USER MOD reduce.3.24.130724 H: found=0, std=0, add=736, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 0 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 65 THR OG1 : rot 180:sc= 0.0114 USER MOD Set 1.2: A 85 TYR OH : rot -65:sc= -4.66! USER MOD Set 2.1: A 12 TYR OH : rot -157:sc= -2! USER MOD Set 2.2: A 14 ASN : amide:sc= 0.134 K(o=-10,f=-20!) USER MOD Set 2.3: A 45 SER OG : rot -120:sc= -0.0812 USER MOD Set 2.4: A 50 MET CE :methyl 179:sc= -1.46 (180deg=-0.388) USER MOD Set 2.5: A 53 GLN : amide:sc= -6.72! C(o=-10!,f=-14!) USER MOD Set 3.1: A 10 THR OG1 : rot 90:sc= -1.57! USER MOD Set 3.2: A 90 SER OG : rot -90:sc= -1.06 USER MOD Single : A 8 ASN : amide:sc= -0.0482 X(o=-0.048,f=-0.12) USER MOD Single : A 9 HIS : no HD1:sc= -0.517 K(o=-0.52,f=-2.5) USER MOD Single : A 15 ASN : amide:sc= 0.00117 X(o=0.0012,f=0) USER MOD Single : A 17 ASN : amide:sc= -1.13 K(o=-1.1,f=-4!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.0017) USER MOD Single : A 22 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.0861) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 HIS : no HD1:sc= -1.1 X(o=-1.1,f=-1.2) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -1.26 K(o=-1.3,f=-2.2!) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= -0.0543 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.0131 X(o=-0.013,f=-0.074) USER MOD Single : A 70 SER OG : rot -135:sc= 0.0233! USER MOD Single : A 71 MET CE :methyl -105:sc= -0.607 (180deg=-3.65!) USER MOD Single : A 72 GLN : amide:sc= -0.187 X(o=-0.19,f=0) USER MOD Single : A 77 TYR OH : rot 50:sc= -1.98! USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.143 X(o=-0.14,f=-0.0078) USER MOD Single : A 87 LYS NZ :NH3+ -161:sc= -0.174 (180deg=-0.933) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 682 N PRO A 7 31.327 -3.334 -28.478 1.00 0.00 N ATOM 683 CA PRO A 7 30.743 -3.013 -27.163 1.00 0.00 C ATOM 684 C PRO A 7 31.145 -1.593 -26.733 1.00 0.00 C ATOM 685 O PRO A 7 32.328 -1.292 -26.585 1.00 0.00 O ATOM 686 CB PRO A 7 31.351 -4.063 -26.227 1.00 0.00 C ATOM 687 CG PRO A 7 32.649 -4.554 -26.906 1.00 0.00 C ATOM 688 CD PRO A 7 32.519 -4.218 -28.403 1.00 0.00 C ATOM 0 HA PRO A 7 29.653 -3.035 -27.161 1.00 0.00 H new ATOM 0 HB2 PRO A 7 31.563 -3.634 -25.248 1.00 0.00 H new ATOM 0 HB3 PRO A 7 30.659 -4.890 -26.069 1.00 0.00 H new ATOM 0 HG2 PRO A 7 33.521 -4.064 -26.474 1.00 0.00 H new ATOM 0 HG3 PRO A 7 32.781 -5.626 -26.760 1.00 0.00 H new ATOM 0 HD2 PRO A 7 33.411 -3.716 -28.777 1.00 0.00 H new ATOM 0 HD3 PRO A 7 32.385 -5.118 -29.003 1.00 0.00 H new ATOM 689 N ASN A 8 30.190 -0.711 -26.532 1.00 0.00 N ATOM 690 CA ASN A 8 30.538 0.680 -26.118 1.00 0.00 C ATOM 691 C ASN A 8 30.326 0.834 -24.604 1.00 0.00 C ATOM 692 O ASN A 8 29.999 -0.129 -23.912 1.00 0.00 O ATOM 693 CB ASN A 8 29.640 1.674 -26.865 1.00 0.00 C ATOM 694 CG ASN A 8 30.448 2.365 -27.971 1.00 0.00 C ATOM 695 OD1 ASN A 8 31.422 3.058 -27.688 1.00 0.00 O ATOM 696 ND2 ASN A 8 30.097 2.218 -29.226 1.00 0.00 N ATOM 0 H ASN A 8 29.193 -0.897 -26.637 1.00 0.00 H new ATOM 0 HA ASN A 8 31.582 0.880 -26.359 1.00 0.00 H new ATOM 0 HB2 ASN A 8 28.784 1.154 -27.296 1.00 0.00 H new ATOM 0 HB3 ASN A 8 29.245 2.416 -26.171 1.00 0.00 H new ATOM 0 HD21 ASN A 8 30.632 2.678 -29.962 1.00 0.00 H new ATOM 0 HD22 ASN A 8 29.289 1.643 -29.466 1.00 0.00 H new ATOM 697 N HIS A 9 30.504 2.024 -24.071 1.00 0.00 N ATOM 698 CA HIS A 9 30.308 2.221 -22.602 1.00 0.00 C ATOM 699 C HIS A 9 28.851 2.624 -22.325 1.00 0.00 C ATOM 700 O HIS A 9 28.252 2.185 -21.344 1.00 0.00 O ATOM 701 CB HIS A 9 31.245 3.327 -22.102 1.00 0.00 C ATOM 702 CG HIS A 9 31.406 3.225 -20.609 1.00 0.00 C ATOM 703 ND1 HIS A 9 32.637 3.001 -20.013 1.00 0.00 N ATOM 704 CD2 HIS A 9 30.503 3.323 -19.579 1.00 0.00 C ATOM 705 CE1 HIS A 9 32.444 2.973 -18.681 1.00 0.00 C ATOM 706 NE2 HIS A 9 31.160 3.163 -18.362 1.00 0.00 N ATOM 0 H HIS A 9 30.775 2.860 -24.589 1.00 0.00 H new ATOM 0 HA HIS A 9 30.533 1.290 -22.081 1.00 0.00 H new ATOM 0 HB2 HIS A 9 32.217 3.240 -22.588 1.00 0.00 H new ATOM 0 HB3 HIS A 9 30.842 4.305 -22.367 1.00 0.00 H new ATOM 0 HD2 HIS A 9 29.444 3.498 -19.695 1.00 0.00 H new ATOM 0 HE1 HIS A 9 33.231 2.816 -17.958 1.00 0.00 H new ATOM 0 HE2 HIS A 9 30.750 3.186 -17.428 1.00 0.00 H new ATOM 707 N THR A 10 28.264 3.455 -23.160 1.00 0.00 N ATOM 708 CA THR A 10 26.853 3.878 -22.926 1.00 0.00 C ATOM 709 C THR A 10 25.923 3.151 -23.912 1.00 0.00 C ATOM 710 O THR A 10 26.254 2.988 -25.085 1.00 0.00 O ATOM 711 CB THR A 10 26.748 5.396 -23.143 1.00 0.00 C ATOM 712 OG1 THR A 10 27.563 6.060 -22.189 1.00 0.00 O ATOM 713 CG2 THR A 10 25.295 5.861 -22.982 1.00 0.00 C ATOM 0 H THR A 10 28.704 3.854 -23.989 1.00 0.00 H new ATOM 0 HA THR A 10 26.557 3.627 -21.907 1.00 0.00 H new ATOM 0 HB THR A 10 27.083 5.634 -24.152 1.00 0.00 H new ATOM 0 HG1 THR A 10 28.465 6.177 -22.554 1.00 0.00 H new ATOM 0 HG21 THR A 10 25.238 6.938 -23.139 1.00 0.00 H new ATOM 0 HG22 THR A 10 24.667 5.354 -23.715 1.00 0.00 H new ATOM 0 HG23 THR A 10 24.946 5.622 -21.978 1.00 0.00 H new ATOM 714 N ILE A 11 24.757 2.726 -23.468 1.00 0.00 N ATOM 715 CA ILE A 11 23.819 2.036 -24.398 1.00 0.00 C ATOM 716 C ILE A 11 22.788 3.053 -24.919 1.00 0.00 C ATOM 717 O ILE A 11 22.690 4.169 -24.407 1.00 0.00 O ATOM 718 CB ILE A 11 23.103 0.886 -23.675 1.00 0.00 C ATOM 719 CG1 ILE A 11 22.258 1.433 -22.508 1.00 0.00 C ATOM 720 CG2 ILE A 11 24.144 -0.099 -23.136 1.00 0.00 C ATOM 721 CD1 ILE A 11 20.842 0.852 -22.577 1.00 0.00 C ATOM 0 H ILE A 11 24.424 2.829 -22.510 1.00 0.00 H new ATOM 0 HA ILE A 11 24.380 1.621 -25.235 1.00 0.00 H new ATOM 0 HB ILE A 11 22.444 0.378 -24.379 1.00 0.00 H new ATOM 0 HG12 ILE A 11 22.722 1.172 -21.557 1.00 0.00 H new ATOM 0 HG13 ILE A 11 22.217 2.521 -22.555 1.00 0.00 H new ATOM 0 HG21 ILE A 11 23.639 -0.917 -22.622 1.00 0.00 H new ATOM 0 HG22 ILE A 11 24.731 -0.498 -23.964 1.00 0.00 H new ATOM 0 HG23 ILE A 11 24.805 0.415 -22.438 1.00 0.00 H new ATOM 0 HD11 ILE A 11 20.248 1.241 -21.750 1.00 0.00 H new ATOM 0 HD12 ILE A 11 20.378 1.135 -23.522 1.00 0.00 H new ATOM 0 HD13 ILE A 11 20.891 -0.235 -22.508 1.00 0.00 H new ATOM 722 N TYR A 12 22.023 2.699 -25.926 1.00 0.00 N ATOM 723 CA TYR A 12 21.018 3.654 -26.475 1.00 0.00 C ATOM 724 C TYR A 12 19.744 2.878 -26.861 1.00 0.00 C ATOM 725 O TYR A 12 19.792 1.954 -27.668 1.00 0.00 O ATOM 726 CB TYR A 12 21.628 4.348 -27.709 1.00 0.00 C ATOM 727 CG TYR A 12 20.560 5.047 -28.526 1.00 0.00 C ATOM 728 CD1 TYR A 12 20.188 6.361 -28.223 1.00 0.00 C ATOM 729 CD2 TYR A 12 19.948 4.374 -29.590 1.00 0.00 C ATOM 730 CE1 TYR A 12 19.204 7.004 -28.986 1.00 0.00 C ATOM 731 CE2 TYR A 12 18.964 5.014 -30.350 1.00 0.00 C ATOM 732 CZ TYR A 12 18.592 6.329 -30.049 1.00 0.00 C ATOM 733 OH TYR A 12 17.619 6.962 -30.801 1.00 0.00 O ATOM 0 H TYR A 12 22.054 1.790 -26.388 1.00 0.00 H new ATOM 0 HA TYR A 12 20.754 4.408 -25.733 1.00 0.00 H new ATOM 0 HB2 TYR A 12 22.378 5.072 -27.389 1.00 0.00 H new ATOM 0 HB3 TYR A 12 22.140 3.611 -28.328 1.00 0.00 H new ATOM 0 HD1 TYR A 12 20.659 6.880 -27.401 1.00 0.00 H new ATOM 0 HD2 TYR A 12 20.236 3.360 -29.824 1.00 0.00 H new ATOM 0 HE1 TYR A 12 18.918 8.019 -28.754 1.00 0.00 H new ATOM 0 HE2 TYR A 12 18.491 4.493 -31.169 1.00 0.00 H new ATOM 0 HH TYR A 12 17.051 6.290 -31.233 1.00 0.00 H new ATOM 734 N ILE A 13 18.604 3.241 -26.313 1.00 0.00 N ATOM 735 CA ILE A 13 17.346 2.521 -26.671 1.00 0.00 C ATOM 736 C ILE A 13 16.615 3.298 -27.776 1.00 0.00 C ATOM 737 O ILE A 13 16.767 4.512 -27.895 1.00 0.00 O ATOM 738 CB ILE A 13 16.443 2.416 -25.438 1.00 0.00 C ATOM 739 CG1 ILE A 13 17.214 1.745 -24.292 1.00 0.00 C ATOM 740 CG2 ILE A 13 15.206 1.584 -25.783 1.00 0.00 C ATOM 741 CD1 ILE A 13 16.890 2.451 -22.974 1.00 0.00 C ATOM 0 H ILE A 13 18.496 3.999 -25.639 1.00 0.00 H new ATOM 0 HA ILE A 13 17.589 1.519 -27.025 1.00 0.00 H new ATOM 0 HB ILE A 13 16.133 3.414 -25.127 1.00 0.00 H new ATOM 0 HG12 ILE A 13 16.945 0.691 -24.227 1.00 0.00 H new ATOM 0 HG13 ILE A 13 18.286 1.789 -24.486 1.00 0.00 H new ATOM 0 HG21 ILE A 13 14.562 1.508 -24.907 1.00 0.00 H new ATOM 0 HG22 ILE A 13 14.659 2.064 -26.594 1.00 0.00 H new ATOM 0 HG23 ILE A 13 15.514 0.586 -26.094 1.00 0.00 H new ATOM 0 HD11 ILE A 13 17.438 1.974 -22.161 1.00 0.00 H new ATOM 0 HD12 ILE A 13 17.181 3.499 -23.042 1.00 0.00 H new ATOM 0 HD13 ILE A 13 15.820 2.384 -22.779 1.00 0.00 H new ATOM 742 N ASN A 14 15.826 2.631 -28.591 1.00 0.00 N ATOM 743 CA ASN A 14 15.101 3.352 -29.678 1.00 0.00 C ATOM 744 C ASN A 14 13.696 2.754 -29.839 1.00 0.00 C ATOM 745 O ASN A 14 13.365 1.747 -29.218 1.00 0.00 O ATOM 746 CB ASN A 14 15.873 3.207 -30.990 1.00 0.00 C ATOM 747 CG ASN A 14 15.668 4.462 -31.847 1.00 0.00 C ATOM 748 OD1 ASN A 14 15.688 5.577 -31.329 1.00 0.00 O ATOM 749 ND2 ASN A 14 15.469 4.348 -33.138 1.00 0.00 N ATOM 0 H ASN A 14 15.657 1.626 -28.547 1.00 0.00 H new ATOM 0 HA ASN A 14 15.018 4.408 -29.422 1.00 0.00 H new ATOM 0 HB2 ASN A 14 16.934 3.063 -30.786 1.00 0.00 H new ATOM 0 HB3 ASN A 14 15.530 2.325 -31.530 1.00 0.00 H new ATOM 0 HD21 ASN A 14 15.332 5.182 -33.708 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.452 3.425 -33.572 1.00 0.00 H new ATOM 750 N ASN A 15 12.856 3.352 -30.659 1.00 0.00 N ATOM 751 CA ASN A 15 11.480 2.806 -30.843 1.00 0.00 C ATOM 752 C ASN A 15 10.756 2.792 -29.488 1.00 0.00 C ATOM 753 O ASN A 15 10.235 1.761 -29.061 1.00 0.00 O ATOM 754 CB ASN A 15 11.565 1.380 -31.396 1.00 0.00 C ATOM 755 CG ASN A 15 10.353 1.106 -32.295 1.00 0.00 C ATOM 756 OD1 ASN A 15 10.383 1.403 -33.487 1.00 0.00 O ATOM 757 ND2 ASN A 15 9.277 0.551 -31.791 1.00 0.00 N ATOM 0 H ASN A 15 13.068 4.189 -31.202 1.00 0.00 H new ATOM 0 HA ASN A 15 10.928 3.431 -31.545 1.00 0.00 H new ATOM 0 HB2 ASN A 15 12.487 1.253 -31.963 1.00 0.00 H new ATOM 0 HB3 ASN A 15 11.593 0.662 -30.576 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.470 0.368 -32.388 1.00 0.00 H new ATOM 0 HD22 ASN A 15 9.247 0.302 -30.802 1.00 0.00 H new ATOM 758 N LEU A 16 10.709 3.912 -28.797 1.00 0.00 N ATOM 759 CA LEU A 16 10.016 3.940 -27.474 1.00 0.00 C ATOM 760 C LEU A 16 8.564 4.407 -27.664 1.00 0.00 C ATOM 761 O LEU A 16 8.107 4.597 -28.790 1.00 0.00 O ATOM 762 CB LEU A 16 10.743 4.902 -26.527 1.00 0.00 C ATOM 763 CG LEU A 16 12.233 4.550 -26.482 1.00 0.00 C ATOM 764 CD1 LEU A 16 12.976 5.587 -25.636 1.00 0.00 C ATOM 765 CD2 LEU A 16 12.413 3.164 -25.858 1.00 0.00 C ATOM 0 H LEU A 16 11.118 4.798 -29.093 1.00 0.00 H new ATOM 0 HA LEU A 16 10.023 2.938 -27.044 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.612 5.930 -26.865 1.00 0.00 H new ATOM 0 HB3 LEU A 16 10.313 4.838 -25.527 1.00 0.00 H new ATOM 0 HG LEU A 16 12.635 4.548 -27.495 1.00 0.00 H new ATOM 0 HD11 LEU A 16 14.037 5.337 -25.603 1.00 0.00 H new ATOM 0 HD12 LEU A 16 12.849 6.575 -26.078 1.00 0.00 H new ATOM 0 HD13 LEU A 16 12.572 5.588 -24.624 1.00 0.00 H new ATOM 0 HD21 LEU A 16 13.474 2.914 -25.826 1.00 0.00 H new ATOM 0 HD22 LEU A 16 12.010 3.166 -24.845 1.00 0.00 H new ATOM 0 HD23 LEU A 16 11.884 2.424 -26.458 1.00 0.00 H new ATOM 766 N ASN A 17 7.825 4.599 -26.591 1.00 0.00 N ATOM 767 CA ASN A 17 6.407 5.056 -26.736 1.00 0.00 C ATOM 768 C ASN A 17 6.372 6.585 -26.835 1.00 0.00 C ATOM 769 O ASN A 17 7.222 7.274 -26.274 1.00 0.00 O ATOM 770 CB ASN A 17 5.584 4.606 -25.522 1.00 0.00 C ATOM 771 CG ASN A 17 4.153 4.277 -25.966 1.00 0.00 C ATOM 772 OD1 ASN A 17 3.943 3.363 -26.760 1.00 0.00 O ATOM 773 ND2 ASN A 17 3.147 4.975 -25.498 1.00 0.00 N ATOM 0 H ASN A 17 8.142 4.460 -25.632 1.00 0.00 H new ATOM 0 HA ASN A 17 5.982 4.618 -27.639 1.00 0.00 H new ATOM 0 HB2 ASN A 17 6.043 3.731 -25.062 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.570 5.392 -24.767 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.195 4.758 -25.793 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.316 5.735 -24.839 1.00 0.00 H new ATOM 774 N GLU A 18 5.408 7.137 -27.541 1.00 0.00 N ATOM 775 CA GLU A 18 5.336 8.622 -27.667 1.00 0.00 C ATOM 776 C GLU A 18 4.246 9.174 -26.733 1.00 0.00 C ATOM 777 O GLU A 18 3.531 10.109 -27.089 1.00 0.00 O ATOM 778 CB GLU A 18 5.000 8.991 -29.113 1.00 0.00 C ATOM 779 CG GLU A 18 6.268 8.924 -29.966 1.00 0.00 C ATOM 780 CD GLU A 18 5.889 8.657 -31.424 1.00 0.00 C ATOM 781 OE1 GLU A 18 5.343 7.598 -31.689 1.00 0.00 O ATOM 782 OE2 GLU A 18 6.151 9.515 -32.250 1.00 0.00 O ATOM 0 H GLU A 18 4.675 6.623 -28.030 1.00 0.00 H new ATOM 0 HA GLU A 18 6.298 9.054 -27.390 1.00 0.00 H new ATOM 0 HB2 GLU A 18 4.247 8.309 -29.508 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.574 9.994 -29.154 1.00 0.00 H new ATOM 0 HG2 GLU A 18 6.821 9.860 -29.889 1.00 0.00 H new ATOM 0 HG3 GLU A 18 6.924 8.135 -29.599 1.00 0.00 H new ATOM 783 N LYS A 19 4.101 8.625 -25.544 1.00 0.00 N ATOM 784 CA LYS A 19 3.057 9.140 -24.608 1.00 0.00 C ATOM 785 C LYS A 19 3.492 8.900 -23.151 1.00 0.00 C ATOM 786 O LYS A 19 2.666 8.591 -22.293 1.00 0.00 O ATOM 787 CB LYS A 19 1.735 8.412 -24.867 1.00 0.00 C ATOM 788 CG LYS A 19 1.371 8.522 -26.349 1.00 0.00 C ATOM 789 CD LYS A 19 -0.025 7.939 -26.577 1.00 0.00 C ATOM 790 CE LYS A 19 -1.081 8.949 -26.126 1.00 0.00 C ATOM 791 NZ LYS A 19 -2.368 8.666 -26.821 1.00 0.00 N ATOM 0 H LYS A 19 4.659 7.849 -25.189 1.00 0.00 H new ATOM 0 HA LYS A 19 2.928 10.210 -24.773 1.00 0.00 H new ATOM 0 HB2 LYS A 19 1.823 7.364 -24.580 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.944 8.845 -24.255 1.00 0.00 H new ATOM 0 HG2 LYS A 19 1.397 9.565 -26.664 1.00 0.00 H new ATOM 0 HG3 LYS A 19 2.103 7.988 -26.955 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -0.163 7.700 -27.631 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -0.137 7.008 -26.022 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -1.218 8.890 -25.046 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -0.749 9.963 -26.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -3.086 9.353 -26.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -2.232 8.743 -27.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -2.686 7.704 -26.585 1.00 0.00 H new ATOM 792 N ILE A 20 4.768 9.024 -22.850 1.00 0.00 N ATOM 793 CA ILE A 20 5.229 8.789 -21.451 1.00 0.00 C ATOM 794 C ILE A 20 5.506 10.123 -20.760 1.00 0.00 C ATOM 795 O ILE A 20 5.747 11.138 -21.413 1.00 0.00 O ATOM 796 CB ILE A 20 6.531 7.971 -21.438 1.00 0.00 C ATOM 797 CG1 ILE A 20 6.516 6.888 -22.531 1.00 0.00 C ATOM 798 CG2 ILE A 20 6.697 7.311 -20.065 1.00 0.00 C ATOM 799 CD1 ILE A 20 5.300 5.982 -22.350 1.00 0.00 C ATOM 0 H ILE A 20 5.501 9.276 -23.513 1.00 0.00 H new ATOM 0 HA ILE A 20 4.443 8.243 -20.929 1.00 0.00 H new ATOM 0 HB ILE A 20 7.366 8.643 -21.636 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.490 7.354 -23.516 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.431 6.297 -22.482 1.00 0.00 H new ATOM 0 HG21 ILE A 20 7.619 6.729 -20.050 1.00 0.00 H new ATOM 0 HG22 ILE A 20 6.741 8.081 -19.294 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.850 6.653 -19.873 1.00 0.00 H new ATOM 0 HD11 ILE A 20 5.297 5.218 -23.127 1.00 0.00 H new ATOM 0 HD12 ILE A 20 5.345 5.504 -21.372 1.00 0.00 H new ATOM 0 HD13 ILE A 20 4.389 6.577 -22.422 1.00 0.00 H new ATOM 800 N LYS A 21 5.505 10.139 -19.448 1.00 0.00 N ATOM 801 CA LYS A 21 5.801 11.406 -18.726 1.00 0.00 C ATOM 802 C LYS A 21 7.325 11.559 -18.633 1.00 0.00 C ATOM 803 O LYS A 21 8.064 10.699 -19.112 1.00 0.00 O ATOM 804 CB LYS A 21 5.200 11.371 -17.316 1.00 0.00 C ATOM 805 CG LYS A 21 3.875 12.137 -17.303 1.00 0.00 C ATOM 806 CD LYS A 21 4.151 13.630 -17.111 1.00 0.00 C ATOM 807 CE LYS A 21 2.947 14.289 -16.437 1.00 0.00 C ATOM 808 NZ LYS A 21 3.013 14.057 -14.967 1.00 0.00 N ATOM 0 H LYS A 21 5.313 9.333 -18.854 1.00 0.00 H new ATOM 0 HA LYS A 21 5.364 12.247 -19.264 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.038 10.339 -17.004 1.00 0.00 H new ATOM 0 HB3 LYS A 21 5.895 11.814 -16.603 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.338 11.973 -18.237 1.00 0.00 H new ATOM 0 HG3 LYS A 21 3.237 11.768 -16.500 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.044 13.770 -16.502 1.00 0.00 H new ATOM 0 HD3 LYS A 21 4.345 14.102 -18.074 1.00 0.00 H new ATOM 0 HE2 LYS A 21 2.939 15.358 -16.647 1.00 0.00 H new ATOM 0 HE3 LYS A 21 2.021 13.878 -16.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 2.081 14.241 -14.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.288 13.071 -14.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.716 14.697 -14.546 1.00 0.00 H new ATOM 809 N LYS A 22 7.821 12.616 -18.030 1.00 0.00 N ATOM 810 CA LYS A 22 9.306 12.767 -17.925 1.00 0.00 C ATOM 811 C LYS A 22 9.802 11.964 -16.720 1.00 0.00 C ATOM 812 O LYS A 22 10.812 11.265 -16.802 1.00 0.00 O ATOM 813 CB LYS A 22 9.684 14.244 -17.760 1.00 0.00 C ATOM 814 CG LYS A 22 9.196 15.035 -18.976 1.00 0.00 C ATOM 815 CD LYS A 22 10.286 15.042 -20.050 1.00 0.00 C ATOM 816 CE LYS A 22 9.898 16.016 -21.164 1.00 0.00 C ATOM 817 NZ LYS A 22 10.166 17.413 -20.719 1.00 0.00 N ATOM 0 H LYS A 22 7.271 13.367 -17.613 1.00 0.00 H new ATOM 0 HA LYS A 22 9.772 12.394 -18.837 1.00 0.00 H new ATOM 0 HB2 LYS A 22 9.239 14.645 -16.850 1.00 0.00 H new ATOM 0 HB3 LYS A 22 10.764 14.345 -17.657 1.00 0.00 H new ATOM 0 HG2 LYS A 22 8.284 14.589 -19.371 1.00 0.00 H new ATOM 0 HG3 LYS A 22 8.951 16.056 -18.685 1.00 0.00 H new ATOM 0 HD2 LYS A 22 11.241 15.335 -19.613 1.00 0.00 H new ATOM 0 HD3 LYS A 22 10.416 14.040 -20.458 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.466 15.796 -22.068 1.00 0.00 H new ATOM 0 HE3 LYS A 22 8.843 15.898 -21.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 9.356 18.017 -20.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 10.309 17.428 -19.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 11.021 17.770 -21.192 1.00 0.00 H new ATOM 818 N ASP A 23 9.098 12.014 -15.613 1.00 0.00 N ATOM 819 CA ASP A 23 9.525 11.210 -14.433 1.00 0.00 C ATOM 820 C ASP A 23 9.157 9.731 -14.669 1.00 0.00 C ATOM 821 O ASP A 23 9.665 8.846 -13.982 1.00 0.00 O ATOM 822 CB ASP A 23 8.826 11.712 -13.162 1.00 0.00 C ATOM 823 CG ASP A 23 9.190 13.179 -12.925 1.00 0.00 C ATOM 824 OD1 ASP A 23 8.756 14.011 -13.704 1.00 0.00 O ATOM 825 OD2 ASP A 23 9.898 13.445 -11.967 1.00 0.00 O ATOM 0 H ASP A 23 8.255 12.572 -15.480 1.00 0.00 H new ATOM 0 HA ASP A 23 10.603 11.312 -14.305 1.00 0.00 H new ATOM 0 HB2 ASP A 23 7.746 11.606 -13.262 1.00 0.00 H new ATOM 0 HB3 ASP A 23 9.128 11.109 -12.306 1.00 0.00 H new ATOM 826 N GLU A 24 8.282 9.431 -15.620 1.00 0.00 N ATOM 827 CA GLU A 24 7.911 8.009 -15.860 1.00 0.00 C ATOM 828 C GLU A 24 8.967 7.327 -16.731 1.00 0.00 C ATOM 829 O GLU A 24 9.352 6.193 -16.456 1.00 0.00 O ATOM 830 CB GLU A 24 6.543 7.925 -16.547 1.00 0.00 C ATOM 831 CG GLU A 24 5.858 6.611 -16.165 1.00 0.00 C ATOM 832 CD GLU A 24 5.223 6.748 -14.780 1.00 0.00 C ATOM 833 OE1 GLU A 24 4.266 7.495 -14.659 1.00 0.00 O ATOM 834 OE2 GLU A 24 5.705 6.103 -13.863 1.00 0.00 O ATOM 0 H GLU A 24 7.822 10.110 -16.226 1.00 0.00 H new ATOM 0 HA GLU A 24 7.858 7.499 -14.898 1.00 0.00 H new ATOM 0 HB2 GLU A 24 5.923 8.770 -16.249 1.00 0.00 H new ATOM 0 HB3 GLU A 24 6.664 7.983 -17.629 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.096 6.359 -16.902 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.583 5.797 -16.165 1.00 0.00 H new ATOM 835 N LEU A 25 9.451 7.969 -17.776 1.00 0.00 N ATOM 836 CA LEU A 25 10.478 7.286 -18.624 1.00 0.00 C ATOM 837 C LEU A 25 11.796 7.161 -17.848 1.00 0.00 C ATOM 838 O LEU A 25 12.488 6.156 -17.963 1.00 0.00 O ATOM 839 CB LEU A 25 10.736 8.063 -19.928 1.00 0.00 C ATOM 840 CG LEU A 25 9.991 7.420 -21.110 1.00 0.00 C ATOM 841 CD1 LEU A 25 10.408 8.114 -22.405 1.00 0.00 C ATOM 842 CD2 LEU A 25 10.316 5.921 -21.217 1.00 0.00 C ATOM 0 H LEU A 25 9.186 8.909 -18.069 1.00 0.00 H new ATOM 0 HA LEU A 25 10.095 6.297 -18.877 1.00 0.00 H new ATOM 0 HB2 LEU A 25 10.413 9.097 -19.809 1.00 0.00 H new ATOM 0 HB3 LEU A 25 11.806 8.085 -20.137 1.00 0.00 H new ATOM 0 HG LEU A 25 8.920 7.533 -20.945 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.882 7.661 -23.246 1.00 0.00 H new ATOM 0 HD12 LEU A 25 10.157 9.173 -22.347 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.483 8.003 -22.547 1.00 0.00 H new ATOM 0 HD21 LEU A 25 9.776 5.491 -22.061 1.00 0.00 H new ATOM 0 HD22 LEU A 25 11.388 5.791 -21.367 1.00 0.00 H new ATOM 0 HD23 LEU A 25 10.015 5.417 -20.299 1.00 0.00 H new ATOM 843 N LYS A 26 12.171 8.154 -17.071 1.00 0.00 N ATOM 844 CA LYS A 26 13.461 8.050 -16.313 1.00 0.00 C ATOM 845 C LYS A 26 13.323 7.056 -15.143 1.00 0.00 C ATOM 846 O LYS A 26 14.299 6.418 -14.753 1.00 0.00 O ATOM 847 CB LYS A 26 13.884 9.431 -15.778 1.00 0.00 C ATOM 848 CG LYS A 26 12.868 9.939 -14.747 1.00 0.00 C ATOM 849 CD LYS A 26 13.394 11.223 -14.102 1.00 0.00 C ATOM 850 CE LYS A 26 14.601 10.897 -13.222 1.00 0.00 C ATOM 851 NZ LYS A 26 14.999 12.111 -12.454 1.00 0.00 N ATOM 0 H LYS A 26 11.648 9.019 -16.931 1.00 0.00 H new ATOM 0 HA LYS A 26 14.228 7.685 -16.996 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.872 9.365 -15.322 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.960 10.140 -16.603 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.909 10.128 -15.229 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.697 9.180 -13.984 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.676 11.940 -14.873 1.00 0.00 H new ATOM 0 HD3 LYS A 26 12.611 11.689 -13.504 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.357 10.085 -12.538 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.432 10.555 -13.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.820 11.889 -11.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 15.249 12.874 -13.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 14.206 12.418 -11.855 1.00 0.00 H new ATOM 852 N LYS A 27 12.146 6.905 -14.567 1.00 0.00 N ATOM 853 CA LYS A 27 11.997 5.942 -13.428 1.00 0.00 C ATOM 854 C LYS A 27 11.979 4.486 -13.941 1.00 0.00 C ATOM 855 O LYS A 27 12.345 3.567 -13.209 1.00 0.00 O ATOM 856 CB LYS A 27 10.695 6.221 -12.666 1.00 0.00 C ATOM 857 CG LYS A 27 10.931 7.331 -11.641 1.00 0.00 C ATOM 858 CD LYS A 27 11.691 6.765 -10.441 1.00 0.00 C ATOM 859 CE LYS A 27 10.732 5.964 -9.559 1.00 0.00 C ATOM 860 NZ LYS A 27 10.155 6.855 -8.514 1.00 0.00 N ATOM 0 H LYS A 27 11.296 7.401 -14.834 1.00 0.00 H new ATOM 0 HA LYS A 27 12.849 6.075 -12.761 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.910 6.515 -13.362 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.353 5.315 -12.165 1.00 0.00 H new ATOM 0 HG2 LYS A 27 11.499 8.144 -12.094 1.00 0.00 H new ATOM 0 HG3 LYS A 27 9.978 7.750 -11.317 1.00 0.00 H new ATOM 0 HD2 LYS A 27 12.506 6.127 -10.782 1.00 0.00 H new ATOM 0 HD3 LYS A 27 12.139 7.575 -9.866 1.00 0.00 H new ATOM 0 HE2 LYS A 27 9.935 5.535 -10.166 1.00 0.00 H new ATOM 0 HE3 LYS A 27 11.260 5.132 -9.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 9.503 6.310 -7.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 10.921 7.244 -7.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 9.638 7.634 -8.969 1.00 0.00 H new ATOM 861 N SER A 28 11.559 4.241 -15.169 1.00 0.00 N ATOM 862 CA SER A 28 11.529 2.831 -15.673 1.00 0.00 C ATOM 863 C SER A 28 12.914 2.419 -16.199 1.00 0.00 C ATOM 864 O SER A 28 13.323 1.272 -16.043 1.00 0.00 O ATOM 865 CB SER A 28 10.502 2.698 -16.803 1.00 0.00 C ATOM 866 OG SER A 28 9.792 1.476 -16.651 1.00 0.00 O ATOM 0 H SER A 28 11.241 4.949 -15.831 1.00 0.00 H new ATOM 0 HA SER A 28 11.250 2.178 -14.846 1.00 0.00 H new ATOM 0 HB2 SER A 28 9.809 3.539 -16.781 1.00 0.00 H new ATOM 0 HB3 SER A 28 11.003 2.723 -17.770 1.00 0.00 H new ATOM 0 HG SER A 28 9.133 1.389 -17.371 1.00 0.00 H new ATOM 867 N LEU A 29 13.648 3.319 -16.821 1.00 0.00 N ATOM 868 CA LEU A 29 15.000 2.939 -17.345 1.00 0.00 C ATOM 869 C LEU A 29 15.958 2.728 -16.166 1.00 0.00 C ATOM 870 O LEU A 29 16.747 1.784 -16.156 1.00 0.00 O ATOM 871 CB LEU A 29 15.543 4.043 -18.265 1.00 0.00 C ATOM 872 CG LEU A 29 14.567 4.263 -19.429 1.00 0.00 C ATOM 873 CD1 LEU A 29 14.486 5.756 -19.760 1.00 0.00 C ATOM 874 CD2 LEU A 29 15.057 3.494 -20.659 1.00 0.00 C ATOM 0 H LEU A 29 13.372 4.287 -16.986 1.00 0.00 H new ATOM 0 HA LEU A 29 14.916 2.016 -17.919 1.00 0.00 H new ATOM 0 HB2 LEU A 29 15.671 4.969 -17.704 1.00 0.00 H new ATOM 0 HB3 LEU A 29 16.525 3.763 -18.647 1.00 0.00 H new ATOM 0 HG LEU A 29 13.579 3.903 -19.143 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.792 5.908 -20.587 1.00 0.00 H new ATOM 0 HD12 LEU A 29 14.135 6.304 -18.886 1.00 0.00 H new ATOM 0 HD13 LEU A 29 15.474 6.120 -20.043 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.364 3.650 -21.486 1.00 0.00 H new ATOM 0 HD22 LEU A 29 16.046 3.853 -20.942 1.00 0.00 H new ATOM 0 HD23 LEU A 29 15.110 2.431 -20.426 1.00 0.00 H new ATOM 875 N HIS A 30 15.904 3.576 -15.166 1.00 0.00 N ATOM 876 CA HIS A 30 16.816 3.399 -13.989 1.00 0.00 C ATOM 877 C HIS A 30 16.479 2.094 -13.243 1.00 0.00 C ATOM 878 O HIS A 30 17.349 1.495 -12.614 1.00 0.00 O ATOM 879 CB HIS A 30 16.671 4.583 -13.022 1.00 0.00 C ATOM 880 CG HIS A 30 17.906 4.684 -12.168 1.00 0.00 C ATOM 881 ND1 HIS A 30 17.944 4.211 -10.865 1.00 0.00 N ATOM 882 CD2 HIS A 30 19.153 5.201 -12.416 1.00 0.00 C ATOM 883 CE1 HIS A 30 19.177 4.451 -10.382 1.00 0.00 C ATOM 884 NE2 HIS A 30 19.954 5.052 -11.287 1.00 0.00 N ATOM 0 H HIS A 30 15.274 4.376 -15.113 1.00 0.00 H new ATOM 0 HA HIS A 30 17.842 3.352 -14.355 1.00 0.00 H new ATOM 0 HB2 HIS A 30 16.525 5.507 -13.581 1.00 0.00 H new ATOM 0 HB3 HIS A 30 15.791 4.448 -12.394 1.00 0.00 H new ATOM 0 HD2 HIS A 30 19.465 5.654 -13.345 1.00 0.00 H new ATOM 0 HE1 HIS A 30 19.499 4.190 -9.385 1.00 0.00 H new ATOM 0 HE2 HIS A 30 20.926 5.340 -11.175 1.00 0.00 H new ATOM 885 N ALA A 31 15.243 1.633 -13.287 1.00 0.00 N ATOM 886 CA ALA A 31 14.897 0.369 -12.564 1.00 0.00 C ATOM 887 C ALA A 31 15.414 -0.840 -13.360 1.00 0.00 C ATOM 888 O ALA A 31 16.337 -1.527 -12.930 1.00 0.00 O ATOM 889 CB ALA A 31 13.374 0.256 -12.398 1.00 0.00 C ATOM 0 H ALA A 31 14.472 2.075 -13.787 1.00 0.00 H new ATOM 0 HA ALA A 31 15.364 0.386 -11.579 1.00 0.00 H new ATOM 0 HB1 ALA A 31 13.133 -0.667 -11.871 1.00 0.00 H new ATOM 0 HB2 ALA A 31 13.006 1.108 -11.825 1.00 0.00 H new ATOM 0 HB3 ALA A 31 12.901 0.247 -13.380 1.00 0.00 H new ATOM 890 N ILE A 32 14.825 -1.133 -14.502 1.00 0.00 N ATOM 891 CA ILE A 32 15.271 -2.306 -15.301 1.00 0.00 C ATOM 892 C ILE A 32 16.806 -2.337 -15.462 1.00 0.00 C ATOM 893 O ILE A 32 17.453 -3.303 -15.073 1.00 0.00 O ATOM 894 CB ILE A 32 14.612 -2.318 -16.696 1.00 0.00 C ATOM 895 CG1 ILE A 32 14.378 -0.901 -17.282 1.00 0.00 C ATOM 896 CG2 ILE A 32 13.276 -3.059 -16.622 1.00 0.00 C ATOM 897 CD1 ILE A 32 14.898 -0.843 -18.721 1.00 0.00 C ATOM 0 H ILE A 32 14.054 -0.603 -14.908 1.00 0.00 H new ATOM 0 HA ILE A 32 14.959 -3.194 -14.751 1.00 0.00 H new ATOM 0 HB ILE A 32 15.307 -2.826 -17.365 1.00 0.00 H new ATOM 0 HG12 ILE A 32 13.315 -0.659 -17.259 1.00 0.00 H new ATOM 0 HG13 ILE A 32 14.888 -0.156 -16.671 1.00 0.00 H new ATOM 0 HG21 ILE A 32 12.810 -3.068 -17.607 1.00 0.00 H new ATOM 0 HG22 ILE A 32 13.446 -4.084 -16.292 1.00 0.00 H new ATOM 0 HG23 ILE A 32 12.619 -2.554 -15.914 1.00 0.00 H new ATOM 0 HD11 ILE A 32 14.731 0.154 -19.128 1.00 0.00 H new ATOM 0 HD12 ILE A 32 15.965 -1.066 -18.732 1.00 0.00 H new ATOM 0 HD13 ILE A 32 14.368 -1.576 -19.329 1.00 0.00 H new ATOM 898 N PHE A 33 17.400 -1.324 -16.040 1.00 0.00 N ATOM 899 CA PHE A 33 18.893 -1.334 -16.234 1.00 0.00 C ATOM 900 C PHE A 33 19.631 -1.470 -14.887 1.00 0.00 C ATOM 901 O PHE A 33 20.712 -2.054 -14.827 1.00 0.00 O ATOM 902 CB PHE A 33 19.343 -0.036 -16.919 1.00 0.00 C ATOM 903 CG PHE A 33 18.999 -0.103 -18.388 1.00 0.00 C ATOM 904 CD1 PHE A 33 19.780 -0.880 -19.250 1.00 0.00 C ATOM 905 CD2 PHE A 33 17.902 0.607 -18.886 1.00 0.00 C ATOM 906 CE1 PHE A 33 19.463 -0.948 -20.612 1.00 0.00 C ATOM 907 CE2 PHE A 33 17.584 0.540 -20.248 1.00 0.00 C ATOM 908 CZ PHE A 33 18.365 -0.238 -21.111 1.00 0.00 C ATOM 0 H PHE A 33 16.924 -0.491 -16.387 1.00 0.00 H new ATOM 0 HA PHE A 33 19.140 -2.192 -16.859 1.00 0.00 H new ATOM 0 HB2 PHE A 33 18.853 0.821 -16.458 1.00 0.00 H new ATOM 0 HB3 PHE A 33 20.416 0.103 -16.791 1.00 0.00 H new ATOM 0 HD1 PHE A 33 20.628 -1.427 -18.865 1.00 0.00 H new ATOM 0 HD2 PHE A 33 17.300 1.207 -18.220 1.00 0.00 H new ATOM 0 HE1 PHE A 33 20.066 -1.548 -21.277 1.00 0.00 H new ATOM 0 HE2 PHE A 33 16.737 1.088 -20.633 1.00 0.00 H new ATOM 0 HZ PHE A 33 18.120 -0.290 -22.162 1.00 0.00 H new ATOM 909 N SER A 34 19.099 -0.931 -13.811 1.00 0.00 N ATOM 910 CA SER A 34 19.817 -1.030 -12.494 1.00 0.00 C ATOM 911 C SER A 34 19.952 -2.498 -12.043 1.00 0.00 C ATOM 912 O SER A 34 20.943 -2.864 -11.412 1.00 0.00 O ATOM 913 CB SER A 34 19.060 -0.248 -11.414 1.00 0.00 C ATOM 914 OG SER A 34 19.561 -0.608 -10.134 1.00 0.00 O ATOM 0 H SER A 34 18.209 -0.432 -13.786 1.00 0.00 H new ATOM 0 HA SER A 34 20.812 -0.606 -12.630 1.00 0.00 H new ATOM 0 HB2 SER A 34 19.178 0.824 -11.575 1.00 0.00 H new ATOM 0 HB3 SER A 34 17.993 -0.464 -11.473 1.00 0.00 H new ATOM 0 HG SER A 34 19.080 -0.108 -9.442 1.00 0.00 H new ATOM 915 N ARG A 35 18.983 -3.346 -12.322 1.00 0.00 N ATOM 916 CA ARG A 35 19.091 -4.778 -11.865 1.00 0.00 C ATOM 917 C ARG A 35 20.458 -5.385 -12.257 1.00 0.00 C ATOM 918 O ARG A 35 20.971 -6.259 -11.559 1.00 0.00 O ATOM 919 CB ARG A 35 17.947 -5.627 -12.457 1.00 0.00 C ATOM 920 CG ARG A 35 18.129 -5.811 -13.969 1.00 0.00 C ATOM 921 CD ARG A 35 16.757 -5.891 -14.640 1.00 0.00 C ATOM 922 NE ARG A 35 16.030 -7.093 -14.143 1.00 0.00 N ATOM 923 CZ ARG A 35 14.806 -6.980 -13.704 1.00 0.00 C ATOM 924 NH1 ARG A 35 13.828 -6.785 -14.546 1.00 0.00 N ATOM 925 NH2 ARG A 35 14.562 -7.062 -12.426 1.00 0.00 N ATOM 0 H ARG A 35 18.134 -3.115 -12.838 1.00 0.00 H new ATOM 0 HA ARG A 35 19.009 -4.786 -10.778 1.00 0.00 H new ATOM 0 HB2 ARG A 35 17.921 -6.601 -11.968 1.00 0.00 H new ATOM 0 HB3 ARG A 35 16.990 -5.145 -12.258 1.00 0.00 H new ATOM 0 HG2 ARG A 35 18.700 -4.979 -14.382 1.00 0.00 H new ATOM 0 HG3 ARG A 35 18.698 -6.719 -14.170 1.00 0.00 H new ATOM 0 HD2 ARG A 35 16.182 -4.990 -14.425 1.00 0.00 H new ATOM 0 HD3 ARG A 35 16.872 -5.944 -15.723 1.00 0.00 H new ATOM 0 HE ARG A 35 16.489 -8.004 -14.146 1.00 0.00 H new ATOM 0 HH11 ARG A 35 14.021 -6.721 -15.546 1.00 0.00 H new ATOM 0 HH12 ARG A 35 12.871 -6.697 -14.204 1.00 0.00 H new ATOM 0 HH21 ARG A 35 15.328 -7.214 -11.769 1.00 0.00 H new ATOM 0 HH22 ARG A 35 13.606 -6.974 -12.083 1.00 0.00 H new ATOM 926 N PHE A 36 21.060 -4.954 -13.347 1.00 0.00 N ATOM 927 CA PHE A 36 22.383 -5.536 -13.740 1.00 0.00 C ATOM 928 C PHE A 36 23.497 -4.864 -12.926 1.00 0.00 C ATOM 929 O PHE A 36 24.318 -5.538 -12.307 1.00 0.00 O ATOM 930 CB PHE A 36 22.638 -5.308 -15.237 1.00 0.00 C ATOM 931 CG PHE A 36 21.422 -5.727 -16.029 1.00 0.00 C ATOM 932 CD1 PHE A 36 21.184 -7.083 -16.282 1.00 0.00 C ATOM 933 CD2 PHE A 36 20.531 -4.759 -16.507 1.00 0.00 C ATOM 934 CE1 PHE A 36 20.055 -7.471 -17.013 1.00 0.00 C ATOM 935 CE2 PHE A 36 19.402 -5.146 -17.238 1.00 0.00 C ATOM 936 CZ PHE A 36 19.164 -6.502 -17.491 1.00 0.00 C ATOM 0 H PHE A 36 20.696 -4.234 -13.971 1.00 0.00 H new ATOM 0 HA PHE A 36 22.373 -6.607 -13.540 1.00 0.00 H new ATOM 0 HB2 PHE A 36 22.860 -4.257 -15.422 1.00 0.00 H new ATOM 0 HB3 PHE A 36 23.509 -5.880 -15.559 1.00 0.00 H new ATOM 0 HD1 PHE A 36 21.871 -7.830 -15.913 1.00 0.00 H new ATOM 0 HD2 PHE A 36 20.715 -3.713 -16.312 1.00 0.00 H new ATOM 0 HE1 PHE A 36 19.871 -8.517 -17.208 1.00 0.00 H new ATOM 0 HE2 PHE A 36 18.715 -4.399 -17.607 1.00 0.00 H new ATOM 0 HZ PHE A 36 18.293 -6.801 -18.055 1.00 0.00 H new ATOM 937 N GLY A 37 23.547 -3.549 -12.910 1.00 0.00 N ATOM 938 CA GLY A 37 24.617 -2.856 -12.128 1.00 0.00 C ATOM 939 C GLY A 37 24.144 -1.449 -11.730 1.00 0.00 C ATOM 940 O GLY A 37 23.003 -1.072 -11.992 1.00 0.00 O ATOM 0 H GLY A 37 22.898 -2.934 -13.401 1.00 0.00 H new ATOM 0 HA2 GLY A 37 24.860 -3.434 -11.236 1.00 0.00 H new ATOM 0 HA3 GLY A 37 25.528 -2.789 -12.722 1.00 0.00 H new ATOM 941 N GLN A 38 24.995 -0.659 -11.107 1.00 0.00 N ATOM 942 CA GLN A 38 24.566 0.719 -10.709 1.00 0.00 C ATOM 943 C GLN A 38 24.569 1.633 -11.943 1.00 0.00 C ATOM 944 O GLN A 38 25.425 1.508 -12.817 1.00 0.00 O ATOM 945 CB GLN A 38 25.514 1.290 -9.640 1.00 0.00 C ATOM 946 CG GLN A 38 26.937 1.418 -10.203 1.00 0.00 C ATOM 947 CD GLN A 38 27.946 0.882 -9.179 1.00 0.00 C ATOM 948 OE1 GLN A 38 28.443 -0.232 -9.319 1.00 0.00 O ATOM 949 NE2 GLN A 38 28.281 1.619 -8.148 1.00 0.00 N ATOM 0 H GLN A 38 25.953 -0.907 -10.862 1.00 0.00 H new ATOM 0 HA GLN A 38 23.560 0.668 -10.292 1.00 0.00 H new ATOM 0 HB2 GLN A 38 25.157 2.266 -9.311 1.00 0.00 H new ATOM 0 HB3 GLN A 38 25.519 0.641 -8.764 1.00 0.00 H new ATOM 0 HG2 GLN A 38 27.021 0.862 -11.137 1.00 0.00 H new ATOM 0 HG3 GLN A 38 27.156 2.461 -10.432 1.00 0.00 H new ATOM 0 HE21 GLN A 38 27.870 2.545 -8.028 1.00 0.00 H new ATOM 0 HE22 GLN A 38 28.952 1.266 -7.466 1.00 0.00 H new ATOM 950 N ILE A 39 23.633 2.553 -12.038 1.00 0.00 N ATOM 951 CA ILE A 39 23.600 3.462 -13.218 1.00 0.00 C ATOM 952 C ILE A 39 24.122 4.847 -12.806 1.00 0.00 C ATOM 953 O ILE A 39 23.534 5.514 -11.957 1.00 0.00 O ATOM 954 CB ILE A 39 22.164 3.587 -13.728 1.00 0.00 C ATOM 955 CG1 ILE A 39 21.593 2.191 -13.983 1.00 0.00 C ATOM 956 CG2 ILE A 39 22.158 4.386 -15.033 1.00 0.00 C ATOM 957 CD1 ILE A 39 20.089 2.295 -14.237 1.00 0.00 C ATOM 0 H ILE A 39 22.897 2.708 -11.349 1.00 0.00 H new ATOM 0 HA ILE A 39 24.229 3.055 -14.010 1.00 0.00 H new ATOM 0 HB ILE A 39 21.554 4.099 -12.984 1.00 0.00 H new ATOM 0 HG12 ILE A 39 22.087 1.735 -14.841 1.00 0.00 H new ATOM 0 HG13 ILE A 39 21.784 1.546 -13.126 1.00 0.00 H new ATOM 0 HG21 ILE A 39 21.135 4.477 -15.399 1.00 0.00 H new ATOM 0 HG22 ILE A 39 22.569 5.380 -14.853 1.00 0.00 H new ATOM 0 HG23 ILE A 39 22.766 3.871 -15.777 1.00 0.00 H new ATOM 0 HD11 ILE A 39 19.681 1.301 -14.419 1.00 0.00 H new ATOM 0 HD12 ILE A 39 19.602 2.733 -13.366 1.00 0.00 H new ATOM 0 HD13 ILE A 39 19.910 2.926 -15.108 1.00 0.00 H new ATOM 958 N LEU A 40 25.217 5.295 -13.382 1.00 0.00 N ATOM 959 CA LEU A 40 25.759 6.639 -13.000 1.00 0.00 C ATOM 960 C LEU A 40 24.698 7.715 -13.263 1.00 0.00 C ATOM 961 O LEU A 40 24.499 8.615 -12.448 1.00 0.00 O ATOM 962 CB LEU A 40 27.020 6.961 -13.817 1.00 0.00 C ATOM 963 CG LEU A 40 28.266 6.603 -13.004 1.00 0.00 C ATOM 964 CD1 LEU A 40 28.305 5.092 -12.760 1.00 0.00 C ATOM 965 CD2 LEU A 40 29.516 7.025 -13.779 1.00 0.00 C ATOM 0 H LEU A 40 25.752 4.794 -14.091 1.00 0.00 H new ATOM 0 HA LEU A 40 26.016 6.623 -11.941 1.00 0.00 H new ATOM 0 HB2 LEU A 40 27.011 6.402 -14.753 1.00 0.00 H new ATOM 0 HB3 LEU A 40 27.036 8.019 -14.078 1.00 0.00 H new ATOM 0 HG LEU A 40 28.235 7.123 -12.047 1.00 0.00 H new ATOM 0 HD11 LEU A 40 29.193 4.840 -12.181 1.00 0.00 H new ATOM 0 HD12 LEU A 40 27.415 4.789 -12.209 1.00 0.00 H new ATOM 0 HD13 LEU A 40 28.335 4.570 -13.716 1.00 0.00 H new ATOM 0 HD21 LEU A 40 30.405 6.771 -13.202 1.00 0.00 H new ATOM 0 HD22 LEU A 40 29.544 6.504 -14.736 1.00 0.00 H new ATOM 0 HD23 LEU A 40 29.491 8.101 -13.952 1.00 0.00 H new ATOM 966 N ASP A 41 24.013 7.649 -14.382 1.00 0.00 N ATOM 967 CA ASP A 41 22.971 8.684 -14.673 1.00 0.00 C ATOM 968 C ASP A 41 22.173 8.307 -15.936 1.00 0.00 C ATOM 969 O ASP A 41 22.600 7.468 -16.728 1.00 0.00 O ATOM 970 CB ASP A 41 23.651 10.038 -14.891 1.00 0.00 C ATOM 971 CG ASP A 41 23.564 10.869 -13.610 1.00 0.00 C ATOM 972 OD1 ASP A 41 22.456 11.107 -13.155 1.00 0.00 O ATOM 973 OD2 ASP A 41 24.605 11.254 -13.104 1.00 0.00 O ATOM 0 H ASP A 41 24.129 6.932 -15.098 1.00 0.00 H new ATOM 0 HA ASP A 41 22.286 8.741 -13.827 1.00 0.00 H new ATOM 0 HB2 ASP A 41 24.694 9.891 -15.171 1.00 0.00 H new ATOM 0 HB3 ASP A 41 23.172 10.569 -15.714 1.00 0.00 H new ATOM 974 N ILE A 42 21.024 8.914 -16.143 1.00 0.00 N ATOM 975 CA ILE A 42 20.215 8.591 -17.352 1.00 0.00 C ATOM 976 C ILE A 42 19.622 9.886 -17.923 1.00 0.00 C ATOM 977 O ILE A 42 19.172 10.754 -17.175 1.00 0.00 O ATOM 978 CB ILE A 42 19.081 7.638 -16.969 1.00 0.00 C ATOM 979 CG1 ILE A 42 19.669 6.390 -16.306 1.00 0.00 C ATOM 980 CG2 ILE A 42 18.309 7.229 -18.224 1.00 0.00 C ATOM 981 CD1 ILE A 42 18.537 5.523 -15.753 1.00 0.00 C ATOM 0 H ILE A 42 20.618 9.616 -15.525 1.00 0.00 H new ATOM 0 HA ILE A 42 20.849 8.116 -18.100 1.00 0.00 H new ATOM 0 HB ILE A 42 18.406 8.138 -16.275 1.00 0.00 H new ATOM 0 HG12 ILE A 42 20.255 5.823 -17.029 1.00 0.00 H new ATOM 0 HG13 ILE A 42 20.347 6.678 -15.502 1.00 0.00 H new ATOM 0 HG21 ILE A 42 17.502 6.550 -17.949 1.00 0.00 H new ATOM 0 HG22 ILE A 42 17.891 8.116 -18.699 1.00 0.00 H new ATOM 0 HG23 ILE A 42 18.983 6.729 -18.919 1.00 0.00 H new ATOM 0 HD11 ILE A 42 18.956 4.635 -15.281 1.00 0.00 H new ATOM 0 HD12 ILE A 42 17.970 6.092 -15.016 1.00 0.00 H new ATOM 0 HD13 ILE A 42 17.877 5.224 -16.567 1.00 0.00 H new ATOM 982 N LEU A 43 19.610 10.046 -19.229 1.00 0.00 N ATOM 983 CA LEU A 43 19.045 11.294 -19.818 1.00 0.00 C ATOM 984 C LEU A 43 17.949 10.937 -20.834 1.00 0.00 C ATOM 985 O LEU A 43 18.039 9.924 -21.525 1.00 0.00 O ATOM 986 CB LEU A 43 20.157 12.077 -20.522 1.00 0.00 C ATOM 987 CG LEU A 43 21.298 12.350 -19.536 1.00 0.00 C ATOM 988 CD1 LEU A 43 22.400 11.305 -19.723 1.00 0.00 C ATOM 989 CD2 LEU A 43 21.875 13.745 -19.795 1.00 0.00 C ATOM 0 H LEU A 43 19.966 9.368 -19.903 1.00 0.00 H new ATOM 0 HA LEU A 43 18.616 11.905 -19.023 1.00 0.00 H new ATOM 0 HB2 LEU A 43 20.529 11.511 -21.376 1.00 0.00 H new ATOM 0 HB3 LEU A 43 19.764 13.017 -20.909 1.00 0.00 H new ATOM 0 HG LEU A 43 20.914 12.296 -18.517 1.00 0.00 H new ATOM 0 HD11 LEU A 43 23.210 11.501 -19.021 1.00 0.00 H new ATOM 0 HD12 LEU A 43 21.993 10.311 -19.539 1.00 0.00 H new ATOM 0 HD13 LEU A 43 22.782 11.358 -20.742 1.00 0.00 H new ATOM 0 HD21 LEU A 43 22.686 13.939 -19.094 1.00 0.00 H new ATOM 0 HD22 LEU A 43 22.256 13.797 -20.815 1.00 0.00 H new ATOM 0 HD23 LEU A 43 21.093 14.493 -19.661 1.00 0.00 H new ATOM 990 N VAL A 44 16.919 11.749 -20.948 1.00 0.00 N ATOM 991 CA VAL A 44 15.835 11.443 -21.929 1.00 0.00 C ATOM 992 C VAL A 44 15.616 12.659 -22.842 1.00 0.00 C ATOM 993 O VAL A 44 15.466 13.784 -22.367 1.00 0.00 O ATOM 994 CB VAL A 44 14.531 11.109 -21.190 1.00 0.00 C ATOM 995 CG1 VAL A 44 14.659 9.739 -20.519 1.00 0.00 C ATOM 996 CG2 VAL A 44 14.243 12.173 -20.124 1.00 0.00 C ATOM 0 H VAL A 44 16.787 12.603 -20.406 1.00 0.00 H new ATOM 0 HA VAL A 44 16.129 10.582 -22.530 1.00 0.00 H new ATOM 0 HB VAL A 44 13.711 11.091 -21.908 1.00 0.00 H new ATOM 0 HG11 VAL A 44 13.733 9.503 -19.995 1.00 0.00 H new ATOM 0 HG12 VAL A 44 14.851 8.979 -21.277 1.00 0.00 H new ATOM 0 HG13 VAL A 44 15.484 9.758 -19.807 1.00 0.00 H new ATOM 0 HG21 VAL A 44 13.316 11.927 -19.606 1.00 0.00 H new ATOM 0 HG22 VAL A 44 15.063 12.201 -19.407 1.00 0.00 H new ATOM 0 HG23 VAL A 44 14.144 13.148 -20.601 1.00 0.00 H new ATOM 997 N SER A 45 15.600 12.465 -24.145 1.00 0.00 N ATOM 998 CA SER A 45 15.396 13.620 -25.067 1.00 0.00 C ATOM 999 C SER A 45 13.938 13.647 -25.548 1.00 0.00 C ATOM 1000 O SER A 45 13.214 12.661 -25.414 1.00 0.00 O ATOM 1001 CB SER A 45 16.326 13.482 -26.274 1.00 0.00 C ATOM 1002 OG SER A 45 17.676 13.459 -25.827 1.00 0.00 O ATOM 0 H SER A 45 15.719 11.560 -24.601 1.00 0.00 H new ATOM 0 HA SER A 45 15.620 14.546 -24.538 1.00 0.00 H new ATOM 0 HB2 SER A 45 16.097 12.568 -26.822 1.00 0.00 H new ATOM 0 HB3 SER A 45 16.173 14.313 -26.962 1.00 0.00 H new ATOM 0 HG SER A 45 18.166 14.208 -26.227 1.00 0.00 H new ATOM 1003 N ARG A 46 13.487 14.750 -26.110 1.00 0.00 N ATOM 1004 CA ARG A 46 12.077 14.814 -26.593 1.00 0.00 C ATOM 1005 C ARG A 46 11.972 15.771 -27.794 1.00 0.00 C ATOM 1006 O ARG A 46 10.991 16.498 -27.932 1.00 0.00 O ATOM 1007 CB ARG A 46 11.173 15.319 -25.465 1.00 0.00 C ATOM 1008 CG ARG A 46 10.605 14.125 -24.692 1.00 0.00 C ATOM 1009 CD ARG A 46 9.621 13.356 -25.580 1.00 0.00 C ATOM 1010 NE ARG A 46 8.226 13.717 -25.201 1.00 0.00 N ATOM 1011 CZ ARG A 46 7.748 13.346 -24.046 1.00 0.00 C ATOM 1012 NH1 ARG A 46 7.857 12.103 -23.664 1.00 0.00 N ATOM 1013 NH2 ARG A 46 7.161 14.216 -23.272 1.00 0.00 N ATOM 0 H ARG A 46 14.035 15.599 -26.251 1.00 0.00 H new ATOM 0 HA ARG A 46 11.762 13.817 -26.901 1.00 0.00 H new ATOM 0 HB2 ARG A 46 11.738 15.965 -24.793 1.00 0.00 H new ATOM 0 HB3 ARG A 46 10.361 15.919 -25.876 1.00 0.00 H new ATOM 0 HG2 ARG A 46 11.414 13.467 -24.374 1.00 0.00 H new ATOM 0 HG3 ARG A 46 10.102 14.470 -23.789 1.00 0.00 H new ATOM 0 HD2 ARG A 46 9.798 13.594 -26.629 1.00 0.00 H new ATOM 0 HD3 ARG A 46 9.774 12.283 -25.467 1.00 0.00 H new ATOM 0 HE ARG A 46 7.645 14.254 -25.845 1.00 0.00 H new ATOM 0 HH11 ARG A 46 8.316 11.422 -24.269 1.00 0.00 H new ATOM 0 HH12 ARG A 46 7.483 11.812 -22.761 1.00 0.00 H new ATOM 0 HH21 ARG A 46 7.075 15.188 -23.570 1.00 0.00 H new ATOM 0 HH22 ARG A 46 6.787 13.925 -22.369 1.00 0.00 H new ATOM 1014 N SER A 47 12.955 15.785 -28.672 1.00 0.00 N ATOM 1015 CA SER A 47 12.879 16.695 -29.855 1.00 0.00 C ATOM 1016 C SER A 47 12.246 15.933 -31.029 1.00 0.00 C ATOM 1017 O SER A 47 12.055 14.720 -30.955 1.00 0.00 O ATOM 1018 CB SER A 47 14.286 17.169 -30.237 1.00 0.00 C ATOM 1019 OG SER A 47 15.129 16.039 -30.420 1.00 0.00 O ATOM 0 H SER A 47 13.796 15.210 -28.617 1.00 0.00 H new ATOM 0 HA SER A 47 12.270 17.566 -29.612 1.00 0.00 H new ATOM 0 HB2 SER A 47 14.247 17.760 -31.152 1.00 0.00 H new ATOM 0 HB3 SER A 47 14.689 17.815 -29.457 1.00 0.00 H new ATOM 0 HG SER A 47 16.029 16.339 -30.666 1.00 0.00 H new ATOM 1020 N LEU A 48 11.907 16.606 -32.110 1.00 0.00 N ATOM 1021 CA LEU A 48 11.278 15.881 -33.267 1.00 0.00 C ATOM 1022 C LEU A 48 12.207 14.750 -33.733 1.00 0.00 C ATOM 1023 O LEU A 48 11.774 13.612 -33.906 1.00 0.00 O ATOM 1024 CB LEU A 48 11.026 16.844 -34.434 1.00 0.00 C ATOM 1025 CG LEU A 48 10.118 16.181 -35.466 1.00 0.00 C ATOM 1026 CD1 LEU A 48 9.196 17.238 -36.077 1.00 0.00 C ATOM 1027 CD2 LEU A 48 10.971 15.546 -36.568 1.00 0.00 C ATOM 0 H LEU A 48 12.036 17.609 -32.240 1.00 0.00 H new ATOM 0 HA LEU A 48 10.325 15.466 -32.940 1.00 0.00 H new ATOM 0 HB2 LEU A 48 10.566 17.761 -34.067 1.00 0.00 H new ATOM 0 HB3 LEU A 48 11.972 17.125 -34.896 1.00 0.00 H new ATOM 0 HG LEU A 48 9.520 15.407 -34.984 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.545 16.770 -36.815 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.589 17.689 -35.292 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.796 18.009 -36.560 1.00 0.00 H new ATOM 0 HD21 LEU A 48 10.321 15.073 -37.304 1.00 0.00 H new ATOM 0 HD22 LEU A 48 11.570 16.316 -37.054 1.00 0.00 H new ATOM 0 HD23 LEU A 48 11.630 14.796 -36.131 1.00 0.00 H new ATOM 1028 N LYS A 49 13.474 15.034 -33.946 1.00 0.00 N ATOM 1029 CA LYS A 49 14.410 13.956 -34.405 1.00 0.00 C ATOM 1030 C LYS A 49 14.475 12.837 -33.352 1.00 0.00 C ATOM 1031 O LYS A 49 14.570 11.660 -33.696 1.00 0.00 O ATOM 1032 CB LYS A 49 15.820 14.528 -34.620 1.00 0.00 C ATOM 1033 CG LYS A 49 16.023 14.852 -36.102 1.00 0.00 C ATOM 1034 CD LYS A 49 16.650 13.648 -36.808 1.00 0.00 C ATOM 1035 CE LYS A 49 17.254 14.093 -38.141 1.00 0.00 C ATOM 1036 NZ LYS A 49 16.195 14.094 -39.190 1.00 0.00 N ATOM 0 H LYS A 49 13.895 15.955 -33.823 1.00 0.00 H new ATOM 0 HA LYS A 49 14.038 13.553 -35.347 1.00 0.00 H new ATOM 0 HB2 LYS A 49 15.954 15.428 -34.019 1.00 0.00 H new ATOM 0 HB3 LYS A 49 16.569 13.809 -34.289 1.00 0.00 H new ATOM 0 HG2 LYS A 49 15.068 15.101 -36.565 1.00 0.00 H new ATOM 0 HG3 LYS A 49 16.666 15.725 -36.209 1.00 0.00 H new ATOM 0 HD2 LYS A 49 17.421 13.205 -36.178 1.00 0.00 H new ATOM 0 HD3 LYS A 49 15.896 12.879 -36.977 1.00 0.00 H new ATOM 0 HE2 LYS A 49 17.685 15.089 -38.043 1.00 0.00 H new ATOM 0 HE3 LYS A 49 18.064 13.422 -38.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 16.605 14.396 -40.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.804 13.135 -39.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.436 14.751 -38.917 1.00 0.00 H new ATOM 1037 N MET A 50 14.430 13.167 -32.078 1.00 0.00 N ATOM 1038 CA MET A 50 14.496 12.104 -31.033 1.00 0.00 C ATOM 1039 C MET A 50 13.124 11.957 -30.356 1.00 0.00 C ATOM 1040 O MET A 50 12.973 12.237 -29.167 1.00 0.00 O ATOM 1041 CB MET A 50 15.547 12.486 -29.985 1.00 0.00 C ATOM 1042 CG MET A 50 16.897 12.706 -30.671 1.00 0.00 C ATOM 1043 SD MET A 50 17.806 14.010 -29.808 1.00 0.00 S ATOM 1044 CE MET A 50 18.706 12.937 -28.662 1.00 0.00 C ATOM 0 H MET A 50 14.351 14.121 -31.725 1.00 0.00 H new ATOM 0 HA MET A 50 14.771 11.157 -31.497 1.00 0.00 H new ATOM 0 HB2 MET A 50 15.241 13.392 -29.462 1.00 0.00 H new ATOM 0 HB3 MET A 50 15.632 11.699 -29.236 1.00 0.00 H new ATOM 0 HG2 MET A 50 17.474 11.781 -30.667 1.00 0.00 H new ATOM 0 HG3 MET A 50 16.746 12.983 -31.714 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.356 13.543 -28.031 1.00 0.00 H new ATOM 0 HE2 MET A 50 17.996 12.395 -28.037 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.308 12.225 -29.227 1.00 0.00 H new ATOM 1045 N ARG A 51 12.115 11.522 -31.082 1.00 0.00 N ATOM 1046 CA ARG A 51 10.768 11.363 -30.462 1.00 0.00 C ATOM 1047 C ARG A 51 10.540 9.889 -30.091 1.00 0.00 C ATOM 1048 O ARG A 51 9.509 9.307 -30.424 1.00 0.00 O ATOM 1049 CB ARG A 51 9.692 11.816 -31.451 1.00 0.00 C ATOM 1050 CG ARG A 51 9.403 13.302 -31.238 1.00 0.00 C ATOM 1051 CD ARG A 51 8.023 13.639 -31.803 1.00 0.00 C ATOM 1052 NE ARG A 51 7.435 14.771 -31.032 1.00 0.00 N ATOM 1053 CZ ARG A 51 6.593 14.534 -30.064 1.00 0.00 C ATOM 1054 NH1 ARG A 51 6.865 13.620 -29.174 1.00 0.00 N ATOM 1055 NH2 ARG A 51 5.480 15.212 -29.986 1.00 0.00 N ATOM 0 H ARG A 51 12.172 11.274 -32.070 1.00 0.00 H new ATOM 0 HA ARG A 51 10.711 11.974 -29.561 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.026 11.642 -32.474 1.00 0.00 H new ATOM 0 HB3 ARG A 51 8.782 11.233 -31.309 1.00 0.00 H new ATOM 0 HG2 ARG A 51 9.441 13.542 -30.175 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.166 13.906 -31.729 1.00 0.00 H new ATOM 0 HD2 ARG A 51 8.105 13.906 -32.857 1.00 0.00 H new ATOM 0 HD3 ARG A 51 7.371 12.767 -31.744 1.00 0.00 H new ATOM 0 HE ARG A 51 7.691 15.731 -31.261 1.00 0.00 H new ATOM 0 HH11 ARG A 51 7.735 13.091 -29.235 1.00 0.00 H new ATOM 0 HH12 ARG A 51 6.207 13.434 -28.417 1.00 0.00 H new ATOM 0 HH21 ARG A 51 5.269 15.927 -30.682 1.00 0.00 H new ATOM 0 HH22 ARG A 51 4.822 15.027 -29.229 1.00 0.00 H new ATOM 1056 N GLY A 52 11.477 9.270 -29.406 1.00 0.00 N ATOM 1057 CA GLY A 52 11.294 7.836 -29.019 1.00 0.00 C ATOM 1058 C GLY A 52 12.662 7.173 -28.790 1.00 0.00 C ATOM 1059 O GLY A 52 12.990 6.173 -29.428 1.00 0.00 O ATOM 0 H GLY A 52 12.353 9.694 -29.102 1.00 0.00 H new ATOM 0 HA2 GLY A 52 10.692 7.770 -28.112 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.751 7.306 -29.802 1.00 0.00 H new ATOM 1060 N GLN A 53 13.471 7.703 -27.896 1.00 0.00 N ATOM 1061 CA GLN A 53 14.812 7.087 -27.647 1.00 0.00 C ATOM 1062 C GLN A 53 15.324 7.482 -26.250 1.00 0.00 C ATOM 1063 O GLN A 53 14.690 8.267 -25.545 1.00 0.00 O ATOM 1064 CB GLN A 53 15.799 7.578 -28.707 1.00 0.00 C ATOM 1065 CG GLN A 53 15.789 9.108 -28.746 1.00 0.00 C ATOM 1066 CD GLN A 53 17.079 9.612 -29.406 1.00 0.00 C ATOM 1067 OE1 GLN A 53 17.938 10.178 -28.735 1.00 0.00 O ATOM 1068 NE2 GLN A 53 17.265 9.441 -30.692 1.00 0.00 N ATOM 0 H GLN A 53 13.260 8.528 -27.335 1.00 0.00 H new ATOM 0 HA GLN A 53 14.722 6.002 -27.700 1.00 0.00 H new ATOM 0 HB2 GLN A 53 16.802 7.216 -28.480 1.00 0.00 H new ATOM 0 HB3 GLN A 53 15.529 7.177 -29.684 1.00 0.00 H new ATOM 0 HG2 GLN A 53 14.921 9.462 -29.302 1.00 0.00 H new ATOM 0 HG3 GLN A 53 15.705 9.508 -27.735 1.00 0.00 H new ATOM 0 HE21 GLN A 53 16.554 8.971 -31.252 1.00 0.00 H new ATOM 0 HE22 GLN A 53 18.121 9.778 -31.133 1.00 0.00 H new ATOM 1069 N ALA A 54 16.456 6.958 -25.829 1.00 0.00 N ATOM 1070 CA ALA A 54 16.982 7.317 -24.474 1.00 0.00 C ATOM 1071 C ALA A 54 18.475 6.955 -24.363 1.00 0.00 C ATOM 1072 O ALA A 54 19.023 6.263 -25.220 1.00 0.00 O ATOM 1073 CB ALA A 54 16.196 6.551 -23.408 1.00 0.00 C ATOM 0 H ALA A 54 17.031 6.304 -26.361 1.00 0.00 H new ATOM 0 HA ALA A 54 16.867 8.391 -24.324 1.00 0.00 H new ATOM 0 HB1 ALA A 54 16.576 6.810 -22.420 1.00 0.00 H new ATOM 0 HB2 ALA A 54 15.141 6.817 -23.472 1.00 0.00 H new ATOM 0 HB3 ALA A 54 16.310 5.479 -23.572 1.00 0.00 H new ATOM 1074 N PHE A 55 19.146 7.403 -23.323 1.00 0.00 N ATOM 1075 CA PHE A 55 20.593 7.075 -23.171 1.00 0.00 C ATOM 1076 C PHE A 55 20.856 6.601 -21.734 1.00 0.00 C ATOM 1077 O PHE A 55 20.403 7.227 -20.775 1.00 0.00 O ATOM 1078 CB PHE A 55 21.436 8.321 -23.453 1.00 0.00 C ATOM 1079 CG PHE A 55 21.195 8.789 -24.868 1.00 0.00 C ATOM 1080 CD1 PHE A 55 20.018 9.476 -25.189 1.00 0.00 C ATOM 1081 CD2 PHE A 55 22.153 8.541 -25.858 1.00 0.00 C ATOM 1082 CE1 PHE A 55 19.799 9.913 -26.500 1.00 0.00 C ATOM 1083 CE2 PHE A 55 21.934 8.979 -27.170 1.00 0.00 C ATOM 1084 CZ PHE A 55 20.756 9.665 -27.490 1.00 0.00 C ATOM 0 H PHE A 55 18.751 7.979 -22.579 1.00 0.00 H new ATOM 0 HA PHE A 55 20.862 6.288 -23.876 1.00 0.00 H new ATOM 0 HB2 PHE A 55 21.179 9.113 -22.749 1.00 0.00 H new ATOM 0 HB3 PHE A 55 22.493 8.097 -23.309 1.00 0.00 H new ATOM 0 HD1 PHE A 55 19.279 9.669 -24.425 1.00 0.00 H new ATOM 0 HD2 PHE A 55 23.061 8.012 -25.610 1.00 0.00 H new ATOM 0 HE1 PHE A 55 18.891 10.442 -26.748 1.00 0.00 H new ATOM 0 HE2 PHE A 55 22.673 8.788 -27.934 1.00 0.00 H new ATOM 0 HZ PHE A 55 20.586 10.003 -28.502 1.00 0.00 H new ATOM 1085 N VAL A 56 21.576 5.514 -21.555 1.00 0.00 N ATOM 1086 CA VAL A 56 21.849 5.028 -20.170 1.00 0.00 C ATOM 1087 C VAL A 56 23.364 4.906 -19.954 1.00 0.00 C ATOM 1088 O VAL A 56 24.090 4.451 -20.835 1.00 0.00 O ATOM 1089 CB VAL A 56 21.199 3.657 -19.970 1.00 0.00 C ATOM 1090 CG1 VAL A 56 21.380 3.212 -18.518 1.00 0.00 C ATOM 1091 CG2 VAL A 56 19.706 3.745 -20.292 1.00 0.00 C ATOM 0 H VAL A 56 21.980 4.951 -22.303 1.00 0.00 H new ATOM 0 HA VAL A 56 21.435 5.737 -19.453 1.00 0.00 H new ATOM 0 HB VAL A 56 21.672 2.934 -20.634 1.00 0.00 H new ATOM 0 HG11 VAL A 56 20.917 2.236 -18.376 1.00 0.00 H new ATOM 0 HG12 VAL A 56 22.443 3.146 -18.287 1.00 0.00 H new ATOM 0 HG13 VAL A 56 20.909 3.937 -17.854 1.00 0.00 H new ATOM 0 HG21 VAL A 56 19.245 2.768 -20.149 1.00 0.00 H new ATOM 0 HG22 VAL A 56 19.233 4.470 -19.630 1.00 0.00 H new ATOM 0 HG23 VAL A 56 19.575 4.060 -21.327 1.00 0.00 H new ATOM 1092 N ILE A 57 23.862 5.294 -18.800 1.00 0.00 N ATOM 1093 CA ILE A 57 25.328 5.184 -18.550 1.00 0.00 C ATOM 1094 C ILE A 57 25.570 4.165 -17.429 1.00 0.00 C ATOM 1095 O ILE A 57 25.094 4.339 -16.309 1.00 0.00 O ATOM 1096 CB ILE A 57 25.880 6.548 -18.130 1.00 0.00 C ATOM 1097 CG1 ILE A 57 25.506 7.596 -19.181 1.00 0.00 C ATOM 1098 CG2 ILE A 57 27.403 6.468 -18.012 1.00 0.00 C ATOM 1099 CD1 ILE A 57 25.669 8.997 -18.586 1.00 0.00 C ATOM 0 H ILE A 57 23.316 5.679 -18.029 1.00 0.00 H new ATOM 0 HA ILE A 57 25.832 4.857 -19.459 1.00 0.00 H new ATOM 0 HB ILE A 57 25.454 6.830 -17.167 1.00 0.00 H new ATOM 0 HG12 ILE A 57 26.140 7.487 -20.061 1.00 0.00 H new ATOM 0 HG13 ILE A 57 24.477 7.446 -19.509 1.00 0.00 H new ATOM 0 HG21 ILE A 57 27.796 7.440 -17.713 1.00 0.00 H new ATOM 0 HG22 ILE A 57 27.671 5.722 -17.264 1.00 0.00 H new ATOM 0 HG23 ILE A 57 27.828 6.185 -18.975 1.00 0.00 H new ATOM 0 HD11 ILE A 57 25.403 9.743 -19.334 1.00 0.00 H new ATOM 0 HD12 ILE A 57 25.016 9.103 -17.720 1.00 0.00 H new ATOM 0 HD13 ILE A 57 26.705 9.144 -18.280 1.00 0.00 H new ATOM 1100 N PHE A 58 26.296 3.099 -17.699 1.00 0.00 N ATOM 1101 CA PHE A 58 26.547 2.088 -16.632 1.00 0.00 C ATOM 1102 C PHE A 58 27.904 2.365 -15.972 1.00 0.00 C ATOM 1103 O PHE A 58 28.784 2.981 -16.574 1.00 0.00 O ATOM 1104 CB PHE A 58 26.552 0.683 -17.240 1.00 0.00 C ATOM 1105 CG PHE A 58 25.174 0.077 -17.114 1.00 0.00 C ATOM 1106 CD1 PHE A 58 24.668 -0.260 -15.852 1.00 0.00 C ATOM 1107 CD2 PHE A 58 24.402 -0.151 -18.259 1.00 0.00 C ATOM 1108 CE1 PHE A 58 23.392 -0.825 -15.737 1.00 0.00 C ATOM 1109 CE2 PHE A 58 23.127 -0.714 -18.145 1.00 0.00 C ATOM 1110 CZ PHE A 58 22.622 -1.051 -16.884 1.00 0.00 C ATOM 0 H PHE A 58 26.718 2.893 -18.604 1.00 0.00 H new ATOM 0 HA PHE A 58 25.758 2.153 -15.883 1.00 0.00 H new ATOM 0 HB2 PHE A 58 26.846 0.730 -18.288 1.00 0.00 H new ATOM 0 HB3 PHE A 58 27.285 0.057 -16.731 1.00 0.00 H new ATOM 0 HD1 PHE A 58 25.262 -0.084 -14.968 1.00 0.00 H new ATOM 0 HD2 PHE A 58 24.792 0.108 -19.232 1.00 0.00 H new ATOM 0 HE1 PHE A 58 23.002 -1.086 -14.764 1.00 0.00 H new ATOM 0 HE2 PHE A 58 22.532 -0.889 -19.029 1.00 0.00 H new ATOM 0 HZ PHE A 58 21.637 -1.486 -16.796 1.00 0.00 H new ATOM 1111 N LYS A 59 28.098 1.934 -14.744 1.00 0.00 N ATOM 1112 CA LYS A 59 29.411 2.191 -14.061 1.00 0.00 C ATOM 1113 C LYS A 59 30.564 1.658 -14.926 1.00 0.00 C ATOM 1114 O LYS A 59 31.619 2.284 -15.017 1.00 0.00 O ATOM 1115 CB LYS A 59 29.447 1.495 -12.694 1.00 0.00 C ATOM 1116 CG LYS A 59 30.628 2.029 -11.883 1.00 0.00 C ATOM 1117 CD LYS A 59 31.077 0.970 -10.874 1.00 0.00 C ATOM 1118 CE LYS A 59 31.847 1.642 -9.736 1.00 0.00 C ATOM 1119 NZ LYS A 59 32.443 0.599 -8.856 1.00 0.00 N ATOM 0 H LYS A 59 27.412 1.421 -14.190 1.00 0.00 H new ATOM 0 HA LYS A 59 29.522 3.266 -13.921 1.00 0.00 H new ATOM 0 HB2 LYS A 59 28.514 1.672 -12.159 1.00 0.00 H new ATOM 0 HB3 LYS A 59 29.539 0.417 -12.825 1.00 0.00 H new ATOM 0 HG2 LYS A 59 31.453 2.285 -12.548 1.00 0.00 H new ATOM 0 HG3 LYS A 59 30.342 2.943 -11.363 1.00 0.00 H new ATOM 0 HD2 LYS A 59 30.211 0.440 -10.478 1.00 0.00 H new ATOM 0 HD3 LYS A 59 31.707 0.229 -11.365 1.00 0.00 H new ATOM 0 HE2 LYS A 59 32.631 2.282 -10.141 1.00 0.00 H new ATOM 0 HE3 LYS A 59 31.179 2.282 -9.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 32.967 1.056 -8.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 31.686 0.006 -8.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 33.093 0.006 -9.411 1.00 0.00 H new ATOM 1120 N GLU A 60 30.395 0.519 -15.564 1.00 0.00 N ATOM 1121 CA GLU A 60 31.494 -0.026 -16.408 1.00 0.00 C ATOM 1122 C GLU A 60 30.932 -0.490 -17.761 1.00 0.00 C ATOM 1123 O GLU A 60 29.723 -0.662 -17.917 1.00 0.00 O ATOM 1124 CB GLU A 60 32.146 -1.213 -15.693 1.00 0.00 C ATOM 1125 CG GLU A 60 33.388 -0.737 -14.936 1.00 0.00 C ATOM 1126 CD GLU A 60 34.282 -1.937 -14.618 1.00 0.00 C ATOM 1127 OE1 GLU A 60 34.033 -2.589 -13.616 1.00 0.00 O ATOM 1128 OE2 GLU A 60 35.201 -2.185 -15.381 1.00 0.00 O ATOM 0 H GLU A 60 29.547 -0.048 -15.533 1.00 0.00 H new ATOM 0 HA GLU A 60 32.237 0.753 -16.576 1.00 0.00 H new ATOM 0 HB2 GLU A 60 31.437 -1.667 -15.000 1.00 0.00 H new ATOM 0 HB3 GLU A 60 32.421 -1.980 -16.417 1.00 0.00 H new ATOM 0 HG2 GLU A 60 33.936 -0.010 -15.536 1.00 0.00 H new ATOM 0 HG3 GLU A 60 33.095 -0.234 -14.015 1.00 0.00 H new ATOM 1129 N VAL A 61 31.781 -0.700 -18.744 1.00 0.00 N ATOM 1130 CA VAL A 61 31.278 -1.156 -20.081 1.00 0.00 C ATOM 1131 C VAL A 61 30.634 -2.549 -19.950 1.00 0.00 C ATOM 1132 O VAL A 61 29.646 -2.843 -20.618 1.00 0.00 O ATOM 1133 CB VAL A 61 32.435 -1.220 -21.094 1.00 0.00 C ATOM 1134 CG1 VAL A 61 31.910 -1.673 -22.464 1.00 0.00 C ATOM 1135 CG2 VAL A 61 33.071 0.170 -21.223 1.00 0.00 C ATOM 0 H VAL A 61 32.791 -0.576 -18.678 1.00 0.00 H new ATOM 0 HA VAL A 61 30.534 -0.442 -20.435 1.00 0.00 H new ATOM 0 HB VAL A 61 33.180 -1.936 -20.745 1.00 0.00 H new ATOM 0 HG11 VAL A 61 32.736 -1.715 -23.174 1.00 0.00 H new ATOM 0 HG12 VAL A 61 31.459 -2.661 -22.372 1.00 0.00 H new ATOM 0 HG13 VAL A 61 31.162 -0.964 -22.819 1.00 0.00 H new ATOM 0 HG21 VAL A 61 33.891 0.130 -21.940 1.00 0.00 H new ATOM 0 HG22 VAL A 61 32.322 0.882 -21.569 1.00 0.00 H new ATOM 0 HG23 VAL A 61 33.452 0.487 -20.252 1.00 0.00 H new ATOM 1136 N SER A 62 31.169 -3.413 -19.114 1.00 0.00 N ATOM 1137 CA SER A 62 30.562 -4.779 -18.971 1.00 0.00 C ATOM 1138 C SER A 62 29.121 -4.657 -18.449 1.00 0.00 C ATOM 1139 O SER A 62 28.241 -5.406 -18.866 1.00 0.00 O ATOM 1140 CB SER A 62 31.383 -5.627 -17.992 1.00 0.00 C ATOM 1141 OG SER A 62 31.028 -5.283 -16.659 1.00 0.00 O ATOM 0 H SER A 62 31.988 -3.235 -18.532 1.00 0.00 H new ATOM 0 HA SER A 62 30.559 -5.262 -19.948 1.00 0.00 H new ATOM 0 HB2 SER A 62 31.198 -6.687 -18.168 1.00 0.00 H new ATOM 0 HB3 SER A 62 32.448 -5.458 -18.152 1.00 0.00 H new ATOM 0 HG SER A 62 31.550 -5.825 -16.031 1.00 0.00 H new ATOM 1142 N SER A 63 28.855 -3.741 -17.540 1.00 0.00 N ATOM 1143 CA SER A 63 27.457 -3.604 -17.008 1.00 0.00 C ATOM 1144 C SER A 63 26.469 -3.320 -18.157 1.00 0.00 C ATOM 1145 O SER A 63 25.319 -3.758 -18.114 1.00 0.00 O ATOM 1146 CB SER A 63 27.385 -2.458 -15.990 1.00 0.00 C ATOM 1147 OG SER A 63 27.699 -2.958 -14.698 1.00 0.00 O ATOM 0 H SER A 63 29.537 -3.091 -17.149 1.00 0.00 H new ATOM 0 HA SER A 63 27.186 -4.541 -16.521 1.00 0.00 H new ATOM 0 HB2 SER A 63 28.082 -1.667 -16.266 1.00 0.00 H new ATOM 0 HB3 SER A 63 26.388 -2.018 -15.990 1.00 0.00 H new ATOM 0 HG SER A 63 27.656 -2.228 -14.045 1.00 0.00 H new ATOM 1148 N ALA A 64 26.880 -2.602 -19.184 1.00 0.00 N ATOM 1149 CA ALA A 64 25.939 -2.315 -20.312 1.00 0.00 C ATOM 1150 C ALA A 64 25.818 -3.549 -21.219 1.00 0.00 C ATOM 1151 O ALA A 64 24.776 -3.769 -21.835 1.00 0.00 O ATOM 1152 CB ALA A 64 26.447 -1.125 -21.140 1.00 0.00 C ATOM 0 H ALA A 64 27.816 -2.209 -19.285 1.00 0.00 H new ATOM 0 HA ALA A 64 24.962 -2.071 -19.895 1.00 0.00 H new ATOM 0 HB1 ALA A 64 25.753 -0.927 -21.957 1.00 0.00 H new ATOM 0 HB2 ALA A 64 26.519 -0.243 -20.503 1.00 0.00 H new ATOM 0 HB3 ALA A 64 27.430 -1.359 -21.548 1.00 0.00 H new ATOM 1153 N THR A 65 26.852 -4.358 -21.328 1.00 0.00 N ATOM 1154 CA THR A 65 26.755 -5.560 -22.211 1.00 0.00 C ATOM 1155 C THR A 65 25.652 -6.493 -21.692 1.00 0.00 C ATOM 1156 O THR A 65 24.847 -7.000 -22.467 1.00 0.00 O ATOM 1157 CB THR A 65 28.091 -6.317 -22.240 1.00 0.00 C ATOM 1158 OG1 THR A 65 29.160 -5.383 -22.278 1.00 0.00 O ATOM 1159 CG2 THR A 65 28.148 -7.212 -23.479 1.00 0.00 C ATOM 0 H THR A 65 27.744 -4.237 -20.849 1.00 0.00 H new ATOM 0 HA THR A 65 26.515 -5.231 -23.222 1.00 0.00 H new ATOM 0 HB THR A 65 28.178 -6.935 -21.346 1.00 0.00 H new ATOM 0 HG1 THR A 65 30.014 -5.864 -22.295 1.00 0.00 H new ATOM 0 HG21 THR A 65 29.097 -7.748 -23.497 1.00 0.00 H new ATOM 0 HG22 THR A 65 27.327 -7.928 -23.448 1.00 0.00 H new ATOM 0 HG23 THR A 65 28.061 -6.598 -24.376 1.00 0.00 H new ATOM 1160 N ASN A 66 25.592 -6.734 -20.398 1.00 0.00 N ATOM 1161 CA ASN A 66 24.526 -7.641 -19.863 1.00 0.00 C ATOM 1162 C ASN A 66 23.164 -6.942 -19.974 1.00 0.00 C ATOM 1163 O ASN A 66 22.171 -7.560 -20.350 1.00 0.00 O ATOM 1164 CB ASN A 66 24.803 -7.981 -18.391 1.00 0.00 C ATOM 1165 CG ASN A 66 24.405 -9.436 -18.119 1.00 0.00 C ATOM 1166 OD1 ASN A 66 23.431 -9.693 -17.415 1.00 0.00 O ATOM 1167 ND2 ASN A 66 25.108 -10.414 -18.638 1.00 0.00 N ATOM 0 H ASN A 66 26.227 -6.346 -19.700 1.00 0.00 H new ATOM 0 HA ASN A 66 24.521 -8.563 -20.444 1.00 0.00 H new ATOM 0 HB2 ASN A 66 25.859 -7.833 -18.165 1.00 0.00 H new ATOM 0 HB3 ASN A 66 24.241 -7.311 -17.740 1.00 0.00 H new ATOM 0 HD21 ASN A 66 24.845 -11.383 -18.457 1.00 0.00 H new ATOM 0 HD22 ASN A 66 25.917 -10.206 -19.223 1.00 0.00 H new ATOM 1168 N ALA A 67 23.089 -5.668 -19.657 1.00 0.00 N ATOM 1169 CA ALA A 67 21.772 -4.953 -19.758 1.00 0.00 C ATOM 1170 C ALA A 67 21.199 -5.059 -21.187 1.00 0.00 C ATOM 1171 O ALA A 67 19.988 -4.967 -21.377 1.00 0.00 O ATOM 1172 CB ALA A 67 21.948 -3.469 -19.402 1.00 0.00 C ATOM 0 H ALA A 67 23.872 -5.098 -19.337 1.00 0.00 H new ATOM 0 HA ALA A 67 21.080 -5.423 -19.059 1.00 0.00 H new ATOM 0 HB1 ALA A 67 20.987 -2.960 -19.478 1.00 0.00 H new ATOM 0 HB2 ALA A 67 22.325 -3.382 -18.383 1.00 0.00 H new ATOM 0 HB3 ALA A 67 22.657 -3.011 -20.092 1.00 0.00 H new ATOM 1173 N LEU A 68 22.026 -5.233 -22.201 1.00 0.00 N ATOM 1174 CA LEU A 68 21.487 -5.317 -23.597 1.00 0.00 C ATOM 1175 C LEU A 68 21.144 -6.772 -23.973 1.00 0.00 C ATOM 1176 O LEU A 68 20.226 -7.009 -24.757 1.00 0.00 O ATOM 1177 CB LEU A 68 22.529 -4.777 -24.582 1.00 0.00 C ATOM 1178 CG LEU A 68 21.821 -4.100 -25.759 1.00 0.00 C ATOM 1179 CD1 LEU A 68 22.621 -2.874 -26.201 1.00 0.00 C ATOM 1180 CD2 LEU A 68 21.713 -5.086 -26.926 1.00 0.00 C ATOM 0 H LEU A 68 23.039 -5.319 -22.119 1.00 0.00 H new ATOM 0 HA LEU A 68 20.576 -4.720 -23.647 1.00 0.00 H new ATOM 0 HB2 LEU A 68 23.184 -4.065 -24.080 1.00 0.00 H new ATOM 0 HB3 LEU A 68 23.159 -5.590 -24.942 1.00 0.00 H new ATOM 0 HG LEU A 68 20.823 -3.790 -25.451 1.00 0.00 H new ATOM 0 HD11 LEU A 68 22.116 -2.393 -27.039 1.00 0.00 H new ATOM 0 HD12 LEU A 68 22.698 -2.171 -25.371 1.00 0.00 H new ATOM 0 HD13 LEU A 68 23.620 -3.183 -26.508 1.00 0.00 H new ATOM 0 HD21 LEU A 68 21.209 -4.604 -27.764 1.00 0.00 H new ATOM 0 HD22 LEU A 68 22.712 -5.397 -27.233 1.00 0.00 H new ATOM 0 HD23 LEU A 68 21.141 -5.960 -26.613 1.00 0.00 H new ATOM 1181 N ARG A 69 21.853 -7.752 -23.451 1.00 0.00 N ATOM 1182 CA ARG A 69 21.533 -9.172 -23.820 1.00 0.00 C ATOM 1183 C ARG A 69 20.163 -9.557 -23.247 1.00 0.00 C ATOM 1184 O ARG A 69 19.262 -9.957 -23.981 1.00 0.00 O ATOM 1185 CB ARG A 69 22.600 -10.129 -23.264 1.00 0.00 C ATOM 1186 CG ARG A 69 23.979 -9.771 -23.830 1.00 0.00 C ATOM 1187 CD ARG A 69 24.028 -10.080 -25.330 1.00 0.00 C ATOM 1188 NE ARG A 69 24.812 -11.328 -25.552 1.00 0.00 N ATOM 1189 CZ ARG A 69 25.944 -11.281 -26.200 1.00 0.00 C ATOM 1190 NH1 ARG A 69 27.028 -10.881 -25.591 1.00 0.00 N ATOM 1191 NH2 ARG A 69 25.993 -11.633 -27.455 1.00 0.00 N ATOM 0 H ARG A 69 22.626 -7.632 -22.797 1.00 0.00 H new ATOM 0 HA ARG A 69 21.517 -9.252 -24.907 1.00 0.00 H new ATOM 0 HB2 ARG A 69 22.619 -10.071 -22.176 1.00 0.00 H new ATOM 0 HB3 ARG A 69 22.348 -11.157 -23.524 1.00 0.00 H new ATOM 0 HG2 ARG A 69 24.187 -8.714 -23.661 1.00 0.00 H new ATOM 0 HG3 ARG A 69 24.752 -10.335 -23.309 1.00 0.00 H new ATOM 0 HD2 ARG A 69 23.018 -10.197 -25.722 1.00 0.00 H new ATOM 0 HD3 ARG A 69 24.484 -9.250 -25.869 1.00 0.00 H new ATOM 0 HE ARG A 69 24.464 -12.219 -25.198 1.00 0.00 H new ATOM 0 HH11 ARG A 69 26.990 -10.606 -24.610 1.00 0.00 H new ATOM 0 HH12 ARG A 69 27.913 -10.844 -26.097 1.00 0.00 H new ATOM 0 HH21 ARG A 69 25.146 -11.945 -27.931 1.00 0.00 H new ATOM 0 HH22 ARG A 69 26.878 -11.596 -27.961 1.00 0.00 H new ATOM 1192 N SER A 70 19.987 -9.453 -21.952 1.00 0.00 N ATOM 1193 CA SER A 70 18.667 -9.823 -21.342 1.00 0.00 C ATOM 1194 C SER A 70 17.556 -8.878 -21.837 1.00 0.00 C ATOM 1195 O SER A 70 16.398 -9.281 -21.936 1.00 0.00 O ATOM 1196 CB SER A 70 18.746 -9.740 -19.813 1.00 0.00 C ATOM 1197 OG SER A 70 18.787 -8.376 -19.417 1.00 0.00 O ATOM 0 H SER A 70 20.695 -9.130 -21.292 1.00 0.00 H new ATOM 0 HA SER A 70 18.433 -10.844 -21.643 1.00 0.00 H new ATOM 0 HB2 SER A 70 17.884 -10.234 -19.366 1.00 0.00 H new ATOM 0 HB3 SER A 70 19.634 -10.261 -19.455 1.00 0.00 H new ATOM 0 HG SER A 70 19.479 -8.254 -18.734 1.00 0.00 H new ATOM 1198 N MET A 71 17.864 -7.632 -22.148 1.00 0.00 N ATOM 1199 CA MET A 71 16.793 -6.704 -22.622 1.00 0.00 C ATOM 1200 C MET A 71 16.834 -6.569 -24.155 1.00 0.00 C ATOM 1201 O MET A 71 16.505 -5.513 -24.694 1.00 0.00 O ATOM 1202 CB MET A 71 16.994 -5.325 -21.989 1.00 0.00 C ATOM 1203 CG MET A 71 16.916 -5.445 -20.466 1.00 0.00 C ATOM 1204 SD MET A 71 16.235 -3.916 -19.775 1.00 0.00 S ATOM 1205 CE MET A 71 14.598 -4.027 -20.540 1.00 0.00 C ATOM 0 H MET A 71 18.799 -7.229 -22.093 1.00 0.00 H new ATOM 0 HA MET A 71 15.825 -7.111 -22.329 1.00 0.00 H new ATOM 0 HB2 MET A 71 17.961 -4.916 -22.283 1.00 0.00 H new ATOM 0 HB3 MET A 71 16.232 -4.633 -22.349 1.00 0.00 H new ATOM 0 HG2 MET A 71 16.289 -6.293 -20.189 1.00 0.00 H new ATOM 0 HG3 MET A 71 17.907 -5.633 -20.054 1.00 0.00 H new ATOM 0 HE1 MET A 71 14.533 -3.317 -21.364 1.00 0.00 H new ATOM 0 HE2 MET A 71 14.441 -5.037 -20.918 1.00 0.00 H new ATOM 0 HE3 MET A 71 13.833 -3.794 -19.799 1.00 0.00 H new ATOM 1206 N GLN A 72 17.208 -7.607 -24.875 1.00 0.00 N ATOM 1207 CA GLN A 72 17.232 -7.499 -26.368 1.00 0.00 C ATOM 1208 C GLN A 72 15.790 -7.604 -26.881 1.00 0.00 C ATOM 1209 O GLN A 72 15.222 -8.694 -26.932 1.00 0.00 O ATOM 1210 CB GLN A 72 18.078 -8.627 -26.973 1.00 0.00 C ATOM 1211 CG GLN A 72 18.146 -8.459 -28.493 1.00 0.00 C ATOM 1212 CD GLN A 72 19.429 -7.709 -28.868 1.00 0.00 C ATOM 1213 OE1 GLN A 72 20.424 -8.328 -29.241 1.00 0.00 O ATOM 1214 NE2 GLN A 72 19.469 -6.400 -28.793 1.00 0.00 N ATOM 0 H GLN A 72 17.493 -8.510 -24.497 1.00 0.00 H new ATOM 0 HA GLN A 72 17.672 -6.546 -26.660 1.00 0.00 H new ATOM 0 HB2 GLN A 72 19.082 -8.609 -26.550 1.00 0.00 H new ATOM 0 HB3 GLN A 72 17.644 -9.595 -26.723 1.00 0.00 H new ATOM 0 HG2 GLN A 72 18.128 -9.435 -28.978 1.00 0.00 H new ATOM 0 HG3 GLN A 72 17.274 -7.910 -28.848 1.00 0.00 H new ATOM 0 HE21 GLN A 72 18.647 -5.881 -28.484 1.00 0.00 H new ATOM 0 HE22 GLN A 72 20.322 -5.901 -29.043 1.00 0.00 H new ATOM 1215 N GLY A 73 15.173 -6.499 -27.241 1.00 0.00 N ATOM 1216 CA GLY A 73 13.761 -6.564 -27.719 1.00 0.00 C ATOM 1217 C GLY A 73 12.859 -6.864 -26.515 1.00 0.00 C ATOM 1218 O GLY A 73 12.331 -7.968 -26.384 1.00 0.00 O ATOM 0 H GLY A 73 15.586 -5.566 -27.223 1.00 0.00 H new ATOM 0 HA2 GLY A 73 13.473 -5.621 -28.183 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.652 -7.339 -28.478 1.00 0.00 H new ATOM 1219 N PHE A 74 12.682 -5.915 -25.619 1.00 0.00 N ATOM 1220 CA PHE A 74 11.829 -6.174 -24.420 1.00 0.00 C ATOM 1221 C PHE A 74 10.603 -5.244 -24.435 1.00 0.00 C ATOM 1222 O PHE A 74 10.521 -4.349 -25.273 1.00 0.00 O ATOM 1223 CB PHE A 74 12.655 -5.917 -23.151 1.00 0.00 C ATOM 1224 CG PHE A 74 12.956 -7.225 -22.454 1.00 0.00 C ATOM 1225 CD1 PHE A 74 13.486 -8.303 -23.176 1.00 0.00 C ATOM 1226 CD2 PHE A 74 12.707 -7.358 -21.082 1.00 0.00 C ATOM 1227 CE1 PHE A 74 13.765 -9.510 -22.527 1.00 0.00 C ATOM 1228 CE2 PHE A 74 12.987 -8.567 -20.434 1.00 0.00 C ATOM 1229 CZ PHE A 74 13.515 -9.643 -21.155 1.00 0.00 C ATOM 0 H PHE A 74 13.090 -4.981 -25.670 1.00 0.00 H new ATOM 0 HA PHE A 74 11.487 -7.209 -24.435 1.00 0.00 H new ATOM 0 HB2 PHE A 74 13.585 -5.411 -23.409 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.108 -5.255 -22.479 1.00 0.00 H new ATOM 0 HD1 PHE A 74 13.679 -8.202 -24.234 1.00 0.00 H new ATOM 0 HD2 PHE A 74 12.299 -6.528 -20.524 1.00 0.00 H new ATOM 0 HE1 PHE A 74 14.174 -10.340 -23.084 1.00 0.00 H new ATOM 0 HE2 PHE A 74 12.795 -8.669 -19.376 1.00 0.00 H new ATOM 0 HZ PHE A 74 13.730 -10.576 -20.654 1.00 0.00 H new ATOM 1230 N PRO A 75 9.676 -5.463 -23.515 1.00 0.00 N ATOM 1231 CA PRO A 75 8.457 -4.639 -23.424 1.00 0.00 C ATOM 1232 C PRO A 75 8.765 -3.297 -22.739 1.00 0.00 C ATOM 1233 O PRO A 75 9.585 -3.228 -21.826 1.00 0.00 O ATOM 1234 CB PRO A 75 7.508 -5.483 -22.567 1.00 0.00 C ATOM 1235 CG PRO A 75 8.397 -6.449 -21.752 1.00 0.00 C ATOM 1236 CD PRO A 75 9.745 -6.537 -22.489 1.00 0.00 C ATOM 0 HA PRO A 75 8.035 -4.394 -24.399 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.915 -4.850 -21.906 1.00 0.00 H new ATOM 0 HB3 PRO A 75 6.807 -6.035 -23.193 1.00 0.00 H new ATOM 0 HG2 PRO A 75 8.535 -6.083 -20.735 1.00 0.00 H new ATOM 0 HG3 PRO A 75 7.932 -7.432 -21.676 1.00 0.00 H new ATOM 0 HD2 PRO A 75 10.581 -6.382 -21.807 1.00 0.00 H new ATOM 0 HD3 PRO A 75 9.884 -7.516 -22.947 1.00 0.00 H new ATOM 1237 N PHE A 76 8.128 -2.229 -23.163 1.00 0.00 N ATOM 1238 CA PHE A 76 8.392 -0.902 -22.535 1.00 0.00 C ATOM 1239 C PHE A 76 7.191 0.028 -22.779 1.00 0.00 C ATOM 1240 O PHE A 76 7.031 0.572 -23.869 1.00 0.00 O ATOM 1241 CB PHE A 76 9.651 -0.297 -23.160 1.00 0.00 C ATOM 1242 CG PHE A 76 10.245 0.738 -22.233 1.00 0.00 C ATOM 1243 CD1 PHE A 76 10.468 0.430 -20.884 1.00 0.00 C ATOM 1244 CD2 PHE A 76 10.581 2.003 -22.726 1.00 0.00 C ATOM 1245 CE1 PHE A 76 11.025 1.392 -20.031 1.00 0.00 C ATOM 1246 CE2 PHE A 76 11.138 2.962 -21.874 1.00 0.00 C ATOM 1247 CZ PHE A 76 11.360 2.657 -20.526 1.00 0.00 C ATOM 0 H PHE A 76 7.439 -2.223 -23.915 1.00 0.00 H new ATOM 0 HA PHE A 76 8.539 -1.022 -21.462 1.00 0.00 H new ATOM 0 HB2 PHE A 76 10.381 -1.082 -23.357 1.00 0.00 H new ATOM 0 HB3 PHE A 76 9.407 0.160 -24.119 1.00 0.00 H new ATOM 0 HD1 PHE A 76 10.211 -0.547 -20.503 1.00 0.00 H new ATOM 0 HD2 PHE A 76 10.410 2.239 -23.766 1.00 0.00 H new ATOM 0 HE1 PHE A 76 11.196 1.157 -18.991 1.00 0.00 H new ATOM 0 HE2 PHE A 76 11.397 3.938 -22.256 1.00 0.00 H new ATOM 0 HZ PHE A 76 11.790 3.398 -19.868 1.00 0.00 H new ATOM 1248 N TYR A 77 6.337 0.210 -21.794 1.00 0.00 N ATOM 1249 CA TYR A 77 5.150 1.095 -21.983 1.00 0.00 C ATOM 1250 C TYR A 77 4.272 0.557 -23.122 1.00 0.00 C ATOM 1251 O TYR A 77 3.904 1.292 -24.037 1.00 0.00 O ATOM 1252 CB TYR A 77 5.614 2.515 -22.305 1.00 0.00 C ATOM 1253 CG TYR A 77 6.244 3.111 -21.073 1.00 0.00 C ATOM 1254 CD1 TYR A 77 7.594 2.875 -20.792 1.00 0.00 C ATOM 1255 CD2 TYR A 77 5.473 3.888 -20.203 1.00 0.00 C ATOM 1256 CE1 TYR A 77 8.173 3.416 -19.642 1.00 0.00 C ATOM 1257 CE2 TYR A 77 6.050 4.428 -19.049 1.00 0.00 C ATOM 1258 CZ TYR A 77 7.401 4.190 -18.768 1.00 0.00 C ATOM 1259 OH TYR A 77 7.969 4.717 -17.630 1.00 0.00 O ATOM 0 H TYR A 77 6.415 -0.218 -20.871 1.00 0.00 H new ATOM 0 HA TYR A 77 4.564 1.111 -21.064 1.00 0.00 H new ATOM 0 HB2 TYR A 77 6.331 2.501 -23.126 1.00 0.00 H new ATOM 0 HB3 TYR A 77 4.770 3.124 -22.629 1.00 0.00 H new ATOM 0 HD1 TYR A 77 8.189 2.274 -21.464 1.00 0.00 H new ATOM 0 HD2 TYR A 77 4.431 4.071 -20.422 1.00 0.00 H new ATOM 0 HE1 TYR A 77 9.216 3.237 -19.427 1.00 0.00 H new ATOM 0 HE2 TYR A 77 5.455 5.027 -18.376 1.00 0.00 H new ATOM 0 HH TYR A 77 8.800 5.181 -17.864 1.00 0.00 H new ATOM 1260 N ASP A 78 3.916 -0.711 -23.084 1.00 0.00 N ATOM 1261 CA ASP A 78 3.053 -1.282 -24.160 1.00 0.00 C ATOM 1262 C ASP A 78 3.693 -1.044 -25.538 1.00 0.00 C ATOM 1263 O ASP A 78 3.131 -0.345 -26.381 1.00 0.00 O ATOM 1264 CB ASP A 78 1.677 -0.611 -24.111 1.00 0.00 C ATOM 1265 CG ASP A 78 0.681 -1.430 -24.934 1.00 0.00 C ATOM 1266 OD1 ASP A 78 0.587 -2.623 -24.698 1.00 0.00 O ATOM 1267 OD2 ASP A 78 0.030 -0.850 -25.787 1.00 0.00 O ATOM 0 H ASP A 78 4.188 -1.369 -22.353 1.00 0.00 H new ATOM 0 HA ASP A 78 2.947 -2.355 -24.002 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.335 -0.533 -23.079 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.741 0.404 -24.503 1.00 0.00 H new ATOM 1268 N LYS A 79 4.851 -1.615 -25.796 1.00 0.00 N ATOM 1269 CA LYS A 79 5.496 -1.412 -27.133 1.00 0.00 C ATOM 1270 C LYS A 79 6.825 -2.199 -27.211 1.00 0.00 C ATOM 1271 O LYS A 79 7.588 -2.196 -26.248 1.00 0.00 O ATOM 1272 CB LYS A 79 5.784 0.078 -27.338 1.00 0.00 C ATOM 1273 CG LYS A 79 5.684 0.416 -28.828 1.00 0.00 C ATOM 1274 CD LYS A 79 5.727 1.933 -29.013 1.00 0.00 C ATOM 1275 CE LYS A 79 5.696 2.267 -30.505 1.00 0.00 C ATOM 1276 NZ LYS A 79 5.392 3.715 -30.684 1.00 0.00 N ATOM 0 H LYS A 79 5.370 -2.205 -25.146 1.00 0.00 H new ATOM 0 HA LYS A 79 4.820 -1.772 -27.909 1.00 0.00 H new ATOM 0 HB2 LYS A 79 5.074 0.678 -26.769 1.00 0.00 H new ATOM 0 HB3 LYS A 79 6.779 0.322 -26.965 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.505 -0.050 -29.373 1.00 0.00 H new ATOM 0 HG3 LYS A 79 4.758 0.015 -29.241 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.879 2.396 -28.508 1.00 0.00 H new ATOM 0 HD3 LYS A 79 6.630 2.340 -28.557 1.00 0.00 H new ATOM 0 HE2 LYS A 79 6.656 2.027 -30.962 1.00 0.00 H new ATOM 0 HE3 LYS A 79 4.943 1.661 -31.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 5.371 3.942 -31.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.466 3.930 -30.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 6.126 4.284 -30.217 1.00 0.00 H new ATOM 1277 N PRO A 80 7.090 -2.852 -28.334 1.00 0.00 N ATOM 1278 CA PRO A 80 8.333 -3.625 -28.501 1.00 0.00 C ATOM 1279 C PRO A 80 9.499 -2.679 -28.822 1.00 0.00 C ATOM 1280 O PRO A 80 9.377 -1.804 -29.680 1.00 0.00 O ATOM 1281 CB PRO A 80 8.035 -4.543 -29.690 1.00 0.00 C ATOM 1282 CG PRO A 80 6.895 -3.869 -30.488 1.00 0.00 C ATOM 1283 CD PRO A 80 6.203 -2.888 -29.525 1.00 0.00 C ATOM 0 HA PRO A 80 8.619 -4.180 -27.607 1.00 0.00 H new ATOM 0 HB2 PRO A 80 8.921 -4.672 -30.312 1.00 0.00 H new ATOM 0 HB3 PRO A 80 7.737 -5.535 -29.350 1.00 0.00 H new ATOM 0 HG2 PRO A 80 7.289 -3.344 -31.358 1.00 0.00 H new ATOM 0 HG3 PRO A 80 6.189 -4.613 -30.857 1.00 0.00 H new ATOM 0 HD2 PRO A 80 6.098 -1.900 -29.972 1.00 0.00 H new ATOM 0 HD3 PRO A 80 5.201 -3.228 -29.264 1.00 0.00 H new ATOM 1284 N MET A 81 10.626 -2.826 -28.160 1.00 0.00 N ATOM 1285 CA MET A 81 11.774 -1.920 -28.451 1.00 0.00 C ATOM 1286 C MET A 81 13.089 -2.715 -28.451 1.00 0.00 C ATOM 1287 O MET A 81 13.361 -3.495 -27.535 1.00 0.00 O ATOM 1288 CB MET A 81 11.842 -0.809 -27.395 1.00 0.00 C ATOM 1289 CG MET A 81 11.785 -1.412 -25.989 1.00 0.00 C ATOM 1290 SD MET A 81 12.444 -0.218 -24.800 1.00 0.00 S ATOM 1291 CE MET A 81 13.446 -1.381 -23.842 1.00 0.00 C ATOM 0 H MET A 81 10.794 -3.528 -27.439 1.00 0.00 H new ATOM 0 HA MET A 81 11.629 -1.474 -29.435 1.00 0.00 H new ATOM 0 HB2 MET A 81 12.762 -0.238 -27.517 1.00 0.00 H new ATOM 0 HB3 MET A 81 11.014 -0.114 -27.534 1.00 0.00 H new ATOM 0 HG2 MET A 81 10.757 -1.669 -25.732 1.00 0.00 H new ATOM 0 HG3 MET A 81 12.363 -2.335 -25.953 1.00 0.00 H new ATOM 0 HE1 MET A 81 13.953 -0.848 -23.038 1.00 0.00 H new ATOM 0 HE2 MET A 81 12.803 -2.152 -23.418 1.00 0.00 H new ATOM 0 HE3 MET A 81 14.187 -1.845 -24.493 1.00 0.00 H new ATOM 1292 N ARG A 82 13.918 -2.527 -29.457 1.00 0.00 N ATOM 1293 CA ARG A 82 15.214 -3.260 -29.506 1.00 0.00 C ATOM 1294 C ARG A 82 16.311 -2.351 -28.945 1.00 0.00 C ATOM 1295 O ARG A 82 16.210 -1.127 -29.021 1.00 0.00 O ATOM 1296 CB ARG A 82 15.549 -3.628 -30.954 1.00 0.00 C ATOM 1297 CG ARG A 82 14.753 -4.869 -31.364 1.00 0.00 C ATOM 1298 CD ARG A 82 14.994 -5.162 -32.846 1.00 0.00 C ATOM 1299 NE ARG A 82 14.741 -6.606 -33.114 1.00 0.00 N ATOM 1300 CZ ARG A 82 15.549 -7.511 -32.632 1.00 0.00 C ATOM 1301 NH1 ARG A 82 16.795 -7.543 -33.017 1.00 0.00 N ATOM 1302 NH2 ARG A 82 15.112 -8.381 -31.765 1.00 0.00 N ATOM 0 H ARG A 82 13.747 -1.897 -30.241 1.00 0.00 H new ATOM 0 HA ARG A 82 15.143 -4.173 -28.916 1.00 0.00 H new ATOM 0 HB2 ARG A 82 15.311 -2.795 -31.616 1.00 0.00 H new ATOM 0 HB3 ARG A 82 16.617 -3.819 -31.054 1.00 0.00 H new ATOM 0 HG2 ARG A 82 15.055 -5.724 -30.759 1.00 0.00 H new ATOM 0 HG3 ARG A 82 13.690 -4.709 -31.182 1.00 0.00 H new ATOM 0 HD2 ARG A 82 14.337 -4.546 -33.461 1.00 0.00 H new ATOM 0 HD3 ARG A 82 16.018 -4.905 -33.117 1.00 0.00 H new ATOM 0 HE ARG A 82 13.936 -6.887 -33.674 1.00 0.00 H new ATOM 0 HH11 ARG A 82 17.137 -6.861 -33.694 1.00 0.00 H new ATOM 0 HH12 ARG A 82 17.427 -8.250 -32.641 1.00 0.00 H new ATOM 0 HH21 ARG A 82 14.138 -8.355 -31.463 1.00 0.00 H new ATOM 0 HH22 ARG A 82 15.744 -9.088 -31.389 1.00 0.00 H new ATOM 1303 N ILE A 83 17.350 -2.910 -28.370 1.00 0.00 N ATOM 1304 CA ILE A 83 18.426 -2.051 -27.802 1.00 0.00 C ATOM 1305 C ILE A 83 19.703 -2.160 -28.652 1.00 0.00 C ATOM 1306 O ILE A 83 20.117 -3.248 -29.044 1.00 0.00 O ATOM 1307 CB ILE A 83 18.723 -2.488 -26.369 1.00 0.00 C ATOM 1308 CG1 ILE A 83 17.434 -2.420 -25.547 1.00 0.00 C ATOM 1309 CG2 ILE A 83 19.771 -1.554 -25.753 1.00 0.00 C ATOM 1310 CD1 ILE A 83 17.692 -2.967 -24.144 1.00 0.00 C ATOM 0 H ILE A 83 17.495 -3.915 -28.272 1.00 0.00 H new ATOM 0 HA ILE A 83 18.090 -1.014 -27.807 1.00 0.00 H new ATOM 0 HB ILE A 83 19.106 -3.508 -26.370 1.00 0.00 H new ATOM 0 HG12 ILE A 83 17.082 -1.390 -25.488 1.00 0.00 H new ATOM 0 HG13 ILE A 83 16.649 -2.997 -26.035 1.00 0.00 H new ATOM 0 HG21 ILE A 83 19.982 -1.867 -24.730 1.00 0.00 H new ATOM 0 HG22 ILE A 83 20.687 -1.597 -26.342 1.00 0.00 H new ATOM 0 HG23 ILE A 83 19.390 -0.533 -25.748 1.00 0.00 H new ATOM 0 HD11 ILE A 83 16.773 -2.918 -23.560 1.00 0.00 H new ATOM 0 HD12 ILE A 83 18.023 -4.003 -24.213 1.00 0.00 H new ATOM 0 HD13 ILE A 83 18.464 -2.371 -23.657 1.00 0.00 H new ATOM 1311 N GLN A 84 20.342 -1.045 -28.929 1.00 0.00 N ATOM 1312 CA GLN A 84 21.597 -1.071 -29.734 1.00 0.00 C ATOM 1313 C GLN A 84 22.653 -0.242 -28.993 1.00 0.00 C ATOM 1314 O GLN A 84 22.338 0.804 -28.433 1.00 0.00 O ATOM 1315 CB GLN A 84 21.347 -0.452 -31.114 1.00 0.00 C ATOM 1316 CG GLN A 84 20.126 -1.100 -31.776 1.00 0.00 C ATOM 1317 CD GLN A 84 19.386 -0.049 -32.616 1.00 0.00 C ATOM 1318 OE1 GLN A 84 19.200 -0.232 -33.817 1.00 0.00 O ATOM 1319 NE2 GLN A 84 18.949 1.052 -32.051 1.00 0.00 N ATOM 0 H GLN A 84 20.043 -0.117 -28.629 1.00 0.00 H new ATOM 0 HA GLN A 84 21.935 -2.099 -29.865 1.00 0.00 H new ATOM 0 HB2 GLN A 84 21.188 0.622 -31.015 1.00 0.00 H new ATOM 0 HB3 GLN A 84 22.225 -0.587 -31.745 1.00 0.00 H new ATOM 0 HG2 GLN A 84 20.439 -1.932 -32.407 1.00 0.00 H new ATOM 0 HG3 GLN A 84 19.460 -1.509 -31.016 1.00 0.00 H new ATOM 0 HE21 GLN A 84 19.101 1.209 -31.055 1.00 0.00 H new ATOM 0 HE22 GLN A 84 18.458 1.751 -32.608 1.00 0.00 H new ATOM 1320 N TYR A 85 23.898 -0.675 -28.965 1.00 0.00 N ATOM 1321 CA TYR A 85 24.947 0.120 -28.235 1.00 0.00 C ATOM 1322 C TYR A 85 24.902 1.592 -28.683 1.00 0.00 C ATOM 1323 O TYR A 85 24.161 1.948 -29.598 1.00 0.00 O ATOM 1324 CB TYR A 85 26.343 -0.449 -28.519 1.00 0.00 C ATOM 1325 CG TYR A 85 26.612 -1.626 -27.607 1.00 0.00 C ATOM 1326 CD1 TYR A 85 26.404 -1.513 -26.224 1.00 0.00 C ATOM 1327 CD2 TYR A 85 27.075 -2.831 -28.147 1.00 0.00 C ATOM 1328 CE1 TYR A 85 26.658 -2.605 -25.387 1.00 0.00 C ATOM 1329 CE2 TYR A 85 27.331 -3.922 -27.310 1.00 0.00 C ATOM 1330 CZ TYR A 85 27.123 -3.810 -25.931 1.00 0.00 C ATOM 1331 OH TYR A 85 27.377 -4.887 -25.108 1.00 0.00 O ATOM 0 H TYR A 85 24.229 -1.531 -29.409 1.00 0.00 H new ATOM 0 HA TYR A 85 24.743 0.056 -27.166 1.00 0.00 H new ATOM 0 HB2 TYR A 85 26.413 -0.761 -29.561 1.00 0.00 H new ATOM 0 HB3 TYR A 85 27.098 0.322 -28.365 1.00 0.00 H new ATOM 0 HD1 TYR A 85 26.048 -0.583 -25.806 1.00 0.00 H new ATOM 0 HD2 TYR A 85 27.235 -2.919 -29.211 1.00 0.00 H new ATOM 0 HE1 TYR A 85 26.496 -2.519 -24.323 1.00 0.00 H new ATOM 0 HE2 TYR A 85 27.689 -4.851 -27.728 1.00 0.00 H new ATOM 0 HH TYR A 85 28.119 -4.671 -24.506 1.00 0.00 H new ATOM 1332 N ALA A 86 25.672 2.457 -28.058 1.00 0.00 N ATOM 1333 CA ALA A 86 25.653 3.895 -28.459 1.00 0.00 C ATOM 1334 C ALA A 86 26.745 4.153 -29.508 1.00 0.00 C ATOM 1335 O ALA A 86 27.485 3.244 -29.882 1.00 0.00 O ATOM 1336 CB ALA A 86 25.904 4.781 -27.234 1.00 0.00 C ATOM 0 H ALA A 86 26.307 2.227 -27.294 1.00 0.00 H new ATOM 0 HA ALA A 86 24.677 4.134 -28.882 1.00 0.00 H new ATOM 0 HB1 ALA A 86 25.889 5.829 -27.534 1.00 0.00 H new ATOM 0 HB2 ALA A 86 25.126 4.605 -26.492 1.00 0.00 H new ATOM 0 HB3 ALA A 86 26.876 4.541 -26.804 1.00 0.00 H new ATOM 1337 N LYS A 87 26.867 5.371 -29.992 1.00 0.00 N ATOM 1338 CA LYS A 87 27.919 5.662 -31.015 1.00 0.00 C ATOM 1339 C LYS A 87 29.239 6.020 -30.313 1.00 0.00 C ATOM 1340 O LYS A 87 30.314 5.626 -30.764 1.00 0.00 O ATOM 1341 CB LYS A 87 27.481 6.836 -31.899 1.00 0.00 C ATOM 1342 CG LYS A 87 26.316 6.397 -32.788 1.00 0.00 C ATOM 1343 CD LYS A 87 25.570 7.631 -33.298 1.00 0.00 C ATOM 1344 CE LYS A 87 24.432 7.193 -34.225 1.00 0.00 C ATOM 1345 NZ LYS A 87 24.974 6.318 -35.300 1.00 0.00 N ATOM 0 H LYS A 87 26.288 6.167 -29.724 1.00 0.00 H new ATOM 0 HA LYS A 87 28.062 4.777 -31.636 1.00 0.00 H new ATOM 0 HB2 LYS A 87 27.181 7.680 -31.278 1.00 0.00 H new ATOM 0 HB3 LYS A 87 28.315 7.173 -32.514 1.00 0.00 H new ATOM 0 HG2 LYS A 87 26.687 5.810 -33.628 1.00 0.00 H new ATOM 0 HG3 LYS A 87 25.637 5.755 -32.226 1.00 0.00 H new ATOM 0 HD2 LYS A 87 25.171 8.200 -32.459 1.00 0.00 H new ATOM 0 HD3 LYS A 87 26.256 8.289 -33.832 1.00 0.00 H new ATOM 0 HE2 LYS A 87 23.671 6.659 -33.656 1.00 0.00 H new ATOM 0 HE3 LYS A 87 23.949 8.067 -34.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 24.300 6.283 -36.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 25.881 6.701 -35.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 25.120 5.358 -34.926 1.00 0.00 H new ATOM 1346 N THR A 88 29.192 6.753 -29.220 1.00 0.00 N ATOM 1347 CA THR A 88 30.453 7.118 -28.516 1.00 0.00 C ATOM 1348 C THR A 88 30.276 6.953 -27.002 1.00 0.00 C ATOM 1349 O THR A 88 29.207 6.573 -26.525 1.00 0.00 O ATOM 1350 CB THR A 88 30.826 8.571 -28.830 1.00 0.00 C ATOM 1351 OG1 THR A 88 29.754 9.452 -28.474 1.00 0.00 O ATOM 1352 CG2 THR A 88 31.149 8.689 -30.320 1.00 0.00 C ATOM 0 H THR A 88 28.337 7.109 -28.793 1.00 0.00 H new ATOM 0 HA THR A 88 31.250 6.458 -28.860 1.00 0.00 H new ATOM 0 HB THR A 88 31.701 8.858 -28.246 1.00 0.00 H new ATOM 0 HG1 THR A 88 30.008 10.376 -28.679 1.00 0.00 H new ATOM 0 HG21 THR A 88 31.416 9.720 -30.554 1.00 0.00 H new ATOM 0 HG22 THR A 88 31.985 8.033 -30.564 1.00 0.00 H new ATOM 0 HG23 THR A 88 30.277 8.398 -30.906 1.00 0.00 H new ATOM 1353 N ASP A 89 31.305 7.231 -26.231 1.00 0.00 N ATOM 1354 CA ASP A 89 31.182 7.086 -24.745 1.00 0.00 C ATOM 1355 C ASP A 89 30.283 8.204 -24.195 1.00 0.00 C ATOM 1356 O ASP A 89 29.791 9.041 -24.950 1.00 0.00 O ATOM 1357 CB ASP A 89 32.566 7.174 -24.086 1.00 0.00 C ATOM 1358 CG ASP A 89 33.420 5.985 -24.530 1.00 0.00 C ATOM 1359 OD1 ASP A 89 33.632 5.847 -25.724 1.00 0.00 O ATOM 1360 OD2 ASP A 89 33.848 5.234 -23.670 1.00 0.00 O ATOM 0 H ASP A 89 32.215 7.549 -26.564 1.00 0.00 H new ATOM 0 HA ASP A 89 30.743 6.114 -24.519 1.00 0.00 H new ATOM 0 HB2 ASP A 89 33.053 8.109 -24.363 1.00 0.00 H new ATOM 0 HB3 ASP A 89 32.464 7.177 -23.001 1.00 0.00 H new ATOM 1361 N SER A 90 30.055 8.242 -22.899 1.00 0.00 N ATOM 1362 CA SER A 90 29.185 9.315 -22.328 1.00 0.00 C ATOM 1363 C SER A 90 30.047 10.527 -21.947 1.00 0.00 C ATOM 1364 O SER A 90 31.275 10.459 -21.972 1.00 0.00 O ATOM 1365 CB SER A 90 28.464 8.795 -21.082 1.00 0.00 C ATOM 1366 OG SER A 90 27.159 9.358 -21.025 1.00 0.00 O ATOM 0 H SER A 90 30.432 7.580 -22.221 1.00 0.00 H new ATOM 0 HA SER A 90 28.447 9.609 -23.074 1.00 0.00 H new ATOM 0 HB2 SER A 90 28.402 7.707 -21.111 1.00 0.00 H new ATOM 0 HB3 SER A 90 29.026 9.059 -20.186 1.00 0.00 H new ATOM 0 HG SER A 90 27.187 10.199 -20.523 1.00 0.00 H new ATOM 1367 N ASP A 91 29.435 11.636 -21.588 1.00 0.00 N ATOM 1368 CA ASP A 91 30.234 12.835 -21.206 1.00 0.00 C ATOM 1369 C ASP A 91 30.639 12.753 -19.730 1.00 0.00 C ATOM 1370 O ASP A 91 31.695 13.261 -19.351 1.00 0.00 O ATOM 1371 CB ASP A 91 29.425 14.115 -21.449 1.00 0.00 C ATOM 1372 CG ASP A 91 29.837 14.732 -22.786 1.00 0.00 C ATOM 1373 OD1 ASP A 91 31.021 14.964 -22.969 1.00 0.00 O ATOM 1374 OD2 ASP A 91 28.962 14.963 -23.605 1.00 0.00 O ATOM 0 H ASP A 91 28.423 11.756 -21.545 1.00 0.00 H new ATOM 0 HA ASP A 91 31.133 12.861 -21.822 1.00 0.00 H new ATOM 0 HB2 ASP A 91 28.359 13.889 -21.454 1.00 0.00 H new ATOM 0 HB3 ASP A 91 29.596 14.825 -20.640 1.00 0.00 H new ATOM 1375 N ILE A 92 29.854 12.119 -18.881 1.00 0.00 N ATOM 1376 CA ILE A 92 30.270 12.018 -17.455 1.00 0.00 C ATOM 1377 C ILE A 92 31.575 11.190 -17.364 1.00 0.00 C ATOM 1378 O ILE A 92 32.327 11.331 -16.405 1.00 0.00 O ATOM 1379 CB ILE A 92 29.154 11.380 -16.607 1.00 0.00 C ATOM 1380 CG1 ILE A 92 28.940 9.921 -17.029 1.00 0.00 C ATOM 1381 CG2 ILE A 92 27.852 12.171 -16.794 1.00 0.00 C ATOM 1382 CD1 ILE A 92 27.885 9.271 -16.127 1.00 0.00 C ATOM 0 H ILE A 92 28.964 11.679 -19.115 1.00 0.00 H new ATOM 0 HA ILE A 92 30.453 13.017 -17.060 1.00 0.00 H new ATOM 0 HB ILE A 92 29.446 11.404 -15.557 1.00 0.00 H new ATOM 0 HG12 ILE A 92 28.619 9.877 -18.070 1.00 0.00 H new ATOM 0 HG13 ILE A 92 29.879 9.371 -16.961 1.00 0.00 H new ATOM 0 HG21 ILE A 92 27.062 11.719 -16.194 1.00 0.00 H new ATOM 0 HG22 ILE A 92 28.004 13.203 -16.476 1.00 0.00 H new ATOM 0 HG23 ILE A 92 27.564 12.154 -17.845 1.00 0.00 H new ATOM 0 HD11 ILE A 92 27.736 8.235 -16.430 1.00 0.00 H new ATOM 0 HD12 ILE A 92 28.223 9.301 -15.091 1.00 0.00 H new ATOM 0 HD13 ILE A 92 26.944 9.814 -16.217 1.00 0.00 H new ATOM 1383 N ILE A 93 31.889 10.357 -18.354 1.00 0.00 N ATOM 1384 CA ILE A 93 33.173 9.582 -18.293 1.00 0.00 C ATOM 1385 C ILE A 93 34.328 10.543 -18.627 1.00 0.00 C ATOM 1386 O ILE A 93 35.429 10.416 -18.099 1.00 0.00 O ATOM 1387 CB ILE A 93 33.217 8.410 -19.310 1.00 0.00 C ATOM 1388 CG1 ILE A 93 31.825 7.850 -19.689 1.00 0.00 C ATOM 1389 CG2 ILE A 93 34.052 7.273 -18.720 1.00 0.00 C ATOM 1390 CD1 ILE A 93 30.912 7.717 -18.470 1.00 0.00 C ATOM 0 H ILE A 93 31.317 10.190 -19.182 1.00 0.00 H new ATOM 0 HA ILE A 93 33.257 9.159 -17.292 1.00 0.00 H new ATOM 0 HB ILE A 93 33.655 8.812 -20.223 1.00 0.00 H new ATOM 0 HG12 ILE A 93 31.357 8.506 -20.423 1.00 0.00 H new ATOM 0 HG13 ILE A 93 31.943 6.875 -20.162 1.00 0.00 H new ATOM 0 HG21 ILE A 93 34.089 6.444 -19.427 1.00 0.00 H new ATOM 0 HG22 ILE A 93 35.064 7.628 -18.524 1.00 0.00 H new ATOM 0 HG23 ILE A 93 33.599 6.935 -17.788 1.00 0.00 H new ATOM 0 HD11 ILE A 93 29.945 7.321 -18.781 1.00 0.00 H new ATOM 0 HD12 ILE A 93 31.367 7.040 -17.747 1.00 0.00 H new ATOM 0 HD13 ILE A 93 30.772 8.696 -18.012 1.00 0.00 H new