USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 541 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 47 LYS NZ :NH3+ -129:sc= 1.58 (180deg=1.24) USER MOD Set 1.2: A 82 THR OG1 : rot 92:sc= 1.32 USER MOD Single : A 43 ASN : amide:sc= 0.919 K(o=0.92,f=-0.32) USER MOD Single : A 51 GLN : amide:sc= 0.724 K(o=0.72,f=0) USER MOD Single : A 53 SER OG : rot -169:sc= -1.26 USER MOD Single : A 62 GLN : amide:sc= -1.04 K(o=-1,f=-0.15) USER MOD Single : A 63 LYS NZ :NH3+ -138:sc= 1.19 (180deg=0.692) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= -1.29! C(o=-1.3!,f=-4.4!) USER MOD Single : A 84 SER OG : rot 180:sc= 0.0972 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= -1.11 K(o=-1.1,f=0) USER MOD Single : A 100 ASN : amide:sc= -0.0782 K(o=-0.078,f=-2.1!) USER MOD Single : A 106 ASN : amide:sc= -2.96! K(o=-3!,f=0.49) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 675 N ASN A 43 14.502 -2.110 -2.759 1.00 0.00 N ATOM 676 CA ASN A 43 15.225 -1.907 -1.531 1.00 0.00 C ATOM 677 C ASN A 43 16.646 -2.351 -1.720 1.00 0.00 C ATOM 678 O ASN A 43 16.896 -3.416 -2.301 1.00 0.00 O ATOM 679 CB ASN A 43 14.576 -2.724 -0.401 1.00 0.00 C ATOM 680 CG ASN A 43 13.109 -2.384 -0.161 1.00 0.00 C ATOM 681 OD1 ASN A 43 12.677 -1.253 -0.349 1.00 0.00 O ATOM 682 ND2 ASN A 43 12.335 -3.367 0.245 1.00 0.00 N ATOM 0 HA ASN A 43 15.200 -0.850 -1.264 1.00 0.00 H new ATOM 0 HB2 ASN A 43 14.660 -3.785 -0.638 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.133 -2.558 0.521 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.343 -3.199 0.413 1.00 0.00 H new ATOM 0 HD22 ASN A 43 12.727 -4.297 0.392 1.00 0.00 H new ATOM 689 N LEU A 44 17.578 -1.560 -1.270 1.00 0.00 N ATOM 690 CA LEU A 44 18.981 -1.899 -1.404 1.00 0.00 C ATOM 691 C LEU A 44 19.765 -1.601 -0.137 1.00 0.00 C ATOM 692 O LEU A 44 19.331 -0.816 0.732 1.00 0.00 O ATOM 693 CB LEU A 44 19.623 -1.133 -2.585 1.00 0.00 C ATOM 694 CG LEU A 44 19.133 -1.476 -4.001 1.00 0.00 C ATOM 695 CD1 LEU A 44 19.772 -0.545 -5.016 1.00 0.00 C ATOM 696 CD2 LEU A 44 19.462 -2.924 -4.347 1.00 0.00 C ATOM 0 H LEU A 44 17.399 -0.671 -0.804 1.00 0.00 H new ATOM 0 HA LEU A 44 19.024 -2.972 -1.593 1.00 0.00 H new ATOM 0 HB2 LEU A 44 19.463 -0.067 -2.422 1.00 0.00 H new ATOM 0 HB3 LEU A 44 20.699 -1.302 -2.551 1.00 0.00 H new ATOM 0 HG LEU A 44 18.051 -1.348 -4.030 1.00 0.00 H new ATOM 0 HD11 LEU A 44 19.417 -0.798 -6.015 1.00 0.00 H new ATOM 0 HD12 LEU A 44 19.502 0.485 -4.785 1.00 0.00 H new ATOM 0 HD13 LEU A 44 20.856 -0.654 -4.977 1.00 0.00 H new ATOM 0 HD21 LEU A 44 19.107 -3.147 -5.353 1.00 0.00 H new ATOM 0 HD22 LEU A 44 20.541 -3.073 -4.301 1.00 0.00 H new ATOM 0 HD23 LEU A 44 18.974 -3.588 -3.634 1.00 0.00 H new ATOM 708 N ILE A 45 20.881 -2.262 -0.018 1.00 0.00 N ATOM 709 CA ILE A 45 21.859 -1.992 0.990 1.00 0.00 C ATOM 710 C ILE A 45 23.172 -1.670 0.320 1.00 0.00 C ATOM 711 O ILE A 45 23.603 -2.376 -0.607 1.00 0.00 O ATOM 712 CB ILE A 45 22.014 -3.126 2.074 1.00 0.00 C ATOM 713 CG1 ILE A 45 23.428 -3.138 2.630 1.00 0.00 C ATOM 714 CG2 ILE A 45 21.758 -4.442 1.494 1.00 0.00 C ATOM 715 CD1 ILE A 45 23.642 -3.928 3.892 1.00 0.00 C ATOM 0 H ILE A 45 21.141 -3.027 -0.641 1.00 0.00 H new ATOM 0 HA ILE A 45 21.507 -1.133 1.561 1.00 0.00 H new ATOM 0 HB ILE A 45 21.292 -2.918 2.864 1.00 0.00 H new ATOM 0 HG12 ILE A 45 24.094 -3.533 1.863 1.00 0.00 H new ATOM 0 HG13 ILE A 45 23.731 -2.108 2.816 1.00 0.00 H new ATOM 0 HG21 ILE A 45 21.871 -5.207 2.262 1.00 0.00 H new ATOM 0 HG22 ILE A 45 20.743 -4.474 1.098 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.468 -4.629 0.689 1.00 0.00 H new ATOM 0 HD11 ILE A 45 24.688 -3.861 4.190 1.00 0.00 H new ATOM 0 HD12 ILE A 45 23.012 -3.525 4.685 1.00 0.00 H new ATOM 0 HD13 ILE A 45 23.381 -4.972 3.717 1.00 0.00 H new ATOM 727 N VAL A 46 23.784 -0.613 0.770 1.00 0.00 N ATOM 728 CA VAL A 46 24.996 -0.134 0.183 1.00 0.00 C ATOM 729 C VAL A 46 26.180 -0.331 1.134 1.00 0.00 C ATOM 730 O VAL A 46 26.128 0.058 2.316 1.00 0.00 O ATOM 731 CB VAL A 46 24.871 1.368 -0.213 1.00 0.00 C ATOM 732 CG1 VAL A 46 26.174 1.902 -0.758 1.00 0.00 C ATOM 733 CG2 VAL A 46 23.773 1.572 -1.238 1.00 0.00 C ATOM 0 H VAL A 46 23.452 -0.058 1.559 1.00 0.00 H new ATOM 0 HA VAL A 46 25.176 -0.715 -0.721 1.00 0.00 H new ATOM 0 HB VAL A 46 24.618 1.918 0.693 1.00 0.00 H new ATOM 0 HG11 VAL A 46 26.054 2.952 -1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 46 26.952 1.807 -0.000 1.00 0.00 H new ATOM 0 HG13 VAL A 46 26.459 1.333 -1.643 1.00 0.00 H new ATOM 0 HG21 VAL A 46 23.708 2.629 -1.496 1.00 0.00 H new ATOM 0 HG22 VAL A 46 23.999 0.993 -2.133 1.00 0.00 H new ATOM 0 HG23 VAL A 46 22.821 1.241 -0.823 1.00 0.00 H new ATOM 743 N LYS A 47 27.200 -0.967 0.629 1.00 0.00 N ATOM 744 CA LYS A 47 28.460 -1.134 1.316 1.00 0.00 C ATOM 745 C LYS A 47 29.586 -0.892 0.341 1.00 0.00 C ATOM 746 O LYS A 47 29.454 -1.175 -0.843 1.00 0.00 O ATOM 747 CB LYS A 47 28.650 -2.515 1.966 1.00 0.00 C ATOM 748 CG LYS A 47 27.803 -2.793 3.196 1.00 0.00 C ATOM 749 CD LYS A 47 28.461 -3.887 4.021 1.00 0.00 C ATOM 750 CE LYS A 47 27.703 -4.197 5.291 1.00 0.00 C ATOM 751 NZ LYS A 47 28.490 -5.073 6.199 1.00 0.00 N ATOM 0 H LYS A 47 27.182 -1.397 -0.296 1.00 0.00 H new ATOM 0 HA LYS A 47 28.463 -0.409 2.130 1.00 0.00 H new ATOM 0 HB2 LYS A 47 28.433 -3.279 1.219 1.00 0.00 H new ATOM 0 HB3 LYS A 47 29.699 -2.625 2.239 1.00 0.00 H new ATOM 0 HG2 LYS A 47 27.697 -1.886 3.791 1.00 0.00 H new ATOM 0 HG3 LYS A 47 26.800 -3.099 2.899 1.00 0.00 H new ATOM 0 HD2 LYS A 47 28.539 -4.793 3.419 1.00 0.00 H new ATOM 0 HD3 LYS A 47 29.477 -3.584 4.274 1.00 0.00 H new ATOM 0 HE2 LYS A 47 27.457 -3.268 5.804 1.00 0.00 H new ATOM 0 HE3 LYS A 47 26.760 -4.683 5.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 27.908 -5.885 6.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 29.338 -5.414 5.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 28.774 -4.534 7.041 1.00 0.00 H new ATOM 764 N ALA A 48 30.679 -0.369 0.819 1.00 0.00 N ATOM 765 CA ALA A 48 31.792 -0.076 -0.028 1.00 0.00 C ATOM 766 C ALA A 48 33.072 -0.115 0.752 1.00 0.00 C ATOM 767 O ALA A 48 33.060 -0.199 1.985 1.00 0.00 O ATOM 768 CB ALA A 48 31.623 1.283 -0.695 1.00 0.00 C ATOM 0 H ALA A 48 30.820 -0.136 1.802 1.00 0.00 H new ATOM 0 HA ALA A 48 31.834 -0.838 -0.806 1.00 0.00 H new ATOM 0 HB1 ALA A 48 32.482 1.484 -1.335 1.00 0.00 H new ATOM 0 HB2 ALA A 48 30.715 1.282 -1.297 1.00 0.00 H new ATOM 0 HB3 ALA A 48 31.551 2.057 0.069 1.00 0.00 H new ATOM 774 N ASP A 49 34.165 -0.047 0.027 1.00 0.00 N ATOM 775 CA ASP A 49 35.508 -0.065 0.587 1.00 0.00 C ATOM 776 C ASP A 49 35.814 1.257 1.277 1.00 0.00 C ATOM 777 O ASP A 49 36.561 1.315 2.252 1.00 0.00 O ATOM 778 CB ASP A 49 36.505 -0.336 -0.541 1.00 0.00 C ATOM 779 CG ASP A 49 37.923 -0.451 -0.065 1.00 0.00 C ATOM 780 OD1 ASP A 49 38.305 -1.516 0.444 1.00 0.00 O ATOM 781 OD2 ASP A 49 38.702 0.503 -0.236 1.00 0.00 O ATOM 0 H ASP A 49 34.151 0.024 -0.990 1.00 0.00 H new ATOM 0 HA ASP A 49 35.587 -0.853 1.336 1.00 0.00 H new ATOM 0 HB2 ASP A 49 36.224 -1.258 -1.051 1.00 0.00 H new ATOM 0 HB3 ASP A 49 36.440 0.467 -1.275 1.00 0.00 H new ATOM 786 N VAL A 50 35.205 2.298 0.774 1.00 0.00 N ATOM 787 CA VAL A 50 35.327 3.626 1.299 1.00 0.00 C ATOM 788 C VAL A 50 33.966 4.027 1.864 1.00 0.00 C ATOM 789 O VAL A 50 32.940 3.823 1.191 1.00 0.00 O ATOM 790 CB VAL A 50 35.738 4.598 0.167 1.00 0.00 C ATOM 791 CG1 VAL A 50 35.739 6.023 0.643 1.00 0.00 C ATOM 792 CG2 VAL A 50 37.101 4.224 -0.387 1.00 0.00 C ATOM 0 H VAL A 50 34.591 2.240 -0.039 1.00 0.00 H new ATOM 0 HA VAL A 50 36.088 3.665 2.078 1.00 0.00 H new ATOM 0 HB VAL A 50 35.000 4.512 -0.630 1.00 0.00 H new ATOM 0 HG11 VAL A 50 36.032 6.680 -0.176 1.00 0.00 H new ATOM 0 HG12 VAL A 50 34.740 6.293 0.985 1.00 0.00 H new ATOM 0 HG13 VAL A 50 36.446 6.131 1.466 1.00 0.00 H new ATOM 0 HG21 VAL A 50 37.374 4.918 -1.182 1.00 0.00 H new ATOM 0 HG22 VAL A 50 37.844 4.274 0.409 1.00 0.00 H new ATOM 0 HG23 VAL A 50 37.066 3.211 -0.787 1.00 0.00 H new ATOM 802 N GLN A 51 33.940 4.604 3.070 1.00 0.00 N ATOM 803 CA GLN A 51 32.675 4.928 3.729 1.00 0.00 C ATOM 804 C GLN A 51 31.857 5.888 2.918 1.00 0.00 C ATOM 805 O GLN A 51 30.732 5.614 2.602 1.00 0.00 O ATOM 806 CB GLN A 51 32.830 5.499 5.133 1.00 0.00 C ATOM 807 CG GLN A 51 31.493 5.525 5.880 1.00 0.00 C ATOM 808 CD GLN A 51 31.492 6.377 7.119 1.00 0.00 C ATOM 809 OE1 GLN A 51 31.844 5.926 8.204 1.00 0.00 O ATOM 810 NE2 GLN A 51 31.026 7.585 6.981 1.00 0.00 N ATOM 0 H GLN A 51 34.773 4.853 3.604 1.00 0.00 H new ATOM 0 HA GLN A 51 32.166 3.968 3.814 1.00 0.00 H new ATOM 0 HB2 GLN A 51 33.549 4.901 5.693 1.00 0.00 H new ATOM 0 HB3 GLN A 51 33.234 6.510 5.073 1.00 0.00 H new ATOM 0 HG2 GLN A 51 30.719 5.888 5.203 1.00 0.00 H new ATOM 0 HG3 GLN A 51 31.224 4.505 6.155 1.00 0.00 H new ATOM 0 HE21 GLN A 51 30.744 7.921 6.060 1.00 0.00 H new ATOM 0 HE22 GLN A 51 30.943 8.195 7.794 1.00 0.00 H new ATOM 819 N GLY A 52 32.426 6.980 2.526 1.00 0.00 N ATOM 820 CA GLY A 52 31.630 7.949 1.815 1.00 0.00 C ATOM 821 C GLY A 52 31.317 7.569 0.387 1.00 0.00 C ATOM 822 O GLY A 52 30.691 8.331 -0.330 1.00 0.00 O ATOM 0 H GLY A 52 33.404 7.227 2.674 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.694 8.097 2.353 1.00 0.00 H new ATOM 0 HA3 GLY A 52 32.154 8.905 1.818 1.00 0.00 H new ATOM 826 N SER A 53 31.701 6.378 -0.018 1.00 0.00 N ATOM 827 CA SER A 53 31.337 5.894 -1.311 1.00 0.00 C ATOM 828 C SER A 53 30.001 5.203 -1.162 1.00 0.00 C ATOM 829 O SER A 53 29.238 5.059 -2.121 1.00 0.00 O ATOM 830 CB SER A 53 32.404 4.960 -1.853 1.00 0.00 C ATOM 831 OG SER A 53 33.649 5.643 -1.925 1.00 0.00 O ATOM 0 H SER A 53 32.265 5.735 0.537 1.00 0.00 H new ATOM 0 HA SER A 53 31.255 6.709 -2.030 1.00 0.00 H new ATOM 0 HB2 SER A 53 32.495 4.085 -1.210 1.00 0.00 H new ATOM 0 HB3 SER A 53 32.118 4.601 -2.841 1.00 0.00 H new ATOM 0 HG SER A 53 34.290 5.102 -2.432 1.00 0.00 H new ATOM 837 N VAL A 54 29.706 4.814 0.085 1.00 0.00 N ATOM 838 CA VAL A 54 28.433 4.263 0.403 1.00 0.00 C ATOM 839 C VAL A 54 27.453 5.410 0.462 1.00 0.00 C ATOM 840 O VAL A 54 26.412 5.390 -0.166 1.00 0.00 O ATOM 841 CB VAL A 54 28.408 3.443 1.760 1.00 0.00 C ATOM 842 CG1 VAL A 54 29.555 2.494 1.887 1.00 0.00 C ATOM 843 CG2 VAL A 54 28.209 4.246 3.049 1.00 0.00 C ATOM 0 H VAL A 54 30.349 4.881 0.874 1.00 0.00 H new ATOM 0 HA VAL A 54 28.169 3.539 -0.368 1.00 0.00 H new ATOM 0 HB VAL A 54 27.486 2.870 1.660 1.00 0.00 H new ATOM 0 HG11 VAL A 54 29.484 1.962 2.836 1.00 0.00 H new ATOM 0 HG12 VAL A 54 29.527 1.778 1.066 1.00 0.00 H new ATOM 0 HG13 VAL A 54 30.492 3.049 1.852 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.211 3.569 3.903 1.00 0.00 H new ATOM 0 HG22 VAL A 54 29.018 4.968 3.156 1.00 0.00 H new ATOM 0 HG23 VAL A 54 27.256 4.773 3.006 1.00 0.00 H new ATOM 853 N GLU A 55 27.879 6.459 1.141 1.00 0.00 N ATOM 854 CA GLU A 55 27.067 7.634 1.385 1.00 0.00 C ATOM 855 C GLU A 55 26.773 8.394 0.115 1.00 0.00 C ATOM 856 O GLU A 55 25.680 8.913 -0.050 1.00 0.00 O ATOM 857 CB GLU A 55 27.717 8.524 2.426 1.00 0.00 C ATOM 858 CG GLU A 55 27.971 7.803 3.731 1.00 0.00 C ATOM 859 CD GLU A 55 28.522 8.695 4.782 1.00 0.00 C ATOM 860 OE1 GLU A 55 29.742 8.957 4.782 1.00 0.00 O ATOM 861 OE2 GLU A 55 27.745 9.165 5.636 1.00 0.00 O ATOM 0 H GLU A 55 28.814 6.518 1.544 1.00 0.00 H new ATOM 0 HA GLU A 55 26.107 7.296 1.776 1.00 0.00 H new ATOM 0 HB2 GLU A 55 28.661 8.904 2.035 1.00 0.00 H new ATOM 0 HB3 GLU A 55 27.078 9.387 2.611 1.00 0.00 H new ATOM 0 HG2 GLU A 55 27.039 7.364 4.086 1.00 0.00 H new ATOM 0 HG3 GLU A 55 28.665 6.981 3.558 1.00 0.00 H new ATOM 868 N ALA A 56 27.735 8.424 -0.800 1.00 0.00 N ATOM 869 CA ALA A 56 27.539 9.071 -2.095 1.00 0.00 C ATOM 870 C ALA A 56 26.429 8.368 -2.875 1.00 0.00 C ATOM 871 O ALA A 56 25.668 8.998 -3.618 1.00 0.00 O ATOM 872 CB ALA A 56 28.829 9.063 -2.898 1.00 0.00 C ATOM 0 H ALA A 56 28.658 8.009 -0.671 1.00 0.00 H new ATOM 0 HA ALA A 56 27.246 10.106 -1.921 1.00 0.00 H new ATOM 0 HB1 ALA A 56 28.662 9.549 -3.859 1.00 0.00 H new ATOM 0 HB2 ALA A 56 29.603 9.600 -2.349 1.00 0.00 H new ATOM 0 HB3 ALA A 56 29.149 8.034 -3.063 1.00 0.00 H new ATOM 878 N LEU A 57 26.328 7.064 -2.693 1.00 0.00 N ATOM 879 CA LEU A 57 25.312 6.298 -3.354 1.00 0.00 C ATOM 880 C LEU A 57 23.990 6.461 -2.603 1.00 0.00 C ATOM 881 O LEU A 57 22.958 6.759 -3.201 1.00 0.00 O ATOM 882 CB LEU A 57 25.750 4.826 -3.469 1.00 0.00 C ATOM 883 CG LEU A 57 24.813 3.882 -4.229 1.00 0.00 C ATOM 884 CD1 LEU A 57 24.502 4.436 -5.617 1.00 0.00 C ATOM 885 CD2 LEU A 57 25.458 2.512 -4.373 1.00 0.00 C ATOM 0 H LEU A 57 26.944 6.520 -2.089 1.00 0.00 H new ATOM 0 HA LEU A 57 25.163 6.663 -4.370 1.00 0.00 H new ATOM 0 HB2 LEU A 57 26.726 4.799 -3.954 1.00 0.00 H new ATOM 0 HB3 LEU A 57 25.884 4.432 -2.462 1.00 0.00 H new ATOM 0 HG LEU A 57 23.886 3.795 -3.663 1.00 0.00 H new ATOM 0 HD11 LEU A 57 23.835 3.751 -6.141 1.00 0.00 H new ATOM 0 HD12 LEU A 57 24.020 5.409 -5.521 1.00 0.00 H new ATOM 0 HD13 LEU A 57 25.428 4.544 -6.182 1.00 0.00 H new ATOM 0 HD21 LEU A 57 24.784 1.848 -4.915 1.00 0.00 H new ATOM 0 HD22 LEU A 57 26.394 2.607 -4.923 1.00 0.00 H new ATOM 0 HD23 LEU A 57 25.658 2.098 -3.385 1.00 0.00 H new ATOM 897 N VAL A 58 24.063 6.343 -1.287 1.00 0.00 N ATOM 898 CA VAL A 58 22.915 6.485 -0.385 1.00 0.00 C ATOM 899 C VAL A 58 22.209 7.815 -0.559 1.00 0.00 C ATOM 900 O VAL A 58 20.994 7.856 -0.651 1.00 0.00 O ATOM 901 CB VAL A 58 23.351 6.310 1.095 1.00 0.00 C ATOM 902 CG1 VAL A 58 22.251 6.699 2.086 1.00 0.00 C ATOM 903 CG2 VAL A 58 23.760 4.887 1.322 1.00 0.00 C ATOM 0 H VAL A 58 24.936 6.142 -0.799 1.00 0.00 H new ATOM 0 HA VAL A 58 22.210 5.697 -0.649 1.00 0.00 H new ATOM 0 HB VAL A 58 24.190 6.983 1.273 1.00 0.00 H new ATOM 0 HG11 VAL A 58 22.612 6.556 3.105 1.00 0.00 H new ATOM 0 HG12 VAL A 58 21.982 7.745 1.939 1.00 0.00 H new ATOM 0 HG13 VAL A 58 21.374 6.073 1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 58 24.067 4.758 2.360 1.00 0.00 H new ATOM 0 HG22 VAL A 58 22.919 4.228 1.108 1.00 0.00 H new ATOM 0 HG23 VAL A 58 24.592 4.638 0.664 1.00 0.00 H new ATOM 913 N ALA A 59 22.970 8.881 -0.658 1.00 0.00 N ATOM 914 CA ALA A 59 22.414 10.225 -0.777 1.00 0.00 C ATOM 915 C ALA A 59 21.589 10.415 -2.040 1.00 0.00 C ATOM 916 O ALA A 59 20.718 11.281 -2.092 1.00 0.00 O ATOM 917 CB ALA A 59 23.498 11.280 -0.663 1.00 0.00 C ATOM 0 H ALA A 59 23.990 8.850 -0.659 1.00 0.00 H new ATOM 0 HA ALA A 59 21.727 10.350 0.060 1.00 0.00 H new ATOM 0 HB1 ALA A 59 23.053 12.271 -0.756 1.00 0.00 H new ATOM 0 HB2 ALA A 59 23.990 11.193 0.305 1.00 0.00 H new ATOM 0 HB3 ALA A 59 24.231 11.136 -1.457 1.00 0.00 H new ATOM 923 N ALA A 60 21.804 9.584 -3.023 1.00 0.00 N ATOM 924 CA ALA A 60 21.063 9.702 -4.250 1.00 0.00 C ATOM 925 C ALA A 60 19.940 8.723 -4.206 1.00 0.00 C ATOM 926 O ALA A 60 18.881 8.957 -4.724 1.00 0.00 O ATOM 927 CB ALA A 60 21.949 9.418 -5.436 1.00 0.00 C ATOM 0 H ALA A 60 22.482 8.822 -3.000 1.00 0.00 H new ATOM 0 HA ALA A 60 20.680 10.717 -4.355 1.00 0.00 H new ATOM 0 HB1 ALA A 60 21.369 9.513 -6.354 1.00 0.00 H new ATOM 0 HB2 ALA A 60 22.774 10.130 -5.453 1.00 0.00 H new ATOM 0 HB3 ALA A 60 22.345 8.405 -5.360 1.00 0.00 H new ATOM 933 N LEU A 61 20.183 7.679 -3.495 1.00 0.00 N ATOM 934 CA LEU A 61 19.292 6.568 -3.370 1.00 0.00 C ATOM 935 C LEU A 61 18.124 6.925 -2.439 1.00 0.00 C ATOM 936 O LEU A 61 17.005 6.501 -2.636 1.00 0.00 O ATOM 937 CB LEU A 61 20.109 5.395 -2.829 1.00 0.00 C ATOM 938 CG LEU A 61 20.275 4.152 -3.713 1.00 0.00 C ATOM 939 CD1 LEU A 61 18.953 3.454 -3.921 1.00 0.00 C ATOM 940 CD2 LEU A 61 20.895 4.517 -5.054 1.00 0.00 C ATOM 0 H LEU A 61 21.044 7.566 -2.960 1.00 0.00 H new ATOM 0 HA LEU A 61 18.854 6.301 -4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 61 21.105 5.767 -2.589 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.653 5.077 -1.891 1.00 0.00 H new ATOM 0 HG LEU A 61 20.947 3.467 -3.197 1.00 0.00 H new ATOM 0 HD11 LEU A 61 19.100 2.577 -4.551 1.00 0.00 H new ATOM 0 HD12 LEU A 61 18.549 3.145 -2.957 1.00 0.00 H new ATOM 0 HD13 LEU A 61 18.254 4.136 -4.406 1.00 0.00 H new ATOM 0 HD21 LEU A 61 21.002 3.619 -5.662 1.00 0.00 H new ATOM 0 HD22 LEU A 61 20.252 5.230 -5.570 1.00 0.00 H new ATOM 0 HD23 LEU A 61 21.876 4.964 -4.892 1.00 0.00 H new ATOM 952 N GLN A 62 18.397 7.738 -1.442 1.00 0.00 N ATOM 953 CA GLN A 62 17.368 8.187 -0.515 1.00 0.00 C ATOM 954 C GLN A 62 16.435 9.195 -1.175 1.00 0.00 C ATOM 955 O GLN A 62 15.309 9.395 -0.731 1.00 0.00 O ATOM 956 CB GLN A 62 17.988 8.763 0.760 1.00 0.00 C ATOM 957 CG GLN A 62 18.935 9.923 0.529 1.00 0.00 C ATOM 958 CD GLN A 62 19.600 10.437 1.799 1.00 0.00 C ATOM 959 OE1 GLN A 62 19.941 11.613 1.890 1.00 0.00 O ATOM 960 NE2 GLN A 62 19.779 9.583 2.785 1.00 0.00 N ATOM 0 H GLN A 62 19.328 8.107 -1.248 1.00 0.00 H new ATOM 0 HA GLN A 62 16.773 7.318 -0.233 1.00 0.00 H new ATOM 0 HB2 GLN A 62 17.187 9.091 1.423 1.00 0.00 H new ATOM 0 HB3 GLN A 62 18.526 7.969 1.278 1.00 0.00 H new ATOM 0 HG2 GLN A 62 19.708 9.614 -0.175 1.00 0.00 H new ATOM 0 HG3 GLN A 62 18.386 10.740 0.061 1.00 0.00 H new ATOM 0 HE21 GLN A 62 19.485 8.612 2.679 1.00 0.00 H new ATOM 0 HE22 GLN A 62 20.212 9.892 3.655 1.00 0.00 H new ATOM 969 N LYS A 63 16.900 9.811 -2.244 1.00 0.00 N ATOM 970 CA LYS A 63 16.093 10.774 -2.962 1.00 0.00 C ATOM 971 C LYS A 63 15.397 10.153 -4.179 1.00 0.00 C ATOM 972 O LYS A 63 14.762 10.865 -4.967 1.00 0.00 O ATOM 973 CB LYS A 63 16.873 12.057 -3.344 1.00 0.00 C ATOM 974 CG LYS A 63 18.123 11.856 -4.177 1.00 0.00 C ATOM 975 CD LYS A 63 18.667 13.179 -4.733 1.00 0.00 C ATOM 976 CE LYS A 63 18.947 14.218 -3.641 1.00 0.00 C ATOM 977 NZ LYS A 63 20.039 13.819 -2.725 1.00 0.00 N ATOM 0 H LYS A 63 17.831 9.661 -2.633 1.00 0.00 H new ATOM 0 HA LYS A 63 15.315 11.085 -2.265 1.00 0.00 H new ATOM 0 HB2 LYS A 63 16.200 12.718 -3.890 1.00 0.00 H new ATOM 0 HB3 LYS A 63 17.152 12.574 -2.426 1.00 0.00 H new ATOM 0 HG2 LYS A 63 18.890 11.377 -3.569 1.00 0.00 H new ATOM 0 HG3 LYS A 63 17.902 11.180 -5.003 1.00 0.00 H new ATOM 0 HD2 LYS A 63 19.586 12.984 -5.285 1.00 0.00 H new ATOM 0 HD3 LYS A 63 17.950 13.591 -5.443 1.00 0.00 H new ATOM 0 HE2 LYS A 63 19.203 15.168 -4.109 1.00 0.00 H new ATOM 0 HE3 LYS A 63 18.038 14.382 -3.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.774 14.052 -1.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 20.203 12.795 -2.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 20.909 14.329 -2.979 1.00 0.00 H new ATOM 1098 N VAL A 71 13.438 3.526 -5.539 1.00 0.00 N ATOM 1099 CA VAL A 71 14.565 2.697 -5.234 1.00 0.00 C ATOM 1100 C VAL A 71 15.241 3.343 -4.067 1.00 0.00 C ATOM 1101 O VAL A 71 15.790 4.410 -4.202 1.00 0.00 O ATOM 1102 CB VAL A 71 15.568 2.608 -6.418 1.00 0.00 C ATOM 1103 CG1 VAL A 71 16.657 1.583 -6.130 1.00 0.00 C ATOM 1104 CG2 VAL A 71 14.859 2.300 -7.734 1.00 0.00 C ATOM 0 HA VAL A 71 14.234 1.679 -5.027 1.00 0.00 H new ATOM 0 HB VAL A 71 16.040 3.585 -6.524 1.00 0.00 H new ATOM 0 HG11 VAL A 71 17.347 1.539 -6.973 1.00 0.00 H new ATOM 0 HG12 VAL A 71 17.201 1.873 -5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 71 16.204 0.603 -5.980 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.593 2.246 -8.538 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.339 1.346 -7.652 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.139 3.088 -7.953 1.00 0.00 H new ATOM 1114 N LYS A 72 15.189 2.732 -2.936 1.00 0.00 N ATOM 1115 CA LYS A 72 15.708 3.360 -1.766 1.00 0.00 C ATOM 1116 C LYS A 72 16.490 2.372 -0.936 1.00 0.00 C ATOM 1117 O LYS A 72 16.311 1.150 -1.035 1.00 0.00 O ATOM 1118 CB LYS A 72 14.558 4.034 -0.971 1.00 0.00 C ATOM 1119 CG LYS A 72 14.991 4.851 0.247 1.00 0.00 C ATOM 1120 CD LYS A 72 13.827 5.632 0.831 1.00 0.00 C ATOM 1121 CE LYS A 72 14.259 6.466 2.029 1.00 0.00 C ATOM 1122 NZ LYS A 72 13.146 7.283 2.557 1.00 0.00 N ATOM 0 H LYS A 72 14.795 1.802 -2.793 1.00 0.00 H new ATOM 0 HA LYS A 72 16.406 4.146 -2.053 1.00 0.00 H new ATOM 0 HB2 LYS A 72 14.006 4.687 -1.647 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.866 3.260 -0.640 1.00 0.00 H new ATOM 0 HG2 LYS A 72 15.402 4.186 1.006 1.00 0.00 H new ATOM 0 HG3 LYS A 72 15.787 5.539 -0.038 1.00 0.00 H new ATOM 0 HD2 LYS A 72 13.405 6.284 0.066 1.00 0.00 H new ATOM 0 HD3 LYS A 72 13.039 4.942 1.132 1.00 0.00 H new ATOM 0 HE2 LYS A 72 14.632 5.809 2.814 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.084 7.118 1.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 13.478 7.837 3.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 12.806 7.928 1.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 12.369 6.660 2.856 1.00 0.00 H new ATOM 1135 N ILE A 73 17.353 2.897 -0.138 1.00 0.00 N ATOM 1136 CA ILE A 73 18.198 2.122 0.692 1.00 0.00 C ATOM 1137 C ILE A 73 17.601 1.937 2.068 1.00 0.00 C ATOM 1138 O ILE A 73 16.710 2.684 2.474 1.00 0.00 O ATOM 1139 CB ILE A 73 19.632 2.723 0.779 1.00 0.00 C ATOM 1140 CG1 ILE A 73 19.640 4.276 0.850 1.00 0.00 C ATOM 1141 CG2 ILE A 73 20.457 2.254 -0.391 1.00 0.00 C ATOM 1142 CD1 ILE A 73 18.974 4.899 2.063 1.00 0.00 C ATOM 0 H ILE A 73 17.492 3.903 -0.044 1.00 0.00 H new ATOM 0 HA ILE A 73 18.284 1.138 0.231 1.00 0.00 H new ATOM 0 HB ILE A 73 20.068 2.365 1.712 1.00 0.00 H new ATOM 0 HG12 ILE A 73 20.676 4.614 0.817 1.00 0.00 H new ATOM 0 HG13 ILE A 73 19.150 4.662 -0.044 1.00 0.00 H new ATOM 0 HG21 ILE A 73 21.459 2.678 -0.323 1.00 0.00 H new ATOM 0 HG22 ILE A 73 20.522 1.166 -0.377 1.00 0.00 H new ATOM 0 HG23 ILE A 73 19.988 2.578 -1.320 1.00 0.00 H new ATOM 0 HD11 ILE A 73 19.044 5.985 1.999 1.00 0.00 H new ATOM 0 HD12 ILE A 73 17.925 4.604 2.094 1.00 0.00 H new ATOM 0 HD13 ILE A 73 19.474 4.556 2.969 1.00 0.00 H new ATOM 1154 N ILE A 74 18.039 0.916 2.745 1.00 0.00 N ATOM 1155 CA ILE A 74 17.584 0.655 4.092 1.00 0.00 C ATOM 1156 C ILE A 74 18.763 0.673 5.068 1.00 0.00 C ATOM 1157 O ILE A 74 18.628 1.095 6.219 1.00 0.00 O ATOM 1158 CB ILE A 74 16.857 -0.723 4.173 1.00 0.00 C ATOM 1159 CG1 ILE A 74 15.660 -0.745 3.212 1.00 0.00 C ATOM 1160 CG2 ILE A 74 16.398 -1.029 5.607 1.00 0.00 C ATOM 1161 CD1 ILE A 74 14.956 -2.075 3.140 1.00 0.00 C ATOM 0 H ILE A 74 18.716 0.242 2.389 1.00 0.00 H new ATOM 0 HA ILE A 74 16.880 1.440 4.367 1.00 0.00 H new ATOM 0 HB ILE A 74 17.565 -1.497 3.878 1.00 0.00 H new ATOM 0 HG12 ILE A 74 14.945 0.017 3.522 1.00 0.00 H new ATOM 0 HG13 ILE A 74 16.003 -0.473 2.214 1.00 0.00 H new ATOM 0 HG21 ILE A 74 15.895 -1.996 5.630 1.00 0.00 H new ATOM 0 HG22 ILE A 74 17.264 -1.055 6.268 1.00 0.00 H new ATOM 0 HG23 ILE A 74 15.709 -0.254 5.942 1.00 0.00 H new ATOM 0 HD11 ILE A 74 14.123 -2.008 2.440 1.00 0.00 H new ATOM 0 HD12 ILE A 74 15.655 -2.839 2.800 1.00 0.00 H new ATOM 0 HD13 ILE A 74 14.580 -2.342 4.128 1.00 0.00 H new ATOM 1173 N HIS A 75 19.924 0.282 4.584 1.00 0.00 N ATOM 1174 CA HIS A 75 21.083 0.075 5.435 1.00 0.00 C ATOM 1175 C HIS A 75 22.366 0.333 4.610 1.00 0.00 C ATOM 1176 O HIS A 75 22.472 -0.123 3.475 1.00 0.00 O ATOM 1177 CB HIS A 75 20.949 -1.378 5.985 1.00 0.00 C ATOM 1178 CG HIS A 75 22.008 -1.929 6.902 1.00 0.00 C ATOM 1179 ND1 HIS A 75 22.724 -1.196 7.821 1.00 0.00 N ATOM 1180 CD2 HIS A 75 22.455 -3.195 7.013 1.00 0.00 C ATOM 1181 CE1 HIS A 75 23.579 -1.995 8.443 1.00 0.00 C ATOM 1182 NE2 HIS A 75 23.431 -3.216 7.963 1.00 0.00 N ATOM 0 H HIS A 75 20.093 0.099 3.595 1.00 0.00 H new ATOM 0 HA HIS A 75 21.143 0.761 6.280 1.00 0.00 H new ATOM 0 HB2 HIS A 75 19.997 -1.440 6.512 1.00 0.00 H new ATOM 0 HB3 HIS A 75 20.882 -2.046 5.126 1.00 0.00 H new ATOM 0 HD2 HIS A 75 22.101 -4.045 6.448 1.00 0.00 H new ATOM 0 HE1 HIS A 75 24.278 -1.698 9.211 1.00 0.00 H new ATOM 0 HE2 HIS A 75 23.959 -4.038 8.255 1.00 0.00 H new ATOM 1190 N ALA A 76 23.280 1.116 5.164 1.00 0.00 N ATOM 1191 CA ALA A 76 24.516 1.544 4.492 1.00 0.00 C ATOM 1192 C ALA A 76 25.667 1.499 5.476 1.00 0.00 C ATOM 1193 O ALA A 76 25.565 2.064 6.569 1.00 0.00 O ATOM 1194 CB ALA A 76 24.340 2.970 4.038 1.00 0.00 C ATOM 0 H ALA A 76 23.189 1.483 6.111 1.00 0.00 H new ATOM 0 HA ALA A 76 24.723 0.887 3.647 1.00 0.00 H new ATOM 0 HB1 ALA A 76 25.247 3.307 3.536 1.00 0.00 H new ATOM 0 HB2 ALA A 76 23.499 3.031 3.347 1.00 0.00 H new ATOM 0 HB3 ALA A 76 24.146 3.606 4.902 1.00 0.00 H new ATOM 1200 N ALA A 77 26.756 0.864 5.111 1.00 0.00 N ATOM 1201 CA ALA A 77 27.881 0.747 6.022 1.00 0.00 C ATOM 1202 C ALA A 77 29.185 0.577 5.274 1.00 0.00 C ATOM 1203 O ALA A 77 29.202 0.137 4.125 1.00 0.00 O ATOM 1204 CB ALA A 77 27.673 -0.428 6.971 1.00 0.00 C ATOM 0 H ALA A 77 26.891 0.423 4.201 1.00 0.00 H new ATOM 0 HA ALA A 77 27.938 1.671 6.597 1.00 0.00 H new ATOM 0 HB1 ALA A 77 28.524 -0.504 7.648 1.00 0.00 H new ATOM 0 HB2 ALA A 77 26.762 -0.272 7.549 1.00 0.00 H new ATOM 0 HB3 ALA A 77 27.584 -1.349 6.395 1.00 0.00 H new ATOM 1210 N VAL A 78 30.270 0.913 5.930 1.00 0.00 N ATOM 1211 CA VAL A 78 31.581 0.733 5.368 1.00 0.00 C ATOM 1212 C VAL A 78 32.132 -0.600 5.841 1.00 0.00 C ATOM 1213 O VAL A 78 32.639 -0.742 6.958 1.00 0.00 O ATOM 1214 CB VAL A 78 32.558 1.921 5.696 1.00 0.00 C ATOM 1215 CG1 VAL A 78 32.664 2.214 7.200 1.00 0.00 C ATOM 1216 CG2 VAL A 78 33.941 1.682 5.085 1.00 0.00 C ATOM 0 H VAL A 78 30.266 1.318 6.866 1.00 0.00 H new ATOM 0 HA VAL A 78 31.495 0.730 4.281 1.00 0.00 H new ATOM 0 HB VAL A 78 32.125 2.810 5.238 1.00 0.00 H new ATOM 0 HG11 VAL A 78 33.353 3.043 7.361 1.00 0.00 H new ATOM 0 HG12 VAL A 78 31.681 2.478 7.590 1.00 0.00 H new ATOM 0 HG13 VAL A 78 33.034 1.329 7.718 1.00 0.00 H new ATOM 0 HG21 VAL A 78 34.596 2.519 5.328 1.00 0.00 H new ATOM 0 HG22 VAL A 78 34.363 0.762 5.489 1.00 0.00 H new ATOM 0 HG23 VAL A 78 33.850 1.595 4.002 1.00 0.00 H new ATOM 1226 N GLY A 79 31.950 -1.585 5.039 1.00 0.00 N ATOM 1227 CA GLY A 79 32.365 -2.873 5.400 1.00 0.00 C ATOM 1228 C GLY A 79 32.154 -3.820 4.295 1.00 0.00 C ATOM 1229 O GLY A 79 31.609 -3.455 3.246 1.00 0.00 O ATOM 0 H GLY A 79 31.511 -1.513 4.121 1.00 0.00 H new ATOM 0 HA2 GLY A 79 33.420 -2.856 5.674 1.00 0.00 H new ATOM 0 HA3 GLY A 79 31.813 -3.205 6.279 1.00 0.00 H new ATOM 1233 N ALA A 80 32.581 -5.010 4.507 1.00 0.00 N ATOM 1234 CA ALA A 80 32.443 -6.056 3.556 1.00 0.00 C ATOM 1235 C ALA A 80 31.100 -6.746 3.743 1.00 0.00 C ATOM 1236 O ALA A 80 30.359 -6.436 4.691 1.00 0.00 O ATOM 1237 CB ALA A 80 33.604 -7.016 3.722 1.00 0.00 C ATOM 0 H ALA A 80 33.049 -5.294 5.368 1.00 0.00 H new ATOM 0 HA ALA A 80 32.465 -5.661 2.540 1.00 0.00 H new ATOM 0 HB1 ALA A 80 33.513 -7.826 2.998 1.00 0.00 H new ATOM 0 HB2 ALA A 80 34.542 -6.485 3.556 1.00 0.00 H new ATOM 0 HB3 ALA A 80 33.594 -7.428 4.731 1.00 0.00 H new ATOM 1243 N ILE A 81 30.763 -7.646 2.849 1.00 0.00 N ATOM 1244 CA ILE A 81 29.518 -8.366 2.967 1.00 0.00 C ATOM 1245 C ILE A 81 29.663 -9.400 4.047 1.00 0.00 C ATOM 1246 O ILE A 81 30.391 -10.389 3.903 1.00 0.00 O ATOM 1247 CB ILE A 81 28.996 -9.015 1.629 1.00 0.00 C ATOM 1248 CG1 ILE A 81 28.419 -7.975 0.656 1.00 0.00 C ATOM 1249 CG2 ILE A 81 27.935 -10.060 1.907 1.00 0.00 C ATOM 1250 CD1 ILE A 81 29.397 -7.004 0.080 1.00 0.00 C ATOM 0 H ILE A 81 31.329 -7.895 2.038 1.00 0.00 H new ATOM 0 HA ILE A 81 28.753 -7.634 3.225 1.00 0.00 H new ATOM 0 HB ILE A 81 29.865 -9.480 1.163 1.00 0.00 H new ATOM 0 HG12 ILE A 81 27.936 -8.504 -0.165 1.00 0.00 H new ATOM 0 HG13 ILE A 81 27.642 -7.413 1.174 1.00 0.00 H new ATOM 0 HG21 ILE A 81 27.593 -10.491 0.966 1.00 0.00 H new ATOM 0 HG22 ILE A 81 28.354 -10.846 2.535 1.00 0.00 H new ATOM 0 HG23 ILE A 81 27.093 -9.596 2.421 1.00 0.00 H new ATOM 0 HD11 ILE A 81 28.878 -6.320 -0.591 1.00 0.00 H new ATOM 0 HD12 ILE A 81 29.865 -6.438 0.885 1.00 0.00 H new ATOM 0 HD13 ILE A 81 30.163 -7.545 -0.475 1.00 0.00 H new ATOM 1262 N THR A 82 29.032 -9.146 5.125 1.00 0.00 N ATOM 1263 CA THR A 82 29.090 -9.988 6.243 1.00 0.00 C ATOM 1264 C THR A 82 27.791 -10.763 6.379 1.00 0.00 C ATOM 1265 O THR A 82 26.738 -10.293 5.928 1.00 0.00 O ATOM 1266 CB THR A 82 29.403 -9.141 7.474 1.00 0.00 C ATOM 1267 OG1 THR A 82 28.910 -7.805 7.225 1.00 0.00 O ATOM 1268 CG2 THR A 82 30.903 -9.091 7.734 1.00 0.00 C ATOM 0 H THR A 82 28.445 -8.322 5.254 1.00 0.00 H new ATOM 0 HA THR A 82 29.883 -10.728 6.131 1.00 0.00 H new ATOM 0 HB THR A 82 28.926 -9.578 8.352 1.00 0.00 H new ATOM 0 HG1 THR A 82 27.994 -7.726 7.563 1.00 0.00 H new ATOM 0 HG21 THR A 82 31.099 -8.482 8.616 1.00 0.00 H new ATOM 0 HG22 THR A 82 31.277 -10.101 7.900 1.00 0.00 H new ATOM 0 HG23 THR A 82 31.407 -8.655 6.872 1.00 0.00 H new ATOM 1276 N GLU A 83 27.879 -11.937 6.983 1.00 0.00 N ATOM 1277 CA GLU A 83 26.768 -12.876 7.094 1.00 0.00 C ATOM 1278 C GLU A 83 25.523 -12.241 7.718 1.00 0.00 C ATOM 1279 O GLU A 83 24.428 -12.356 7.180 1.00 0.00 O ATOM 1280 CB GLU A 83 27.234 -14.122 7.861 1.00 0.00 C ATOM 1281 CG GLU A 83 26.187 -15.194 8.050 1.00 0.00 C ATOM 1282 CD GLU A 83 26.765 -16.473 8.605 1.00 0.00 C ATOM 1283 OE1 GLU A 83 27.079 -16.530 9.802 1.00 0.00 O ATOM 1284 OE2 GLU A 83 26.933 -17.448 7.847 1.00 0.00 O ATOM 0 H GLU A 83 28.738 -12.273 7.418 1.00 0.00 H new ATOM 0 HA GLU A 83 26.464 -13.174 6.091 1.00 0.00 H new ATOM 0 HB2 GLU A 83 28.083 -14.556 7.334 1.00 0.00 H new ATOM 0 HB3 GLU A 83 27.593 -13.811 8.842 1.00 0.00 H new ATOM 0 HG2 GLU A 83 25.413 -14.827 8.723 1.00 0.00 H new ATOM 0 HG3 GLU A 83 25.706 -15.401 7.094 1.00 0.00 H new ATOM 1291 N SER A 84 25.715 -11.513 8.779 1.00 0.00 N ATOM 1292 CA SER A 84 24.630 -10.883 9.503 1.00 0.00 C ATOM 1293 C SER A 84 23.972 -9.721 8.719 1.00 0.00 C ATOM 1294 O SER A 84 22.838 -9.342 8.989 1.00 0.00 O ATOM 1295 CB SER A 84 25.166 -10.447 10.849 1.00 0.00 C ATOM 1296 OG SER A 84 26.483 -9.943 10.687 1.00 0.00 O ATOM 0 H SER A 84 26.637 -11.333 9.177 1.00 0.00 H new ATOM 0 HA SER A 84 23.822 -11.602 9.642 1.00 0.00 H new ATOM 0 HB2 SER A 84 24.521 -9.681 11.280 1.00 0.00 H new ATOM 0 HB3 SER A 84 25.169 -11.288 11.542 1.00 0.00 H new ATOM 0 HG SER A 84 26.833 -9.658 11.557 1.00 0.00 H new ATOM 1302 N ASP A 85 24.663 -9.194 7.722 1.00 0.00 N ATOM 1303 CA ASP A 85 24.091 -8.121 6.903 1.00 0.00 C ATOM 1304 C ASP A 85 23.184 -8.697 5.859 1.00 0.00 C ATOM 1305 O ASP A 85 22.239 -8.052 5.396 1.00 0.00 O ATOM 1306 CB ASP A 85 25.165 -7.245 6.262 1.00 0.00 C ATOM 1307 CG ASP A 85 25.708 -6.204 7.203 1.00 0.00 C ATOM 1308 OD1 ASP A 85 25.113 -5.121 7.324 1.00 0.00 O ATOM 1309 OD2 ASP A 85 26.782 -6.431 7.791 1.00 0.00 O ATOM 0 H ASP A 85 25.605 -9.481 7.457 1.00 0.00 H new ATOM 0 HA ASP A 85 23.512 -7.477 7.565 1.00 0.00 H new ATOM 0 HB2 ASP A 85 25.983 -7.877 5.915 1.00 0.00 H new ATOM 0 HB3 ASP A 85 24.748 -6.752 5.384 1.00 0.00 H new ATOM 1314 N ILE A 86 23.448 -9.933 5.515 1.00 0.00 N ATOM 1315 CA ILE A 86 22.654 -10.647 4.548 1.00 0.00 C ATOM 1316 C ILE A 86 21.293 -11.021 5.137 1.00 0.00 C ATOM 1317 O ILE A 86 20.308 -11.205 4.405 1.00 0.00 O ATOM 1318 CB ILE A 86 23.417 -11.867 4.051 1.00 0.00 C ATOM 1319 CG1 ILE A 86 24.709 -11.389 3.406 1.00 0.00 C ATOM 1320 CG2 ILE A 86 22.595 -12.687 3.077 1.00 0.00 C ATOM 1321 CD1 ILE A 86 25.505 -12.472 2.785 1.00 0.00 C ATOM 0 H ILE A 86 24.223 -10.474 5.900 1.00 0.00 H new ATOM 0 HA ILE A 86 22.463 -10.001 3.691 1.00 0.00 H new ATOM 0 HB ILE A 86 23.638 -12.521 4.894 1.00 0.00 H new ATOM 0 HG12 ILE A 86 24.471 -10.645 2.646 1.00 0.00 H new ATOM 0 HG13 ILE A 86 25.318 -10.891 4.160 1.00 0.00 H new ATOM 0 HG21 ILE A 86 23.175 -13.548 2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 86 21.684 -13.030 3.568 1.00 0.00 H new ATOM 0 HG23 ILE A 86 22.333 -12.073 2.215 1.00 0.00 H new ATOM 0 HD11 ILE A 86 26.411 -12.053 2.347 1.00 0.00 H new ATOM 0 HD12 ILE A 86 25.776 -13.206 3.544 1.00 0.00 H new ATOM 0 HD13 ILE A 86 24.916 -12.956 2.006 1.00 0.00 H new ATOM 1333 N SER A 87 21.222 -11.036 6.456 1.00 0.00 N ATOM 1334 CA SER A 87 19.982 -11.285 7.154 1.00 0.00 C ATOM 1335 C SER A 87 18.935 -10.208 6.777 1.00 0.00 C ATOM 1336 O SER A 87 17.730 -10.467 6.805 1.00 0.00 O ATOM 1337 CB SER A 87 20.239 -11.287 8.657 1.00 0.00 C ATOM 1338 OG SER A 87 21.288 -12.186 8.986 1.00 0.00 O ATOM 0 H SER A 87 22.022 -10.876 7.068 1.00 0.00 H new ATOM 0 HA SER A 87 19.588 -12.259 6.863 1.00 0.00 H new ATOM 0 HB2 SER A 87 20.498 -10.281 8.988 1.00 0.00 H new ATOM 0 HB3 SER A 87 19.330 -11.572 9.186 1.00 0.00 H new ATOM 0 HG SER A 87 21.439 -12.172 9.954 1.00 0.00 H new ATOM 1344 N LEU A 88 19.420 -9.020 6.398 1.00 0.00 N ATOM 1345 CA LEU A 88 18.573 -7.930 5.960 1.00 0.00 C ATOM 1346 C LEU A 88 18.153 -8.147 4.511 1.00 0.00 C ATOM 1347 O LEU A 88 17.000 -7.880 4.141 1.00 0.00 O ATOM 1348 CB LEU A 88 19.316 -6.568 6.145 1.00 0.00 C ATOM 1349 CG LEU A 88 18.626 -5.262 5.638 1.00 0.00 C ATOM 1350 CD1 LEU A 88 18.778 -5.064 4.132 1.00 0.00 C ATOM 1351 CD2 LEU A 88 17.158 -5.280 5.997 1.00 0.00 C ATOM 0 H LEU A 88 20.415 -8.798 6.390 1.00 0.00 H new ATOM 0 HA LEU A 88 17.670 -7.903 6.570 1.00 0.00 H new ATOM 0 HB2 LEU A 88 19.518 -6.444 7.209 1.00 0.00 H new ATOM 0 HB3 LEU A 88 20.281 -6.647 5.645 1.00 0.00 H new ATOM 0 HG LEU A 88 19.125 -4.428 6.131 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.280 -4.141 3.834 1.00 0.00 H new ATOM 0 HD12 LEU A 88 19.836 -5.003 3.878 1.00 0.00 H new ATOM 0 HD13 LEU A 88 18.327 -5.906 3.607 1.00 0.00 H new ATOM 0 HD21 LEU A 88 16.685 -4.365 5.640 1.00 0.00 H new ATOM 0 HD22 LEU A 88 16.680 -6.142 5.531 1.00 0.00 H new ATOM 0 HD23 LEU A 88 17.049 -5.346 7.080 1.00 0.00 H new ATOM 1363 N ALA A 89 19.079 -8.647 3.720 1.00 0.00 N ATOM 1364 CA ALA A 89 18.880 -8.849 2.296 1.00 0.00 C ATOM 1365 C ALA A 89 17.629 -9.685 2.022 1.00 0.00 C ATOM 1366 O ALA A 89 16.701 -9.216 1.395 1.00 0.00 O ATOM 1367 CB ALA A 89 20.118 -9.476 1.686 1.00 0.00 C ATOM 0 H ALA A 89 20.002 -8.929 4.049 1.00 0.00 H new ATOM 0 HA ALA A 89 18.720 -7.879 1.825 1.00 0.00 H new ATOM 0 HB1 ALA A 89 19.962 -9.625 0.618 1.00 0.00 H new ATOM 0 HB2 ALA A 89 20.973 -8.817 1.839 1.00 0.00 H new ATOM 0 HB3 ALA A 89 20.311 -10.438 2.162 1.00 0.00 H new ATOM 1373 N THR A 90 17.582 -10.880 2.551 1.00 0.00 N ATOM 1374 CA THR A 90 16.399 -11.731 2.383 1.00 0.00 C ATOM 1375 C THR A 90 15.177 -11.161 3.144 1.00 0.00 C ATOM 1376 O THR A 90 14.035 -11.334 2.706 1.00 0.00 O ATOM 1377 CB THR A 90 16.691 -13.201 2.815 1.00 0.00 C ATOM 1378 OG1 THR A 90 15.488 -13.998 2.862 1.00 0.00 O ATOM 1379 CG2 THR A 90 17.395 -13.241 4.141 1.00 0.00 C ATOM 0 H THR A 90 18.334 -11.297 3.100 1.00 0.00 H new ATOM 0 HA THR A 90 16.153 -11.738 1.321 1.00 0.00 H new ATOM 0 HB THR A 90 17.345 -13.633 2.058 1.00 0.00 H new ATOM 0 HG1 THR A 90 15.712 -14.912 3.135 1.00 0.00 H new ATOM 0 HG21 THR A 90 17.587 -14.277 4.420 1.00 0.00 H new ATOM 0 HG22 THR A 90 18.340 -12.704 4.067 1.00 0.00 H new ATOM 0 HG23 THR A 90 16.769 -12.771 4.900 1.00 0.00 H new ATOM 1387 N ALA A 91 15.436 -10.423 4.236 1.00 0.00 N ATOM 1388 CA ALA A 91 14.371 -9.866 5.074 1.00 0.00 C ATOM 1389 C ALA A 91 13.510 -8.898 4.303 1.00 0.00 C ATOM 1390 O ALA A 91 12.347 -9.164 4.028 1.00 0.00 O ATOM 1391 CB ALA A 91 14.940 -9.180 6.306 1.00 0.00 C ATOM 0 H ALA A 91 16.378 -10.200 4.557 1.00 0.00 H new ATOM 0 HA ALA A 91 13.750 -10.702 5.394 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.125 -8.777 6.907 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.504 -9.902 6.897 1.00 0.00 H new ATOM 0 HB3 ALA A 91 15.599 -8.368 5.999 1.00 0.00 H new ATOM 1397 N SER A 92 14.096 -7.811 3.902 1.00 0.00 N ATOM 1398 CA SER A 92 13.374 -6.776 3.221 1.00 0.00 C ATOM 1399 C SER A 92 13.454 -6.930 1.702 1.00 0.00 C ATOM 1400 O SER A 92 13.013 -6.048 0.963 1.00 0.00 O ATOM 1401 CB SER A 92 13.867 -5.422 3.698 1.00 0.00 C ATOM 1402 OG SER A 92 13.717 -5.322 5.114 1.00 0.00 O ATOM 0 H SER A 92 15.088 -7.615 4.037 1.00 0.00 H new ATOM 0 HA SER A 92 12.315 -6.860 3.467 1.00 0.00 H new ATOM 0 HB2 SER A 92 14.914 -5.289 3.424 1.00 0.00 H new ATOM 0 HB3 SER A 92 13.306 -4.627 3.207 1.00 0.00 H new ATOM 0 HG SER A 92 14.038 -4.447 5.416 1.00 0.00 H new ATOM 1408 N ASN A 93 14.058 -8.044 1.255 1.00 0.00 N ATOM 1409 CA ASN A 93 14.173 -8.392 -0.189 1.00 0.00 C ATOM 1410 C ASN A 93 15.096 -7.417 -0.882 1.00 0.00 C ATOM 1411 O ASN A 93 14.959 -7.122 -2.083 1.00 0.00 O ATOM 1412 CB ASN A 93 12.792 -8.456 -0.912 1.00 0.00 C ATOM 1413 CG ASN A 93 11.909 -9.658 -0.534 1.00 0.00 C ATOM 1414 OD1 ASN A 93 11.155 -10.161 -1.366 1.00 0.00 O ATOM 1415 ND2 ASN A 93 11.968 -10.116 0.697 1.00 0.00 N ATOM 0 H ASN A 93 14.482 -8.733 1.876 1.00 0.00 H new ATOM 0 HA ASN A 93 14.594 -9.396 -0.246 1.00 0.00 H new ATOM 0 HB2 ASN A 93 12.243 -7.540 -0.694 1.00 0.00 H new ATOM 0 HB3 ASN A 93 12.964 -8.476 -1.988 1.00 0.00 H new ATOM 0 HD21 ASN A 93 11.382 -10.902 0.977 1.00 0.00 H new ATOM 0 HD22 ASN A 93 12.600 -9.685 1.372 1.00 0.00 H new ATOM 1422 N ALA A 94 16.071 -6.972 -0.129 1.00 0.00 N ATOM 1423 CA ALA A 94 17.039 -6.027 -0.582 1.00 0.00 C ATOM 1424 C ALA A 94 18.261 -6.761 -1.087 1.00 0.00 C ATOM 1425 O ALA A 94 18.540 -7.875 -0.669 1.00 0.00 O ATOM 1426 CB ALA A 94 17.422 -5.099 0.562 1.00 0.00 C ATOM 0 H ALA A 94 16.210 -7.269 0.837 1.00 0.00 H new ATOM 0 HA ALA A 94 16.618 -5.433 -1.393 1.00 0.00 H new ATOM 0 HB1 ALA A 94 18.162 -4.378 0.214 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.536 -4.569 0.913 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.843 -5.684 1.380 1.00 0.00 H new ATOM 1432 N ILE A 95 18.962 -6.157 -1.981 1.00 0.00 N ATOM 1433 CA ILE A 95 20.166 -6.744 -2.519 1.00 0.00 C ATOM 1434 C ILE A 95 21.356 -5.981 -1.967 1.00 0.00 C ATOM 1435 O ILE A 95 21.292 -4.749 -1.803 1.00 0.00 O ATOM 1436 CB ILE A 95 20.161 -6.701 -4.086 1.00 0.00 C ATOM 1437 CG1 ILE A 95 19.018 -7.561 -4.661 1.00 0.00 C ATOM 1438 CG2 ILE A 95 21.508 -7.110 -4.686 1.00 0.00 C ATOM 1439 CD1 ILE A 95 19.092 -9.038 -4.298 1.00 0.00 C ATOM 0 H ILE A 95 18.728 -5.243 -2.368 1.00 0.00 H new ATOM 0 HA ILE A 95 20.225 -7.792 -2.225 1.00 0.00 H new ATOM 0 HB ILE A 95 19.988 -5.663 -4.371 1.00 0.00 H new ATOM 0 HG12 ILE A 95 18.067 -7.161 -4.309 1.00 0.00 H new ATOM 0 HG13 ILE A 95 19.021 -7.467 -5.747 1.00 0.00 H new ATOM 0 HG21 ILE A 95 21.451 -7.063 -5.774 1.00 0.00 H new ATOM 0 HG22 ILE A 95 22.284 -6.431 -4.334 1.00 0.00 H new ATOM 0 HG23 ILE A 95 21.749 -8.128 -4.379 1.00 0.00 H new ATOM 0 HD11 ILE A 95 18.249 -9.565 -4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 95 20.024 -9.459 -4.675 1.00 0.00 H new ATOM 0 HD13 ILE A 95 19.056 -9.149 -3.214 1.00 0.00 H new ATOM 1451 N VAL A 96 22.413 -6.698 -1.652 1.00 0.00 N ATOM 1452 CA VAL A 96 23.598 -6.090 -1.108 1.00 0.00 C ATOM 1453 C VAL A 96 24.565 -5.813 -2.232 1.00 0.00 C ATOM 1454 O VAL A 96 24.957 -6.733 -2.969 1.00 0.00 O ATOM 1455 CB VAL A 96 24.302 -6.984 -0.049 1.00 0.00 C ATOM 1456 CG1 VAL A 96 25.355 -6.194 0.710 1.00 0.00 C ATOM 1457 CG2 VAL A 96 23.309 -7.632 0.908 1.00 0.00 C ATOM 0 H VAL A 96 22.471 -7.710 -1.766 1.00 0.00 H new ATOM 0 HA VAL A 96 23.293 -5.170 -0.609 1.00 0.00 H new ATOM 0 HB VAL A 96 24.798 -7.792 -0.587 1.00 0.00 H new ATOM 0 HG11 VAL A 96 25.834 -6.840 1.446 1.00 0.00 H new ATOM 0 HG12 VAL A 96 26.104 -5.821 0.011 1.00 0.00 H new ATOM 0 HG13 VAL A 96 24.883 -5.353 1.218 1.00 0.00 H new ATOM 0 HG21 VAL A 96 23.847 -8.247 1.629 1.00 0.00 H new ATOM 0 HG22 VAL A 96 22.753 -6.857 1.435 1.00 0.00 H new ATOM 0 HG23 VAL A 96 22.616 -8.257 0.345 1.00 0.00 H new ATOM 1467 N ILE A 97 24.904 -4.568 -2.392 1.00 0.00 N ATOM 1468 CA ILE A 97 25.846 -4.161 -3.391 1.00 0.00 C ATOM 1469 C ILE A 97 27.094 -3.648 -2.694 1.00 0.00 C ATOM 1470 O ILE A 97 27.022 -2.720 -1.878 1.00 0.00 O ATOM 1471 CB ILE A 97 25.258 -3.053 -4.323 1.00 0.00 C ATOM 1472 CG1 ILE A 97 23.961 -3.555 -4.993 1.00 0.00 C ATOM 1473 CG2 ILE A 97 26.285 -2.642 -5.384 1.00 0.00 C ATOM 1474 CD1 ILE A 97 23.271 -2.529 -5.879 1.00 0.00 C ATOM 0 H ILE A 97 24.532 -3.802 -1.830 1.00 0.00 H new ATOM 0 HA ILE A 97 26.085 -5.018 -4.021 1.00 0.00 H new ATOM 0 HB ILE A 97 25.022 -2.178 -3.718 1.00 0.00 H new ATOM 0 HG12 ILE A 97 24.194 -4.436 -5.592 1.00 0.00 H new ATOM 0 HG13 ILE A 97 23.265 -3.872 -4.216 1.00 0.00 H new ATOM 0 HG21 ILE A 97 25.858 -1.870 -6.024 1.00 0.00 H new ATOM 0 HG22 ILE A 97 27.179 -2.255 -4.895 1.00 0.00 H new ATOM 0 HG23 ILE A 97 26.550 -3.509 -5.989 1.00 0.00 H new ATOM 0 HD11 ILE A 97 22.370 -2.966 -6.308 1.00 0.00 H new ATOM 0 HD12 ILE A 97 23.003 -1.656 -5.284 1.00 0.00 H new ATOM 0 HD13 ILE A 97 23.946 -2.228 -6.681 1.00 0.00 H new ATOM 1486 N GLY A 98 28.203 -4.280 -2.970 1.00 0.00 N ATOM 1487 CA GLY A 98 29.454 -3.884 -2.408 1.00 0.00 C ATOM 1488 C GLY A 98 30.535 -3.985 -3.444 1.00 0.00 C ATOM 1489 O GLY A 98 30.313 -4.552 -4.514 1.00 0.00 O ATOM 0 H GLY A 98 28.258 -5.085 -3.593 1.00 0.00 H new ATOM 0 HA2 GLY A 98 29.388 -2.861 -2.037 1.00 0.00 H new ATOM 0 HA3 GLY A 98 29.696 -4.518 -1.555 1.00 0.00 H new ATOM 1493 N PHE A 99 31.709 -3.490 -3.147 1.00 0.00 N ATOM 1494 CA PHE A 99 32.786 -3.519 -4.113 1.00 0.00 C ATOM 1495 C PHE A 99 34.118 -3.394 -3.446 1.00 0.00 C ATOM 1496 O PHE A 99 34.263 -2.629 -2.497 1.00 0.00 O ATOM 1497 CB PHE A 99 32.602 -2.481 -5.262 1.00 0.00 C ATOM 1498 CG PHE A 99 32.324 -1.051 -4.852 1.00 0.00 C ATOM 1499 CD1 PHE A 99 33.356 -0.193 -4.520 1.00 0.00 C ATOM 1500 CD2 PHE A 99 31.024 -0.566 -4.833 1.00 0.00 C ATOM 1501 CE1 PHE A 99 33.102 1.120 -4.174 1.00 0.00 C ATOM 1502 CE2 PHE A 99 30.762 0.746 -4.493 1.00 0.00 C ATOM 1503 CZ PHE A 99 31.803 1.589 -4.163 1.00 0.00 C ATOM 0 H PHE A 99 31.947 -3.064 -2.251 1.00 0.00 H new ATOM 0 HA PHE A 99 32.749 -4.497 -4.592 1.00 0.00 H new ATOM 0 HB2 PHE A 99 33.503 -2.489 -5.875 1.00 0.00 H new ATOM 0 HB3 PHE A 99 31.782 -2.818 -5.896 1.00 0.00 H new ATOM 0 HD1 PHE A 99 34.374 -0.554 -4.531 1.00 0.00 H new ATOM 0 HD2 PHE A 99 30.206 -1.224 -5.088 1.00 0.00 H new ATOM 0 HE1 PHE A 99 33.917 1.778 -3.913 1.00 0.00 H new ATOM 0 HE2 PHE A 99 29.746 1.111 -4.485 1.00 0.00 H new ATOM 0 HZ PHE A 99 31.602 2.616 -3.896 1.00 0.00 H new ATOM 1513 N ASN A 100 35.059 -4.253 -3.874 1.00 0.00 N ATOM 1514 CA ASN A 100 36.464 -4.302 -3.391 1.00 0.00 C ATOM 1515 C ASN A 100 36.587 -4.875 -1.988 1.00 0.00 C ATOM 1516 O ASN A 100 37.612 -5.430 -1.608 1.00 0.00 O ATOM 1517 CB ASN A 100 37.187 -2.952 -3.540 1.00 0.00 C ATOM 1518 CG ASN A 100 37.375 -2.550 -5.000 1.00 0.00 C ATOM 1519 OD1 ASN A 100 36.563 -2.882 -5.872 1.00 0.00 O ATOM 1520 ND2 ASN A 100 38.424 -1.844 -5.278 1.00 0.00 N ATOM 0 H ASN A 100 34.865 -4.956 -4.587 1.00 0.00 H new ATOM 0 HA ASN A 100 36.981 -5.001 -4.048 1.00 0.00 H new ATOM 0 HB2 ASN A 100 36.617 -2.179 -3.024 1.00 0.00 H new ATOM 0 HB3 ASN A 100 38.161 -3.009 -3.054 1.00 0.00 H new ATOM 0 HD21 ASN A 100 38.599 -1.546 -6.238 1.00 0.00 H new ATOM 0 HD22 ASN A 100 39.076 -1.586 -4.537 1.00 0.00 H new ATOM 1527 N VAL A 101 35.522 -4.788 -1.261 1.00 0.00 N ATOM 1528 CA VAL A 101 35.415 -5.321 0.068 1.00 0.00 C ATOM 1529 C VAL A 101 35.210 -6.812 0.039 1.00 0.00 C ATOM 1530 O VAL A 101 35.934 -7.541 0.701 1.00 0.00 O ATOM 1531 CB VAL A 101 34.304 -4.635 0.903 1.00 0.00 C ATOM 1532 CG1 VAL A 101 34.795 -3.332 1.454 1.00 0.00 C ATOM 1533 CG2 VAL A 101 33.022 -4.407 0.090 1.00 0.00 C ATOM 0 H VAL A 101 34.670 -4.329 -1.582 1.00 0.00 H new ATOM 0 HA VAL A 101 36.362 -5.106 0.562 1.00 0.00 H new ATOM 0 HB VAL A 101 34.059 -5.310 1.723 1.00 0.00 H new ATOM 0 HG11 VAL A 101 34.003 -2.862 2.038 1.00 0.00 H new ATOM 0 HG12 VAL A 101 35.660 -3.510 2.093 1.00 0.00 H new ATOM 0 HG13 VAL A 101 35.079 -2.674 0.633 1.00 0.00 H new ATOM 0 HG21 VAL A 101 32.274 -3.924 0.718 1.00 0.00 H new ATOM 0 HG22 VAL A 101 33.243 -3.770 -0.766 1.00 0.00 H new ATOM 0 HG23 VAL A 101 32.638 -5.365 -0.260 1.00 0.00 H new ATOM 1543 N ARG A 102 34.232 -7.256 -0.782 1.00 0.00 N ATOM 1544 CA ARG A 102 33.913 -8.678 -0.979 1.00 0.00 C ATOM 1545 C ARG A 102 33.207 -9.270 0.253 1.00 0.00 C ATOM 1546 O ARG A 102 33.018 -8.563 1.226 1.00 0.00 O ATOM 1547 CB ARG A 102 35.174 -9.414 -1.436 1.00 0.00 C ATOM 1548 CG ARG A 102 35.599 -8.920 -2.804 1.00 0.00 C ATOM 1549 CD ARG A 102 37.070 -9.060 -3.051 1.00 0.00 C ATOM 1550 NE ARG A 102 37.874 -8.173 -2.189 1.00 0.00 N ATOM 1551 CZ ARG A 102 39.146 -8.374 -1.841 1.00 0.00 C ATOM 1552 NH1 ARG A 102 39.750 -9.518 -2.132 1.00 0.00 N ATOM 1553 NH2 ARG A 102 39.803 -7.421 -1.194 1.00 0.00 N ATOM 0 H ARG A 102 33.641 -6.629 -1.328 1.00 0.00 H new ATOM 0 HA ARG A 102 33.182 -8.805 -1.778 1.00 0.00 H new ATOM 0 HB2 ARG A 102 35.978 -9.255 -0.717 1.00 0.00 H new ATOM 0 HB3 ARG A 102 34.986 -10.487 -1.471 1.00 0.00 H new ATOM 0 HG2 ARG A 102 35.054 -9.474 -3.569 1.00 0.00 H new ATOM 0 HG3 ARG A 102 35.318 -7.872 -2.908 1.00 0.00 H new ATOM 0 HD2 ARG A 102 37.367 -10.095 -2.880 1.00 0.00 H new ATOM 0 HD3 ARG A 102 37.283 -8.836 -4.096 1.00 0.00 H new ATOM 0 HE ARG A 102 37.419 -7.335 -1.828 1.00 0.00 H new ATOM 0 HH11 ARG A 102 39.242 -10.252 -2.625 1.00 0.00 H new ATOM 0 HH12 ARG A 102 40.723 -9.664 -1.863 1.00 0.00 H new ATOM 0 HH21 ARG A 102 39.335 -6.543 -0.967 1.00 0.00 H new ATOM 0 HH22 ARG A 102 40.776 -7.566 -0.924 1.00 0.00 H new ATOM 1566 N PRO A 103 32.670 -10.498 0.206 1.00 0.00 N ATOM 1567 CA PRO A 103 32.034 -11.075 1.366 1.00 0.00 C ATOM 1568 C PRO A 103 32.957 -11.894 2.214 1.00 0.00 C ATOM 1569 O PRO A 103 34.095 -12.196 1.840 1.00 0.00 O ATOM 1570 CB PRO A 103 30.976 -12.019 0.792 1.00 0.00 C ATOM 1571 CG PRO A 103 31.229 -12.084 -0.689 1.00 0.00 C ATOM 1572 CD PRO A 103 32.548 -11.389 -0.950 1.00 0.00 C ATOM 0 HA PRO A 103 31.653 -10.278 2.005 1.00 0.00 H new ATOM 0 HB2 PRO A 103 31.051 -13.008 1.243 1.00 0.00 H new ATOM 0 HB3 PRO A 103 29.972 -11.650 0.999 1.00 0.00 H new ATOM 0 HG2 PRO A 103 31.266 -13.119 -1.028 1.00 0.00 H new ATOM 0 HG3 PRO A 103 30.423 -11.598 -1.238 1.00 0.00 H new ATOM 0 HD2 PRO A 103 33.375 -12.096 -1.006 1.00 0.00 H new ATOM 0 HD3 PRO A 103 32.537 -10.836 -1.889 1.00 0.00 H new ATOM 1580 N ASP A 104 32.451 -12.228 3.352 1.00 0.00 N ATOM 1581 CA ASP A 104 33.050 -13.187 4.225 1.00 0.00 C ATOM 1582 C ASP A 104 32.678 -14.552 3.645 1.00 0.00 C ATOM 1583 O ASP A 104 31.611 -14.679 3.008 1.00 0.00 O ATOM 1584 CB ASP A 104 32.430 -13.024 5.631 1.00 0.00 C ATOM 1585 CG ASP A 104 33.005 -13.956 6.678 1.00 0.00 C ATOM 1586 OD1 ASP A 104 32.788 -15.169 6.594 1.00 0.00 O ATOM 1587 OD2 ASP A 104 33.635 -13.479 7.639 1.00 0.00 O ATOM 0 H ASP A 104 31.584 -11.831 3.714 1.00 0.00 H new ATOM 0 HA ASP A 104 34.131 -13.069 4.307 1.00 0.00 H new ATOM 0 HB2 ASP A 104 32.572 -11.995 5.961 1.00 0.00 H new ATOM 0 HB3 ASP A 104 31.355 -13.192 5.563 1.00 0.00 H new ATOM 1592 N ALA A 105 33.516 -15.547 3.822 1.00 0.00 N ATOM 1593 CA ALA A 105 33.241 -16.893 3.320 1.00 0.00 C ATOM 1594 C ALA A 105 31.947 -17.472 3.903 1.00 0.00 C ATOM 1595 O ALA A 105 31.303 -18.300 3.286 1.00 0.00 O ATOM 1596 CB ALA A 105 34.411 -17.824 3.575 1.00 0.00 C ATOM 0 H ALA A 105 34.405 -15.458 4.314 1.00 0.00 H new ATOM 0 HA ALA A 105 33.102 -16.807 2.242 1.00 0.00 H new ATOM 0 HB1 ALA A 105 34.177 -18.817 3.191 1.00 0.00 H new ATOM 0 HB2 ALA A 105 35.298 -17.440 3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 105 34.600 -17.885 4.647 1.00 0.00 H new ATOM 1602 N ASN A 106 31.560 -17.027 5.078 1.00 0.00 N ATOM 1603 CA ASN A 106 30.309 -17.470 5.686 1.00 0.00 C ATOM 1604 C ASN A 106 29.147 -16.713 5.081 1.00 0.00 C ATOM 1605 O ASN A 106 28.067 -17.259 4.921 1.00 0.00 O ATOM 1606 CB ASN A 106 30.316 -17.275 7.214 1.00 0.00 C ATOM 1607 CG ASN A 106 31.352 -18.115 7.955 1.00 0.00 C ATOM 1608 OD1 ASN A 106 32.501 -17.714 8.131 1.00 0.00 O ATOM 1609 ND2 ASN A 106 30.956 -19.260 8.427 1.00 0.00 N ATOM 0 H ASN A 106 32.089 -16.358 5.638 1.00 0.00 H new ATOM 0 HA ASN A 106 30.202 -18.536 5.485 1.00 0.00 H new ATOM 0 HB2 ASN A 106 30.497 -16.223 7.432 1.00 0.00 H new ATOM 0 HB3 ASN A 106 29.327 -17.516 7.603 1.00 0.00 H new ATOM 0 HD21 ASN A 106 31.603 -19.845 8.955 1.00 0.00 H new ATOM 0 HD22 ASN A 106 29.998 -19.573 8.269 1.00 0.00 H new ATOM 1616 N ALA A 107 29.397 -15.487 4.676 1.00 0.00 N ATOM 1617 CA ALA A 107 28.365 -14.644 4.106 1.00 0.00 C ATOM 1618 C ALA A 107 27.991 -15.101 2.710 1.00 0.00 C ATOM 1619 O ALA A 107 26.824 -15.177 2.373 1.00 0.00 O ATOM 1620 CB ALA A 107 28.802 -13.199 4.083 1.00 0.00 C ATOM 0 H ALA A 107 30.315 -15.047 4.731 1.00 0.00 H new ATOM 0 HA ALA A 107 27.483 -14.730 4.741 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.011 -12.586 3.651 1.00 0.00 H new ATOM 0 HB2 ALA A 107 29.006 -12.864 5.100 1.00 0.00 H new ATOM 0 HB3 ALA A 107 29.706 -13.102 3.481 1.00 0.00 H new ATOM 1626 N LYS A 108 28.985 -15.434 1.915 1.00 0.00 N ATOM 1627 CA LYS A 108 28.761 -15.894 0.540 1.00 0.00 C ATOM 1628 C LYS A 108 27.882 -17.182 0.525 1.00 0.00 C ATOM 1629 O LYS A 108 27.196 -17.459 -0.451 1.00 0.00 O ATOM 1630 CB LYS A 108 30.117 -16.136 -0.144 1.00 0.00 C ATOM 1631 CG LYS A 108 30.888 -17.349 0.364 1.00 0.00 C ATOM 1632 CD LYS A 108 32.265 -17.454 -0.274 1.00 0.00 C ATOM 1633 CE LYS A 108 32.178 -17.596 -1.781 1.00 0.00 C ATOM 1634 NZ LYS A 108 33.503 -17.708 -2.398 1.00 0.00 N ATOM 0 H LYS A 108 29.967 -15.398 2.190 1.00 0.00 H new ATOM 0 HA LYS A 108 28.221 -15.126 -0.014 1.00 0.00 H new ATOM 0 HB2 LYS A 108 29.951 -16.252 -1.215 1.00 0.00 H new ATOM 0 HB3 LYS A 108 30.737 -15.249 -0.012 1.00 0.00 H new ATOM 0 HG2 LYS A 108 30.994 -17.285 1.447 1.00 0.00 H new ATOM 0 HG3 LYS A 108 30.320 -18.255 0.153 1.00 0.00 H new ATOM 0 HD2 LYS A 108 32.849 -16.568 -0.026 1.00 0.00 H new ATOM 0 HD3 LYS A 108 32.794 -18.312 0.142 1.00 0.00 H new ATOM 0 HE2 LYS A 108 31.587 -18.478 -2.029 1.00 0.00 H new ATOM 0 HE3 LYS A 108 31.656 -16.735 -2.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 33.399 -17.803 -3.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 34.059 -16.856 -2.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 33.992 -18.545 -2.021 1.00 0.00 H new ATOM 1647 N ARG A 109 27.915 -17.923 1.643 1.00 0.00 N ATOM 1648 CA ARG A 109 27.155 -19.067 1.890 1.00 0.00 C ATOM 1649 C ARG A 109 25.743 -18.631 2.252 1.00 0.00 C ATOM 1650 O ARG A 109 24.759 -19.013 1.612 1.00 0.00 O ATOM 1651 CB ARG A 109 27.718 -19.663 3.143 1.00 0.00 C ATOM 1652 CG ARG A 109 29.035 -20.358 3.154 1.00 0.00 C ATOM 1653 CD ARG A 109 29.174 -21.091 4.494 1.00 0.00 C ATOM 1654 NE ARG A 109 28.670 -20.271 5.633 1.00 0.00 N ATOM 1655 CZ ARG A 109 28.535 -20.680 6.905 1.00 0.00 C ATOM 1656 NH1 ARG A 109 28.926 -21.894 7.283 1.00 0.00 N ATOM 1657 NH2 ARG A 109 28.012 -19.856 7.813 1.00 0.00 N ATOM 0 H ARG A 109 28.527 -17.688 2.424 1.00 0.00 H new ATOM 0 HA ARG A 109 27.162 -19.742 1.034 1.00 0.00 H new ATOM 0 HB2 ARG A 109 27.779 -18.859 3.876 1.00 0.00 H new ATOM 0 HB3 ARG A 109 26.981 -20.376 3.513 1.00 0.00 H new ATOM 0 HG2 ARG A 109 29.100 -21.063 2.325 1.00 0.00 H new ATOM 0 HG3 ARG A 109 29.845 -19.640 3.027 1.00 0.00 H new ATOM 0 HD2 ARG A 109 28.624 -22.031 4.452 1.00 0.00 H new ATOM 0 HD3 ARG A 109 30.221 -21.342 4.663 1.00 0.00 H new ATOM 0 HE ARG A 109 28.403 -19.309 5.426 1.00 0.00 H new ATOM 0 HH11 ARG A 109 29.337 -22.533 6.602 1.00 0.00 H new ATOM 0 HH12 ARG A 109 28.815 -22.186 8.254 1.00 0.00 H new ATOM 0 HH21 ARG A 109 27.716 -18.919 7.541 1.00 0.00 H new ATOM 0 HH22 ARG A 109 27.908 -20.163 8.780 1.00 0.00 H new ATOM 1670 N ALA A 110 25.692 -17.788 3.308 1.00 0.00 N ATOM 1671 CA ALA A 110 24.477 -17.270 3.903 1.00 0.00 C ATOM 1672 C ALA A 110 23.566 -16.715 2.874 1.00 0.00 C ATOM 1673 O ALA A 110 22.425 -17.092 2.831 1.00 0.00 O ATOM 1674 CB ALA A 110 24.810 -16.221 4.936 1.00 0.00 C ATOM 0 H ALA A 110 26.534 -17.449 3.772 1.00 0.00 H new ATOM 0 HA ALA A 110 23.961 -18.096 4.391 1.00 0.00 H new ATOM 0 HB1 ALA A 110 23.889 -15.839 5.376 1.00 0.00 H new ATOM 0 HB2 ALA A 110 25.429 -16.663 5.717 1.00 0.00 H new ATOM 0 HB3 ALA A 110 25.352 -15.403 4.462 1.00 0.00 H new ATOM 1680 N ALA A 111 24.123 -15.891 1.987 1.00 0.00 N ATOM 1681 CA ALA A 111 23.394 -15.256 0.887 1.00 0.00 C ATOM 1682 C ALA A 111 22.555 -16.255 0.137 1.00 0.00 C ATOM 1683 O ALA A 111 21.385 -16.029 -0.145 1.00 0.00 O ATOM 1684 CB ALA A 111 24.380 -14.612 -0.078 1.00 0.00 C ATOM 0 H ALA A 111 25.112 -15.641 2.012 1.00 0.00 H new ATOM 0 HA ALA A 111 22.735 -14.500 1.314 1.00 0.00 H new ATOM 0 HB1 ALA A 111 23.834 -14.141 -0.895 1.00 0.00 H new ATOM 0 HB2 ALA A 111 24.966 -13.859 0.449 1.00 0.00 H new ATOM 0 HB3 ALA A 111 25.047 -15.375 -0.480 1.00 0.00 H new ATOM 1690 N GLU A 112 23.121 -17.388 -0.103 1.00 0.00 N ATOM 1691 CA GLU A 112 22.489 -18.374 -0.922 1.00 0.00 C ATOM 1692 C GLU A 112 21.508 -19.243 -0.160 1.00 0.00 C ATOM 1693 O GLU A 112 20.570 -19.800 -0.738 1.00 0.00 O ATOM 1694 CB GLU A 112 23.513 -19.188 -1.653 1.00 0.00 C ATOM 1695 CG GLU A 112 24.263 -18.432 -2.726 1.00 0.00 C ATOM 1696 CD GLU A 112 25.190 -19.327 -3.496 1.00 0.00 C ATOM 1697 OE1 GLU A 112 24.724 -20.019 -4.423 1.00 0.00 O ATOM 1698 OE2 GLU A 112 26.396 -19.359 -3.199 1.00 0.00 O ATOM 0 H GLU A 112 24.034 -17.660 0.261 1.00 0.00 H new ATOM 0 HA GLU A 112 21.889 -17.839 -1.659 1.00 0.00 H new ATOM 0 HB2 GLU A 112 24.231 -19.579 -0.932 1.00 0.00 H new ATOM 0 HB3 GLU A 112 23.019 -20.046 -2.108 1.00 0.00 H new ATOM 0 HG2 GLU A 112 23.551 -17.971 -3.411 1.00 0.00 H new ATOM 0 HG3 GLU A 112 24.834 -17.624 -2.269 1.00 0.00 H new ATOM 1705 N SER A 113 21.702 -19.329 1.102 1.00 0.00 N ATOM 1706 CA SER A 113 20.797 -20.028 1.980 1.00 0.00 C ATOM 1707 C SER A 113 19.684 -19.038 2.371 1.00 0.00 C ATOM 1708 O SER A 113 18.708 -19.354 3.078 1.00 0.00 O ATOM 1709 CB SER A 113 21.614 -20.502 3.191 1.00 0.00 C ATOM 1710 OG SER A 113 20.830 -21.116 4.214 1.00 0.00 O ATOM 0 H SER A 113 22.503 -18.914 1.578 1.00 0.00 H new ATOM 0 HA SER A 113 20.332 -20.899 1.519 1.00 0.00 H new ATOM 0 HB2 SER A 113 22.370 -21.210 2.852 1.00 0.00 H new ATOM 0 HB3 SER A 113 22.144 -19.649 3.616 1.00 0.00 H new ATOM 0 HG SER A 113 21.413 -21.394 4.951 1.00 0.00 H new ATOM 1716 N GLU A 114 19.842 -17.845 1.863 1.00 0.00 N ATOM 1717 CA GLU A 114 18.985 -16.761 2.111 1.00 0.00 C ATOM 1718 C GLU A 114 18.375 -16.229 0.891 1.00 0.00 C ATOM 1719 O GLU A 114 17.803 -15.143 0.916 1.00 0.00 O ATOM 1720 CB GLU A 114 19.718 -15.704 2.830 1.00 0.00 C ATOM 1721 CG GLU A 114 19.805 -16.032 4.286 1.00 0.00 C ATOM 1722 CD GLU A 114 20.489 -15.035 5.169 1.00 0.00 C ATOM 1723 OE1 GLU A 114 21.717 -15.051 5.235 1.00 0.00 O ATOM 1724 OE2 GLU A 114 19.796 -14.309 5.910 1.00 0.00 O ATOM 0 H GLU A 114 20.614 -17.612 1.238 1.00 0.00 H new ATOM 0 HA GLU A 114 18.166 -17.127 2.730 1.00 0.00 H new ATOM 0 HB2 GLU A 114 20.720 -15.599 2.413 1.00 0.00 H new ATOM 0 HB3 GLU A 114 19.215 -14.747 2.695 1.00 0.00 H new ATOM 0 HG2 GLU A 114 18.792 -16.178 4.661 1.00 0.00 H new ATOM 0 HG3 GLU A 114 20.323 -16.986 4.388 1.00 0.00 H new ATOM 1731 N LYS A 115 18.488 -16.977 -0.200 1.00 0.00 N ATOM 1732 CA LYS A 115 17.820 -16.652 -1.403 1.00 0.00 C ATOM 1733 C LYS A 115 18.259 -15.314 -2.023 1.00 0.00 C ATOM 1734 O LYS A 115 17.615 -14.814 -2.958 1.00 0.00 O ATOM 1735 CB LYS A 115 16.356 -16.648 -1.071 1.00 0.00 C ATOM 1736 CG LYS A 115 15.716 -18.012 -0.971 1.00 0.00 C ATOM 1737 CD LYS A 115 14.275 -17.911 -0.491 1.00 0.00 C ATOM 1738 CE LYS A 115 13.632 -19.281 -0.364 1.00 0.00 C ATOM 1739 NZ LYS A 115 12.281 -19.209 0.230 1.00 0.00 N ATOM 0 H LYS A 115 19.053 -17.824 -0.251 1.00 0.00 H new ATOM 0 HA LYS A 115 18.069 -17.387 -2.168 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.216 -16.128 -0.123 1.00 0.00 H new ATOM 0 HB3 LYS A 115 15.829 -16.072 -1.831 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.744 -18.502 -1.944 1.00 0.00 H new ATOM 0 HG3 LYS A 115 16.288 -18.635 -0.284 1.00 0.00 H new ATOM 0 HD2 LYS A 115 14.247 -17.404 0.474 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.700 -17.302 -1.188 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.570 -19.744 -1.349 1.00 0.00 H new ATOM 0 HE3 LYS A 115 14.264 -19.922 0.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.880 -20.166 0.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 12.341 -18.791 1.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.669 -18.619 -0.369 1.00 0.00 H new ATOM 1752 N VAL A 116 19.347 -14.757 -1.552 1.00 0.00 N ATOM 1753 CA VAL A 116 19.777 -13.472 -2.042 1.00 0.00 C ATOM 1754 C VAL A 116 21.132 -13.519 -2.684 1.00 0.00 C ATOM 1755 O VAL A 116 22.040 -14.192 -2.224 1.00 0.00 O ATOM 1756 CB VAL A 116 19.707 -12.359 -0.975 1.00 0.00 C ATOM 1757 CG1 VAL A 116 18.266 -11.995 -0.691 1.00 0.00 C ATOM 1758 CG2 VAL A 116 20.389 -12.800 0.300 1.00 0.00 C ATOM 0 H VAL A 116 19.946 -15.169 -0.836 1.00 0.00 H new ATOM 0 HA VAL A 116 19.057 -13.212 -2.818 1.00 0.00 H new ATOM 0 HB VAL A 116 20.225 -11.481 -1.361 1.00 0.00 H new ATOM 0 HG11 VAL A 116 18.231 -11.209 0.063 1.00 0.00 H new ATOM 0 HG12 VAL A 116 17.793 -11.640 -1.607 1.00 0.00 H new ATOM 0 HG13 VAL A 116 17.734 -12.873 -0.325 1.00 0.00 H new ATOM 0 HG21 VAL A 116 20.329 -12.002 1.040 1.00 0.00 H new ATOM 0 HG22 VAL A 116 19.895 -13.691 0.687 1.00 0.00 H new ATOM 0 HG23 VAL A 116 21.435 -13.025 0.094 1.00 0.00 H new ATOM 1768 N ASP A 117 21.249 -12.833 -3.761 1.00 0.00 N ATOM 1769 CA ASP A 117 22.484 -12.766 -4.483 1.00 0.00 C ATOM 1770 C ASP A 117 23.211 -11.476 -4.146 1.00 0.00 C ATOM 1771 O ASP A 117 22.627 -10.383 -4.242 1.00 0.00 O ATOM 1772 CB ASP A 117 22.224 -12.875 -5.989 1.00 0.00 C ATOM 1773 CG ASP A 117 23.427 -12.520 -6.832 1.00 0.00 C ATOM 1774 OD1 ASP A 117 24.348 -13.343 -6.983 1.00 0.00 O ATOM 1775 OD2 ASP A 117 23.451 -11.410 -7.384 1.00 0.00 O ATOM 0 H ASP A 117 20.489 -12.294 -4.177 1.00 0.00 H new ATOM 0 HA ASP A 117 23.117 -13.603 -4.189 1.00 0.00 H new ATOM 0 HB2 ASP A 117 21.912 -13.893 -6.224 1.00 0.00 H new ATOM 0 HB3 ASP A 117 21.396 -12.218 -6.256 1.00 0.00 H new ATOM 1780 N ILE A 118 24.457 -11.589 -3.733 1.00 0.00 N ATOM 1781 CA ILE A 118 25.244 -10.429 -3.386 1.00 0.00 C ATOM 1782 C ILE A 118 26.076 -9.949 -4.568 1.00 0.00 C ATOM 1783 O ILE A 118 26.702 -10.739 -5.269 1.00 0.00 O ATOM 1784 CB ILE A 118 26.135 -10.695 -2.150 1.00 0.00 C ATOM 1785 CG1 ILE A 118 26.890 -12.034 -2.295 1.00 0.00 C ATOM 1786 CG2 ILE A 118 25.304 -10.653 -0.875 1.00 0.00 C ATOM 1787 CD1 ILE A 118 27.697 -12.424 -1.087 1.00 0.00 C ATOM 0 H ILE A 118 24.946 -12.478 -3.630 1.00 0.00 H new ATOM 0 HA ILE A 118 24.547 -9.633 -3.124 1.00 0.00 H new ATOM 0 HB ILE A 118 26.884 -9.905 -2.084 1.00 0.00 H new ATOM 0 HG12 ILE A 118 26.169 -12.823 -2.506 1.00 0.00 H new ATOM 0 HG13 ILE A 118 27.555 -11.971 -3.157 1.00 0.00 H new ATOM 0 HG21 ILE A 118 25.947 -10.842 -0.015 1.00 0.00 H new ATOM 0 HG22 ILE A 118 24.842 -9.671 -0.774 1.00 0.00 H new ATOM 0 HG23 ILE A 118 24.527 -11.416 -0.922 1.00 0.00 H new ATOM 0 HD11 ILE A 118 28.194 -13.376 -1.274 1.00 0.00 H new ATOM 0 HD12 ILE A 118 28.445 -11.657 -0.886 1.00 0.00 H new ATOM 0 HD13 ILE A 118 27.037 -12.522 -0.225 1.00 0.00 H new ATOM 1799 N ARG A 119 26.049 -8.655 -4.794 1.00 0.00 N ATOM 1800 CA ARG A 119 26.744 -8.051 -5.909 1.00 0.00 C ATOM 1801 C ARG A 119 28.064 -7.482 -5.466 1.00 0.00 C ATOM 1802 O ARG A 119 28.113 -6.635 -4.571 1.00 0.00 O ATOM 1803 CB ARG A 119 25.901 -6.946 -6.546 1.00 0.00 C ATOM 1804 CG ARG A 119 24.642 -7.404 -7.281 1.00 0.00 C ATOM 1805 CD ARG A 119 24.961 -8.274 -8.503 1.00 0.00 C ATOM 1806 NE ARG A 119 25.279 -9.668 -8.166 1.00 0.00 N ATOM 1807 CZ ARG A 119 26.241 -10.421 -8.716 1.00 0.00 C ATOM 1808 NH1 ARG A 119 27.188 -9.871 -9.491 1.00 0.00 N ATOM 1809 NH2 ARG A 119 26.268 -11.721 -8.454 1.00 0.00 N ATOM 0 H ARG A 119 25.543 -7.990 -4.209 1.00 0.00 H new ATOM 0 HA ARG A 119 26.920 -8.831 -6.650 1.00 0.00 H new ATOM 0 HB2 ARG A 119 25.607 -6.245 -5.765 1.00 0.00 H new ATOM 0 HB3 ARG A 119 26.528 -6.397 -7.248 1.00 0.00 H new ATOM 0 HG2 ARG A 119 24.008 -7.965 -6.595 1.00 0.00 H new ATOM 0 HG3 ARG A 119 24.073 -6.531 -7.599 1.00 0.00 H new ATOM 0 HD2 ARG A 119 24.108 -8.259 -9.182 1.00 0.00 H new ATOM 0 HD3 ARG A 119 25.804 -7.837 -9.039 1.00 0.00 H new ATOM 0 HE ARG A 119 24.711 -10.106 -7.441 1.00 0.00 H new ATOM 0 HH11 ARG A 119 27.182 -8.867 -9.668 1.00 0.00 H new ATOM 0 HH12 ARG A 119 27.914 -10.457 -9.903 1.00 0.00 H new ATOM 0 HH21 ARG A 119 25.563 -12.133 -7.842 1.00 0.00 H new ATOM 0 HH22 ARG A 119 26.993 -12.309 -8.864 1.00 0.00 H new ATOM 1822 N LEU A 120 29.124 -7.945 -6.074 1.00 0.00 N ATOM 1823 CA LEU A 120 30.459 -7.485 -5.765 1.00 0.00 C ATOM 1824 C LEU A 120 31.199 -7.075 -6.997 1.00 0.00 C ATOM 1825 O LEU A 120 30.785 -7.384 -8.115 1.00 0.00 O ATOM 1826 CB LEU A 120 31.301 -8.564 -5.054 1.00 0.00 C ATOM 1827 CG LEU A 120 31.189 -8.686 -3.537 1.00 0.00 C ATOM 1828 CD1 LEU A 120 31.455 -7.342 -2.893 1.00 0.00 C ATOM 1829 CD2 LEU A 120 29.855 -9.272 -3.093 1.00 0.00 C ATOM 0 H LEU A 120 29.089 -8.657 -6.803 1.00 0.00 H new ATOM 0 HA LEU A 120 30.324 -6.631 -5.102 1.00 0.00 H new ATOM 0 HB2 LEU A 120 31.037 -9.530 -5.486 1.00 0.00 H new ATOM 0 HB3 LEU A 120 32.348 -8.382 -5.296 1.00 0.00 H new ATOM 0 HG LEU A 120 31.948 -9.392 -3.201 1.00 0.00 H new ATOM 0 HD11 LEU A 120 31.374 -7.435 -1.810 1.00 0.00 H new ATOM 0 HD12 LEU A 120 32.458 -7.006 -3.154 1.00 0.00 H new ATOM 0 HD13 LEU A 120 30.725 -6.616 -3.251 1.00 0.00 H new ATOM 0 HD21 LEU A 120 29.830 -9.336 -2.005 1.00 0.00 H new ATOM 0 HD22 LEU A 120 29.043 -8.631 -3.438 1.00 0.00 H new ATOM 0 HD23 LEU A 120 29.736 -10.269 -3.518 1.00 0.00 H new