.747 -7.515 -1.734 1.00 0.00 H new ATOM 0 HE3 LYS B 55 17.387 -7.828 -1.199 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 17.520 -7.677 -3.507 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 17.545 -9.350 -3.218 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 16.120 -8.603 -3.762 1.00 0.00 H new ATOM 2041 N GLU B 56 11.822 -13.618 -0.621 1.00 0.00 N ATOM 2042 CA GLU B 56 11.445 -14.866 0.032 1.00 0.00 C ATOM 2043 C GLU B 56 9.936 -14.941 0.245 1.00 0.00 C ATOM 2044 O GLU B 56 9.372 -14.188 1.042 1.00 0.00 O ATOM 2045 CB GLU B 56 12.171 -15.002 1.371 1.00 0.00 C ATOM 2046 CG GLU B 56 11.916 -16.326 2.072 1.00 0.00 C ATOM 2047 CD GLU B 56 12.689 -16.455 3.370 1.00 0.00 C ATOM 2048 OE1 GLU B 56 12.163 -16.029 4.420 1.00 0.00 O ATOM 2049 OE2 GLU B 56 13.820 -16.983 3.337 1.00 0.00 O ATOM 0 H GLU B 56 11.110 -12.889 -0.585 1.00 0.00 H new ATOM 0 HA GLU B 56 11.738 -15.690 -0.619 1.00 0.00 H new ATOM 0 HB2 GLU B 56 13.243 -14.888 1.207 1.00 0.00 H new ATOM 0 HB3 GLU B 56 11.861 -14.188 2.027 1.00 0.00 H new ATOM 0 HG2 GLU B 56 10.850 -16.426 2.276 1.00 0.00 H new ATOM 0 HG3 GLU B 56 12.191 -17.144 1.407 1.00 0.00 H new ATOM 2056 N LEU B 57 9.286 -15.850 -0.475 1.00 0.00 N ATOM 2057 CA LEU B 57 7.841 -16.027 -0.365 1.00 0.00 C ATOM 2058 C LEU B 57 7.508 -17.184 0.571 1.00 0.00 C ATOM 2059 O LEU B 57 8.393 -17.926 0.996 1.00 0.00 O ATOM 2060 CB LEU B 57 7.227 -16.274 -1.748 1.00 0.00 C ATOM 2061 CG LEU B 57 7.702 -17.542 -2.464 1.00 0.00 C ATOM 2062 CD1 LEU B 57 6.836 -18.734 -2.086 1.00 0.00 C ATOM 2063 CD2 LEU B 57 7.696 -17.336 -3.971 1.00 0.00 C ATOM 0 H LEU B 57 9.737 -16.476 -1.142 1.00 0.00 H new ATOM 0 HA LEU B 57 7.417 -15.113 0.051 1.00 0.00 H new ATOM 0 HB2 LEU B 57 6.143 -16.322 -1.642 1.00 0.00 H new ATOM 0 HB3 LEU B 57 7.447 -15.415 -2.382 1.00 0.00 H new ATOM 0 HG LEU B 57 8.724 -17.750 -2.146 1.00 0.00 H new ATOM 0 HD11 LEU B 57 7.193 -19.623 -2.607 1.00 0.00 H new ATOM 0 HD12 LEU B 57 6.892 -18.897 -1.010 1.00 0.00 H new ATOM 0 HD13 LEU B 57 5.802 -18.537 -2.370 1.00 0.00 H new ATOM 0 HD21 LEU B 57 8.036 -18.247 -4.464 1.00 0.00 H new ATOM 0 HD22 LEU B 57 6.685 -17.100 -4.302 1.00 0.00 H new ATOM 0 HD23 LEU B 57 8.363 -16.513 -4.228 1.00 0.00 H new ATOM 2075 N LYS B 58 6.225 -17.333 0.890 1.00 0.00 N ATOM 2076 CA LYS B 58 5.779 -18.401 1.774 1.00 0.00 C ATOM 2077 C LYS B 58 4.648 -19.212 1.142 1.00 0.00 C ATOM 2078 O LYS B 58 4.373 -20.337 1.560 1.00 0.00 O ATOM 2079 CB LYS B 58 5.319 -17.819 3.113 1.00 0.00 C ATOM 2080 CG LYS B 58 4.903 -18.874 4.125 1.00 0.00 C ATOM 2081 CD LYS B 58 4.388 -18.247 5.409 1.00 0.00 C ATOM 2082 CE LYS B 58 3.999 -19.307 6.428 1.00 0.00 C ATOM 2083 NZ LYS B 58 5.159 -20.154 6.820 1.00 0.00 N ATOM 0 H LYS B 58 5.478 -16.727 0.549 1.00 0.00 H new ATOM 0 HA LYS B 58 6.623 -19.071 1.941 1.00 0.00 H new ATOM 0 HB2 LYS B 58 6.126 -17.220 3.536 1.00 0.00 H new ATOM 0 HB3 LYS B 58 4.480 -17.145 2.938 1.00 0.00 H new ATOM 0 HG2 LYS B 58 4.128 -19.508 3.693 1.00 0.00 H new ATOM 0 HG3 LYS B 58 5.753 -19.518 4.350 1.00 0.00 H new ATOM 0 HD2 LYS B 58 5.155 -17.598 5.832 1.00 0.00 H new ATOM 0 HD3 LYS B 58 3.525 -17.619 5.188 1.00 0.00 H new ATOM 0 HE2 LYS B 58 3.586 -18.824 7.314 1.00 0.00 H new ATOM 0 HE3 LYS B 58 3.213 -19.938 6.013 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 4.913 -20.710 7.664 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 5.399 -20.797 6.039 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 5.976 -19.547 7.032 1.00 0.00 H new ATOM 2097 N VAL B 59 3.997 -18.641 0.131 1.00 0.00 N ATOM 2098 CA VAL B 59 2.894 -19.318 -0.544 1.00 0.00 C ATOM 2099 C VAL B 59 3.124 -19.396 -2.051 1.00 0.00 C ATOM 2100 O VAL B 59 3.651 -18.464 -2.659 1.00 0.00 O ATOM 2101 CB VAL B 59 1.550 -18.611 -0.279 1.00 0.00 C ATOM 2102 CG1 VAL B 59 1.201 -18.664 1.200 1.00 0.00 C ATOM 2103 CG2 VAL B 59 1.591 -17.173 -0.772 1.00 0.00 C ATOM 0 H VAL B 59 4.214 -17.715 -0.237 1.00 0.00 H new ATOM 0 HA VAL B 59 2.854 -20.328 -0.135 1.00 0.00 H new ATOM 0 HB VAL B 59 0.772 -19.136 -0.833 1.00 0.00 H new ATOM 0 HG11 VAL B 59 0.249 -18.160 1.368 1.00 0.00 H new ATOM 0 HG12 VAL B 59 1.122 -19.704 1.518 1.00 0.00 H new ATOM 0 HG13 VAL B 59 1.981 -18.167 1.776 1.00 0.00 H new ATOM 0 HG21 VAL B 59 0.632 -16.693 -0.575 1.00 0.00 H new ATOM 0 HG22 VAL B 59 2.381 -16.632 -0.251 1.00 0.00 H new ATOM 0 HG23 VAL B 59 1.789 -17.161 -1.844 1.00 0.00 H new ATOM 2113 N ASN B 60 2.721 -20.515 -2.645 1.00 0.00 N ATOM 2114 CA ASN B 60 2.878 -20.722 -4.080 1.00 0.00 C ATOM 2115 C ASN B 60 1.566 -20.453 -4.809 1.00 0.00 C ATOM 2116 O ASN B 60 0.486 -20.624 -4.244 1.00 0.00 O ATOM 2117 CB ASN B 60 3.349 -22.150 -4.363 1.00 0.00 C ATOM 2118 CG ASN B 60 4.505 -22.579 -3.474 1.00 0.00 C ATOM 2119 OD1 ASN B 60 4.624 -23.752 -3.120 1.00 0.00 O ATOM 2120 ND2 ASN B 60 5.367 -21.635 -3.110 1.00 0.00 N ATOM 0 H ASN B 60 2.282 -21.294 -2.153 1.00 0.00 H new ATOM 0 HA ASN B 60 3.629 -20.022 -4.445 1.00 0.00 H new ATOM 0 HB2 ASN B 60 2.515 -22.837 -4.222 1.00 0.00 H new ATOM 0 HB3 ASN B 60 3.652 -22.227 -5.407 1.00 0.00 H new ATOM 0 HD21 ASN B 60 6.162 -21.872 -2.516 1.00 0.00 H new ATOM 0 HD22 ASN B 60 5.234 -20.674 -3.424 1.00 0.00 H new ATOM 2127 N VAL B 61 1.668 -20.028 -6.065 1.00 0.00 N ATOM 2128 CA VAL B 61 0.489 -19.733 -6.873 1.00 0.00 C ATOM 2129 C VAL B 61 -0.463 -20.924 -6.910 1.00 0.00 C ATOM 2130 O VAL B 61 -0.065 -22.040 -7.239 1.00 0.00 O ATOM 2131 CB VAL B 61 0.872 -19.358 -8.317 1.00 0.00 C ATOM 2132 CG1 VAL B 61 -0.346 -18.862 -9.082 1.00 0.00 C ATOM 2133 CG2 VAL B 61 1.979 -18.314 -8.327 1.00 0.00 C ATOM 0 H VAL B 61 2.555 -19.880 -6.546 1.00 0.00 H new ATOM 0 HA VAL B 61 -0.008 -18.883 -6.404 1.00 0.00 H new ATOM 0 HB VAL B 61 1.246 -20.252 -8.815 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -0.055 -18.602 -10.100 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -1.102 -19.646 -9.110 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -0.754 -17.982 -8.585 1.00 0.00 H new ATOM 0 HG21 VAL B 61 2.234 -18.064 -9.357 1.00 0.00 H new ATOM 0 HG22 VAL B 61 1.638 -17.417 -7.809 1.00 0.00 H new ATOM 0 HG23 VAL B 61 2.859 -18.712 -7.822 1.00 0.00 H new ATOM 2143 N GLY B 62 -1.724 -20.677 -6.567 1.00 0.00 N ATOM 2144 CA GLY B 62 -2.714 -21.738 -6.568 1.00 0.00 C ATOM 2145 C GLY B 62 -2.972 -22.293 -5.181 1.00 0.00 C ATOM 2146 O GLY B 62 -3.650 -23.308 -5.028 1.00 0.00 O ATOM 0 H GLY B 62 -2.077 -19.761 -6.289 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -3.648 -21.359 -6.984 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -2.378 -22.543 -7.221 1.00 0.00 H new ATOM 2150 N ASP B 63 -2.428 -21.625 -4.168 1.00 0.00 N ATOM 2151 CA ASP B 63 -2.604 -22.057 -2.787 1.00 0.00 C ATOM 2152 C ASP B 63 -3.609 -21.166 -2.065 1.00 0.00 C ATOM 2153 O ASP B 63 -3.412 -19.956 -1.952 1.00 0.00 O ATOM 2154 CB ASP B 63 -1.264 -22.038 -2.048 1.00 0.00 C ATOM 2155 CG ASP B 63 -1.386 -22.518 -0.615 1.00 0.00 C ATOM 2156 OD1 ASP B 63 -1.299 -23.744 -0.390 1.00 0.00 O ATOM 2157 OD2 ASP B 63 -1.568 -21.668 0.283 1.00 0.00 O ATOM 0 H ASP B 63 -1.862 -20.783 -4.278 1.00 0.00 H new ATOM 0 HA ASP B 63 -2.989 -23.077 -2.797 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -0.550 -22.668 -2.579 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -0.863 -21.025 -2.056 1.00 0.00 H new ATOM 2162 N LYS B 64 -4.687 -21.775 -1.579 1.00 0.00 N ATOM 2163 CA LYS B 64 -5.730 -21.043 -0.868 1.00 0.00 C ATOM 2164 C LYS B 64 -5.151 -20.275 0.317 1.00 0.00 C ATOM 2165 O LYS B 64 -4.097 -20.628 0.844 1.00 0.00 O ATOM 2166 CB LYS B 64 -6.810 -22.009 -0.382 1.00 0.00 C ATOM 2167 CG LYS B 64 -6.284 -23.086 0.552 1.00 0.00 C ATOM 2168 CD LYS B 64 -7.382 -24.052 0.964 1.00 0.00 C ATOM 2169 CE LYS B 64 -6.852 -25.130 1.894 1.00 0.00 C ATOM 2170 NZ LYS B 64 -7.911 -26.109 2.265 1.00 0.00 N ATOM 0 H LYS B 64 -4.861 -22.776 -1.665 1.00 0.00 H new ATOM 0 HA LYS B 64 -6.171 -20.325 -1.559 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -7.588 -21.443 0.130 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -7.277 -22.484 -1.245 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -5.481 -23.635 0.060 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -5.855 -22.621 1.440 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -8.184 -23.504 1.459 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -7.813 -24.515 0.076 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -6.026 -25.653 1.411 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -6.452 -24.667 2.796 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -7.511 -26.829 2.900 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -8.688 -25.614 2.748 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -8.275 -26.569 1.406 1.00 0.00 H new ATOM 2184 N VAL B 65 -5.851 -19.223 0.728 1.00 0.00 N ATOM 2185 CA VAL B 65 -5.414 -18.401 1.850 1.00 0.00 C ATOM 2186 C VAL B 65 -6.444 -18.428 2.974 1.00 0.00 C ATOM 2187 O VAL B 65 -7.611 -18.749 2.751 1.00 0.00 O ATOM 2188 CB VAL B 65 -5.182 -16.939 1.414 1.00 0.00 C ATOM 2189 CG1 VAL B 65 -6.506 -16.229 1.188 1.00 0.00 C ATOM 2190 CG2 VAL B 65 -4.341 -16.196 2.441 1.00 0.00 C ATOM 0 H VAL B 65 -6.725 -18.919 0.300 1.00 0.00 H new ATOM 0 HA VAL B 65 -4.473 -18.818 2.209 1.00 0.00 H new ATOM 0 HB VAL B 65 -4.635 -16.949 0.471 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -6.319 -15.200 0.881 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -7.067 -16.744 0.408 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -7.083 -16.233 2.112 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -4.190 -15.168 2.113 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -4.855 -16.198 3.402 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -3.374 -16.689 2.545 1.00 0.00 H new ATOM 2200 N LYS B 66 -6.008 -18.089 4.183 1.00 0.00 N ATOM 2201 CA LYS B 66 -6.898 -18.073 5.337 1.00 0.00 C ATOM 2202 C LYS B 66 -6.546 -16.930 6.282 1.00 0.00 C ATOM 2203 O LYS B 66 -5.388 -16.525 6.379 1.00 0.00 O ATOM 2204 CB LYS B 66 -6.834 -19.409 6.077 1.00 0.00 C ATOM 2205 CG LYS B 66 -7.302 -20.587 5.238 1.00 0.00 C ATOM 2206 CD LYS B 66 -7.196 -21.898 6.001 1.00 0.00 C ATOM 2207 CE LYS B 66 -5.747 -22.285 6.252 1.00 0.00 C ATOM 2208 NZ LYS B 66 -5.635 -23.587 6.966 1.00 0.00 N ATOM 0 H LYS B 66 -5.045 -17.822 4.388 1.00 0.00 H new ATOM 0 HA LYS B 66 -7.915 -17.917 4.977 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -5.809 -19.588 6.401 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -7.446 -19.347 6.977 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -8.336 -20.427 4.931 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -6.705 -20.646 4.328 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -7.719 -21.809 6.953 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -7.692 -22.688 5.438 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -5.218 -22.346 5.301 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -5.260 -21.506 6.839 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -4.632 -23.815 7.118 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -6.118 -23.522 7.885 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -6.077 -24.335 6.395 1.00 0.00 H new ATOM 2222 N THR B 67 -7.557 -16.413 6.975 1.00 0.00 N ATOM 2223 CA THR B 67 -7.362 -15.314 7.912 1.00 0.00 C ATOM 2224 C THR B 67 -6.360 -15.685 8.998 1.00 0.00 C ATOM 2225 O THR B 67 -6.563 -16.642 9.746 1.00 0.00 O ATOM 2226 CB THR B 67 -8.690 -14.900 8.573 1.00 0.00 C ATOM 2227 OG1 THR B 67 -9.277 -16.026 9.238 1.00 0.00 O ATOM 2228 CG2 THR B 67 -9.662 -14.352 7.539 1.00 0.00 C ATOM 0 H THR B 67 -8.521 -16.739 6.904 1.00 0.00 H new ATOM 0 HA THR B 67 -6.972 -14.474 7.337 1.00 0.00 H new ATOM 0 HB THR B 67 -8.480 -14.116 9.301 1.00 0.00 H new ATOM 0 HG1 THR B 67 -8.577 -16.536 9.697 1.00 0.00 H new ATOM 0 HG21 THR B 67 -10.592 -14.066 8.030 1.00 0.00 H new ATOM 0 HG22 THR B 67 -9.224 -13.479 7.055 1.00 0.00 H new ATOM 0 HG23 THR B 67 -9.867 -15.117 6.790 1.00 0.00 H new ATOM 2236 N GLY B 68 -5.274 -14.922 9.077 1.00 0.00 N ATOM 2237 CA GLY B 68 -4.253 -15.184 10.073 1.00 0.00 C ATOM 2238 C GLY B 68 -3.044 -15.890 9.492 1.00 0.00 C ATOM 2239 O GLY B 68 -2.096 -16.205 10.212 1.00 0.00 O ATOM 0 H GLY B 68 -5.084 -14.126 8.468 1.00 0.00 H new ATOM 0 HA2 GLY B 68 -3.939 -14.242 10.523 1.00 0.00 H new ATOM 0 HA3 GLY B 68 -4.677 -15.793 10.872 1.00 0.00 H new ATOM 2243 N SER B 69 -3.078 -16.139 8.186 1.00 0.00 N ATOM 2244 CA SER B 69 -1.978 -16.812 7.507 1.00 0.00 C ATOM 2245 C SER B 69 -1.122 -15.815 6.733 1.00 0.00 C ATOM 2246 O SER B 69 -1.630 -14.830 6.197 1.00 0.00 O ATOM 2247 CB SER B 69 -2.517 -17.883 6.557 1.00 0.00 C ATOM 2248 OG SER B 69 -3.293 -18.841 7.256 1.00 0.00 O ATOM 0 H SER B 69 -3.856 -15.884 7.578 1.00 0.00 H new ATOM 0 HA SER B 69 -1.354 -17.287 8.264 1.00 0.00 H new ATOM 0 HB2 SER B 69 -3.124 -17.414 5.782 1.00 0.00 H new ATOM 0 HB3 SER B 69 -1.687 -18.379 6.055 1.00 0.00 H new ATOM 0 HG SER B 69 -3.627 -19.514 6.626 1.00 0.00 H new ATOM 2254 N LEU B 70 0.180 -16.077 6.681 1.00 0.00 N ATOM 2255 CA LEU B 70 1.112 -15.205 5.974 1.00 0.00 C ATOM 2256 C LEU B 70 1.114 -15.509 4.480 1.00 0.00 C ATOM 2257 O LEU B 70 0.530 -16.499 4.038 1.00 0.00 O ATOM 2258 CB LEU B 70 2.528 -15.364 6.539 1.00 0.00 C ATOM 2259 CG LEU B 70 2.763 -14.729 7.914 1.00 0.00 C ATOM 2260 CD1 LEU B 70 1.931 -15.425 8.982 1.00 0.00 C ATOM 2261 CD2 LEU B 70 4.240 -14.780 8.275 1.00 0.00 C ATOM 0 H LEU B 70 0.615 -16.888 7.121 1.00 0.00 H new ATOM 0 HA LEU B 70 0.785 -14.175 6.119 1.00 0.00 H new ATOM 0 HB2 LEU B 70 2.757 -16.428 6.605 1.00 0.00 H new ATOM 0 HB3 LEU B 70 3.234 -14.929 5.831 1.00 0.00 H new ATOM 0 HG LEU B 70 2.451 -13.686 7.866 1.00 0.00 H new ATOM 0 HD11 LEU B 70 2.115 -14.957 9.949 1.00 0.00 H new ATOM 0 HD12 LEU B 70 0.873 -15.339 8.733 1.00 0.00 H new ATOM 0 HD13 LEU B 70 2.208 -16.478 9.030 1.00 0.00 H new ATOM 0 HD21 LEU B 70 4.391 -14.325 9.254 1.00 0.00 H new ATOM 0 HD22 LEU B 70 4.572 -15.818 8.302 1.00 0.00 H new ATOM 0 HD23 LEU B 70 4.816 -14.233 7.528 1.00 0.00 H new ATOM 2273 N ILE B 71 1.771 -14.652 3.704 1.00 0.00 N ATOM 2274 CA ILE B 71 1.844 -14.833 2.259 1.00 0.00 C ATOM 2275 C ILE B 71 3.276 -14.698 1.744 1.00 0.00 C ATOM 2276 O ILE B 71 3.788 -15.594 1.073 1.00 0.00 O ATOM 2277 CB ILE B 71 0.937 -13.828 1.519 1.00 0.00 C ATOM 2278 CG1 ILE B 71 1.116 -12.418 2.092 1.00 0.00 C ATOM 2279 CG2 ILE B 71 -0.517 -14.267 1.614 1.00 0.00 C ATOM 2280 CD1 ILE B 71 0.344 -11.353 1.342 1.00 0.00 C ATOM 0 H ILE B 71 2.260 -13.827 4.051 1.00 0.00 H new ATOM 0 HA ILE B 71 1.493 -15.845 2.055 1.00 0.00 H new ATOM 0 HB ILE B 71 1.225 -13.805 0.468 1.00 0.00 H new ATOM 0 HG12 ILE B 71 0.800 -12.417 3.135 1.00 0.00 H new ATOM 0 HG13 ILE B 71 2.176 -12.162 2.080 1.00 0.00 H new ATOM 0 HG21 ILE B 71 -1.148 -13.551 1.088 1.00 0.00 H new ATOM 0 HG22 ILE B 71 -0.630 -15.252 1.160 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -0.815 -14.314 2.661 1.00 0.00 H new ATOM 0 HD11 ILE B 71 0.520 -10.382 1.805 1.00 0.00 H new ATOM 0 HD12 ILE B 71 0.676 -11.326 0.304 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -0.721 -11.584 1.376 1.00 0.00 H new ATOM 2292 N MET B 72 3.921 -13.580 2.064 1.00 0.00 N ATOM 2293 CA MET B 72 5.292 -13.335 1.623 1.00 0.00 C ATOM 2294 C MET B 72 6.057 -12.500 2.646 1.00 0.00 C ATOM 2295 O MET B 72 5.490 -12.033 3.633 1.00 0.00 O ATOM 2296 CB MET B 72 5.295 -12.619 0.268 1.00 0.00 C ATOM 2297 CG MET B 72 4.770 -13.471 -0.877 1.00 0.00 C ATOM 2298 SD MET B 72 4.730 -12.577 -2.443 1.00 0.00 S ATOM 2299 CE MET B 72 4.110 -13.847 -3.543 1.00 0.00 C ATOM 0 H MET B 72 3.518 -12.830 2.626 1.00 0.00 H new ATOM 0 HA MET B 72 5.788 -14.300 1.523 1.00 0.00 H new ATOM 0 HB2 MET B 72 4.690 -11.716 0.344 1.00 0.00 H new ATOM 0 HB3 MET B 72 6.312 -12.303 0.037 1.00 0.00 H new ATOM 0 HG2 MET B 72 5.397 -14.356 -0.984 1.00 0.00 H new ATOM 0 HG3 MET B 72 3.766 -13.819 -0.636 1.00 0.00 H new ATOM 0 HE1 MET B 72 4.029 -13.446 -4.553 1.00 0.00 H new ATOM 0 HE2 MET B 72 4.795 -14.695 -3.543 1.00 0.00 H new ATOM 0 HE3 MET B 72 3.127 -14.175 -3.203 1.00 0.00 H new ATOM 2309 N ILE B 73 7.352 -12.323 2.401 1.00 0.00 N ATOM 2310 CA ILE B 73 8.204 -11.539 3.288 1.00 0.00 C ATOM 2311 C ILE B 73 8.989 -10.504 2.491 1.00 0.00 C ATOM 2312 O ILE B 73 9.530 -10.811 1.427 1.00 0.00 O ATOM 2313 CB ILE B 73 9.187 -12.435 4.070 1.00 0.00 C ATOM 2314 CG1 ILE B 73 8.439 -13.603 4.719 1.00 0.00 C ATOM 2315 CG2 ILE B 73 9.924 -11.618 5.124 1.00 0.00 C ATOM 2316 CD1 ILE B 73 9.347 -14.600 5.406 1.00 0.00 C ATOM 0 H ILE B 73 7.835 -12.714 1.592 1.00 0.00 H new ATOM 0 HA ILE B 73 7.553 -11.036 4.003 1.00 0.00 H new ATOM 0 HB ILE B 73 9.921 -12.840 3.374 1.00 0.00 H new ATOM 0 HG12 ILE B 73 7.730 -13.209 5.447 1.00 0.00 H new ATOM 0 HG13 ILE B 73 7.858 -14.120 3.955 1.00 0.00 H new ATOM 0 HG21 ILE B 73 10.614 -12.263 5.668 1.00 0.00 H new ATOM 0 HG22 ILE B 73 10.482 -10.817 4.639 1.00 0.00 H new ATOM 0 HG23 ILE B 73 9.204 -11.188 5.820 1.00 0.00 H new ATOM 0 HD11 ILE B 73 8.747 -15.399 5.842 1.00 0.00 H new ATOM 0 HD12 ILE B 73 10.040 -15.023 4.678 1.00 0.00 H new ATOM 0 HD13 ILE B 73 9.909 -14.098 6.193 1.00 0.00 H new ATOM 2328 N PHE B 74 9.054 -9.282 3.007 1.00 0.00 N ATOM 2329 CA PHE B 74 9.766 -8.207 2.325 1.00 0.00 C ATOM 2330 C PHE B 74 10.991 -7.771 3.115 1.00 0.00 C ATOM 2331 O PHE B 74 10.939 -7.644 4.337 1.00 0.00 O ATOM 2332 CB PHE B 74 8.844 -7.005 2.116 1.00 0.00 C ATOM 2333 CG PHE B 74 7.612 -7.310 1.314 1.00 0.00 C ATOM 2334 CD1 PHE B 74 7.691 -7.516 -0.054 1.00 0.00 C ATOM 2335 CD2 PHE B 74 6.372 -7.376 1.927 1.00 0.00 C ATOM 2336 CE1 PHE B 74 6.556 -7.785 -0.796 1.00 0.00 C ATOM 2337 CE2 PHE B 74 5.233 -7.647 1.192 1.00 0.00 C ATOM 2338 CZ PHE B 74 5.325 -7.849 -0.170 1.00 0.00 C ATOM 0 H PHE B 74 8.624 -9.011 3.892 1.00 0.00 H new ATOM 0 HA PHE B 74 10.091 -8.589 1.357 1.00 0.00 H new ATOM 0 HB2 PHE B 74 8.544 -6.617 3.089 1.00 0.00 H new ATOM 0 HB3 PHE B 74 9.403 -6.214 1.616 1.00 0.00 H new ATOM 0 HD1 PHE B 74 8.651 -7.466 -0.547 1.00 0.00 H new ATOM 0 HD2 PHE B 74 6.294 -7.214 2.992 1.00 0.00 H new ATOM 0 HE1 PHE B 74 6.631 -7.945 -1.862 1.00 0.00 H new ATOM 0 HE2 PHE B 74 4.273 -7.701 1.683 1.00 0.00 H new ATOM 0 HZ PHE B 74 4.436 -8.057 -0.747 1.00 0.00 H new ATOM 2348 N GLU B 75 12.093 -7.542 2.411 1.00 0.00 N ATOM 2349 CA GLU B 75 13.324 -7.101 3.051 1.00 0.00 C ATOM 2350 C GLU B 75 13.331 -5.582 3.173 1.00 0.00 C ATOM 2351 O GLU B 75 13.750 -4.875 2.256 1.00 0.00 O ATOM 2352 CB GLU B 75 14.542 -7.574 2.255 1.00 0.00 C ATOM 2353 CG GLU B 75 15.871 -7.226 2.908 1.00 0.00 C ATOM 2354 CD GLU B 75 17.057 -7.770 2.135 1.00 0.00 C ATOM 2355 OE1 GLU B 75 17.474 -8.913 2.416 1.00 0.00 O ATOM 2356 OE2 GLU B 75 17.567 -7.054 1.248 1.00 0.00 O ATOM 0 H GLU B 75 12.158 -7.654 1.399 1.00 0.00 H new ATOM 0 HA GLU B 75 13.375 -7.537 4.049 1.00 0.00 H new ATOM 0 HB2 GLU B 75 14.483 -8.655 2.125 1.00 0.00 H new ATOM 0 HB3 GLU B 75 14.509 -7.131 1.260 1.00 0.00 H new ATOM 0 HG2 GLU B 75 15.960 -6.143 2.989 1.00 0.00 H new ATOM 0 HG3 GLU B 75 15.889 -7.624 3.923 1.00 0.00 H new ATOM 2363 N VAL B 76 12.852 -5.088 4.309 1.00 0.00 N ATOM 2364 CA VAL B 76 12.789 -3.654 4.556 1.00 0.00 C ATOM 2365 C VAL B 76 13.789 -3.235 5.628 1.00 0.00 C ATOM 2366 O VAL B 76 13.722 -3.701 6.765 1.00 0.00 O ATOM 2367 CB VAL B 76 11.370 -3.226 4.988 1.00 0.00 C ATOM 2368 CG1 VAL B 76 10.800 -4.207 6.001 1.00 0.00 C ATOM 2369 CG2 VAL B 76 11.379 -1.817 5.561 1.00 0.00 C ATOM 0 H VAL B 76 12.501 -5.662 5.075 1.00 0.00 H new ATOM 0 HA VAL B 76 13.042 -3.156 3.620 1.00 0.00 H new ATOM 0 HB VAL B 76 10.732 -3.231 4.104 1.00 0.00 H new ATOM 0 HG11 VAL B 76 9.799 -3.888 6.293 1.00 0.00 H new ATOM 0 HG12 VAL B 76 10.749 -5.201 5.556 1.00 0.00 H new ATOM 0 HG13 VAL B 76 11.443 -4.236 6.881 1.00 0.00 H new ATOM 0 HG21 VAL B 76 10.368 -1.539 5.858 1.00 0.00 H new ATOM 0 HG22 VAL B 76 12.035 -1.782 6.431 1.00 0.00 H new ATOM 0 HG23 VAL B 76 11.740 -1.119 4.806 1.00 0.00 H new