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 Set 1.1: A 72 MET CE :methyl 157:sc= -0.137 (180deg=-0.843) USER MOD Set 1.2: B 72 MET CE :methyl 158:sc= -0.155 (180deg=-0.717) USER MOD Single : A 43 SER OG : rot 40:sc= 0.527 USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -130:sc= 0.312 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ -165:sc= -1.26 (180deg=-1.57) USER MOD Single : A 60 ASN : amide:sc= -0.637 K(o=-0.64,f=-0.0065) USER MOD Single : A 64 LYS NZ :NH3+ -166:sc= -0.0301 (180deg=-0.255) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : B 43 SER OG : rot 44:sc= 0.863 USER MOD Single : B 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ -133:sc= 0.286 (180deg=0) USER MOD Single : B 58 LYS NZ :NH3+ -164:sc= -1.2 (180deg=-1.5) USER MOD Single : B 60 ASN : amide:sc= -0.653 K(o=-0.65,f=0) USER MOD Single : B 64 LYS NZ :NH3+ -167:sc= -0.0457 (180deg=-0.261) USER MOD Single : B 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 THR OG1 : rot 31:sc= 0.109 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 581 N SER A 43 13.312 -6.163 7.704 1.00 0.00 N ATOM 582 CA SER A 43 12.387 -7.197 7.247 1.00 0.00 C ATOM 583 C SER A 43 11.191 -7.314 8.186 1.00 0.00 C ATOM 584 O SER A 43 11.349 -7.308 9.408 1.00 0.00 O ATOM 585 CB SER A 43 13.106 -8.543 7.143 1.00 0.00 C ATOM 586 OG SER A 43 12.223 -9.558 6.694 1.00 0.00 O ATOM 0 HA SER A 43 12.021 -6.912 6.261 1.00 0.00 H new ATOM 0 HB2 SER A 43 13.947 -8.458 6.455 1.00 0.00 H new ATOM 0 HB3 SER A 43 13.516 -8.817 8.115 1.00 0.00 H new ATOM 0 HG SER A 43 11.643 -9.199 5.991 1.00 0.00 H new ATOM 592 N MET A 44 9.993 -7.427 7.610 1.00 0.00 N ATOM 593 CA MET A 44 8.775 -7.534 8.407 1.00 0.00 C ATOM 594 C MET A 44 7.746 -8.431 7.727 1.00 0.00 C ATOM 595 O MET A 44 7.306 -8.154 6.610 1.00 0.00 O ATOM 596 CB MET A 44 8.172 -6.148 8.650 1.00 0.00 C ATOM 597 CG MET A 44 9.070 -5.221 9.455 1.00 0.00 C ATOM 598 SD MET A 44 8.305 -3.620 9.782 1.00 0.00 S ATOM 599 CE MET A 44 9.616 -2.794 10.682 1.00 0.00 C ATOM 0 H MET A 44 9.843 -7.447 6.601 1.00 0.00 H new ATOM 0 HA MET A 44 9.044 -7.982 9.364 1.00 0.00 H new ATOM 0 HB2 MET A 44 7.954 -5.683 7.689 1.00 0.00 H new ATOM 0 HB3 MET A 44 7.222 -6.262 9.172 1.00 0.00 H new ATOM 0 HG2 MET A 44 9.322 -5.698 10.402 1.00 0.00 H new ATOM 0 HG3 MET A 44 10.005 -5.069 8.916 1.00 0.00 H new ATOM 0 HE1 MET A 44 9.293 -1.789 10.955 1.00 0.00 H new ATOM 0 HE2 MET A 44 9.849 -3.358 11.585 1.00 0.00 H new ATOM 0 HE3 MET A 44 10.505 -2.732 10.054 1.00 0.00 H new ATOM 609 N GLU A 45 7.371 -9.507 8.410 1.00 0.00 N ATOM 610 CA GLU A 45 6.386 -10.448 7.891 1.00 0.00 C ATOM 611 C GLU A 45 5.003 -9.803 7.819 1.00 0.00 C ATOM 612 O GLU A 45 4.698 -8.884 8.579 1.00 0.00 O ATOM 613 CB GLU A 45 6.332 -11.692 8.780 1.00 0.00 C ATOM 614 CG GLU A 45 7.693 -12.327 9.022 1.00 0.00 C ATOM 615 CD GLU A 45 7.616 -13.553 9.909 1.00 0.00 C ATOM 616 OE1 GLU A 45 7.708 -13.399 11.145 1.00 0.00 O ATOM 617 OE2 GLU A 45 7.464 -14.669 9.368 1.00 0.00 O ATOM 0 H GLU A 45 7.737 -9.750 9.330 1.00 0.00 H new ATOM 0 HA GLU A 45 6.686 -10.736 6.883 1.00 0.00 H new ATOM 0 HB2 GLU A 45 5.890 -11.424 9.739 1.00 0.00 H new ATOM 0 HB3 GLU A 45 5.673 -12.429 8.320 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.136 -12.603 8.065 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.356 -11.593 9.480 1.00 0.00 H new ATOM 624 N VAL A 46 4.173 -10.292 6.901 1.00 0.00 N ATOM 625 CA VAL A 46 2.820 -9.765 6.734 1.00 0.00 C ATOM 626 C VAL A 46 1.807 -10.899 6.555 1.00 0.00 C ATOM 627 O VAL A 46 2.085 -11.882 5.866 1.00 0.00 O ATOM 628 CB VAL A 46 2.729 -8.814 5.524 1.00 0.00 C ATOM 629 CG1 VAL A 46 3.662 -7.627 5.700 1.00 0.00 C ATOM 630 CG2 VAL A 46 3.041 -9.554 4.233 1.00 0.00 C ATOM 0 H VAL A 46 4.412 -11.051 6.262 1.00 0.00 H new ATOM 0 HA VAL A 46 2.584 -9.207 7.640 1.00 0.00 H new ATOM 0 HB VAL A 46 1.707 -8.439 5.464 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.581 -6.969 4.835 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.386 -7.078 6.600 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.689 -7.982 5.792 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.971 -8.864 3.392 1.00 0.00 H new ATOM 0 HG22 VAL A 46 4.050 -9.964 4.283 1.00 0.00 H new ATOM 0 HG23 VAL A 46 2.326 -10.366 4.097 1.00 0.00 H new ATOM 640 N PRO A 47 0.618 -10.781 7.177 1.00 0.00 N ATOM 641 CA PRO A 47 -0.432 -11.783 7.085 1.00 0.00 C ATOM 642 C PRO A 47 -1.540 -11.386 6.111 1.00 0.00 C ATOM 643 O PRO A 47 -1.762 -10.202 5.858 1.00 0.00 O ATOM 644 CB PRO A 47 -0.966 -11.780 8.513 1.00 0.00 C ATOM 645 CG PRO A 47 -0.819 -10.358 8.975 1.00 0.00 C ATOM 646 CD PRO A 47 0.206 -9.693 8.074 1.00 0.00 C ATOM 0 HA PRO A 47 -0.074 -12.745 6.718 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -2.007 -12.101 8.547 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -0.401 -12.463 9.148 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -1.774 -9.836 8.921 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.496 -10.324 10.015 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -0.224 -8.857 7.522 1.00 0.00 H new ATOM 0 HD3 PRO A 47 1.048 -9.299 8.643 1.00 0.00 H new ATOM 654 N ALA A 48 -2.230 -12.383 5.567 1.00 0.00 N ATOM 655 CA ALA A 48 -3.317 -12.136 4.626 1.00 0.00 C ATOM 656 C ALA A 48 -4.476 -11.412 5.311 1.00 0.00 C ATOM 657 O ALA A 48 -4.712 -11.603 6.505 1.00 0.00 O ATOM 658 CB ALA A 48 -3.794 -13.446 4.014 1.00 0.00 C ATOM 0 H ALA A 48 -2.056 -13.369 5.761 1.00 0.00 H new ATOM 0 HA ALA A 48 -2.941 -11.495 3.829 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.605 -13.246 3.314 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -2.968 -13.923 3.486 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -4.151 -14.108 4.803 1.00 0.00 H new ATOM 664 N PRO A 49 -5.217 -10.567 4.568 1.00 0.00 N ATOM 665 CA PRO A 49 -6.348 -9.817 5.123 1.00 0.00 C ATOM 666 C PRO A 49 -7.556 -10.703 5.409 1.00 0.00 C ATOM 667 O PRO A 49 -8.135 -10.647 6.494 1.00 0.00 O ATOM 668 CB PRO A 49 -6.677 -8.804 4.026 1.00 0.00 C ATOM 669 CG PRO A 49 -6.210 -9.444 2.765 1.00 0.00 C ATOM 670 CD PRO A 49 -5.012 -10.276 3.136 1.00 0.00 C ATOM 0 HA PRO A 49 -6.099 -9.363 6.082 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.746 -8.593 3.990 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.170 -7.855 4.199 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -6.994 -10.063 2.329 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -5.947 -8.692 2.021 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -4.961 -11.190 2.545 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -4.081 -9.735 2.967 1.00 0.00 H new ATOM 678 N PHE A 50 -7.933 -11.520 4.430 1.00 0.00 N ATOM 679 CA PHE A 50 -9.077 -12.413 4.577 1.00 0.00 C ATOM 680 C PHE A 50 -8.890 -13.680 3.750 1.00 0.00 C ATOM 681 O PHE A 50 -8.186 -13.673 2.740 1.00 0.00 O ATOM 682 CB PHE A 50 -10.363 -11.699 4.150 1.00 0.00 C ATOM 683 CG PHE A 50 -10.359 -11.264 2.711 1.00 0.00 C ATOM 684 CD1 PHE A 50 -9.696 -10.111 2.324 1.00 0.00 C ATOM 685 CD2 PHE A 50 -11.016 -12.011 1.745 1.00 0.00 C ATOM 686 CE1 PHE A 50 -9.686 -9.711 1.001 1.00 0.00 C ATOM 687 CE2 PHE A 50 -11.010 -11.615 0.421 1.00 0.00 C ATOM 688 CZ PHE A 50 -10.344 -10.464 0.048 1.00 0.00 C ATOM 0 H PHE A 50 -7.463 -11.582 3.527 1.00 0.00 H new ATOM 0 HA PHE A 50 -9.154 -12.695 5.627 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.211 -12.363 4.318 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -10.512 -10.826 4.785 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -9.181 -9.518 3.065 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -11.538 -12.912 2.030 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -9.164 -8.810 0.713 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -11.526 -12.205 -0.322 1.00 0.00 H new ATOM 0 HZ PHE A 50 -10.338 -10.153 -0.986 1.00 0.00 H new ATOM 698 N ALA A 51 -9.524 -14.764 4.186 1.00 0.00 N ATOM 699 CA ALA A 51 -9.432 -16.037 3.481 1.00 0.00 C ATOM 700 C ALA A 51 -9.953 -15.901 2.054 1.00 0.00 C ATOM 701 O ALA A 51 -10.936 -15.204 1.807 1.00 0.00 O ATOM 702 CB ALA A 51 -10.202 -17.113 4.230 1.00 0.00 C ATOM 0 H ALA A 51 -10.106 -14.786 5.023 1.00 0.00 H new ATOM 0 HA ALA A 51 -8.383 -16.330 3.434 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.124 -18.058 3.692 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.784 -17.230 5.230 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -11.250 -16.824 4.306 1.00 0.00 H new ATOM 708 N GLY A 52 -9.289 -16.573 1.119 1.00 0.00 N ATOM 709 CA GLY A 52 -9.699 -16.502 -0.271 1.00 0.00 C ATOM 710 C GLY A 52 -9.096 -17.600 -1.120 1.00 0.00 C ATOM 711 O GLY A 52 -8.551 -18.573 -0.598 1.00 0.00 O ATOM 0 H GLY A 52 -8.477 -17.164 1.298 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.786 -16.562 -0.327 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.411 -15.534 -0.680 1.00 0.00 H new ATOM 715 N VAL A 53 -9.207 -17.446 -2.434 1.00 0.00 N ATOM 716 CA VAL A 53 -8.664 -18.419 -3.370 1.00 0.00 C ATOM 717 C VAL A 53 -7.936 -17.715 -4.508 1.00 0.00 C ATOM 718 O VAL A 53 -8.474 -16.798 -5.127 1.00 0.00 O ATOM 719 CB VAL A 53 -9.769 -19.321 -3.958 1.00 0.00 C ATOM 720 CG1 VAL A 53 -9.178 -20.325 -4.936 1.00 0.00 C ATOM 721 CG2 VAL A 53 -10.526 -20.033 -2.848 1.00 0.00 C ATOM 0 H VAL A 53 -9.671 -16.652 -2.876 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.964 -19.044 -2.815 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.473 -18.690 -4.501 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.973 -20.952 -5.339 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.686 -19.793 -5.751 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.450 -20.951 -4.420 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -11.301 -20.664 -3.283 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.835 -20.650 -2.274 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.986 -19.296 -2.190 1.00 0.00 H new ATOM 731 N VAL A 54 -6.709 -18.147 -4.776 1.00 0.00 N ATOM 732 CA VAL A 54 -5.910 -17.554 -5.838 1.00 0.00 C ATOM 733 C VAL A 54 -6.456 -17.937 -7.208 1.00 0.00 C ATOM 734 O VAL A 54 -6.233 -19.049 -7.689 1.00 0.00 O ATOM 735 CB VAL A 54 -4.434 -17.985 -5.742 1.00 0.00 C ATOM 736 CG1 VAL A 54 -3.623 -17.390 -6.882 1.00 0.00 C ATOM 737 CG2 VAL A 54 -3.849 -17.583 -4.397 1.00 0.00 C ATOM 0 H VAL A 54 -6.248 -18.905 -4.272 1.00 0.00 H new ATOM 0 HA VAL A 54 -5.968 -16.473 -5.715 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.388 -19.071 -5.826 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.584 -17.708 -6.794 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -4.028 -17.733 -7.834 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -3.675 -16.302 -6.836 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.806 -17.895 -4.346 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.910 -16.501 -4.283 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.411 -18.065 -3.597 1.00 0.00 H new ATOM 747 N LYS A 55 -7.176 -17.010 -7.831 1.00 0.00 N ATOM 748 CA LYS A 55 -7.755 -17.246 -9.147 1.00 0.00 C ATOM 749 C LYS A 55 -6.906 -16.603 -10.240 1.00 0.00 C ATOM 750 O LYS A 55 -6.711 -17.184 -11.307 1.00 0.00 O ATOM 751 CB LYS A 55 -9.184 -16.700 -9.204 1.00 0.00 C ATOM 752 CG LYS A 55 -9.891 -16.968 -10.523 1.00 0.00 C ATOM 753 CD LYS A 55 -11.317 -16.443 -10.506 1.00 0.00 C ATOM 754 CE LYS A 55 -12.038 -16.745 -11.811 1.00 0.00 C ATOM 755 NZ LYS A 55 -13.439 -16.240 -11.804 1.00 0.00 N ATOM 0 H LYS A 55 -7.372 -16.087 -7.444 1.00 0.00 H new ATOM 0 HA LYS A 55 -7.778 -18.322 -9.318 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -9.765 -17.143 -8.395 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -9.159 -15.625 -9.028 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -9.338 -16.497 -11.336 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -9.899 -18.040 -10.722 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -11.862 -16.893 -9.676 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -11.307 -15.367 -10.335 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -11.493 -16.292 -12.639 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -12.041 -17.821 -11.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -14.083 -16.999 -12.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -13.692 -15.932 -10.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -13.521 -15.436 -12.459 1.00 0.00 H new ATOM 769 N GLU A 56 -6.400 -15.404 -9.965 1.00 0.00 N ATOM 770 CA GLU A 56 -5.573 -14.687 -10.931 1.00 0.00 C ATOM 771 C GLU A 56 -4.545 -13.809 -10.226 1.00 0.00 C ATOM 772 O GLU A 56 -4.889 -12.788 -9.630 1.00 0.00 O ATOM 773 CB GLU A 56 -6.449 -13.831 -11.849 1.00 0.00 C ATOM 774 CG GLU A 56 -5.669 -13.106 -12.933 1.00 0.00 C ATOM 775 CD GLU A 56 -6.560 -12.266 -13.828 1.00 0.00 C ATOM 776 OE1 GLU A 56 -7.111 -12.817 -14.803 1.00 0.00 O ATOM 777 OE2 GLU A 56 -6.707 -11.056 -13.552 1.00 0.00 O ATOM 0 H GLU A 56 -6.547 -14.910 -9.085 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.041 -15.425 -11.532 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.200 -14.467 -12.317 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -6.984 -13.097 -11.246 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -4.919 -12.466 -12.469 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -5.134 -13.836 -13.541 1.00 0.00 H new ATOM 784 N LEU A 57 -3.282 -14.218 -10.295 1.00 0.00 N ATOM 785 CA LEU A 57 -2.198 -13.471 -9.666 1.00 0.00 C ATOM 786 C LEU A 57 -2.019 -12.107 -10.326 1.00 0.00 C ATOM 787 O LEU A 57 -2.617 -11.825 -11.365 1.00 0.00 O ATOM 788 CB LEU A 57 -0.889 -14.266 -9.739 1.00 0.00 C ATOM 789 CG LEU A 57 -0.135 -14.185 -11.073 1.00 0.00 C ATOM 790 CD1 LEU A 57 1.223 -14.856 -10.953 1.00 0.00 C ATOM 791 CD2 LEU A 57 -0.945 -14.822 -12.194 1.00 0.00 C ATOM 0 H LEU A 57 -2.984 -15.064 -10.781 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.460 -13.314 -8.620 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.228 -13.915 -8.947 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.109 -15.313 -9.530 1.00 0.00 H new ATOM 0 HG LEU A 57 0.014 -13.133 -11.317 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.747 -14.791 -11.907 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.809 -14.356 -10.182 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.089 -15.904 -10.684 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.390 -14.752 -13.129 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.130 -15.870 -11.959 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.896 -14.300 -12.297 1.00 0.00 H new ATOM 803 N LYS A 58 -1.189 -11.266 -9.716 1.00 0.00 N ATOM 804 CA LYS A 58 -0.928 -9.931 -10.243 1.00 0.00 C ATOM 805 C LYS A 58 0.572 -9.677 -10.361 1.00 0.00 C ATOM 806 O LYS A 58 1.032 -9.058 -11.321 1.00 0.00 O ATOM 807 CB LYS A 58 -1.565 -8.867 -9.345 1.00 0.00 C ATOM 808 CG LYS A 58 -3.083 -8.955 -9.272 1.00 0.00 C ATOM 809 CD LYS A 58 -3.732 -8.692 -10.625 1.00 0.00 C ATOM 810 CE LYS A 58 -3.500 -7.262 -11.091 1.00 0.00 C ATOM 811 NZ LYS A 58 -4.004 -6.266 -10.106 1.00 0.00 N ATOM 0 H LYS A 58 -0.686 -11.486 -8.856 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.371 -9.870 -11.237 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.156 -8.961 -8.339 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -1.285 -7.880 -9.712 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.373 -9.944 -8.916 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.454 -8.233 -8.545 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.329 -9.385 -11.363 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.803 -8.884 -10.559 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.434 -7.102 -11.255 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.997 -7.108 -12.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.063 -5.331 -10.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.948 -6.551 -9.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.354 -6.219 -9.296 1.00 0.00 H new ATOM 825 N VAL A 59 1.328 -10.160 -9.380 1.00 0.00 N ATOM 826 CA VAL A 59 2.771 -9.989 -9.370 1.00 0.00 C ATOM 827 C VAL A 59 3.476 -11.342 -9.407 1.00 0.00 C ATOM 828 O VAL A 59 2.870 -12.375 -9.124 1.00 0.00 O ATOM 829 CB VAL A 59 3.232 -9.222 -8.118 1.00 0.00 C ATOM 830 CG1 VAL A 59 4.610 -8.623 -8.332 1.00 0.00 C ATOM 831 CG2 VAL A 59 2.225 -8.145 -7.747 1.00 0.00 C ATOM 0 H VAL A 59 0.960 -10.675 -8.580 1.00 0.00 H new ATOM 0 HA VAL A 59 3.034 -9.415 -10.258 1.00 0.00 H new ATOM 0 HB VAL A 59 3.295 -9.927 -7.289 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.916 -8.085 -7.435 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.325 -9.419 -8.540 1.00 0.00 H new ATOM 0 HG13 VAL A 59 4.580 -7.933 -9.176 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.570 -7.615 -6.859 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.123 -7.442 -8.573 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.259 -8.606 -7.542 1.00 0.00 H new ATOM 841 N ASN A 60 4.755 -11.324 -9.755 1.00 0.00 N ATOM 842 CA ASN A 60 5.546 -12.547 -9.830 1.00 0.00 C ATOM 843 C ASN A 60 6.602 -12.574 -8.729 1.00 0.00 C ATOM 844 O ASN A 60 7.120 -11.532 -8.327 1.00 0.00 O ATOM 845 CB ASN A 60 6.222 -12.659 -11.200 1.00 0.00 C ATOM 846 CG ASN A 60 5.280 -12.346 -12.351 1.00 0.00 C ATOM 847 OD1 ASN A 60 5.697 -11.808 -13.377 1.00 0.00 O ATOM 848 ND2 ASN A 60 4.004 -12.684 -12.192 1.00 0.00 N ATOM 0 H ASN A 60 5.269 -10.475 -9.990 1.00 0.00 H new ATOM 0 HA ASN A 60 4.876 -13.395 -9.692 1.00 0.00 H new ATOM 0 HB2 ASN A 60 7.072 -11.978 -11.237 1.00 0.00 H new ATOM 0 HB3 ASN A 60 6.616 -13.668 -11.324 1.00 0.00 H new ATOM 0 HD21 ASN A 60 3.331 -12.499 -12.936 1.00 0.00 H new ATOM 0 HD22 ASN A 60 3.698 -13.128 -11.326 1.00 0.00 H new ATOM 855 N VAL A 61 6.914 -13.773 -8.244 1.00 0.00 N ATOM 856 CA VAL A 61 7.907 -13.935 -7.189 1.00 0.00 C ATOM 857 C VAL A 61 9.282 -13.469 -7.655 1.00 0.00 C ATOM 858 O VAL A 61 9.824 -13.985 -8.634 1.00 0.00 O ATOM 859 CB VAL A 61 8.003 -15.403 -6.729 1.00 0.00 C ATOM 860 CG1 VAL A 61 8.977 -15.537 -5.567 1.00 0.00 C ATOM 861 CG2 VAL A 61 6.630 -15.934 -6.348 1.00 0.00 C ATOM 0 H VAL A 61 6.493 -14.645 -8.565 1.00 0.00 H new ATOM 0 HA VAL A 61 7.582 -13.320 -6.350 1.00 0.00 H new ATOM 0 HB VAL A 61 8.380 -16.001 -7.559 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.031 -16.580 -5.256 1.00 0.00 H new ATOM 0 HG12 VAL A 61 9.965 -15.200 -5.880 1.00 0.00 H new ATOM 0 HG13 VAL A 61 8.633 -14.927 -4.732 1.00 0.00 H new ATOM 0 HG21 VAL A 61 6.718 -16.972 -6.026 1.00 0.00 H new ATOM 0 HG22 VAL A 61 6.221 -15.335 -5.534 1.00 0.00 H new ATOM 0 HG23 VAL A 61 5.966 -15.877 -7.210 1.00 0.00 H new ATOM 871 N GLY A 62 9.841 -12.491 -6.949 1.00 0.00 N ATOM 872 CA GLY A 62 11.150 -11.973 -7.305 1.00 0.00 C ATOM 873 C GLY A 62 11.112 -10.501 -7.669 1.00 0.00 C ATOM 874 O GLY A 62 12.154 -9.881 -7.883 1.00 0.00 O ATOM 0 H GLY A 62 9.411 -12.048 -6.137 1.00 0.00 H new ATOM 0 HA2 GLY A 62 11.835 -12.120 -6.470 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.546 -12.542 -8.146 1.00 0.00 H new ATOM 878 N ASP A 63 9.908 -9.942 -7.738 1.00 0.00 N ATOM 879 CA ASP A 63 9.737 -8.534 -8.078 1.00 0.00 C ATOM 880 C ASP A 63 9.401 -7.712 -6.838 1.00 0.00 C ATOM 881 O ASP A 63 8.453 -8.020 -6.116 1.00 0.00 O ATOM 882 CB ASP A 63 8.637 -8.373 -9.128 1.00 0.00 C ATOM 883 CG ASP A 63 8.949 -9.122 -10.409 1.00 0.00 C ATOM 884 OD1 ASP A 63 8.639 -10.330 -10.481 1.00 0.00 O ATOM 885 OD2 ASP A 63 9.503 -8.500 -11.340 1.00 0.00 O ATOM 0 H ASP A 63 9.037 -10.442 -7.563 1.00 0.00 H new ATOM 0 HA ASP A 63 10.677 -8.167 -8.489 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.693 -8.734 -8.720 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.504 -7.315 -9.352 1.00 0.00 H new ATOM 890 N LYS A 64 10.188 -6.666 -6.599 1.00 0.00 N ATOM 891 CA LYS A 64 9.981 -5.792 -5.449 1.00 0.00 C ATOM 892 C LYS A 64 8.558 -5.238 -5.432 1.00 0.00 C ATOM 893 O LYS A 64 7.893 -5.173 -6.467 1.00 0.00 O ATOM 894 CB LYS A 64 10.995 -4.641 -5.459 1.00 0.00 C ATOM 895 CG LYS A 64 10.715 -3.566 -6.505 1.00 0.00 C ATOM 896 CD LYS A 64 10.902 -4.085 -7.924 1.00 0.00 C ATOM 897 CE LYS A 64 12.346 -4.479 -8.197 1.00 0.00 C ATOM 898 NZ LYS A 64 13.276 -3.327 -8.041 1.00 0.00 N ATOM 0 H LYS A 64 10.977 -6.403 -7.189 1.00 0.00 H new ATOM 0 HA LYS A 64 10.130 -6.384 -4.546 1.00 0.00 H new ATOM 0 HB2 LYS A 64 11.010 -4.177 -4.473 1.00 0.00 H new ATOM 0 HB3 LYS A 64 11.990 -5.050 -5.633 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.695 -3.201 -6.385 1.00 0.00 H new ATOM 0 HG3 LYS A 64 11.379 -2.718 -6.339 1.00 0.00 H new ATOM 0 HD2 LYS A 64 10.254 -4.947 -8.084 1.00 0.00 H new ATOM 0 HD3 LYS A 64 10.594 -3.318 -8.635 1.00 0.00 H new ATOM 0 HE2 LYS A 64 12.639 -5.277 -7.515 1.00 0.00 H new ATOM 0 HE3 LYS A 64 12.428 -4.877 -9.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 14.198 -3.566 -8.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.882 -2.495 -8.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 13.398 -3.114 -7.030 1.00 0.00 H new ATOM 912 N VAL A 65 8.099 -4.839 -4.249 1.00 0.00 N ATOM 913 CA VAL A 65 6.754 -4.295 -4.094 1.00 0.00 C ATOM 914 C VAL A 65 6.796 -2.825 -3.682 1.00 0.00 C ATOM 915 O VAL A 65 7.806 -2.342 -3.169 1.00 0.00 O ATOM 916 CB VAL A 65 5.951 -5.090 -3.044 1.00 0.00 C ATOM 917 CG1 VAL A 65 6.478 -4.820 -1.643 1.00 0.00 C ATOM 918 CG2 VAL A 65 4.469 -4.763 -3.139 1.00 0.00 C ATOM 0 H VAL A 65 8.639 -4.882 -3.384 1.00 0.00 H new ATOM 0 HA VAL A 65 6.262 -4.380 -5.063 1.00 0.00 H new ATOM 0 HB VAL A 65 6.077 -6.153 -3.252 1.00 0.00 H new ATOM 0 HG11 VAL A 65 5.897 -5.391 -0.919 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.525 -5.118 -1.584 1.00 0.00 H new ATOM 0 HG13 VAL A 65 6.391 -3.757 -1.420 1.00 0.00 H new ATOM 0 HG21 VAL A 65 3.922 -5.335 -2.390 1.00 0.00 H new ATOM 0 HG22 VAL A 65 4.319 -3.698 -2.963 1.00 0.00 H new ATOM 0 HG23 VAL A 65 4.102 -5.022 -4.132 1.00 0.00 H new ATOM 928 N LYS A 66 5.693 -2.120 -3.915 1.00 0.00 N ATOM 929 CA LYS A 66 5.594 -0.708 -3.564 1.00 0.00 C ATOM 930 C LYS A 66 4.206 -0.383 -3.026 1.00 0.00 C ATOM 931 O LYS A 66 3.241 -1.097 -3.298 1.00 0.00 O ATOM 932 CB LYS A 66 5.902 0.166 -4.781 1.00 0.00 C ATOM 933 CG LYS A 66 7.324 0.015 -5.291 1.00 0.00 C ATOM 934 CD LYS A 66 7.591 0.931 -6.472 1.00 0.00 C ATOM 935 CE LYS A 66 9.008 0.765 -6.994 1.00 0.00 C ATOM 936 NZ LYS A 66 9.279 1.654 -8.156 1.00 0.00 N ATOM 0 H LYS A 66 4.853 -2.505 -4.347 1.00 0.00 H new ATOM 0 HA LYS A 66 6.326 -0.499 -2.784 1.00 0.00 H new ATOM 0 HB2 LYS A 66 5.208 -0.085 -5.583 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.726 1.210 -4.522 1.00 0.00 H new ATOM 0 HG2 LYS A 66 8.026 0.241 -4.488 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.498 -1.020 -5.585 1.00 0.00 H new ATOM 0 HD2 LYS A 66 6.880 0.715 -7.270 1.00 0.00 H new ATOM 0 HD3 LYS A 66 7.431 1.967 -6.174 1.00 0.00 H new ATOM 0 HE2 LYS A 66 9.717 0.985 -6.196 1.00 0.00 H new ATOM 0 HE3 LYS A 66 9.168 -0.273 -7.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 10.256 1.511 -8.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 8.619 1.428 -8.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 9.151 2.646 -7.871 1.00 0.00 H new ATOM 950 N THR A 67 4.113 0.700 -2.260 1.00 0.00 N ATOM 951 CA THR A 67 2.843 1.120 -1.682 1.00 0.00 C ATOM 952 C THR A 67 1.847 1.513 -2.768 1.00 0.00 C ATOM 953 O THR A 67 2.180 2.259 -3.688 1.00 0.00 O ATOM 954 CB THR A 67 3.030 2.309 -0.721 1.00 0.00 C ATOM 955 OG1 THR A 67 3.633 3.409 -1.414 1.00 0.00 O ATOM 956 CG2 THR A 67 3.895 1.914 0.464 1.00 0.00 C ATOM 0 H THR A 67 4.903 1.302 -2.026 1.00 0.00 H new ATOM 0 HA THR A 67 2.453 0.268 -1.125 1.00 0.00 H new ATOM 0 HB THR A 67 2.049 2.608 -0.351 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.747 4.162 -0.797 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.013 2.769 1.129 1.00 0.00 H new ATOM 0 HG22 THR A 67 3.419 1.096 1.005 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.874 1.592 0.109 1.00 0.00 H new ATOM 964 N GLY A 68 0.622 1.007 -2.652 1.00 0.00 N ATOM 965 CA GLY A 68 -0.406 1.316 -3.629 1.00 0.00 C ATOM 966 C GLY A 68 -0.517 0.259 -4.711 1.00 0.00 C ATOM 967 O GLY A 68 -1.486 0.240 -5.470 1.00 0.00 O ATOM 0 H GLY A 68 0.324 0.388 -1.898 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.366 1.415 -3.122 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.188 2.280 -4.089 1.00 0.00 H new ATOM 971 N SER A 69 0.477 -0.622 -4.782 1.00 0.00 N ATOM 972 CA SER A 69 0.486 -1.688 -5.778 1.00 0.00 C ATOM 973 C SER A 69 -0.213 -2.935 -5.246 1.00 0.00 C ATOM 974 O SER A 69 -0.091 -3.271 -4.068 1.00 0.00 O ATOM 975 CB SER A 69 1.921 -2.026 -6.184 1.00 0.00 C ATOM 976 OG SER A 69 1.949 -3.060 -7.154 1.00 0.00 O ATOM 0 H SER A 69 1.286 -0.618 -4.161 1.00 0.00 H new ATOM 0 HA SER A 69 -0.057 -1.335 -6.655 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.408 -1.136 -6.583 1.00 0.00 H new ATOM 0 HB3 SER A 69 2.488 -2.333 -5.305 1.00 0.00 H new ATOM 0 HG SER A 69 2.878 -3.255 -7.397 1.00 0.00 H new ATOM 982 N LEU A 70 -0.945 -3.615 -6.122 1.00 0.00 N ATOM 983 CA LEU A 70 -1.666 -4.824 -5.742 1.00 0.00 C ATOM 984 C LEU A 70 -0.724 -6.023 -5.683 1.00 0.00 C ATOM 985 O LEU A 70 0.401 -5.963 -6.181 1.00 0.00 O ATOM 986 CB LEU A 70 -2.804 -5.100 -6.729 1.00 0.00 C ATOM 987 CG LEU A 70 -3.992 -4.138 -6.647 1.00 0.00 C ATOM 988 CD1 LEU A 70 -3.595 -2.744 -7.112 1.00 0.00 C ATOM 989 CD2 LEU A 70 -5.157 -4.661 -7.472 1.00 0.00 C ATOM 0 H LEU A 70 -1.055 -3.349 -7.101 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.088 -4.667 -4.749 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -2.401 -5.067 -7.741 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -3.167 -6.114 -6.564 1.00 0.00 H new ATOM 0 HG LEU A 70 -4.305 -4.073 -5.605 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -4.456 -2.079 -7.044 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -2.793 -2.364 -6.480 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.252 -2.789 -8.146 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.993 -3.965 -7.403 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.851 -4.758 -8.514 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.463 -5.636 -7.092 1.00 0.00 H new ATOM 1001 N ILE A 71 -1.189 -7.110 -5.074 1.00 0.00 N ATOM 1002 CA ILE A 71 -0.381 -8.318 -4.951 1.00 0.00 C ATOM 1003 C ILE A 71 -1.115 -9.542 -5.493 1.00 0.00 C ATOM 1004 O ILE A 71 -0.551 -10.322 -6.260 1.00 0.00 O ATOM 1005 CB ILE A 71 0.028 -8.580 -3.487 1.00 0.00 C ATOM 1006 CG1 ILE A 71 -1.193 -8.507 -2.566 1.00 0.00 C ATOM 1007 CG2 ILE A 71 1.092 -7.583 -3.052 1.00 0.00 C ATOM 1008 CD1 ILE A 71 -0.896 -8.883 -1.129 1.00 0.00 C ATOM 0 H ILE A 71 -2.118 -7.179 -4.659 1.00 0.00 H new ATOM 0 HA ILE A 71 0.517 -8.151 -5.546 1.00 0.00 H new ATOM 0 HB ILE A 71 0.446 -9.584 -3.416 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.596 -7.495 -2.591 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.968 -9.168 -2.952 1.00 0.00 H new ATOM 0 HG21 ILE A 71 1.372 -7.778 -2.017 1.00 0.00 H new ATOM 0 HG22 ILE A 71 1.969 -7.685 -3.691 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.698 -6.570 -3.136 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.808 -8.808 -0.537 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -0.522 -9.906 -1.090 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.144 -8.206 -0.724 1.00 0.00 H new ATOM 1020 N MET A 72 -2.371 -9.707 -5.090 1.00 0.00 N ATOM 1021 CA MET A 72 -3.175 -10.839 -5.537 1.00 0.00 C ATOM 1022 C MET A 72 -4.650 -10.609 -5.225 1.00 0.00 C ATOM 1023 O MET A 72 -4.988 -10.012 -4.205 1.00 0.00 O ATOM 1024 CB MET A 72 -2.690 -12.130 -4.870 1.00 0.00 C ATOM 1025 CG MET A 72 -2.603 -12.038 -3.355 1.00 0.00 C ATOM 1026 SD MET A 72 -1.869 -13.506 -2.611 1.00 0.00 S ATOM 1027 CE MET A 72 -0.215 -13.447 -3.297 1.00 0.00 C ATOM 0 H MET A 72 -2.854 -9.071 -4.455 1.00 0.00 H new ATOM 0 HA MET A 72 -3.062 -10.935 -6.617 1.00 0.00 H new ATOM 0 HB2 MET A 72 -3.365 -12.943 -5.138 1.00 0.00 H new ATOM 0 HB3 MET A 72 -1.708 -12.387 -5.267 1.00 0.00 H new ATOM 0 HG2 MET A 72 -2.013 -11.163 -3.081 1.00 0.00 H new ATOM 0 HG3 MET A 72 -3.602 -11.889 -2.946 1.00 0.00 H new ATOM 0 HE1 MET A 72 0.465 -14.006 -2.655 1.00 0.00 H new ATOM 0 HE2 MET A 72 -0.219 -13.888 -4.294 1.00 0.00 H new ATOM 0 HE3 MET A 72 0.116 -12.410 -3.360 1.00 0.00 H new ATOM 1037 N ILE A 73 -5.523 -11.086 -6.106 1.00 0.00 N ATOM 1038 CA ILE A 73 -6.959 -10.919 -5.916 1.00 0.00 C ATOM 1039 C ILE A 73 -7.619 -12.231 -5.510 1.00 0.00 C ATOM 1040 O ILE A 73 -7.368 -13.276 -6.109 1.00 0.00 O ATOM 1041 CB ILE A 73 -7.642 -10.399 -7.198 1.00 0.00 C ATOM 1042 CG1 ILE A 73 -6.772 -9.340 -7.887 1.00 0.00 C ATOM 1043 CG2 ILE A 73 -9.018 -9.834 -6.871 1.00 0.00 C ATOM 1044 CD1 ILE A 73 -6.428 -8.158 -7.005 1.00 0.00 C ATOM 0 H ILE A 73 -5.263 -11.589 -6.954 1.00 0.00 H new ATOM 0 HA ILE A 73 -7.084 -10.186 -5.119 1.00 0.00 H new ATOM 0 HB ILE A 73 -7.765 -11.235 -7.887 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -5.848 -9.808 -8.227 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -7.291 -8.979 -8.775 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -9.489 -9.471 -7.785 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -9.637 -10.615 -6.430 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -8.915 -9.011 -6.164 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.811 -7.454 -7.564 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.345 -7.663 -6.686 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -5.879 -8.505 -6.129 1.00 0.00 H new ATOM 1056 N PHE A 74 -8.462 -12.167 -4.484 1.00 0.00 N ATOM 1057 CA PHE A 74 -9.166 -13.347 -3.999 1.00 0.00 C ATOM 1058 C PHE A 74 -10.640 -13.289 -4.369 1.00 0.00 C ATOM 1059 O PHE A 74 -11.171 -12.225 -4.683 1.00 0.00 O ATOM 1060 CB PHE A 74 -9.037 -13.459 -2.482 1.00 0.00 C ATOM 1061 CG PHE A 74 -7.622 -13.466 -1.995 1.00 0.00 C ATOM 1062 CD1 PHE A 74 -6.775 -14.513 -2.306 1.00 0.00 C ATOM 1063 CD2 PHE A 74 -7.142 -12.425 -1.219 1.00 0.00 C ATOM 1064 CE1 PHE A 74 -5.473 -14.525 -1.853 1.00 0.00 C ATOM 1065 CE2 PHE A 74 -5.841 -12.430 -0.760 1.00 0.00 C ATOM 1066 CZ PHE A 74 -5.003 -13.481 -1.077 1.00 0.00 C ATOM 0 H PHE A 74 -8.674 -11.310 -3.973 1.00 0.00 H new ATOM 0 HA PHE A 74 -8.713 -14.220 -4.470 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -9.567 -12.626 -2.019 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.530 -14.373 -2.151 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.137 -15.331 -2.911 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.793 -11.600 -0.970 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -4.821 -15.349 -2.104 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -5.478 -11.613 -0.154 1.00 0.00 H new ATOM 0 HZ PHE A 74 -3.984 -13.488 -0.720 1.00 0.00 H new ATOM 1076 N GLU A 75 -11.295 -14.444 -4.331 1.00 0.00 N ATOM 1077 CA GLU A 75 -12.713 -14.525 -4.643 1.00 0.00 C ATOM 1078 C GLU A 75 -13.450 -15.284 -3.547 1.00 0.00 C ATOM 1079 O GLU A 75 -13.551 -16.510 -3.586 1.00 0.00 O ATOM 1080 CB GLU A 75 -12.932 -15.210 -5.993 1.00 0.00 C ATOM 1081 CG GLU A 75 -14.345 -15.057 -6.529 1.00 0.00 C ATOM 1082 CD GLU A 75 -14.576 -15.851 -7.800 1.00 0.00 C ATOM 1083 OE1 GLU A 75 -14.163 -15.378 -8.879 1.00 0.00 O ATOM 1084 OE2 GLU A 75 -15.169 -16.948 -7.714 1.00 0.00 O ATOM 0 H GLU A 75 -10.865 -15.336 -4.087 1.00 0.00 H new ATOM 0 HA GLU A 75 -13.109 -13.511 -4.702 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -12.230 -14.798 -6.718 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -12.702 -16.271 -5.894 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -15.055 -15.381 -5.768 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -14.544 -14.003 -6.722 1.00 0.00 H new ATOM 1091 N VAL A 76 -13.957 -14.545 -2.565 1.00 0.00 N ATOM 1092 CA VAL A 76 -14.684 -15.147 -1.455 1.00 0.00 C ATOM 1093 C VAL A 76 -16.184 -15.148 -1.725 1.00 0.00 C ATOM 1094 O VAL A 76 -16.806 -14.093 -1.839 1.00 0.00 O ATOM 1095 CB VAL A 76 -14.393 -14.407 -0.131 1.00 0.00 C ATOM 1096 CG1 VAL A 76 -14.465 -12.900 -0.330 1.00 0.00 C ATOM 1097 CG2 VAL A 76 -15.355 -14.850 0.964 1.00 0.00 C ATOM 0 H VAL A 76 -13.877 -13.529 -2.516 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.341 -16.177 -1.361 1.00 0.00 H new ATOM 0 HB VAL A 76 -13.381 -14.664 0.183 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -14.257 -12.398 0.615 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -13.728 -12.595 -1.073 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -15.462 -12.626 -0.675 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -15.129 -14.314 1.886 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -16.379 -14.632 0.659 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -15.247 -15.922 1.132 1.00 0.00 H new ATOM 1853 N SER B 43 -15.315 -11.297 -4.858 1.00 0.00 N ATOM 1854 CA SER B 43 -13.911 -11.002 -5.118 1.00 0.00 C ATOM 1855 C SER B 43 -13.554 -9.593 -4.654 1.00 0.00 C ATOM 1856 O SER B 43 -14.278 -8.637 -4.933 1.00 0.00 O ATOM 1857 CB SER B 43 -13.607 -11.153 -6.610 1.00 0.00 C ATOM 1858 OG SER B 43 -12.253 -10.840 -6.891 1.00 0.00 O ATOM 0 HA SER B 43 -13.306 -11.713 -4.555 1.00 0.00 H new ATOM 0 HB2 SER B 43 -13.820 -12.174 -6.926 1.00 0.00 H new ATOM 0 HB3 SER B 43 -14.261 -10.498 -7.185 1.00 0.00 H new ATOM 0 HG SER B 43 -11.675 -11.256 -6.218 1.00 0.00 H new ATOM 1864 N MET B 44 -12.436 -9.471 -3.944 1.00 0.00 N ATOM 1865 CA MET B 44 -11.989 -8.176 -3.443 1.00 0.00 C ATOM 1866 C MET B 44 -10.479 -8.024 -3.591 1.00 0.00 C ATOM 1867 O MET B 44 -9.709 -8.853 -3.104 1.00 0.00 O ATOM 1868 CB MET B 44 -12.391 -8.007 -1.975 1.00 0.00 C ATOM 1869 CG MET B 44 -13.894 -8.026 -1.752 1.00 0.00 C ATOM 1870 SD MET B 44 -14.345 -7.812 -0.018 1.00 0.00 S ATOM 1871 CE MET B 44 -16.130 -7.910 -0.116 1.00 0.00 C ATOM 0 H MET B 44 -11.825 -10.251 -3.703 1.00 0.00 H new ATOM 0 HA MET B 44 -12.472 -7.400 -4.037 1.00 0.00 H new ATOM 0 HB2 MET B 44 -11.934 -8.804 -1.388 1.00 0.00 H new ATOM 0 HB3 MET B 44 -11.988 -7.065 -1.602 1.00 0.00 H new ATOM 0 HG2 MET B 44 -14.355 -7.234 -2.343 1.00 0.00 H new ATOM 0 HG3 MET B 44 -14.299 -8.971 -2.114 1.00 0.00 H new ATOM 0 HE1 MET B 44 -16.556 -7.795 0.881 1.00 0.00 H new ATOM 0 HE2 MET B 44 -16.503 -7.117 -0.764 1.00 0.00 H new ATOM 0 HE3 MET B 44 -16.419 -8.878 -0.525 1.00 0.00 H new ATOM 1881 N GLU B 45 -10.064 -6.956 -4.268 1.00 0.00 N ATOM 1882 CA GLU B 45 -8.648 -6.685 -4.486 1.00 0.00 C ATOM 1883 C GLU B 45 -7.978 -6.226 -3.194 1.00 0.00 C ATOM 1884 O GLU B 45 -8.627 -5.647 -2.322 1.00 0.00 O ATOM 1885 CB GLU B 45 -8.478 -5.616 -5.567 1.00 0.00 C ATOM 1886 CG GLU B 45 -9.213 -5.936 -6.859 1.00 0.00 C ATOM 1887 CD GLU B 45 -9.063 -4.845 -7.901 1.00 0.00 C ATOM 1888 OE1 GLU B 45 -9.837 -3.866 -7.850 1.00 0.00 O ATOM 1889 OE2 GLU B 45 -8.174 -4.972 -8.769 1.00 0.00 O ATOM 0 H GLU B 45 -10.692 -6.263 -4.676 1.00 0.00 H new ATOM 0 HA GLU B 45 -8.170 -7.608 -4.814 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.836 -4.661 -5.182 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -7.416 -5.495 -5.783 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.836 -6.875 -7.264 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -10.271 -6.084 -6.643 1.00 0.00 H new ATOM 1896 N VAL B 46 -6.679 -6.488 -3.076 1.00 0.00 N ATOM 1897 CA VAL B 46 -5.931 -6.095 -1.888 1.00 0.00 C ATOM 1898 C VAL B 46 -4.598 -5.443 -2.259 1.00 0.00 C ATOM 1899 O VAL B 46 -3.914 -5.894 -3.178 1.00 0.00 O ATOM 1900 CB VAL B 46 -5.664 -7.296 -0.958 1.00 0.00 C ATOM 1901 CG1 VAL B 46 -6.970 -7.948 -0.540 1.00 0.00 C ATOM 1902 CG2 VAL B 46 -4.751 -8.309 -1.631 1.00 0.00 C ATOM 0 H VAL B 46 -6.126 -6.969 -3.786 1.00 0.00 H new ATOM 0 HA VAL B 46 -6.550 -5.371 -1.359 1.00 0.00 H new ATOM 0 HB VAL B 46 -5.161 -6.928 -0.064 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -6.761 -8.793 0.116 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -7.586 -7.221 -0.010 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -7.502 -8.298 -1.425 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -4.577 -9.147 -0.956 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -5.221 -8.671 -2.545 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -3.800 -7.836 -1.875 1.00 0.00 H new ATOM 1912 N PRO B 47 -4.212 -4.362 -1.552 1.00 0.00 N ATOM 1913 CA PRO B 47 -2.967 -3.654 -1.796 1.00 0.00 C ATOM 1914 C PRO B 47 -1.885 -4.008 -0.778 1.00 0.00 C ATOM 1915 O PRO B 47 -2.185 -4.431 0.338 1.00 0.00 O ATOM 1916 CB PRO B 47 -3.410 -2.208 -1.608 1.00 0.00 C ATOM 1917 CG PRO B 47 -4.458 -2.268 -0.534 1.00 0.00 C ATOM 1918 CD PRO B 47 -4.980 -3.692 -0.493 1.00 0.00 C ATOM 0 HA PRO B 47 -2.523 -3.886 -2.764 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -2.575 -1.573 -1.312 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -3.813 -1.794 -2.532 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -4.036 -1.985 0.431 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -5.266 -1.568 -0.746 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -4.813 -4.154 0.480 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -6.052 -3.734 -0.685 1.00 0.00 H new ATOM 1926 N ALA B 48 -0.627 -3.831 -1.171 1.00 0.00 N ATOM 1927 CA ALA B 48 0.495 -4.129 -0.290 1.00 0.00 C ATOM 1928 C ALA B 48 0.530 -3.160 0.893 1.00 0.00 C ATOM 1929 O ALA B 48 0.128 -2.004 0.765 1.00 0.00 O ATOM 1930 CB ALA B 48 1.804 -4.070 -1.062 1.00 0.00 C ATOM 0 H ALA B 48 -0.360 -3.483 -2.092 1.00 0.00 H new ATOM 0 HA ALA B 48 0.364 -5.138 0.100 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.633 -4.295 -0.391 1.00 0.00 H new ATOM 0 HB2 ALA B 48 1.783 -4.801 -1.870 1.00 0.00 H new ATOM 0 HB3 ALA B 48 1.936 -3.072 -1.479 1.00 0.00 H new ATOM 1936 N PRO B 49 1.010 -3.619 2.064 1.00 0.00 N ATOM 1937 CA PRO B 49 1.086 -2.779 3.265 1.00 0.00 C ATOM 1938 C PRO B 49 2.186 -1.724 3.182 1.00 0.00 C ATOM 1939 O PRO B 49 1.955 -0.551 3.473 1.00 0.00 O ATOM 1940 CB PRO B 49 1.391 -3.780 4.380 1.00 0.00 C ATOM 1941 CG PRO B 49 2.082 -4.912 3.700 1.00 0.00 C ATOM 1942 CD PRO B 49 1.509 -4.986 2.311 1.00 0.00 C ATOM 0 HA PRO B 49 0.167 -2.212 3.417 1.00 0.00 H new ATOM 0 HB2 PRO B 49 2.023 -3.335 5.148 1.00 0.00 H new ATOM 0 HB3 PRO B 49 0.478 -4.113 4.873 1.00 0.00 H new ATOM 0 HG2 PRO B 49 3.159 -4.747 3.668 1.00 0.00 H new ATOM 0 HG3 PRO B 49 1.919 -5.846 4.238 1.00 0.00 H new ATOM 0 HD2 PRO B 49 2.265 -5.274 1.581 1.00 0.00 H new ATOM 0 HD3 PRO B 49 0.708 -5.722 2.247 1.00 0.00 H new ATOM 1950 N PHE B 50 3.384 -2.146 2.785 1.00 0.00 N ATOM 1951 CA PHE B 50 4.517 -1.235 2.672 1.00 0.00 C ATOM 1952 C PHE B 50 5.480 -1.693 1.580 1.00 0.00 C ATOM 1953 O PHE B 50 5.542 -2.878 1.251 1.00 0.00 O ATOM 1954 CB PHE B 50 5.255 -1.136 4.010 1.00 0.00 C ATOM 1955 CG PHE B 50 5.827 -2.444 4.480 1.00 0.00 C ATOM 1956 CD1 PHE B 50 5.025 -3.380 5.114 1.00 0.00 C ATOM 1957 CD2 PHE B 50 7.167 -2.737 4.284 1.00 0.00 C ATOM 1958 CE1 PHE B 50 5.549 -4.584 5.543 1.00 0.00 C ATOM 1959 CE2 PHE B 50 7.697 -3.941 4.712 1.00 0.00 C ATOM 1960 CZ PHE B 50 6.886 -4.865 5.343 1.00 0.00 C ATOM 0 H PHE B 50 3.594 -3.113 2.537 1.00 0.00 H new ATOM 0 HA PHE B 50 4.133 -0.251 2.402 1.00 0.00 H new ATOM 0 HB2 PHE B 50 6.062 -0.409 3.918 1.00 0.00 H new ATOM 0 HB3 PHE B 50 4.569 -0.756 4.767 1.00 0.00 H new ATOM 0 HD1 PHE B 50 3.979 -3.166 5.274 1.00 0.00 H new ATOM 0 HD2 PHE B 50 7.805 -2.018 3.792 1.00 0.00 H new ATOM 0 HE1 PHE B 50 4.913 -5.305 6.035 1.00 0.00 H new ATOM 0 HE2 PHE B 50 8.743 -4.158 4.553 1.00 0.00 H new ATOM 0 HZ PHE B 50 7.297 -5.805 5.679 1.00 0.00 H new ATOM 1970 N ALA B 51 6.229 -0.746 1.025 1.00 0.00 N ATOM 1971 CA ALA B 51 7.190 -1.050 -0.029 1.00 0.00 C ATOM 1972 C ALA B 51 8.319 -1.933 0.490 1.00 0.00 C ATOM 1973 O ALA B 51 8.787 -1.761 1.617 1.00 0.00 O ATOM 1974 CB ALA B 51 7.752 0.237 -0.614 1.00 0.00 C ATOM 0 H ALA B 51 6.189 0.239 1.288 1.00 0.00 H new ATOM 0 HA ALA B 51 6.669 -1.599 -0.813 1.00 0.00 H new ATOM 0 HB1 ALA B 51 8.468 -0.003 -1.400 1.00 0.00 H new ATOM 0 HB2 ALA B 51 6.940 0.832 -1.032 1.00 0.00 H new ATOM 0 HB3 ALA B 51 8.251 0.806 0.171 1.00 0.00 H new ATOM 1980 N GLY B 52 8.753 -2.879 -0.338 1.00 0.00 N ATOM 1981 CA GLY B 52 9.827 -3.773 0.053 1.00 0.00 C ATOM 1982 C GLY B 52 10.388 -4.554 -1.120 1.00 0.00 C ATOM 1983 O GLY B 52 10.219 -4.158 -2.273 1.00 0.00 O ATOM 0 H GLY B 52 8.379 -3.042 -1.273 1.00 0.00 H new ATOM 0 HA2 GLY B 52 10.626 -3.195 0.516 1.00 0.00 H new ATOM 0 HA3 GLY B 52 9.460 -4.469 0.807 1.00 0.00 H new ATOM 1987 N VAL B 53 11.056 -5.666 -0.826 1.00 0.00 N ATOM 1988 CA VAL B 53 11.647 -6.502 -1.865 1.00 0.00 C ATOM 1989 C VAL B 53 11.416 -7.984 -1.581 1.00 0.00 C ATOM 1990 O VAL B 53 11.624 -8.450 -0.461 1.00 0.00 O ATOM 1991 CB VAL B 53 13.163 -6.244 -1.996 1.00 0.00 C ATOM 1992 CG1 VAL B 53 13.765 -7.117 -3.088 1.00 0.00 C ATOM 1993 CG2 VAL B 53 13.435 -4.774 -2.272 1.00 0.00 C ATOM 0 H VAL B 53 11.201 -6.009 0.124 1.00 0.00 H new ATOM 0 HA VAL B 53 11.157 -6.237 -2.802 1.00 0.00 H new ATOM 0 HB VAL B 53 13.637 -6.507 -1.050 1.00 0.00 H new ATOM 0 HG11 VAL B 53 14.834 -6.919 -3.164 1.00 0.00 H new ATOM 0 HG12 VAL B 53 13.607 -8.167 -2.843 1.00 0.00 H new ATOM 0 HG13 VAL B 53 13.286 -6.890 -4.040 1.00 0.00 H new ATOM 0 HG21 VAL B 53 14.509 -4.613 -2.361 1.00 0.00 H new ATOM 0 HG22 VAL B 53 12.946 -4.482 -3.201 1.00 0.00 H new ATOM 0 HG23 VAL B 53 13.045 -4.172 -1.452 1.00 0.00 H new ATOM 2003 N VAL B 54 10.988 -8.718 -2.604 1.00 0.00 N ATOM 2004 CA VAL B 54 10.734 -10.148 -2.468 1.00 0.00 C ATOM 2005 C VAL B 54 12.043 -10.927 -2.368 1.00 0.00 C ATOM 2006 O VAL B 54 12.720 -11.151 -3.371 1.00 0.00 O ATOM 2007 CB VAL B 54 9.910 -10.687 -3.655 1.00 0.00 C ATOM 2008 CG1 VAL B 54 9.708 -12.191 -3.537 1.00 0.00 C ATOM 2009 CG2 VAL B 54 8.570 -9.972 -3.740 1.00 0.00 C ATOM 0 H VAL B 54 10.810 -8.345 -3.537 1.00 0.00 H new ATOM 0 HA VAL B 54 10.162 -10.287 -1.551 1.00 0.00 H new ATOM 0 HB VAL B 54 10.466 -10.492 -4.572 1.00 0.00 H new ATOM 0 HG11 VAL B 54 9.124 -12.547 -4.386 1.00 0.00 H new ATOM 0 HG12 VAL B 54 10.678 -12.689 -3.529 1.00 0.00 H new ATOM 0 HG13 VAL B 54 9.177 -12.415 -2.612 1.00 0.00 H new ATOM 0 HG21 VAL B 54 8.001 -10.364 -4.583 1.00 0.00 H new ATOM 0 HG22 VAL B 54 8.012 -10.135 -2.818 1.00 0.00 H new ATOM 0 HG23 VAL B 54 8.736 -8.904 -3.880 1.00 0.00 H new ATOM 2019 N LYS B 55 12.396 -11.330 -1.151 1.00 0.00 N ATOM 2020 CA LYS B 55 13.624 -12.081 -0.920 1.00 0.00 C ATOM 2021 C LYS B 55 13.338 -13.574 -0.780 1.00 0.00 C ATOM 2022 O LYS B 55 14.086 -14.409 -1.288 1.00 0.00 O ATOM 2023 CB LYS B 55 14.335 -11.566 0.333 1.00 0.00 C ATOM 2024 CG LYS B 55 15.685 -12.217 0.581 1.00 0.00 C ATOM 2025 CD LYS B 55 16.363 -11.639 1.811 1.00 0.00 C ATOM 2026 CE LYS B 55 17.717 -12.285 2.058 1.00 0.00 C ATOM 2027 NZ LYS B 55 18.394 -11.714 3.255 1.00 0.00 N ATOM 0 H LYS B 55 11.848 -11.149 -0.310 1.00 0.00 H new ATOM 0 HA LYS B 55 14.273 -11.936 -1.784 1.00 0.00 H new ATOM 0 HB2 LYS B 55 14.472 -10.488 0.245 1.00 0.00 H new ATOM 0 HB3 LYS B 55 13.695 -11.736 1.199 1.00 0.00 H new ATOM 0 HG2 LYS B 55 15.554 -13.292 0.707 1.00 0.00 H new ATOM 0 HG3 LYS B 55 16.325 -12.074 -0.290 1.00 0.00 H new ATOM 0 HD2 LYS B 55 16.489 -10.564 1.686 1.00 0.00 H new ATOM 0 HD3 LYS B 55 15.725 -11.786 2.682 1.00 0.00 H new ATOM 0 HE2 LYS B 55 17.588 -13.359 2.192 1.00 0.00 H new ATOM 0 HE3 LYS B 55 18.351 -12.147 1.182 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 19.383 -11.494 3.022 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 17.905 -10.844 3.548 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 18.367 -12.405 4.032 1.00 0.00 H new ATOM 2041 N GLU B 56 12.250 -13.903 -0.088 1.00 0.00 N ATOM 2042 CA GLU B 56 11.869 -15.297 0.116 1.00 0.00 C ATOM 2043 C GLU B 56 10.353 -15.438 0.219 1.00 0.00 C ATOM 2044 O GLU B 56 9.746 -15.020 1.204 1.00 0.00 O ATOM 2045 CB GLU B 56 12.531 -15.846 1.383 1.00 0.00 C ATOM 2046 CG GLU B 56 12.258 -17.322 1.623 1.00 0.00 C ATOM 2047 CD GLU B 56 12.880 -17.828 2.909 1.00 0.00 C ATOM 2048 OE1 GLU B 56 12.208 -17.761 3.960 1.00 0.00 O ATOM 2049 OE2 GLU B 56 14.039 -18.291 2.865 1.00 0.00 O ATOM 0 H GLU B 56 11.619 -13.225 0.339 1.00 0.00 H new ATOM 0 HA GLU B 56 12.211 -15.872 -0.745 1.00 0.00 H new ATOM 0 HB2 GLU B 56 13.608 -15.691 1.316 1.00 0.00 H new ATOM 0 HB3 GLU B 56 12.179 -15.276 2.243 1.00 0.00 H new ATOM 0 HG2 GLU B 56 11.181 -17.488 1.655 1.00 0.00 H new ATOM 0 HG3 GLU B 56 12.645 -17.900 0.784 1.00 0.00 H new ATOM 2056 N LEU B 57 9.749 -16.028 -0.809 1.00 0.00 N ATOM 2057 CA LEU B 57 8.303 -16.226 -0.836 1.00 0.00 C ATOM 2058 C LEU B 57 7.865 -17.197 0.258 1.00 0.00 C ATOM 2059 O LEU B 57 8.697 -17.818 0.921 1.00 0.00 O ATOM 2060 CB LEU B 57 7.856 -16.746 -2.209 1.00 0.00 C ATOM 2061 CG LEU B 57 8.071 -18.246 -2.452 1.00 0.00 C ATOM 2062 CD1 LEU B 57 7.457 -18.662 -3.779 1.00 0.00 C ATOM 2063 CD2 LEU B 57 9.552 -18.593 -2.420 1.00 0.00 C ATOM 0 H LEU B 57 10.238 -16.377 -1.633 1.00 0.00 H new ATOM 0 HA LEU B 57 7.829 -15.262 -0.653 1.00 0.00 H new ATOM 0 HB2 LEU B 57 6.796 -16.524 -2.334 1.00 0.00 H new ATOM 0 HB3 LEU B 57 8.391 -16.191 -2.980 1.00 0.00 H new ATOM 0 HG LEU B 57 7.575 -18.795 -1.651 1.00 0.00 H new ATOM 0 HD11 LEU B 57 7.618 -19.728 -3.936 1.00 0.00 H new ATOM 0 HD12 LEU B 57 6.387 -18.455 -3.766 1.00 0.00 H new ATOM 0 HD13 LEU B 57 7.925 -18.101 -4.588 1.00 0.00 H new ATOM 0 HD21 LEU B 57 9.679 -19.661 -2.595 1.00 0.00 H new ATOM 0 HD22 LEU B 57 10.074 -18.034 -3.197 1.00 0.00 H new ATOM 0 HD23 LEU B 57 9.966 -18.333 -1.446 1.00 0.00 H new ATOM 2075 N LYS B 58 6.554 -17.325 0.439 1.00 0.00 N ATOM 2076 CA LYS B 58 6.003 -18.221 1.449 1.00 0.00 C ATOM 2077 C LYS B 58 4.942 -19.135 0.845 1.00 0.00 C ATOM 2078 O LYS B 58 4.853 -20.313 1.190 1.00 0.00 O ATOM 2079 CB LYS B 58 5.404 -17.417 2.606 1.00 0.00 C ATOM 2080 CG LYS B 58 6.425 -16.580 3.364 1.00 0.00 C ATOM 2081 CD LYS B 58 7.473 -17.448 4.049 1.00 0.00 C ATOM 2082 CE LYS B 58 6.862 -18.308 5.144 1.00 0.00 C ATOM 2083 NZ LYS B 58 6.167 -17.489 6.175 1.00 0.00 N ATOM 0 H LYS B 58 5.853 -16.819 -0.102 1.00 0.00 H new ATOM 0 HA LYS B 58 6.815 -18.840 1.830 1.00 0.00 H new ATOM 0 HB2 LYS B 58 4.627 -16.760 2.216 1.00 0.00 H new ATOM 0 HB3 LYS B 58 4.922 -18.103 3.302 1.00 0.00 H new ATOM 0 HG2 LYS B 58 6.916 -15.894 2.674 1.00 0.00 H new ATOM 0 HG3 LYS B 58 5.914 -15.971 4.110 1.00 0.00 H new ATOM 0 HD2 LYS B 58 7.955 -18.088 3.310 1.00 0.00 H new ATOM 0 HD3 LYS B 58 8.249 -16.813 4.476 1.00 0.00 H new ATOM 0 HE2 LYS B 58 6.155 -19.010 4.702 1.00 0.00 H new ATOM 0 HE3 LYS B 58 7.644 -18.900 5.619 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 6.004 -18.066 7.025 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 6.756 -16.668 6.421 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 5.254 -17.160 5.800 1.00 0.00 H new ATOM 2097 N VAL B 59 4.136 -18.582 -0.057 1.00 0.00 N ATOM 2098 CA VAL B 59 3.083 -19.345 -0.713 1.00 0.00 C ATOM 2099 C VAL B 59 3.311 -19.395 -2.220 1.00 0.00 C ATOM 2100 O VAL B 59 4.093 -18.617 -2.766 1.00 0.00 O ATOM 2101 CB VAL B 59 1.695 -18.735 -0.435 1.00 0.00 C ATOM 2102 CG1 VAL B 59 0.600 -19.767 -0.644 1.00 0.00 C ATOM 2103 CG2 VAL B 59 1.631 -18.162 0.973 1.00 0.00 C ATOM 0 H VAL B 59 4.194 -17.607 -0.349 1.00 0.00 H new ATOM 0 HA VAL B 59 3.115 -20.356 -0.306 1.00 0.00 H new ATOM 0 HB VAL B 59 1.535 -17.921 -1.143 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -0.370 -19.314 -0.442 1.00 0.00 H new ATOM 0 HG12 VAL B 59 0.627 -20.123 -1.674 1.00 0.00 H new ATOM 0 HG13 VAL B 59 0.757 -20.606 0.034 1.00 0.00 H new ATOM 0 HG21 VAL B 59 0.643 -17.737 1.148 1.00 0.00 H new ATOM 0 HG22 VAL B 59 1.818 -18.955 1.697 1.00 0.00 H new ATOM 0 HG23 VAL B 59 2.386 -17.384 1.084 1.00 0.00 H new ATOM 2113 N ASN B 60 2.621 -20.316 -2.884 1.00 0.00 N ATOM 2114 CA ASN B 60 2.746 -20.473 -4.330 1.00 0.00 C ATOM 2115 C ASN B 60 1.450 -20.076 -5.031 1.00 0.00 C ATOM 2116 O ASN B 60 0.360 -20.242 -4.483 1.00 0.00 O ATOM 2117 CB ASN B 60 3.104 -21.922 -4.676 1.00 0.00 C ATOM 2118 CG ASN B 60 4.228 -22.473 -3.816 1.00 0.00 C ATOM 2119 OD1 ASN B 60 4.259 -23.664 -3.508 1.00 0.00 O ATOM 2120 ND2 ASN B 60 5.164 -21.613 -3.424 1.00 0.00 N ATOM 0 H ASN B 60 1.969 -20.966 -2.445 1.00 0.00 H new ATOM 0 HA ASN B 60 3.543 -19.816 -4.677 1.00 0.00 H new ATOM 0 HB2 ASN B 60 2.220 -22.548 -4.555 1.00 0.00 H new ATOM 0 HB3 ASN B 60 3.394 -21.979 -5.725 1.00 0.00 H new ATOM 0 HD21 ASN B 60 5.942 -21.934 -2.848 1.00 0.00 H new ATOM 0 HD22 ASN B 60 5.104 -20.633 -3.700 1.00 0.00 H new ATOM 2127 N VAL B 61 1.577 -19.548 -6.246 1.00 0.00 N ATOM 2128 CA VAL B 61 0.417 -19.123 -7.021 1.00 0.00 C ATOM 2129 C VAL B 61 -0.485 -20.308 -7.354 1.00 0.00 C ATOM 2130 O VAL B 61 -0.060 -21.260 -8.010 1.00 0.00 O ATOM 2131 CB VAL B 61 0.838 -18.428 -8.330 1.00 0.00 C ATOM 2132 CG1 VAL B 61 -0.381 -17.909 -9.077 1.00 0.00 C ATOM 2133 CG2 VAL B 61 1.818 -17.300 -8.046 1.00 0.00 C ATOM 0 H VAL B 61 2.472 -19.405 -6.714 1.00 0.00 H new ATOM 0 HA VAL B 61 -0.133 -18.413 -6.403 1.00 0.00 H new ATOM 0 HB VAL B 61 1.338 -19.161 -8.963 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -0.063 -17.422 -9.999 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -1.043 -18.741 -9.317 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -0.913 -17.191 -8.452 1.00 0.00 H new ATOM 0 HG21 VAL B 61 2.103 -16.822 -8.983 1.00 0.00 H new ATOM 0 HG22 VAL B 61 1.348 -16.566 -7.392 1.00 0.00 H new ATOM 0 HG23 VAL B 61 2.706 -17.703 -7.559 1.00 0.00 H new ATOM 2143 N GLY B 62 -1.731 -20.240 -6.897 1.00 0.00 N ATOM 2144 CA GLY B 62 -2.678 -21.310 -7.155 1.00 0.00 C ATOM 2145 C GLY B 62 -3.186 -21.958 -5.882 1.00 0.00 C ATOM 2146 O GLY B 62 -4.084 -22.798 -5.921 1.00 0.00 O ATOM 0 H GLY B 62 -2.103 -19.462 -6.352 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -3.523 -20.915 -7.719 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -2.204 -22.067 -7.780 1.00 0.00 H new ATOM 2150 N ASP B 63 -2.609 -21.565 -4.750 1.00 0.00 N ATOM 2151 CA ASP B 63 -3.009 -22.113 -3.460 1.00 0.00 C ATOM 2152 C ASP B 63 -3.877 -21.120 -2.693 1.00 0.00 C ATOM 2153 O ASP B 63 -3.492 -19.967 -2.496 1.00 0.00 O ATOM 2154 CB ASP B 63 -1.775 -22.476 -2.632 1.00 0.00 C ATOM 2155 CG ASP B 63 -0.891 -23.491 -3.330 1.00 0.00 C ATOM 2156 OD1 ASP B 63 -0.008 -23.074 -4.109 1.00 0.00 O ATOM 2157 OD2 ASP B 63 -1.083 -24.704 -3.099 1.00 0.00 O ATOM 0 H ASP B 63 -1.864 -20.870 -4.701 1.00 0.00 H new ATOM 0 HA ASP B 63 -3.594 -23.015 -3.642 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -1.198 -21.574 -2.429 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -2.092 -22.875 -1.668 1.00 0.00 H new ATOM 2162 N LYS B 64 -5.050 -21.578 -2.264 1.00 0.00 N ATOM 2163 CA LYS B 64 -5.980 -20.734 -1.523 1.00 0.00 C ATOM 2164 C LYS B 64 -5.315 -20.140 -0.284 1.00 0.00 C ATOM 2165 O LYS B 64 -4.336 -20.683 0.231 1.00 0.00 O ATOM 2166 CB LYS B 64 -7.226 -21.532 -1.118 1.00 0.00 C ATOM 2167 CG LYS B 64 -6.991 -22.535 0.007 1.00 0.00 C ATOM 2168 CD LYS B 64 -6.077 -23.676 -0.420 1.00 0.00 C ATOM 2169 CE LYS B 64 -6.698 -24.512 -1.531 1.00 0.00 C ATOM 2170 NZ LYS B 64 -7.982 -25.136 -1.105 1.00 0.00 N ATOM 0 H LYS B 64 -5.379 -22.531 -2.418 1.00 0.00 H new ATOM 0 HA LYS B 64 -6.281 -19.916 -2.177 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -8.005 -20.835 -0.810 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -7.602 -22.065 -1.992 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -6.553 -22.022 0.863 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -7.948 -22.942 0.335 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -5.124 -23.271 -0.760 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -5.865 -24.313 0.439 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -6.872 -23.883 -2.404 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -5.998 -25.291 -1.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -8.260 -25.863 -1.795 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -7.861 -25.574 -0.170 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -8.722 -24.407 -1.053 1.00 0.00 H new ATOM 2184 N VAL B 65 -5.853 -19.019 0.186 1.00 0.00 N ATOM 2185 CA VAL B 65 -5.319 -18.342 1.362 1.00 0.00 C ATOM 2186 C VAL B 65 -6.304 -18.406 2.528 1.00 0.00 C ATOM 2187 O VAL B 65 -7.496 -18.649 2.333 1.00 0.00 O ATOM 2188 CB VAL B 65 -4.996 -16.865 1.053 1.00 0.00 C ATOM 2189 CG1 VAL B 65 -6.271 -16.039 0.970 1.00 0.00 C ATOM 2190 CG2 VAL B 65 -4.048 -16.292 2.092 1.00 0.00 C ATOM 0 H VAL B 65 -6.662 -18.559 -0.232 1.00 0.00 H new ATOM 0 HA VAL B 65 -4.401 -18.859 1.641 1.00 0.00 H new ATOM 0 HB VAL B 65 -4.501 -16.822 0.083 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -6.019 -15.001 0.751 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -6.908 -16.432 0.178 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -6.801 -16.091 1.921 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -3.834 -15.250 1.854 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -4.509 -16.352 3.078 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -3.119 -16.862 2.091 1.00 0.00 H new ATOM 2200 N LYS B 66 -5.799 -18.188 3.739 1.00 0.00 N ATOM 2201 CA LYS B 66 -6.635 -18.212 4.935 1.00 0.00 C ATOM 2202 C LYS B 66 -6.174 -17.161 5.940 1.00 0.00 C ATOM 2203 O LYS B 66 -5.035 -16.697 5.889 1.00 0.00 O ATOM 2204 CB LYS B 66 -6.608 -19.598 5.582 1.00 0.00 C ATOM 2205 CG LYS B 66 -7.193 -20.693 4.706 1.00 0.00 C ATOM 2206 CD LYS B 66 -7.183 -22.038 5.415 1.00 0.00 C ATOM 2207 CE LYS B 66 -7.762 -23.136 4.536 1.00 0.00 C ATOM 2208 NZ LYS B 66 -7.765 -24.457 5.225 1.00 0.00 N ATOM 0 H LYS B 66 -4.814 -17.993 3.918 1.00 0.00 H new ATOM 0 HA LYS B 66 -7.657 -17.982 4.635 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -5.578 -19.854 5.829 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -7.161 -19.562 6.521 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -8.215 -20.433 4.431 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -6.622 -20.764 3.780 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -6.161 -22.295 5.695 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -7.758 -21.968 6.338 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -8.781 -22.873 4.251 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -7.182 -23.208 3.616 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -8.167 -25.178 4.592 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -6.790 -24.721 5.475 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -8.339 -24.396 6.090 1.00 0.00 H new ATOM 2222 N THR B 67 -7.065 -16.791 6.856 1.00 0.00 N ATOM 2223 CA THR B 67 -6.749 -15.795 7.872 1.00 0.00 C ATOM 2224 C THR B 67 -5.686 -16.309 8.836 1.00 0.00 C ATOM 2225 O THR B 67 -5.792 -17.421 9.356 1.00 0.00 O ATOM 2226 CB THR B 67 -8.000 -15.388 8.673 1.00 0.00 C ATOM 2227 OG1 THR B 67 -8.575 -16.539 9.302 1.00 0.00 O ATOM 2228 CG2 THR B 67 -9.029 -14.730 7.769 1.00 0.00 C ATOM 0 H THR B 67 -8.011 -17.167 6.914 1.00 0.00 H new ATOM 0 HA THR B 67 -6.366 -14.921 7.346 1.00 0.00 H new ATOM 0 HB THR B 67 -7.699 -14.671 9.436 1.00 0.00 H new ATOM 0 HG1 THR B 67 -7.868 -17.183 9.515 1.00 0.00 H new ATOM 0 HG21 THR B 67 -9.904 -14.451 8.356 1.00 0.00 H new ATOM 0 HG22 THR B 67 -8.597 -13.838 7.315 1.00 0.00 H new ATOM 0 HG23 THR B 67 -9.325 -15.428 6.986 1.00 0.00 H new ATOM 2236 N GLY B 68 -4.663 -15.494 9.069 1.00 0.00 N ATOM 2237 CA GLY B 68 -3.593 -15.882 9.970 1.00 0.00 C ATOM 2238 C GLY B 68 -2.397 -16.455 9.237 1.00 0.00 C ATOM 2239 O GLY B 68 -1.325 -16.620 9.819 1.00 0.00 O ATOM 0 H GLY B 68 -4.555 -14.570 8.650 1.00 0.00 H new ATOM 0 HA2 GLY B 68 -3.278 -15.015 10.550 1.00 0.00 H new ATOM 0 HA3 GLY B 68 -3.969 -16.620 10.679 1.00 0.00 H new ATOM 2243 N SER B 69 -2.581 -16.757 7.956 1.00 0.00 N ATOM 2244 CA SER B 69 -1.507 -17.314 7.141 1.00 0.00 C ATOM 2245 C SER B 69 -0.714 -16.207 6.456 1.00 0.00 C ATOM 2246 O SER B 69 -1.276 -15.194 6.041 1.00 0.00 O ATOM 2247 CB SER B 69 -2.077 -18.271 6.092 1.00 0.00 C ATOM 2248 OG SER B 69 -1.049 -18.803 5.274 1.00 0.00 O ATOM 0 H SER B 69 -3.463 -16.626 7.460 1.00 0.00 H new ATOM 0 HA SER B 69 -0.835 -17.865 7.799 1.00 0.00 H new ATOM 0 HB2 SER B 69 -2.609 -19.083 6.587 1.00 0.00 H new ATOM 0 HB3 SER B 69 -2.804 -17.745 5.472 1.00 0.00 H new ATOM 0 HG SER B 69 -1.439 -19.412 4.613 1.00 0.00 H new ATOM 2254 N LEU B 70 0.595 -16.408 6.342 1.00 0.00 N ATOM 2255 CA LEU B 70 1.468 -15.427 5.707 1.00 0.00 C ATOM 2256 C LEU B 70 1.406 -15.552 4.188 1.00 0.00 C ATOM 2257 O LEU B 70 0.898 -16.541 3.658 1.00 0.00 O ATOM 2258 CB LEU B 70 2.911 -15.602 6.188 1.00 0.00 C ATOM 2259 CG LEU B 70 3.181 -15.151 7.628 1.00 0.00 C ATOM 2260 CD1 LEU B 70 2.497 -16.077 8.623 1.00 0.00 C ATOM 2261 CD2 LEU B 70 4.677 -15.092 7.896 1.00 0.00 C ATOM 0 H LEU B 70 1.075 -17.242 6.681 1.00 0.00 H new ATOM 0 HA LEU B 70 1.121 -14.433 5.989 1.00 0.00 H new ATOM 0 HB2 LEU B 70 3.182 -16.654 6.097 1.00 0.00 H new ATOM 0 HB3 LEU B 70 3.569 -15.045 5.521 1.00 0.00 H new ATOM 0 HG LEU B 70 2.767 -14.151 7.754 1.00 0.00 H new ATOM 0 HD11 LEU B 70 2.703 -15.737 9.638 1.00 0.00 H new ATOM 0 HD12 LEU B 70 1.421 -16.068 8.449 1.00 0.00 H new ATOM 0 HD13 LEU B 70 2.876 -17.091 8.496 1.00 0.00 H new ATOM 0 HD21 LEU B 70 4.850 -14.770 8.923 1.00 0.00 H new ATOM 0 HD22 LEU B 70 5.113 -16.080 7.747 1.00 0.00 H new ATOM 0 HD23 LEU B 70 5.142 -14.384 7.210 1.00 0.00 H new ATOM 2273 N ILE B 71 1.927 -14.546 3.493 1.00 0.00 N ATOM 2274 CA ILE B 71 1.925 -14.546 2.034 1.00 0.00 C ATOM 2275 C ILE B 71 3.325 -14.307 1.471 1.00 0.00 C ATOM 2276 O ILE B 71 3.761 -15.011 0.559 1.00 0.00 O ATOM 2277 CB ILE B 71 0.963 -13.479 1.474 1.00 0.00 C ATOM 2278 CG1 ILE B 71 1.229 -12.119 2.129 1.00 0.00 C ATOM 2279 CG2 ILE B 71 -0.483 -13.907 1.693 1.00 0.00 C ATOM 2280 CD1 ILE B 71 0.419 -10.988 1.533 1.00 0.00 C ATOM 0 H ILE B 71 2.355 -13.722 3.915 1.00 0.00 H new ATOM 0 HA ILE B 71 1.583 -15.533 1.722 1.00 0.00 H new ATOM 0 HB ILE B 71 1.137 -13.381 0.402 1.00 0.00 H new ATOM 0 HG12 ILE B 71 1.009 -12.189 3.194 1.00 0.00 H new ATOM 0 HG13 ILE B 71 2.289 -11.883 2.037 1.00 0.00 H new ATOM 0 HG21 ILE B 71 -1.152 -13.145 1.293 1.00 0.00 H new ATOM 0 HG22 ILE B 71 -0.664 -14.853 1.183 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -0.669 -14.029 2.760 1.00 0.00 H new ATOM 0 HD11 ILE B 71 0.660 -10.058 2.047 1.00 0.00 H new ATOM 0 HD12 ILE B 71 0.656 -10.890 0.474 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -0.644 -11.201 1.649 1.00 0.00 H new ATOM 2292 N MET B 72 4.024 -13.316 2.017 1.00 0.00 N ATOM 2293 CA MET B 72 5.372 -12.988 1.561 1.00 0.00 C ATOM 2294 C MET B 72 6.054 -12.027 2.528 1.00 0.00 C ATOM 2295 O MET B 72 5.410 -11.146 3.096 1.00 0.00 O ATOM 2296 CB MET B 72 5.322 -12.371 0.162 1.00 0.00 C ATOM 2297 CG MET B 72 4.372 -11.190 0.052 1.00 0.00 C ATOM 2298 SD MET B 72 4.226 -10.569 -1.634 1.00 0.00 S ATOM 2299 CE MET B 72 3.472 -11.973 -2.450 1.00 0.00 C ATOM 0 H MET B 72 3.680 -12.726 2.775 1.00 0.00 H new ATOM 0 HA MET B 72 5.952 -13.910 1.524 1.00 0.00 H new ATOM 0 HB2 MET B 72 6.324 -12.048 -0.120 1.00 0.00 H new ATOM 0 HB3 MET B 72 5.021 -13.137 -0.553 1.00 0.00 H new ATOM 0 HG2 MET B 72 3.387 -11.487 0.412 1.00 0.00 H new ATOM 0 HG3 MET B 72 4.720 -10.387 0.702 1.00 0.00 H new ATOM 0 HE1 MET B 72 2.969 -11.639 -3.358 1.00 0.00 H new ATOM 0 HE2 MET B 72 4.242 -12.700 -2.708 1.00 0.00 H new ATOM 0 HE3 MET B 72 2.746 -12.435 -1.782 1.00 0.00 H new ATOM 2309 N ILE B 73 7.359 -12.197 2.710 1.00 0.00 N ATOM 2310 CA ILE B 73 8.118 -11.339 3.611 1.00 0.00 C ATOM 2311 C ILE B 73 8.966 -10.349 2.825 1.00 0.00 C ATOM 2312 O ILE B 73 9.555 -10.698 1.801 1.00 0.00 O ATOM 2313 CB ILE B 73 9.033 -12.157 4.544 1.00 0.00 C ATOM 2314 CG1 ILE B 73 8.343 -13.458 4.973 1.00 0.00 C ATOM 2315 CG2 ILE B 73 9.424 -11.328 5.762 1.00 0.00 C ATOM 2316 CD1 ILE B 73 7.003 -13.247 5.650 1.00 0.00 C ATOM 0 H ILE B 73 7.911 -12.919 2.247 1.00 0.00 H new ATOM 0 HA ILE B 73 7.393 -10.799 4.220 1.00 0.00 H new ATOM 0 HB ILE B 73 9.940 -12.418 3.998 1.00 0.00 H new ATOM 0 HG12 ILE B 73 8.201 -14.089 4.096 1.00 0.00 H new ATOM 0 HG13 ILE B 73 9.001 -14.000 5.652 1.00 0.00 H new ATOM 0 HG21 ILE B 73 10.070 -11.918 6.412 1.00 0.00 H new ATOM 0 HG22 ILE B 73 9.956 -10.433 5.438 1.00 0.00 H new ATOM 0 HG23 ILE B 73 8.526 -11.039 6.309 1.00 0.00 H new ATOM 0 HD11 ILE B 73 6.578 -14.213 5.924 1.00 0.00 H new ATOM 0 HD12 ILE B 73 7.140 -12.643 6.547 1.00 0.00 H new ATOM 0 HD13 ILE B 73 6.327 -12.733 4.966 1.00 0.00 H new ATOM 2328 N PHE B 74 9.028 -9.112 3.307 1.00 0.00 N ATOM 2329 CA PHE B 74 9.802 -8.077 2.639 1.00 0.00 C ATOM 2330 C PHE B 74 10.950 -7.624 3.524 1.00 0.00 C ATOM 2331 O PHE B 74 10.920 -7.824 4.737 1.00 0.00 O ATOM 2332 CB PHE B 74 8.915 -6.876 2.296 1.00 0.00 C ATOM 2333 CG PHE B 74 7.678 -7.230 1.519 1.00 0.00 C ATOM 2334 CD1 PHE B 74 7.769 -7.752 0.238 1.00 0.00 C ATOM 2335 CD2 PHE B 74 6.423 -7.032 2.071 1.00 0.00 C ATOM 2336 CE1 PHE B 74 6.629 -8.071 -0.476 1.00 0.00 C ATOM 2337 CE2 PHE B 74 5.281 -7.346 1.361 1.00 0.00 C ATOM 2338 CZ PHE B 74 5.383 -7.866 0.086 1.00 0.00 C ATOM 0 H PHE B 74 8.552 -8.804 4.155 1.00 0.00 H new ATOM 0 HA PHE B 74 10.203 -8.496 1.716 1.00 0.00 H new ATOM 0 HB2 PHE B 74 8.621 -6.379 3.221 1.00 0.00 H new ATOM 0 HB3 PHE B 74 9.500 -6.158 1.721 1.00 0.00 H new ATOM 0 HD1 PHE B 74 8.740 -7.911 -0.207 1.00 0.00 H new ATOM 0 HD2 PHE B 74 6.337 -6.627 3.069 1.00 0.00 H new ATOM 0 HE1 PHE B 74 6.712 -8.480 -1.472 1.00 0.00 H new ATOM 0 HE2 PHE B 74 4.309 -7.185 1.803 1.00 0.00 H new ATOM 0 HZ PHE B 74 4.491 -8.112 -0.471 1.00 0.00 H new ATOM 2348 N GLU B 75 11.963 -7.022 2.914 1.00 0.00 N ATOM 2349 CA GLU B 75 13.111 -6.530 3.662 1.00 0.00 C ATOM 2350 C GLU B 75 13.367 -5.065 3.335 1.00 0.00 C ATOM 2351 O GLU B 75 14.074 -4.745 2.379 1.00 0.00 O ATOM 2352 CB GLU B 75 14.357 -7.360 3.348 1.00 0.00 C ATOM 2353 CG GLU B 75 15.457 -7.221 4.389 1.00 0.00 C ATOM 2354 CD GLU B 75 16.758 -7.864 3.949 1.00 0.00 C ATOM 2355 OE1 GLU B 75 16.915 -9.086 4.158 1.00 0.00 O ATOM 2356 OE2 GLU B 75 17.617 -7.148 3.392 1.00 0.00 O ATOM 0 H GLU B 75 12.013 -6.863 1.908 1.00 0.00 H new ATOM 0 HA GLU B 75 12.890 -6.623 4.725 1.00 0.00 H new ATOM 0 HB2 GLU B 75 14.074 -8.410 3.268 1.00 0.00 H new ATOM 0 HB3 GLU B 75 14.748 -7.060 2.376 1.00 0.00 H new ATOM 0 HG2 GLU B 75 15.629 -6.164 4.593 1.00 0.00 H new ATOM 0 HG3 GLU B 75 15.128 -7.676 5.323 1.00 0.00 H new ATOM 2363 N VAL B 76 12.783 -4.180 4.134 1.00 0.00 N ATOM 2364 CA VAL B 76 12.943 -2.746 3.932 1.00 0.00 C ATOM 2365 C VAL B 76 14.136 -2.218 4.721 1.00 0.00 C ATOM 2366 O VAL B 76 14.149 -2.261 5.948 1.00 0.00 O ATOM 2367 CB VAL B 76 11.667 -1.974 4.339 1.00 0.00 C ATOM 2368 CG1 VAL B 76 11.016 -2.606 5.559 1.00 0.00 C ATOM 2369 CG2 VAL B 76 11.983 -0.512 4.612 1.00 0.00 C ATOM 0 H VAL B 76 12.194 -4.431 4.928 1.00 0.00 H new ATOM 0 HA VAL B 76 13.120 -2.586 2.868 1.00 0.00 H new ATOM 0 HB VAL B 76 10.966 -2.028 3.506 1.00 0.00 H new ATOM 0 HG11 VAL B 76 10.120 -2.045 5.825 1.00 0.00 H new ATOM 0 HG12 VAL B 76 10.744 -3.637 5.333 1.00 0.00 H new ATOM 0 HG13 VAL B 76 11.716 -2.590 6.394 1.00 0.00 H new ATOM 0 HG21 VAL B 76 11.070 0.011 4.897 1.00 0.00 H new ATOM 0 HG22 VAL B 76 12.709 -0.442 5.422 1.00 0.00 H new ATOM 0 HG23 VAL B 76 12.397 -0.055 3.713 1.00 0.00 H new