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+ -141:sc= 2.32 (180deg=1.64) USER MOD Set 1.2: A 82 THR OG1 : rot 103:sc= 0.391 USER MOD Single : A 43 ASN : amide:sc= 0.792 K(o=0.79,f=-0.62) USER MOD Single : A 51 GLN : amide:sc= 0.733 K(o=0.73,f=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.917 K(o=-0.92,f=-0.23) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 HIS : no HD1:sc= -1.89! C(o=-1.9!,f=-5.2!) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot -40:sc= 1.11 USER MOD Single : A 90 THR OG1 : rot 132:sc= 0.459 USER MOD Single : A 92 SER OG : rot -130:sc= -0.137 USER MOD Single : A 93 ASN : amide:sc= -0.92 K(o=-0.92,f=-0.015) USER MOD Single : A 100 ASN : amide:sc= -0.172 K(o=-0.17,f=-1) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 108 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.014) USER MOD Single : A 113 SER OG : rot -29:sc= 0.234 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 675 N ASN A 43 14.558 -2.334 -3.129 1.00 0.00 N ATOM 676 CA ASN A 43 15.275 -2.022 -1.906 1.00 0.00 C ATOM 677 C ASN A 43 16.675 -2.563 -1.995 1.00 0.00 C ATOM 678 O ASN A 43 16.899 -3.607 -2.625 1.00 0.00 O ATOM 679 CB ASN A 43 14.582 -2.636 -0.677 1.00 0.00 C ATOM 680 CG ASN A 43 13.202 -2.076 -0.400 1.00 0.00 C ATOM 681 OD1 ASN A 43 12.902 -0.927 -0.725 1.00 0.00 O ATOM 682 ND2 ASN A 43 12.366 -2.868 0.229 1.00 0.00 N ATOM 0 HA ASN A 43 15.290 -0.938 -1.791 1.00 0.00 H new ATOM 0 HB2 ASN A 43 14.503 -3.714 -0.819 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.210 -2.475 0.199 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.430 -2.538 0.465 1.00 0.00 H new ATOM 0 HD22 ASN A 43 12.652 -3.814 0.482 1.00 0.00 H new ATOM 689 N LEU A 44 17.626 -1.877 -1.392 1.00 0.00 N ATOM 690 CA LEU A 44 19.005 -2.350 -1.388 1.00 0.00 C ATOM 691 C LEU A 44 19.798 -1.805 -0.203 1.00 0.00 C ATOM 692 O LEU A 44 19.358 -0.881 0.504 1.00 0.00 O ATOM 693 CB LEU A 44 19.762 -2.048 -2.714 1.00 0.00 C ATOM 694 CG LEU A 44 19.966 -0.572 -3.114 1.00 0.00 C ATOM 695 CD1 LEU A 44 21.004 -0.477 -4.211 1.00 0.00 C ATOM 696 CD2 LEU A 44 18.672 0.044 -3.605 1.00 0.00 C ATOM 0 H LEU A 44 17.476 -0.996 -0.901 1.00 0.00 H new ATOM 0 HA LEU A 44 18.931 -3.433 -1.291 1.00 0.00 H new ATOM 0 HB2 LEU A 44 20.745 -2.515 -2.651 1.00 0.00 H new ATOM 0 HB3 LEU A 44 19.226 -2.542 -3.524 1.00 0.00 H new ATOM 0 HG LEU A 44 20.302 -0.027 -2.231 1.00 0.00 H new ATOM 0 HD11 LEU A 44 21.144 0.567 -4.490 1.00 0.00 H new ATOM 0 HD12 LEU A 44 21.949 -0.887 -3.854 1.00 0.00 H new ATOM 0 HD13 LEU A 44 20.668 -1.042 -5.080 1.00 0.00 H new ATOM 0 HD21 LEU A 44 18.846 1.084 -3.880 1.00 0.00 H new ATOM 0 HD22 LEU A 44 18.314 -0.506 -4.475 1.00 0.00 H new ATOM 0 HD23 LEU A 44 17.924 -0.002 -2.814 1.00 0.00 H new ATOM 708 N ILE A 45 20.928 -2.414 0.018 1.00 0.00 N ATOM 709 CA ILE A 45 21.896 -2.010 1.004 1.00 0.00 C ATOM 710 C ILE A 45 23.177 -1.665 0.269 1.00 0.00 C ATOM 711 O ILE A 45 23.601 -2.395 -0.638 1.00 0.00 O ATOM 712 CB ILE A 45 22.156 -3.123 2.106 1.00 0.00 C ATOM 713 CG1 ILE A 45 23.629 -3.151 2.575 1.00 0.00 C ATOM 714 CG2 ILE A 45 21.718 -4.484 1.653 1.00 0.00 C ATOM 715 CD1 ILE A 45 23.995 -2.226 3.696 1.00 0.00 C ATOM 0 H ILE A 45 21.214 -3.241 -0.505 1.00 0.00 H new ATOM 0 HA ILE A 45 21.512 -1.147 1.548 1.00 0.00 H new ATOM 0 HB ILE A 45 21.542 -2.845 2.963 1.00 0.00 H new ATOM 0 HG12 ILE A 45 23.869 -4.169 2.881 1.00 0.00 H new ATOM 0 HG13 ILE A 45 24.263 -2.917 1.720 1.00 0.00 H new ATOM 0 HG21 ILE A 45 21.916 -5.211 2.441 1.00 0.00 H new ATOM 0 HG22 ILE A 45 20.650 -4.468 1.434 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.269 -4.763 0.755 1.00 0.00 H new ATOM 0 HD11 ILE A 45 25.053 -2.340 3.931 1.00 0.00 H new ATOM 0 HD12 ILE A 45 23.799 -1.196 3.397 1.00 0.00 H new ATOM 0 HD13 ILE A 45 23.399 -2.468 4.576 1.00 0.00 H new ATOM 727 N VAL A 46 23.753 -0.571 0.636 1.00 0.00 N ATOM 728 CA VAL A 46 24.949 -0.085 0.021 1.00 0.00 C ATOM 729 C VAL A 46 26.166 -0.346 0.931 1.00 0.00 C ATOM 730 O VAL A 46 26.139 -0.024 2.138 1.00 0.00 O ATOM 731 CB VAL A 46 24.811 1.427 -0.247 1.00 0.00 C ATOM 732 CG1 VAL A 46 26.118 2.039 -0.704 1.00 0.00 C ATOM 733 CG2 VAL A 46 23.717 1.719 -1.260 1.00 0.00 C ATOM 0 H VAL A 46 23.402 0.025 1.386 1.00 0.00 H new ATOM 0 HA VAL A 46 25.101 -0.610 -0.922 1.00 0.00 H new ATOM 0 HB VAL A 46 24.533 1.886 0.702 1.00 0.00 H new ATOM 0 HG11 VAL A 46 25.978 3.105 -0.882 1.00 0.00 H new ATOM 0 HG12 VAL A 46 26.876 1.896 0.066 1.00 0.00 H new ATOM 0 HG13 VAL A 46 26.443 1.557 -1.626 1.00 0.00 H new ATOM 0 HG21 VAL A 46 23.650 2.795 -1.423 1.00 0.00 H new ATOM 0 HG22 VAL A 46 23.952 1.223 -2.202 1.00 0.00 H new ATOM 0 HG23 VAL A 46 22.764 1.349 -0.883 1.00 0.00 H new ATOM 743 N LYS A 47 27.207 -0.929 0.358 1.00 0.00 N ATOM 744 CA LYS A 47 28.456 -1.185 1.058 1.00 0.00 C ATOM 745 C LYS A 47 29.643 -0.947 0.158 1.00 0.00 C ATOM 746 O LYS A 47 29.649 -1.332 -1.017 1.00 0.00 O ATOM 747 CB LYS A 47 28.575 -2.593 1.650 1.00 0.00 C ATOM 748 CG LYS A 47 27.765 -2.865 2.898 1.00 0.00 C ATOM 749 CD LYS A 47 28.442 -3.962 3.691 1.00 0.00 C ATOM 750 CE LYS A 47 27.721 -4.305 4.968 1.00 0.00 C ATOM 751 NZ LYS A 47 28.575 -5.117 5.872 1.00 0.00 N ATOM 0 H LYS A 47 27.209 -1.240 -0.613 1.00 0.00 H new ATOM 0 HA LYS A 47 28.449 -0.481 1.890 1.00 0.00 H new ATOM 0 HB2 LYS A 47 28.278 -3.312 0.886 1.00 0.00 H new ATOM 0 HB3 LYS A 47 29.625 -2.782 1.875 1.00 0.00 H new ATOM 0 HG2 LYS A 47 27.684 -1.960 3.500 1.00 0.00 H new ATOM 0 HG3 LYS A 47 26.751 -3.163 2.632 1.00 0.00 H new ATOM 0 HD2 LYS A 47 28.515 -4.856 3.072 1.00 0.00 H new ATOM 0 HD3 LYS A 47 29.460 -3.654 3.928 1.00 0.00 H new ATOM 0 HE2 LYS A 47 27.421 -3.388 5.475 1.00 0.00 H new ATOM 0 HE3 LYS A 47 26.809 -4.855 4.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 27.996 -5.846 6.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 29.329 -5.573 5.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 28.999 -4.501 6.595 1.00 0.00 H new ATOM 764 N ALA A 48 30.650 -0.350 0.718 1.00 0.00 N ATOM 765 CA ALA A 48 31.856 -0.032 0.023 1.00 0.00 C ATOM 766 C ALA A 48 32.976 0.027 1.043 1.00 0.00 C ATOM 767 O ALA A 48 32.698 0.060 2.254 1.00 0.00 O ATOM 768 CB ALA A 48 31.699 1.297 -0.704 1.00 0.00 C ATOM 0 H ALA A 48 30.654 -0.064 1.697 1.00 0.00 H new ATOM 0 HA ALA A 48 32.086 -0.789 -0.727 1.00 0.00 H new ATOM 0 HB1 ALA A 48 32.622 1.534 -1.232 1.00 0.00 H new ATOM 0 HB2 ALA A 48 30.880 1.226 -1.419 1.00 0.00 H new ATOM 0 HB3 ALA A 48 31.482 2.084 0.019 1.00 0.00 H new ATOM 774 N ASP A 49 34.215 0.034 0.585 1.00 0.00 N ATOM 775 CA ASP A 49 35.361 0.054 1.498 1.00 0.00 C ATOM 776 C ASP A 49 35.635 1.473 1.959 1.00 0.00 C ATOM 777 O ASP A 49 36.250 1.694 3.009 1.00 0.00 O ATOM 778 CB ASP A 49 36.632 -0.596 0.886 1.00 0.00 C ATOM 779 CG ASP A 49 37.288 0.187 -0.241 1.00 0.00 C ATOM 780 OD1 ASP A 49 36.948 -0.031 -1.423 1.00 0.00 O ATOM 781 OD2 ASP A 49 38.177 0.993 0.021 1.00 0.00 O ATOM 0 H ASP A 49 34.460 0.026 -0.405 1.00 0.00 H new ATOM 0 HA ASP A 49 35.098 -0.556 2.362 1.00 0.00 H new ATOM 0 HB2 ASP A 49 37.365 -0.739 1.680 1.00 0.00 H new ATOM 0 HB3 ASP A 49 36.369 -1.586 0.513 1.00 0.00 H new ATOM 786 N VAL A 50 35.163 2.421 1.180 1.00 0.00 N ATOM 787 CA VAL A 50 35.214 3.818 1.507 1.00 0.00 C ATOM 788 C VAL A 50 33.843 4.193 2.053 1.00 0.00 C ATOM 789 O VAL A 50 32.826 3.974 1.375 1.00 0.00 O ATOM 790 CB VAL A 50 35.516 4.660 0.236 1.00 0.00 C ATOM 791 CG1 VAL A 50 35.530 6.137 0.547 1.00 0.00 C ATOM 792 CG2 VAL A 50 36.836 4.241 -0.388 1.00 0.00 C ATOM 0 H VAL A 50 34.723 2.231 0.280 1.00 0.00 H new ATOM 0 HA VAL A 50 36.001 4.014 2.236 1.00 0.00 H new ATOM 0 HB VAL A 50 34.716 4.472 -0.481 1.00 0.00 H new ATOM 0 HG11 VAL A 50 35.744 6.698 -0.363 1.00 0.00 H new ATOM 0 HG12 VAL A 50 34.557 6.436 0.937 1.00 0.00 H new ATOM 0 HG13 VAL A 50 36.299 6.345 1.291 1.00 0.00 H new ATOM 0 HG21 VAL A 50 37.026 4.844 -1.276 1.00 0.00 H new ATOM 0 HG22 VAL A 50 37.642 4.389 0.331 1.00 0.00 H new ATOM 0 HG23 VAL A 50 36.789 3.188 -0.667 1.00 0.00 H new ATOM 802 N GLN A 51 33.789 4.743 3.257 1.00 0.00 N ATOM 803 CA GLN A 51 32.508 5.028 3.893 1.00 0.00 C ATOM 804 C GLN A 51 31.723 6.049 3.120 1.00 0.00 C ATOM 805 O GLN A 51 30.549 5.902 2.922 1.00 0.00 O ATOM 806 CB GLN A 51 32.633 5.495 5.334 1.00 0.00 C ATOM 807 CG GLN A 51 31.275 5.533 6.033 1.00 0.00 C ATOM 808 CD GLN A 51 31.297 6.224 7.356 1.00 0.00 C ATOM 809 OE1 GLN A 51 31.559 5.612 8.389 1.00 0.00 O ATOM 810 NE2 GLN A 51 30.958 7.474 7.351 1.00 0.00 N ATOM 0 H GLN A 51 34.607 4.999 3.810 1.00 0.00 H new ATOM 0 HA GLN A 51 31.980 4.074 3.896 1.00 0.00 H new ATOM 0 HB2 GLN A 51 33.303 4.828 5.876 1.00 0.00 H new ATOM 0 HB3 GLN A 51 33.083 6.488 5.358 1.00 0.00 H new ATOM 0 HG2 GLN A 51 30.557 6.034 5.384 1.00 0.00 H new ATOM 0 HG3 GLN A 51 30.920 4.512 6.173 1.00 0.00 H new ATOM 0 HE21 GLN A 51 30.749 7.942 6.469 1.00 0.00 H new ATOM 0 HE22 GLN A 51 30.900 7.990 8.229 1.00 0.00 H new ATOM 819 N GLY A 52 32.355 7.046 2.631 1.00 0.00 N ATOM 820 CA GLY A 52 31.596 8.034 1.934 1.00 0.00 C ATOM 821 C GLY A 52 31.254 7.647 0.525 1.00 0.00 C ATOM 822 O GLY A 52 30.661 8.437 -0.209 1.00 0.00 O ATOM 0 H GLY A 52 33.360 7.207 2.691 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.674 8.226 2.483 1.00 0.00 H new ATOM 0 HA3 GLY A 52 32.158 8.968 1.919 1.00 0.00 H new ATOM 826 N SER A 53 31.592 6.433 0.147 1.00 0.00 N ATOM 827 CA SER A 53 31.201 5.923 -1.122 1.00 0.00 C ATOM 828 C SER A 53 29.806 5.385 -0.920 1.00 0.00 C ATOM 829 O SER A 53 28.936 5.493 -1.799 1.00 0.00 O ATOM 830 CB SER A 53 32.166 4.821 -1.587 1.00 0.00 C ATOM 831 OG SER A 53 31.820 4.326 -2.865 1.00 0.00 O ATOM 0 H SER A 53 32.141 5.787 0.715 1.00 0.00 H new ATOM 0 HA SER A 53 31.224 6.689 -1.897 1.00 0.00 H new ATOM 0 HB2 SER A 53 33.182 5.215 -1.612 1.00 0.00 H new ATOM 0 HB3 SER A 53 32.159 4.003 -0.866 1.00 0.00 H new ATOM 0 HG SER A 53 32.456 3.628 -3.129 1.00 0.00 H new ATOM 837 N VAL A 54 29.571 4.887 0.304 1.00 0.00 N ATOM 838 CA VAL A 54 28.290 4.391 0.678 1.00 0.00 C ATOM 839 C VAL A 54 27.350 5.559 0.857 1.00 0.00 C ATOM 840 O VAL A 54 26.273 5.585 0.291 1.00 0.00 O ATOM 841 CB VAL A 54 28.318 3.491 1.970 1.00 0.00 C ATOM 842 CG1 VAL A 54 29.409 2.460 1.926 1.00 0.00 C ATOM 843 CG2 VAL A 54 28.288 4.222 3.317 1.00 0.00 C ATOM 0 H VAL A 54 30.276 4.828 1.039 1.00 0.00 H new ATOM 0 HA VAL A 54 27.941 3.739 -0.123 1.00 0.00 H new ATOM 0 HB VAL A 54 27.354 2.985 1.929 1.00 0.00 H new ATOM 0 HG11 VAL A 54 29.385 1.866 2.840 1.00 0.00 H new ATOM 0 HG12 VAL A 54 29.259 1.808 1.065 1.00 0.00 H new ATOM 0 HG13 VAL A 54 30.376 2.957 1.841 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.311 3.493 4.127 1.00 0.00 H new ATOM 0 HG22 VAL A 54 29.155 4.878 3.394 1.00 0.00 H new ATOM 0 HG23 VAL A 54 27.376 4.815 3.389 1.00 0.00 H new ATOM 853 N GLU A 55 27.834 6.567 1.574 1.00 0.00 N ATOM 854 CA GLU A 55 27.055 7.752 1.895 1.00 0.00 C ATOM 855 C GLU A 55 26.675 8.519 0.650 1.00 0.00 C ATOM 856 O GLU A 55 25.554 8.986 0.533 1.00 0.00 O ATOM 857 CB GLU A 55 27.800 8.650 2.874 1.00 0.00 C ATOM 858 CG GLU A 55 28.097 7.980 4.207 1.00 0.00 C ATOM 859 CD GLU A 55 28.837 8.875 5.162 1.00 0.00 C ATOM 860 OE1 GLU A 55 30.072 8.984 5.061 1.00 0.00 O ATOM 861 OE2 GLU A 55 28.207 9.483 6.053 1.00 0.00 O ATOM 0 H GLU A 55 28.782 6.583 1.950 1.00 0.00 H new ATOM 0 HA GLU A 55 26.135 7.416 2.373 1.00 0.00 H new ATOM 0 HB2 GLU A 55 28.738 8.969 2.420 1.00 0.00 H new ATOM 0 HB3 GLU A 55 27.210 9.549 3.052 1.00 0.00 H new ATOM 0 HG2 GLU A 55 27.160 7.664 4.666 1.00 0.00 H new ATOM 0 HG3 GLU A 55 28.685 7.079 4.032 1.00 0.00 H new ATOM 868 N ALA A 56 27.597 8.604 -0.298 1.00 0.00 N ATOM 869 CA ALA A 56 27.333 9.292 -1.550 1.00 0.00 C ATOM 870 C ALA A 56 26.242 8.582 -2.333 1.00 0.00 C ATOM 871 O ALA A 56 25.383 9.221 -2.938 1.00 0.00 O ATOM 872 CB ALA A 56 28.595 9.392 -2.384 1.00 0.00 C ATOM 0 H ALA A 56 28.533 8.205 -0.223 1.00 0.00 H new ATOM 0 HA ALA A 56 26.992 10.300 -1.315 1.00 0.00 H new ATOM 0 HB1 ALA A 56 28.374 9.911 -3.317 1.00 0.00 H new ATOM 0 HB2 ALA A 56 29.353 9.946 -1.831 1.00 0.00 H new ATOM 0 HB3 ALA A 56 28.966 8.391 -2.604 1.00 0.00 H new ATOM 878 N LEU A 57 26.245 7.263 -2.281 1.00 0.00 N ATOM 879 CA LEU A 57 25.265 6.501 -3.005 1.00 0.00 C ATOM 880 C LEU A 57 23.928 6.588 -2.287 1.00 0.00 C ATOM 881 O LEU A 57 22.902 6.800 -2.911 1.00 0.00 O ATOM 882 CB LEU A 57 25.728 5.049 -3.197 1.00 0.00 C ATOM 883 CG LEU A 57 24.824 4.142 -4.046 1.00 0.00 C ATOM 884 CD1 LEU A 57 24.554 4.773 -5.407 1.00 0.00 C ATOM 885 CD2 LEU A 57 25.486 2.794 -4.251 1.00 0.00 C ATOM 0 H LEU A 57 26.913 6.707 -1.747 1.00 0.00 H new ATOM 0 HA LEU A 57 25.143 6.921 -4.004 1.00 0.00 H new ATOM 0 HB2 LEU A 57 26.718 5.065 -3.653 1.00 0.00 H new ATOM 0 HB3 LEU A 57 25.838 4.594 -2.213 1.00 0.00 H new ATOM 0 HG LEU A 57 23.880 4.014 -3.517 1.00 0.00 H new ATOM 0 HD11 LEU A 57 23.912 4.115 -5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 57 24.059 5.735 -5.271 1.00 0.00 H new ATOM 0 HD13 LEU A 57 25.497 4.921 -5.933 1.00 0.00 H new ATOM 0 HD21 LEU A 57 24.838 2.158 -4.854 1.00 0.00 H new ATOM 0 HD22 LEU A 57 26.438 2.931 -4.763 1.00 0.00 H new ATOM 0 HD23 LEU A 57 25.659 2.323 -3.284 1.00 0.00 H new ATOM 897 N VAL A 58 23.968 6.490 -0.966 1.00 0.00 N ATOM 898 CA VAL A 58 22.778 6.614 -0.130 1.00 0.00 C ATOM 899 C VAL A 58 22.105 7.966 -0.337 1.00 0.00 C ATOM 900 O VAL A 58 20.898 8.035 -0.494 1.00 0.00 O ATOM 901 CB VAL A 58 23.110 6.420 1.371 1.00 0.00 C ATOM 902 CG1 VAL A 58 21.915 6.746 2.266 1.00 0.00 C ATOM 903 CG2 VAL A 58 23.540 5.002 1.611 1.00 0.00 C ATOM 0 H VAL A 58 24.826 6.322 -0.441 1.00 0.00 H new ATOM 0 HA VAL A 58 22.091 5.824 -0.434 1.00 0.00 H new ATOM 0 HB VAL A 58 23.916 7.108 1.624 1.00 0.00 H new ATOM 0 HG11 VAL A 58 22.191 6.597 3.310 1.00 0.00 H new ATOM 0 HG12 VAL A 58 21.619 7.784 2.114 1.00 0.00 H new ATOM 0 HG13 VAL A 58 21.082 6.090 2.014 1.00 0.00 H new ATOM 0 HG21 VAL A 58 23.773 4.866 2.667 1.00 0.00 H new ATOM 0 HG22 VAL A 58 22.735 4.325 1.327 1.00 0.00 H new ATOM 0 HG23 VAL A 58 24.425 4.784 1.013 1.00 0.00 H new ATOM 913 N ALA A 59 22.903 9.016 -0.411 1.00 0.00 N ATOM 914 CA ALA A 59 22.398 10.375 -0.591 1.00 0.00 C ATOM 915 C ALA A 59 21.709 10.564 -1.944 1.00 0.00 C ATOM 916 O ALA A 59 20.932 11.494 -2.125 1.00 0.00 O ATOM 917 CB ALA A 59 23.511 11.396 -0.408 1.00 0.00 C ATOM 0 H ALA A 59 23.919 8.956 -0.349 1.00 0.00 H new ATOM 0 HA ALA A 59 21.644 10.538 0.179 1.00 0.00 H new ATOM 0 HB1 ALA A 59 23.110 12.400 -0.547 1.00 0.00 H new ATOM 0 HB2 ALA A 59 23.925 11.306 0.596 1.00 0.00 H new ATOM 0 HB3 ALA A 59 24.296 11.214 -1.142 1.00 0.00 H new ATOM 923 N ALA A 60 21.949 9.659 -2.867 1.00 0.00 N ATOM 924 CA ALA A 60 21.348 9.747 -4.182 1.00 0.00 C ATOM 925 C ALA A 60 20.169 8.816 -4.228 1.00 0.00 C ATOM 926 O ALA A 60 19.215 9.017 -4.949 1.00 0.00 O ATOM 927 CB ALA A 60 22.353 9.352 -5.243 1.00 0.00 C ATOM 0 H ALA A 60 22.557 8.851 -2.732 1.00 0.00 H new ATOM 0 HA ALA A 60 21.028 10.771 -4.374 1.00 0.00 H new ATOM 0 HB1 ALA A 60 21.890 9.422 -6.227 1.00 0.00 H new ATOM 0 HB2 ALA A 60 23.212 10.022 -5.198 1.00 0.00 H new ATOM 0 HB3 ALA A 60 22.682 8.328 -5.069 1.00 0.00 H new ATOM 933 N LEU A 61 20.247 7.834 -3.396 1.00 0.00 N ATOM 934 CA LEU A 61 19.291 6.777 -3.306 1.00 0.00 C ATOM 935 C LEU A 61 18.084 7.190 -2.439 1.00 0.00 C ATOM 936 O LEU A 61 16.951 6.830 -2.720 1.00 0.00 O ATOM 937 CB LEU A 61 20.020 5.565 -2.734 1.00 0.00 C ATOM 938 CG LEU A 61 20.199 4.345 -3.636 1.00 0.00 C ATOM 939 CD1 LEU A 61 18.858 3.747 -3.991 1.00 0.00 C ATOM 940 CD2 LEU A 61 20.960 4.707 -4.901 1.00 0.00 C ATOM 0 H LEU A 61 21.013 7.740 -2.729 1.00 0.00 H new ATOM 0 HA LEU A 61 18.881 6.537 -4.287 1.00 0.00 H new ATOM 0 HB2 LEU A 61 21.009 5.891 -2.413 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.485 5.244 -1.840 1.00 0.00 H new ATOM 0 HG LEU A 61 20.781 3.606 -3.086 1.00 0.00 H new ATOM 0 HD11 LEU A 61 19.005 2.879 -4.634 1.00 0.00 H new ATOM 0 HD12 LEU A 61 18.344 3.441 -3.080 1.00 0.00 H new ATOM 0 HD13 LEU A 61 18.256 4.489 -4.516 1.00 0.00 H new ATOM 0 HD21 LEU A 61 21.073 3.820 -5.524 1.00 0.00 H new ATOM 0 HD22 LEU A 61 20.409 5.469 -5.451 1.00 0.00 H new ATOM 0 HD23 LEU A 61 21.945 5.092 -4.636 1.00 0.00 H new ATOM 952 N GLN A 62 18.339 7.956 -1.398 1.00 0.00 N ATOM 953 CA GLN A 62 17.294 8.468 -0.519 1.00 0.00 C ATOM 954 C GLN A 62 16.468 9.564 -1.215 1.00 0.00 C ATOM 955 O GLN A 62 15.319 9.822 -0.844 1.00 0.00 O ATOM 956 CB GLN A 62 17.903 9.015 0.785 1.00 0.00 C ATOM 957 CG GLN A 62 18.856 10.183 0.567 1.00 0.00 C ATOM 958 CD GLN A 62 19.496 10.720 1.833 1.00 0.00 C ATOM 959 OE1 GLN A 62 19.811 11.905 1.910 1.00 0.00 O ATOM 960 NE2 GLN A 62 19.702 9.878 2.820 1.00 0.00 N ATOM 0 H GLN A 62 19.280 8.245 -1.132 1.00 0.00 H new ATOM 0 HA GLN A 62 16.628 7.639 -0.278 1.00 0.00 H new ATOM 0 HB2 GLN A 62 17.098 9.332 1.448 1.00 0.00 H new ATOM 0 HB3 GLN A 62 18.436 8.211 1.293 1.00 0.00 H new ATOM 0 HG2 GLN A 62 19.644 9.869 -0.118 1.00 0.00 H new ATOM 0 HG3 GLN A 62 18.313 10.992 0.079 1.00 0.00 H new ATOM 0 HE21 GLN A 62 19.428 8.900 2.722 1.00 0.00 H new ATOM 0 HE22 GLN A 62 20.136 10.202 3.684 1.00 0.00 H new ATOM 969 N LYS A 63 17.044 10.196 -2.233 1.00 0.00 N ATOM 970 CA LYS A 63 16.338 11.259 -2.943 1.00 0.00 C ATOM 971 C LYS A 63 15.558 10.696 -4.118 1.00 0.00 C ATOM 972 O LYS A 63 14.989 11.438 -4.921 1.00 0.00 O ATOM 973 CB LYS A 63 17.275 12.388 -3.402 1.00 0.00 C ATOM 974 CG LYS A 63 18.353 11.967 -4.381 1.00 0.00 C ATOM 975 CD LYS A 63 19.154 13.158 -4.903 1.00 0.00 C ATOM 976 CE LYS A 63 19.827 13.934 -3.778 1.00 0.00 C ATOM 977 NZ LYS A 63 20.625 15.068 -4.285 1.00 0.00 N ATOM 0 H LYS A 63 17.982 9.996 -2.581 1.00 0.00 H new ATOM 0 HA LYS A 63 15.637 11.700 -2.234 1.00 0.00 H new ATOM 0 HB2 LYS A 63 16.675 13.174 -3.861 1.00 0.00 H new ATOM 0 HB3 LYS A 63 17.752 12.823 -2.524 1.00 0.00 H new ATOM 0 HG2 LYS A 63 19.028 11.262 -3.895 1.00 0.00 H new ATOM 0 HG3 LYS A 63 17.895 11.443 -5.220 1.00 0.00 H new ATOM 0 HD2 LYS A 63 19.911 12.806 -5.603 1.00 0.00 H new ATOM 0 HD3 LYS A 63 18.493 13.824 -5.457 1.00 0.00 H new ATOM 0 HE2 LYS A 63 19.068 14.305 -3.089 1.00 0.00 H new ATOM 0 HE3 LYS A 63 20.472 13.263 -3.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 21.065 15.568 -3.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 21.367 14.713 -4.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 20.006 15.723 -4.805 1.00 0.00 H new ATOM 1098 N VAL A 71 13.209 3.189 -5.854 1.00 0.00 N ATOM 1099 CA VAL A 71 14.425 2.522 -5.470 1.00 0.00 C ATOM 1100 C VAL A 71 14.899 3.213 -4.204 1.00 0.00 C ATOM 1101 O VAL A 71 14.995 4.433 -4.178 1.00 0.00 O ATOM 1102 CB VAL A 71 15.522 2.648 -6.574 1.00 0.00 C ATOM 1103 CG1 VAL A 71 16.750 1.839 -6.213 1.00 0.00 C ATOM 1104 CG2 VAL A 71 14.991 2.230 -7.944 1.00 0.00 C ATOM 0 HA VAL A 71 14.244 1.458 -5.321 1.00 0.00 H new ATOM 0 HB VAL A 71 15.805 3.699 -6.632 1.00 0.00 H new ATOM 0 HG11 VAL A 71 17.499 1.944 -6.998 1.00 0.00 H new ATOM 0 HG12 VAL A 71 17.160 2.201 -5.270 1.00 0.00 H new ATOM 0 HG13 VAL A 71 16.477 0.789 -6.110 1.00 0.00 H new ATOM 0 HG21 VAL A 71 15.782 2.331 -8.687 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.660 1.192 -7.905 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.151 2.868 -8.219 1.00 0.00 H new ATOM 1114 N LYS A 72 15.138 2.477 -3.161 1.00 0.00 N ATOM 1115 CA LYS A 72 15.505 3.079 -1.901 1.00 0.00 C ATOM 1116 C LYS A 72 16.441 2.176 -1.127 1.00 0.00 C ATOM 1117 O LYS A 72 16.456 0.952 -1.313 1.00 0.00 O ATOM 1118 CB LYS A 72 14.221 3.412 -1.098 1.00 0.00 C ATOM 1119 CG LYS A 72 14.421 3.941 0.325 1.00 0.00 C ATOM 1120 CD LYS A 72 13.073 4.274 0.951 1.00 0.00 C ATOM 1121 CE LYS A 72 13.144 4.412 2.468 1.00 0.00 C ATOM 1122 NZ LYS A 72 14.023 5.508 2.931 1.00 0.00 N ATOM 0 H LYS A 72 15.087 1.458 -3.150 1.00 0.00 H new ATOM 0 HA LYS A 72 16.045 4.008 -2.083 1.00 0.00 H new ATOM 0 HB2 LYS A 72 13.650 4.152 -1.659 1.00 0.00 H new ATOM 0 HB3 LYS A 72 13.610 2.511 -1.044 1.00 0.00 H new ATOM 0 HG2 LYS A 72 14.938 3.196 0.930 1.00 0.00 H new ATOM 0 HG3 LYS A 72 15.052 4.830 0.306 1.00 0.00 H new ATOM 0 HD2 LYS A 72 12.699 5.204 0.523 1.00 0.00 H new ATOM 0 HD3 LYS A 72 12.356 3.494 0.695 1.00 0.00 H new ATOM 0 HE2 LYS A 72 12.139 4.578 2.855 1.00 0.00 H new ATOM 0 HE3 LYS A 72 13.498 3.472 2.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.020 5.540 3.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.992 5.342 2.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 13.675 6.414 2.556 1.00 0.00 H new ATOM 1135 N ILE A 73 17.225 2.779 -0.282 1.00 0.00 N ATOM 1136 CA ILE A 73 18.154 2.078 0.541 1.00 0.00 C ATOM 1137 C ILE A 73 17.569 1.762 1.895 1.00 0.00 C ATOM 1138 O ILE A 73 16.712 2.491 2.409 1.00 0.00 O ATOM 1139 CB ILE A 73 19.518 2.816 0.677 1.00 0.00 C ATOM 1140 CG1 ILE A 73 19.381 4.363 0.786 1.00 0.00 C ATOM 1141 CG2 ILE A 73 20.414 2.447 -0.473 1.00 0.00 C ATOM 1142 CD1 ILE A 73 18.634 4.887 1.995 1.00 0.00 C ATOM 0 H ILE A 73 17.233 3.790 -0.146 1.00 0.00 H new ATOM 0 HA ILE A 73 18.358 1.135 0.033 1.00 0.00 H new ATOM 0 HB ILE A 73 19.961 2.486 1.617 1.00 0.00 H new ATOM 0 HG12 ILE A 73 20.381 4.796 0.788 1.00 0.00 H new ATOM 0 HG13 ILE A 73 18.878 4.726 -0.111 1.00 0.00 H new ATOM 0 HG21 ILE A 73 21.367 2.966 -0.373 1.00 0.00 H new ATOM 0 HG22 ILE A 73 20.585 1.371 -0.470 1.00 0.00 H new ATOM 0 HG23 ILE A 73 19.940 2.736 -1.411 1.00 0.00 H new ATOM 0 HD11 ILE A 73 18.604 5.976 1.960 1.00 0.00 H new ATOM 0 HD12 ILE A 73 17.617 4.496 1.992 1.00 0.00 H new ATOM 0 HD13 ILE A 73 19.143 4.567 2.904 1.00 0.00 H new ATOM 1154 N ILE A 74 17.984 0.666 2.440 1.00 0.00 N ATOM 1155 CA ILE A 74 17.503 0.239 3.730 1.00 0.00 C ATOM 1156 C ILE A 74 18.630 0.303 4.753 1.00 0.00 C ATOM 1157 O ILE A 74 18.396 0.441 5.967 1.00 0.00 O ATOM 1158 CB ILE A 74 16.940 -1.218 3.638 1.00 0.00 C ATOM 1159 CG1 ILE A 74 15.848 -1.319 2.552 1.00 0.00 C ATOM 1160 CG2 ILE A 74 16.409 -1.710 4.980 1.00 0.00 C ATOM 1161 CD1 ILE A 74 14.632 -0.434 2.776 1.00 0.00 C ATOM 0 H ILE A 74 18.664 0.037 2.012 1.00 0.00 H new ATOM 0 HA ILE A 74 16.701 0.905 4.047 1.00 0.00 H new ATOM 0 HB ILE A 74 17.770 -1.866 3.357 1.00 0.00 H new ATOM 0 HG12 ILE A 74 16.291 -1.065 1.589 1.00 0.00 H new ATOM 0 HG13 ILE A 74 15.517 -2.355 2.487 1.00 0.00 H new ATOM 0 HG21 ILE A 74 16.028 -2.725 4.870 1.00 0.00 H new ATOM 0 HG22 ILE A 74 17.214 -1.702 5.715 1.00 0.00 H new ATOM 0 HG23 ILE A 74 15.605 -1.055 5.315 1.00 0.00 H new ATOM 0 HD11 ILE A 74 13.923 -0.576 1.960 1.00 0.00 H new ATOM 0 HD12 ILE A 74 14.157 -0.700 3.720 1.00 0.00 H new ATOM 0 HD13 ILE A 74 14.943 0.610 2.808 1.00 0.00 H new ATOM 1173 N HIS A 75 19.853 0.268 4.264 1.00 0.00 N ATOM 1174 CA HIS A 75 20.995 0.166 5.128 1.00 0.00 C ATOM 1175 C HIS A 75 22.250 0.581 4.354 1.00 0.00 C ATOM 1176 O HIS A 75 22.311 0.415 3.126 1.00 0.00 O ATOM 1177 CB HIS A 75 21.056 -1.306 5.609 1.00 0.00 C ATOM 1178 CG HIS A 75 22.105 -1.694 6.624 1.00 0.00 C ATOM 1179 ND1 HIS A 75 22.625 -0.857 7.594 1.00 0.00 N ATOM 1180 CD2 HIS A 75 22.729 -2.872 6.788 1.00 0.00 C ATOM 1181 CE1 HIS A 75 23.533 -1.520 8.295 1.00 0.00 C ATOM 1182 NE2 HIS A 75 23.605 -2.742 7.814 1.00 0.00 N ATOM 0 H HIS A 75 20.074 0.309 3.269 1.00 0.00 H new ATOM 0 HA HIS A 75 20.926 0.826 5.993 1.00 0.00 H new ATOM 0 HB2 HIS A 75 20.082 -1.558 6.028 1.00 0.00 H new ATOM 0 HB3 HIS A 75 21.197 -1.935 4.730 1.00 0.00 H new ATOM 0 HD2 HIS A 75 22.562 -3.766 6.205 1.00 0.00 H new ATOM 0 HE1 HIS A 75 24.112 -1.126 9.117 1.00 0.00 H new ATOM 0 HE2 HIS A 75 24.223 -3.476 8.159 1.00 0.00 H new ATOM 1190 N ALA A 76 23.203 1.138 5.058 1.00 0.00 N ATOM 1191 CA ALA A 76 24.479 1.568 4.525 1.00 0.00 C ATOM 1192 C ALA A 76 25.535 1.222 5.541 1.00 0.00 C ATOM 1193 O ALA A 76 25.251 1.260 6.741 1.00 0.00 O ATOM 1194 CB ALA A 76 24.450 3.066 4.336 1.00 0.00 C ATOM 0 H ALA A 76 23.111 1.313 6.059 1.00 0.00 H new ATOM 0 HA ALA A 76 24.686 1.084 3.570 1.00 0.00 H new ATOM 0 HB1 ALA A 76 25.407 3.401 3.935 1.00 0.00 H new ATOM 0 HB2 ALA A 76 23.653 3.330 3.641 1.00 0.00 H new ATOM 0 HB3 ALA A 76 24.270 3.550 5.296 1.00 0.00 H new ATOM 1200 N ALA A 77 26.719 0.835 5.096 1.00 0.00 N ATOM 1201 CA ALA A 77 27.814 0.527 6.010 1.00 0.00 C ATOM 1202 C ALA A 77 29.128 0.458 5.271 1.00 0.00 C ATOM 1203 O ALA A 77 29.167 0.092 4.096 1.00 0.00 O ATOM 1204 CB ALA A 77 27.566 -0.795 6.727 1.00 0.00 C ATOM 0 H ALA A 77 26.950 0.726 4.108 1.00 0.00 H new ATOM 0 HA ALA A 77 27.862 1.328 6.747 1.00 0.00 H new ATOM 0 HB1 ALA A 77 28.395 -1.004 7.403 1.00 0.00 H new ATOM 0 HB2 ALA A 77 26.640 -0.731 7.298 1.00 0.00 H new ATOM 0 HB3 ALA A 77 27.485 -1.597 5.993 1.00 0.00 H new ATOM 1210 N VAL A 78 30.195 0.797 5.950 1.00 0.00 N ATOM 1211 CA VAL A 78 31.506 0.713 5.370 1.00 0.00 C ATOM 1212 C VAL A 78 32.130 -0.631 5.739 1.00 0.00 C ATOM 1213 O VAL A 78 32.696 -0.829 6.823 1.00 0.00 O ATOM 1214 CB VAL A 78 32.413 1.923 5.783 1.00 0.00 C ATOM 1215 CG1 VAL A 78 32.484 2.122 7.301 1.00 0.00 C ATOM 1216 CG2 VAL A 78 33.806 1.792 5.187 1.00 0.00 C ATOM 0 H VAL A 78 30.178 1.136 6.912 1.00 0.00 H new ATOM 0 HA VAL A 78 31.417 0.772 4.285 1.00 0.00 H new ATOM 0 HB VAL A 78 31.942 2.816 5.372 1.00 0.00 H new ATOM 0 HG11 VAL A 78 33.126 2.974 7.527 1.00 0.00 H new ATOM 0 HG12 VAL A 78 31.483 2.309 7.691 1.00 0.00 H new ATOM 0 HG13 VAL A 78 32.893 1.226 7.767 1.00 0.00 H new ATOM 0 HG21 VAL A 78 34.413 2.645 5.490 1.00 0.00 H new ATOM 0 HG22 VAL A 78 34.269 0.872 5.543 1.00 0.00 H new ATOM 0 HG23 VAL A 78 33.735 1.765 4.100 1.00 0.00 H new ATOM 1226 N GLY A 79 31.956 -1.562 4.870 1.00 0.00 N ATOM 1227 CA GLY A 79 32.425 -2.870 5.098 1.00 0.00 C ATOM 1228 C GLY A 79 32.155 -3.714 3.918 1.00 0.00 C ATOM 1229 O GLY A 79 31.544 -3.256 2.948 1.00 0.00 O ATOM 0 H GLY A 79 31.481 -1.431 3.977 1.00 0.00 H new ATOM 0 HA2 GLY A 79 33.495 -2.851 5.305 1.00 0.00 H new ATOM 0 HA3 GLY A 79 31.938 -3.292 5.977 1.00 0.00 H new ATOM 1233 N ALA A 80 32.598 -4.912 3.970 1.00 0.00 N ATOM 1234 CA ALA A 80 32.346 -5.861 2.938 1.00 0.00 C ATOM 1235 C ALA A 80 31.084 -6.671 3.294 1.00 0.00 C ATOM 1236 O ALA A 80 30.422 -6.372 4.304 1.00 0.00 O ATOM 1237 CB ALA A 80 33.571 -6.722 2.764 1.00 0.00 C ATOM 0 H ALA A 80 33.157 -5.275 4.742 1.00 0.00 H new ATOM 0 HA ALA A 80 32.152 -5.372 1.983 1.00 0.00 H new ATOM 0 HB1 ALA A 80 33.392 -7.454 1.976 1.00 0.00 H new ATOM 0 HB2 ALA A 80 34.420 -6.096 2.491 1.00 0.00 H new ATOM 0 HB3 ALA A 80 33.787 -7.240 3.698 1.00 0.00 H new ATOM 1243 N ILE A 81 30.736 -7.672 2.500 1.00 0.00 N ATOM 1244 CA ILE A 81 29.510 -8.412 2.755 1.00 0.00 C ATOM 1245 C ILE A 81 29.721 -9.388 3.893 1.00 0.00 C ATOM 1246 O ILE A 81 30.451 -10.371 3.765 1.00 0.00 O ATOM 1247 CB ILE A 81 28.920 -9.175 1.513 1.00 0.00 C ATOM 1248 CG1 ILE A 81 28.470 -8.236 0.379 1.00 0.00 C ATOM 1249 CG2 ILE A 81 27.734 -10.020 1.940 1.00 0.00 C ATOM 1250 CD1 ILE A 81 29.572 -7.566 -0.391 1.00 0.00 C ATOM 0 H ILE A 81 31.272 -7.986 1.691 1.00 0.00 H new ATOM 0 HA ILE A 81 28.770 -7.655 3.015 1.00 0.00 H new ATOM 0 HB ILE A 81 29.727 -9.797 1.126 1.00 0.00 H new ATOM 0 HG12 ILE A 81 27.860 -8.808 -0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 81 27.829 -7.464 0.805 1.00 0.00 H new ATOM 0 HG21 ILE A 81 27.331 -10.545 1.074 1.00 0.00 H new ATOM 0 HG22 ILE A 81 28.055 -10.745 2.688 1.00 0.00 H new ATOM 0 HG23 ILE A 81 26.963 -9.377 2.365 1.00 0.00 H new ATOM 0 HD11 ILE A 81 29.141 -6.929 -1.164 1.00 0.00 H new ATOM 0 HD12 ILE A 81 30.172 -6.959 0.287 1.00 0.00 H new ATOM 0 HD13 ILE A 81 30.204 -8.323 -0.856 1.00 0.00 H new ATOM 1262 N THR A 82 29.093 -9.110 4.982 1.00 0.00 N ATOM 1263 CA THR A 82 29.227 -9.894 6.144 1.00 0.00 C ATOM 1264 C THR A 82 27.931 -10.643 6.425 1.00 0.00 C ATOM 1265 O THR A 82 26.836 -10.151 6.100 1.00 0.00 O ATOM 1266 CB THR A 82 29.604 -8.973 7.299 1.00 0.00 C ATOM 1267 OG1 THR A 82 28.885 -7.732 7.126 1.00 0.00 O ATOM 1268 CG2 THR A 82 31.100 -8.701 7.306 1.00 0.00 C ATOM 0 H THR A 82 28.462 -8.315 5.084 1.00 0.00 H new ATOM 0 HA THR A 82 30.009 -10.642 6.013 1.00 0.00 H new ATOM 0 HB THR A 82 29.345 -9.444 8.247 1.00 0.00 H new ATOM 0 HG1 THR A 82 28.125 -7.705 7.744 1.00 0.00 H new ATOM 0 HG21 THR A 82 31.346 -8.042 8.138 1.00 0.00 H new ATOM 0 HG22 THR A 82 31.640 -9.641 7.416 1.00 0.00 H new ATOM 0 HG23 THR A 82 31.388 -8.225 6.369 1.00 0.00 H new ATOM 1276 N GLU A 83 28.071 -11.827 6.997 1.00 0.00 N ATOM 1277 CA GLU A 83 26.971 -12.739 7.330 1.00 0.00 C ATOM 1278 C GLU A 83 25.779 -12.023 8.021 1.00 0.00 C ATOM 1279 O GLU A 83 24.617 -12.253 7.680 1.00 0.00 O ATOM 1280 CB GLU A 83 27.523 -13.806 8.248 1.00 0.00 C ATOM 1281 CG GLU A 83 26.619 -14.983 8.494 1.00 0.00 C ATOM 1282 CD GLU A 83 27.133 -15.841 9.609 1.00 0.00 C ATOM 1283 OE1 GLU A 83 28.316 -16.230 9.584 1.00 0.00 O ATOM 1284 OE2 GLU A 83 26.373 -16.089 10.565 1.00 0.00 O ATOM 0 H GLU A 83 28.985 -12.200 7.255 1.00 0.00 H new ATOM 0 HA GLU A 83 26.581 -13.162 6.404 1.00 0.00 H new ATOM 0 HB2 GLU A 83 28.460 -14.172 7.828 1.00 0.00 H new ATOM 0 HB3 GLU A 83 27.761 -13.347 9.207 1.00 0.00 H new ATOM 0 HG2 GLU A 83 25.617 -14.630 8.737 1.00 0.00 H new ATOM 0 HG3 GLU A 83 26.536 -15.577 7.584 1.00 0.00 H new ATOM 1291 N SER A 84 26.077 -11.160 8.975 1.00 0.00 N ATOM 1292 CA SER A 84 25.051 -10.437 9.734 1.00 0.00 C ATOM 1293 C SER A 84 24.231 -9.490 8.831 1.00 0.00 C ATOM 1294 O SER A 84 23.014 -9.343 9.007 1.00 0.00 O ATOM 1295 CB SER A 84 25.711 -9.671 10.903 1.00 0.00 C ATOM 1296 OG SER A 84 24.759 -8.993 11.714 1.00 0.00 O ATOM 0 H SER A 84 27.033 -10.935 9.252 1.00 0.00 H new ATOM 0 HA SER A 84 24.348 -11.164 10.142 1.00 0.00 H new ATOM 0 HB2 SER A 84 26.276 -10.371 11.519 1.00 0.00 H new ATOM 0 HB3 SER A 84 26.424 -8.949 10.504 1.00 0.00 H new ATOM 0 HG SER A 84 25.222 -8.525 12.440 1.00 0.00 H new ATOM 1302 N ASP A 85 24.875 -8.923 7.832 1.00 0.00 N ATOM 1303 CA ASP A 85 24.223 -7.964 6.950 1.00 0.00 C ATOM 1304 C ASP A 85 23.350 -8.645 5.938 1.00 0.00 C ATOM 1305 O ASP A 85 22.376 -8.070 5.451 1.00 0.00 O ATOM 1306 CB ASP A 85 25.240 -7.049 6.274 1.00 0.00 C ATOM 1307 CG ASP A 85 25.718 -5.953 7.189 1.00 0.00 C ATOM 1308 OD1 ASP A 85 24.980 -4.983 7.406 1.00 0.00 O ATOM 1309 OD2 ASP A 85 26.858 -6.031 7.669 1.00 0.00 O ATOM 0 H ASP A 85 25.852 -9.107 7.606 1.00 0.00 H new ATOM 0 HA ASP A 85 23.578 -7.343 7.571 1.00 0.00 H new ATOM 0 HB2 ASP A 85 26.093 -7.640 5.942 1.00 0.00 H new ATOM 0 HB3 ASP A 85 24.793 -6.607 5.384 1.00 0.00 H new ATOM 1314 N ILE A 86 23.684 -9.874 5.628 1.00 0.00 N ATOM 1315 CA ILE A 86 22.903 -10.667 4.703 1.00 0.00 C ATOM 1316 C ILE A 86 21.502 -10.956 5.240 1.00 0.00 C ATOM 1317 O ILE A 86 20.521 -10.980 4.490 1.00 0.00 O ATOM 1318 CB ILE A 86 23.643 -11.942 4.383 1.00 0.00 C ATOM 1319 CG1 ILE A 86 24.903 -11.567 3.637 1.00 0.00 C ATOM 1320 CG2 ILE A 86 22.783 -12.911 3.592 1.00 0.00 C ATOM 1321 CD1 ILE A 86 25.700 -12.722 3.203 1.00 0.00 C ATOM 0 H ILE A 86 24.501 -10.353 6.007 1.00 0.00 H new ATOM 0 HA ILE A 86 22.769 -10.094 3.786 1.00 0.00 H new ATOM 0 HB ILE A 86 23.900 -12.464 5.305 1.00 0.00 H new ATOM 0 HG12 ILE A 86 24.634 -10.974 2.763 1.00 0.00 H new ATOM 0 HG13 ILE A 86 25.517 -10.933 4.276 1.00 0.00 H new ATOM 0 HG21 ILE A 86 23.353 -13.816 3.382 1.00 0.00 H new ATOM 0 HG22 ILE A 86 21.896 -13.167 4.172 1.00 0.00 H new ATOM 0 HG23 ILE A 86 22.481 -12.447 2.653 1.00 0.00 H new ATOM 0 HD11 ILE A 86 26.588 -12.374 2.675 1.00 0.00 H new ATOM 0 HD12 ILE A 86 26.001 -13.304 4.074 1.00 0.00 H new ATOM 0 HD13 ILE A 86 25.104 -13.346 2.538 1.00 0.00 H new ATOM 1333 N SER A 87 21.407 -11.141 6.516 1.00 0.00 N ATOM 1334 CA SER A 87 20.135 -11.333 7.145 1.00 0.00 C ATOM 1335 C SER A 87 19.183 -10.104 6.964 1.00 0.00 C ATOM 1336 O SER A 87 17.960 -10.257 6.965 1.00 0.00 O ATOM 1337 CB SER A 87 20.352 -11.747 8.586 1.00 0.00 C ATOM 1338 OG SER A 87 21.083 -12.970 8.596 1.00 0.00 O ATOM 0 H SER A 87 22.204 -11.164 7.153 1.00 0.00 H new ATOM 0 HA SER A 87 19.604 -12.144 6.647 1.00 0.00 H new ATOM 0 HB2 SER A 87 20.899 -10.973 9.125 1.00 0.00 H new ATOM 0 HB3 SER A 87 19.395 -11.873 9.093 1.00 0.00 H new ATOM 0 HG SER A 87 20.753 -13.554 7.882 1.00 0.00 H new ATOM 1344 N LEU A 88 19.751 -8.911 6.743 1.00 0.00 N ATOM 1345 CA LEU A 88 18.953 -7.732 6.431 1.00 0.00 C ATOM 1346 C LEU A 88 18.470 -7.840 4.997 1.00 0.00 C ATOM 1347 O LEU A 88 17.328 -7.474 4.672 1.00 0.00 O ATOM 1348 CB LEU A 88 19.785 -6.424 6.657 1.00 0.00 C ATOM 1349 CG LEU A 88 19.155 -5.048 6.238 1.00 0.00 C ATOM 1350 CD1 LEU A 88 19.255 -4.793 4.732 1.00 0.00 C ATOM 1351 CD2 LEU A 88 17.701 -4.982 6.672 1.00 0.00 C ATOM 0 H LEU A 88 20.757 -8.743 6.776 1.00 0.00 H new ATOM 0 HA LEU A 88 18.091 -7.681 7.096 1.00 0.00 H new ATOM 0 HB2 LEU A 88 20.029 -6.367 7.718 1.00 0.00 H new ATOM 0 HB3 LEU A 88 20.727 -6.534 6.119 1.00 0.00 H new ATOM 0 HG LEU A 88 19.728 -4.270 6.742 1.00 0.00 H new ATOM 0 HD11 LEU A 88 18.805 -3.829 4.496 1.00 0.00 H new ATOM 0 HD12 LEU A 88 20.303 -4.787 4.433 1.00 0.00 H new ATOM 0 HD13 LEU A 88 18.728 -5.581 4.194 1.00 0.00 H new ATOM 0 HD21 LEU A 88 17.276 -4.023 6.376 1.00 0.00 H new ATOM 0 HD22 LEU A 88 17.143 -5.789 6.197 1.00 0.00 H new ATOM 0 HD23 LEU A 88 17.640 -5.087 7.755 1.00 0.00 H new ATOM 1363 N ALA A 89 19.334 -8.361 4.161 1.00 0.00 N ATOM 1364 CA ALA A 89 19.078 -8.504 2.751 1.00 0.00 C ATOM 1365 C ALA A 89 17.795 -9.283 2.482 1.00 0.00 C ATOM 1366 O ALA A 89 16.912 -8.807 1.782 1.00 0.00 O ATOM 1367 CB ALA A 89 20.278 -9.126 2.051 1.00 0.00 C ATOM 0 H ALA A 89 20.251 -8.703 4.448 1.00 0.00 H new ATOM 0 HA ALA A 89 18.927 -7.508 2.335 1.00 0.00 H new ATOM 0 HB1 ALA A 89 20.066 -9.226 0.986 1.00 0.00 H new ATOM 0 HB2 ALA A 89 21.151 -8.488 2.189 1.00 0.00 H new ATOM 0 HB3 ALA A 89 20.477 -10.110 2.476 1.00 0.00 H new ATOM 1373 N THR A 90 17.657 -10.434 3.086 1.00 0.00 N ATOM 1374 CA THR A 90 16.460 -11.232 2.891 1.00 0.00 C ATOM 1375 C THR A 90 15.271 -10.666 3.713 1.00 0.00 C ATOM 1376 O THR A 90 14.112 -10.968 3.438 1.00 0.00 O ATOM 1377 CB THR A 90 16.721 -12.736 3.220 1.00 0.00 C ATOM 1378 OG1 THR A 90 15.564 -13.553 2.963 1.00 0.00 O ATOM 1379 CG2 THR A 90 17.206 -12.932 4.647 1.00 0.00 C ATOM 0 H THR A 90 18.349 -10.843 3.714 1.00 0.00 H new ATOM 0 HA THR A 90 16.188 -11.173 1.837 1.00 0.00 H new ATOM 0 HB THR A 90 17.516 -13.061 2.549 1.00 0.00 H new ATOM 0 HG1 THR A 90 15.828 -14.340 2.443 1.00 0.00 H new ATOM 0 HG21 THR A 90 17.375 -13.993 4.831 1.00 0.00 H new ATOM 0 HG22 THR A 90 18.138 -12.386 4.793 1.00 0.00 H new ATOM 0 HG23 THR A 90 16.454 -12.558 5.342 1.00 0.00 H new ATOM 1387 N ALA A 91 15.568 -9.804 4.680 1.00 0.00 N ATOM 1388 CA ALA A 91 14.540 -9.211 5.525 1.00 0.00 C ATOM 1389 C ALA A 91 13.760 -8.141 4.771 1.00 0.00 C ATOM 1390 O ALA A 91 12.559 -8.282 4.527 1.00 0.00 O ATOM 1391 CB ALA A 91 15.151 -8.634 6.793 1.00 0.00 C ATOM 0 H ALA A 91 16.517 -9.500 4.898 1.00 0.00 H new ATOM 0 HA ALA A 91 13.843 -10.000 5.807 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.365 -8.196 7.409 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.650 -9.427 7.350 1.00 0.00 H new ATOM 0 HB3 ALA A 91 15.877 -7.864 6.530 1.00 0.00 H new ATOM 1397 N SER A 92 14.449 -7.108 4.359 1.00 0.00 N ATOM 1398 CA SER A 92 13.819 -5.998 3.668 1.00 0.00 C ATOM 1399 C SER A 92 13.831 -6.187 2.160 1.00 0.00 C ATOM 1400 O SER A 92 13.376 -5.310 1.418 1.00 0.00 O ATOM 1401 CB SER A 92 14.511 -4.697 4.039 1.00 0.00 C ATOM 1402 OG SER A 92 14.371 -4.425 5.424 1.00 0.00 O ATOM 0 H SER A 92 15.456 -7.007 4.489 1.00 0.00 H new ATOM 0 HA SER A 92 12.776 -5.960 3.984 1.00 0.00 H new ATOM 0 HB2 SER A 92 15.568 -4.757 3.781 1.00 0.00 H new ATOM 0 HB3 SER A 92 14.087 -3.877 3.459 1.00 0.00 H new ATOM 0 HG SER A 92 14.054 -3.506 5.546 1.00 0.00 H new ATOM 1408 N ASN A 93 14.380 -7.329 1.709 1.00 0.00 N ATOM 1409 CA ASN A 93 14.490 -7.675 0.261 1.00 0.00 C ATOM 1410 C ASN A 93 15.498 -6.763 -0.397 1.00 0.00 C ATOM 1411 O ASN A 93 15.517 -6.586 -1.611 1.00 0.00 O ATOM 1412 CB ASN A 93 13.123 -7.604 -0.478 1.00 0.00 C ATOM 1413 CG ASN A 93 12.114 -8.643 -0.020 1.00 0.00 C ATOM 1414 OD1 ASN A 93 10.911 -8.391 -0.005 1.00 0.00 O ATOM 1415 ND2 ASN A 93 12.574 -9.819 0.341 1.00 0.00 N ATOM 0 H ASN A 93 14.762 -8.044 2.328 1.00 0.00 H new ATOM 0 HA ASN A 93 14.825 -8.710 0.191 1.00 0.00 H new ATOM 0 HB2 ASN A 93 12.696 -6.611 -0.335 1.00 0.00 H new ATOM 0 HB3 ASN A 93 13.294 -7.726 -1.548 1.00 0.00 H new ATOM 0 HD21 ASN A 93 11.928 -10.549 0.643 1.00 0.00 H new ATOM 0 HD22 ASN A 93 13.577 -10.003 0.320 1.00 0.00 H new ATOM 1422 N ALA A 94 16.371 -6.244 0.418 1.00 0.00 N ATOM 1423 CA ALA A 94 17.373 -5.325 -0.003 1.00 0.00 C ATOM 1424 C ALA A 94 18.630 -6.085 -0.292 1.00 0.00 C ATOM 1425 O ALA A 94 19.191 -6.648 0.599 1.00 0.00 O ATOM 1426 CB ALA A 94 17.625 -4.339 1.127 1.00 0.00 C ATOM 0 H ALA A 94 16.401 -6.457 1.415 1.00 0.00 H new ATOM 0 HA ALA A 94 17.054 -4.791 -0.898 1.00 0.00 H new ATOM 0 HB1 ALA A 94 18.391 -3.625 0.823 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.703 -3.805 1.357 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.962 -4.878 2.012 1.00 0.00 H new ATOM 1432 N ILE A 95 19.104 -6.081 -1.503 1.00 0.00 N ATOM 1433 CA ILE A 95 20.289 -6.866 -1.781 1.00 0.00 C ATOM 1434 C ILE A 95 21.518 -6.011 -1.613 1.00 0.00 C ATOM 1435 O ILE A 95 21.443 -4.770 -1.682 1.00 0.00 O ATOM 1436 CB ILE A 95 20.287 -7.539 -3.183 1.00 0.00 C ATOM 1437 CG1 ILE A 95 20.255 -6.496 -4.314 1.00 0.00 C ATOM 1438 CG2 ILE A 95 19.117 -8.514 -3.298 1.00 0.00 C ATOM 1439 CD1 ILE A 95 20.373 -7.097 -5.705 1.00 0.00 C ATOM 0 H ILE A 95 18.713 -5.567 -2.293 1.00 0.00 H new ATOM 0 HA ILE A 95 20.293 -7.683 -1.059 1.00 0.00 H new ATOM 0 HB ILE A 95 21.217 -8.098 -3.291 1.00 0.00 H new ATOM 0 HG12 ILE A 95 19.324 -5.932 -4.250 1.00 0.00 H new ATOM 0 HG13 ILE A 95 21.069 -5.786 -4.165 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.126 -8.979 -4.284 1.00 0.00 H new ATOM 0 HG22 ILE A 95 19.209 -9.285 -2.533 1.00 0.00 H new ATOM 0 HG23 ILE A 95 18.180 -7.975 -3.160 1.00 0.00 H new ATOM 0 HD11 ILE A 95 20.343 -6.301 -6.449 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.316 -7.637 -5.789 1.00 0.00 H new ATOM 0 HD13 ILE A 95 19.545 -7.785 -5.876 1.00 0.00 H new ATOM 1451 N VAL A 96 22.630 -6.646 -1.365 1.00 0.00 N ATOM 1452 CA VAL A 96 23.835 -5.933 -1.053 1.00 0.00 C ATOM 1453 C VAL A 96 24.652 -5.728 -2.294 1.00 0.00 C ATOM 1454 O VAL A 96 25.079 -6.699 -2.944 1.00 0.00 O ATOM 1455 CB VAL A 96 24.715 -6.670 0.002 1.00 0.00 C ATOM 1456 CG1 VAL A 96 25.810 -5.750 0.526 1.00 0.00 C ATOM 1457 CG2 VAL A 96 23.889 -7.247 1.148 1.00 0.00 C ATOM 0 H VAL A 96 22.726 -7.661 -1.373 1.00 0.00 H new ATOM 0 HA VAL A 96 23.526 -4.977 -0.630 1.00 0.00 H new ATOM 0 HB VAL A 96 25.183 -7.515 -0.504 1.00 0.00 H new ATOM 0 HG11 VAL A 96 26.413 -6.284 1.261 1.00 0.00 H new ATOM 0 HG12 VAL A 96 26.444 -5.432 -0.301 1.00 0.00 H new ATOM 0 HG13 VAL A 96 25.358 -4.876 0.994 1.00 0.00 H new ATOM 0 HG21 VAL A 96 24.549 -7.750 1.855 1.00 0.00 H new ATOM 0 HG22 VAL A 96 23.359 -6.441 1.656 1.00 0.00 H new ATOM 0 HG23 VAL A 96 23.168 -7.963 0.753 1.00 0.00 H new ATOM 1467 N ILE A 97 24.829 -4.494 -2.638 1.00 0.00 N ATOM 1468 CA ILE A 97 25.696 -4.137 -3.705 1.00 0.00 C ATOM 1469 C ILE A 97 27.000 -3.654 -3.083 1.00 0.00 C ATOM 1470 O ILE A 97 27.057 -2.615 -2.399 1.00 0.00 O ATOM 1471 CB ILE A 97 25.064 -3.077 -4.683 1.00 0.00 C ATOM 1472 CG1 ILE A 97 26.045 -2.679 -5.804 1.00 0.00 C ATOM 1473 CG2 ILE A 97 24.544 -1.840 -3.949 1.00 0.00 C ATOM 1474 CD1 ILE A 97 26.438 -3.814 -6.729 1.00 0.00 C ATOM 0 H ILE A 97 24.372 -3.704 -2.182 1.00 0.00 H new ATOM 0 HA ILE A 97 25.879 -5.005 -4.338 1.00 0.00 H new ATOM 0 HB ILE A 97 24.204 -3.562 -5.144 1.00 0.00 H new ATOM 0 HG12 ILE A 97 25.595 -1.883 -6.397 1.00 0.00 H new ATOM 0 HG13 ILE A 97 26.947 -2.268 -5.351 1.00 0.00 H new ATOM 0 HG21 ILE A 97 24.119 -1.141 -4.670 1.00 0.00 H new ATOM 0 HG22 ILE A 97 23.776 -2.137 -3.235 1.00 0.00 H new ATOM 0 HG23 ILE A 97 25.366 -1.359 -3.419 1.00 0.00 H new ATOM 0 HD11 ILE A 97 27.129 -3.444 -7.486 1.00 0.00 H new ATOM 0 HD12 ILE A 97 26.920 -4.603 -6.152 1.00 0.00 H new ATOM 0 HD13 ILE A 97 25.547 -4.212 -7.215 1.00 0.00 H new ATOM 1486 N GLY A 98 28.007 -4.453 -3.239 1.00 0.00 N ATOM 1487 CA GLY A 98 29.261 -4.142 -2.664 1.00 0.00 C ATOM 1488 C GLY A 98 30.227 -3.691 -3.701 1.00 0.00 C ATOM 1489 O GLY A 98 30.285 -4.263 -4.796 1.00 0.00 O ATOM 0 H GLY A 98 27.977 -5.327 -3.763 1.00 0.00 H new ATOM 0 HA2 GLY A 98 29.137 -3.361 -1.914 1.00 0.00 H new ATOM 0 HA3 GLY A 98 29.657 -5.018 -2.150 1.00 0.00 H new ATOM 1493 N PHE A 99 31.016 -2.718 -3.393 1.00 0.00 N ATOM 1494 CA PHE A 99 31.907 -2.221 -4.402 1.00 0.00 C ATOM 1495 C PHE A 99 33.281 -2.832 -4.202 1.00 0.00 C ATOM 1496 O PHE A 99 34.051 -2.380 -3.372 1.00 0.00 O ATOM 1497 CB PHE A 99 31.951 -0.691 -4.408 1.00 0.00 C ATOM 1498 CG PHE A 99 32.188 -0.124 -5.780 1.00 0.00 C ATOM 1499 CD1 PHE A 99 31.117 0.090 -6.631 1.00 0.00 C ATOM 1500 CD2 PHE A 99 33.457 0.181 -6.230 1.00 0.00 C ATOM 1501 CE1 PHE A 99 31.306 0.599 -7.897 1.00 0.00 C ATOM 1502 CE2 PHE A 99 33.647 0.689 -7.504 1.00 0.00 C ATOM 1503 CZ PHE A 99 32.572 0.897 -8.333 1.00 0.00 C ATOM 0 H PHE A 99 31.069 -2.259 -2.484 1.00 0.00 H new ATOM 0 HA PHE A 99 31.537 -2.517 -5.384 1.00 0.00 H new ATOM 0 HB2 PHE A 99 31.011 -0.303 -4.016 1.00 0.00 H new ATOM 0 HB3 PHE A 99 32.740 -0.351 -3.737 1.00 0.00 H new ATOM 0 HD1 PHE A 99 30.117 -0.146 -6.297 1.00 0.00 H new ATOM 0 HD2 PHE A 99 34.308 0.022 -5.584 1.00 0.00 H new ATOM 0 HE1 PHE A 99 30.458 0.763 -8.546 1.00 0.00 H new ATOM 0 HE2 PHE A 99 34.644 0.922 -7.847 1.00 0.00 H new ATOM 0 HZ PHE A 99 32.723 1.294 -9.326 1.00 0.00 H new ATOM 1513 N ASN A 100 33.521 -3.937 -4.926 1.00 0.00 N ATOM 1514 CA ASN A 100 34.789 -4.735 -4.901 1.00 0.00 C ATOM 1515 C ASN A 100 35.111 -5.263 -3.476 1.00 0.00 C ATOM 1516 O ASN A 100 36.172 -5.795 -3.213 1.00 0.00 O ATOM 1517 CB ASN A 100 35.975 -3.910 -5.475 1.00 0.00 C ATOM 1518 CG ASN A 100 37.218 -4.757 -5.755 1.00 0.00 C ATOM 1519 OD1 ASN A 100 37.113 -5.941 -6.074 1.00 0.00 O ATOM 1520 ND2 ASN A 100 38.382 -4.166 -5.658 1.00 0.00 N ATOM 0 H ASN A 100 32.828 -4.323 -5.568 1.00 0.00 H new ATOM 0 HA ASN A 100 34.640 -5.605 -5.540 1.00 0.00 H new ATOM 0 HB2 ASN A 100 35.658 -3.425 -6.398 1.00 0.00 H new ATOM 0 HB3 ASN A 100 36.233 -3.119 -4.771 1.00 0.00 H new ATOM 0 HD21 ASN A 100 39.237 -4.689 -5.849 1.00 0.00 H new ATOM 0 HD22 ASN A 100 38.434 -3.183 -5.391 1.00 0.00 H new ATOM 1527 N VAL A 101 34.133 -5.210 -2.612 1.00 0.00 N ATOM 1528 CA VAL A 101 34.335 -5.537 -1.208 1.00 0.00 C ATOM 1529 C VAL A 101 34.377 -7.023 -0.928 1.00 0.00 C ATOM 1530 O VAL A 101 35.290 -7.486 -0.257 1.00 0.00 O ATOM 1531 CB VAL A 101 33.349 -4.827 -0.268 1.00 0.00 C ATOM 1532 CG1 VAL A 101 33.695 -3.371 -0.128 1.00 0.00 C ATOM 1533 CG2 VAL A 101 31.926 -4.966 -0.739 1.00 0.00 C ATOM 0 H VAL A 101 33.178 -4.942 -2.849 1.00 0.00 H new ATOM 0 HA VAL A 101 35.329 -5.147 -0.987 1.00 0.00 H new ATOM 0 HB VAL A 101 33.435 -5.311 0.705 1.00 0.00 H new ATOM 0 HG11 VAL A 101 32.982 -2.891 0.542 1.00 0.00 H new ATOM 0 HG12 VAL A 101 34.701 -3.274 0.281 1.00 0.00 H new ATOM 0 HG13 VAL A 101 33.653 -2.891 -1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 101 31.261 -4.450 -0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 101 31.827 -4.527 -1.732 1.00 0.00 H new ATOM 0 HG23 VAL A 101 31.658 -6.022 -0.780 1.00 0.00 H new ATOM 1543 N ARG A 102 33.379 -7.761 -1.444 1.00 0.00 N ATOM 1544 CA ARG A 102 33.331 -9.240 -1.356 1.00 0.00 C ATOM 1545 C ARG A 102 32.880 -9.740 0.029 1.00 0.00 C ATOM 1546 O ARG A 102 32.863 -8.980 0.973 1.00 0.00 O ATOM 1547 CB ARG A 102 34.652 -9.823 -1.868 1.00 0.00 C ATOM 1548 CG ARG A 102 34.803 -9.511 -3.339 1.00 0.00 C ATOM 1549 CD ARG A 102 36.216 -9.521 -3.820 1.00 0.00 C ATOM 1550 NE ARG A 102 37.022 -8.423 -3.252 1.00 0.00 N ATOM 1551 CZ ARG A 102 38.353 -8.425 -3.122 1.00 0.00 C ATOM 1552 NH1 ARG A 102 39.041 -9.561 -3.265 1.00 0.00 N ATOM 1553 NH2 ARG A 102 38.991 -7.294 -2.815 1.00 0.00 N ATOM 0 H ARG A 102 32.582 -7.355 -1.934 1.00 0.00 H new ATOM 0 HA ARG A 102 32.549 -9.620 -2.013 1.00 0.00 H new ATOM 0 HB2 ARG A 102 35.488 -9.404 -1.309 1.00 0.00 H new ATOM 0 HB3 ARG A 102 34.672 -10.901 -1.710 1.00 0.00 H new ATOM 0 HG2 ARG A 102 34.229 -10.237 -3.915 1.00 0.00 H new ATOM 0 HG3 ARG A 102 34.369 -8.531 -3.538 1.00 0.00 H new ATOM 0 HD2 ARG A 102 36.676 -10.475 -3.561 1.00 0.00 H new ATOM 0 HD3 ARG A 102 36.225 -9.447 -4.907 1.00 0.00 H new ATOM 0 HE ARG A 102 36.522 -7.593 -2.932 1.00 0.00 H new ATOM 0 HH11 ARG A 102 38.551 -10.431 -3.474 1.00 0.00 H new ATOM 0 HH12 ARG A 102 40.056 -9.558 -3.165 1.00 0.00 H new ATOM 0 HH21 ARG A 102 38.464 -6.431 -2.680 1.00 0.00 H new ATOM 0 HH22 ARG A 102 40.006 -7.292 -2.715 1.00 0.00 H new ATOM 1566 N PRO A 103 32.386 -10.979 0.140 1.00 0.00 N ATOM 1567 CA PRO A 103 31.866 -11.504 1.391 1.00 0.00 C ATOM 1568 C PRO A 103 32.817 -12.407 2.149 1.00 0.00 C ATOM 1569 O PRO A 103 33.950 -12.681 1.717 1.00 0.00 O ATOM 1570 CB PRO A 103 30.695 -12.377 0.915 1.00 0.00 C ATOM 1571 CG PRO A 103 30.914 -12.595 -0.566 1.00 0.00 C ATOM 1572 CD PRO A 103 32.235 -11.968 -0.920 1.00 0.00 C ATOM 0 HA PRO A 103 31.638 -10.686 2.074 1.00 0.00 H new ATOM 0 HB2 PRO A 103 30.673 -13.326 1.450 1.00 0.00 H new ATOM 0 HB3 PRO A 103 29.740 -11.884 1.100 1.00 0.00 H new ATOM 0 HG2 PRO A 103 30.919 -13.659 -0.801 1.00 0.00 H new ATOM 0 HG3 PRO A 103 30.107 -12.144 -1.144 1.00 0.00 H new ATOM 0 HD2 PRO A 103 33.047 -12.696 -0.920 1.00 0.00 H new ATOM 0 HD3 PRO A 103 32.219 -11.509 -1.909 1.00 0.00 H new ATOM 1580 N ASP A 104 32.340 -12.855 3.294 1.00 0.00 N ATOM 1581 CA ASP A 104 32.977 -13.917 4.031 1.00 0.00 C ATOM 1582 C ASP A 104 32.680 -15.195 3.273 1.00 0.00 C ATOM 1583 O ASP A 104 31.699 -15.251 2.501 1.00 0.00 O ATOM 1584 CB ASP A 104 32.379 -14.082 5.444 1.00 0.00 C ATOM 1585 CG ASP A 104 32.528 -12.901 6.360 1.00 0.00 C ATOM 1586 OD1 ASP A 104 33.548 -12.808 7.068 1.00 0.00 O ATOM 1587 OD2 ASP A 104 31.602 -12.084 6.443 1.00 0.00 O ATOM 0 H ASP A 104 31.497 -12.489 3.736 1.00 0.00 H new ATOM 0 HA ASP A 104 34.040 -13.696 4.130 1.00 0.00 H new ATOM 0 HB2 ASP A 104 31.317 -14.309 5.344 1.00 0.00 H new ATOM 0 HB3 ASP A 104 32.846 -14.946 5.917 1.00 0.00 H new ATOM 1592 N ALA A 105 33.456 -16.218 3.496 1.00 0.00 N ATOM 1593 CA ALA A 105 33.236 -17.491 2.831 1.00 0.00 C ATOM 1594 C ALA A 105 31.938 -18.117 3.326 1.00 0.00 C ATOM 1595 O ALA A 105 31.278 -18.853 2.607 1.00 0.00 O ATOM 1596 CB ALA A 105 34.409 -18.430 3.056 1.00 0.00 C ATOM 0 H ALA A 105 34.252 -16.204 4.134 1.00 0.00 H new ATOM 0 HA ALA A 105 33.153 -17.315 1.758 1.00 0.00 H new ATOM 0 HB1 ALA A 105 34.220 -19.376 2.548 1.00 0.00 H new ATOM 0 HB2 ALA A 105 35.318 -17.979 2.657 1.00 0.00 H new ATOM 0 HB3 ALA A 105 34.532 -18.610 4.124 1.00 0.00 H new ATOM 1602 N ASN A 106 31.574 -17.801 4.546 1.00 0.00 N ATOM 1603 CA ASN A 106 30.324 -18.277 5.099 1.00 0.00 C ATOM 1604 C ASN A 106 29.200 -17.337 4.711 1.00 0.00 C ATOM 1605 O ASN A 106 28.103 -17.780 4.439 1.00 0.00 O ATOM 1606 CB ASN A 106 30.405 -18.402 6.603 1.00 0.00 C ATOM 1607 CG ASN A 106 29.207 -19.113 7.199 1.00 0.00 C ATOM 1608 OD1 ASN A 106 28.190 -18.505 7.518 1.00 0.00 O ATOM 1609 ND2 ASN A 106 29.337 -20.401 7.379 1.00 0.00 N ATOM 0 H ASN A 106 32.124 -17.217 5.176 1.00 0.00 H new ATOM 0 HA ASN A 106 30.123 -19.267 4.691 1.00 0.00 H new ATOM 0 HB2 ASN A 106 31.313 -18.944 6.870 1.00 0.00 H new ATOM 0 HB3 ASN A 106 30.487 -17.408 7.042 1.00 0.00 H new ATOM 0 HD21 ASN A 106 28.577 -20.937 7.798 1.00 0.00 H new ATOM 0 HD22 ASN A 106 30.199 -20.870 7.100 1.00 0.00 H new ATOM 1616 N ALA A 107 29.479 -16.031 4.659 1.00 0.00 N ATOM 1617 CA ALA A 107 28.470 -15.075 4.227 1.00 0.00 C ATOM 1618 C ALA A 107 28.000 -15.386 2.810 1.00 0.00 C ATOM 1619 O ALA A 107 26.822 -15.402 2.547 1.00 0.00 O ATOM 1620 CB ALA A 107 28.954 -13.631 4.335 1.00 0.00 C ATOM 0 H ALA A 107 30.380 -15.622 4.907 1.00 0.00 H new ATOM 0 HA ALA A 107 27.623 -15.178 4.905 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.165 -12.957 4.001 1.00 0.00 H new ATOM 0 HB2 ALA A 107 29.207 -13.409 5.372 1.00 0.00 H new ATOM 0 HB3 ALA A 107 29.836 -13.495 3.709 1.00 0.00 H new ATOM 1626 N LYS A 108 28.932 -15.691 1.916 1.00 0.00 N ATOM 1627 CA LYS A 108 28.589 -16.026 0.531 1.00 0.00 C ATOM 1628 C LYS A 108 27.619 -17.237 0.459 1.00 0.00 C ATOM 1629 O LYS A 108 26.792 -17.330 -0.451 1.00 0.00 O ATOM 1630 CB LYS A 108 29.884 -16.226 -0.321 1.00 0.00 C ATOM 1631 CG LYS A 108 30.646 -17.563 -0.212 1.00 0.00 C ATOM 1632 CD LYS A 108 29.992 -18.719 -0.997 1.00 0.00 C ATOM 1633 CE LYS A 108 29.800 -18.395 -2.484 1.00 0.00 C ATOM 1634 NZ LYS A 108 31.065 -18.041 -3.162 1.00 0.00 N ATOM 0 H LYS A 108 29.931 -15.715 2.120 1.00 0.00 H new ATOM 0 HA LYS A 108 28.048 -15.187 0.094 1.00 0.00 H new ATOM 0 HB2 LYS A 108 29.616 -16.083 -1.368 1.00 0.00 H new ATOM 0 HB3 LYS A 108 30.578 -15.428 -0.058 1.00 0.00 H new ATOM 0 HG2 LYS A 108 31.664 -17.421 -0.574 1.00 0.00 H new ATOM 0 HG3 LYS A 108 30.718 -17.845 0.839 1.00 0.00 H new ATOM 0 HD2 LYS A 108 30.610 -19.612 -0.901 1.00 0.00 H new ATOM 0 HD3 LYS A 108 29.024 -18.952 -0.553 1.00 0.00 H new ATOM 0 HE2 LYS A 108 29.354 -19.255 -2.984 1.00 0.00 H new ATOM 0 HE3 LYS A 108 29.097 -17.568 -2.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 30.887 -17.898 -4.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 31.446 -17.165 -2.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 31.753 -18.810 -3.036 1.00 0.00 H new ATOM 1647 N ARG A 109 27.725 -18.135 1.442 1.00 0.00 N ATOM 1648 CA ARG A 109 26.937 -19.267 1.581 1.00 0.00 C ATOM 1649 C ARG A 109 25.579 -18.843 2.112 1.00 0.00 C ATOM 1650 O ARG A 109 24.528 -19.155 1.526 1.00 0.00 O ATOM 1651 CB ARG A 109 27.611 -20.103 2.639 1.00 0.00 C ATOM 1652 CG ARG A 109 28.896 -20.815 2.287 1.00 0.00 C ATOM 1653 CD ARG A 109 29.292 -21.784 3.398 1.00 0.00 C ATOM 1654 NE ARG A 109 30.618 -22.390 3.180 1.00 0.00 N ATOM 1655 CZ ARG A 109 31.119 -23.434 3.876 1.00 0.00 C ATOM 1656 NH1 ARG A 109 30.366 -24.083 4.770 1.00 0.00 N ATOM 1657 NH2 ARG A 109 32.362 -23.836 3.663 1.00 0.00 N ATOM 0 H ARG A 109 28.419 -18.045 2.185 1.00 0.00 H new ATOM 0 HA ARG A 109 26.817 -19.803 0.639 1.00 0.00 H new ATOM 0 HB2 ARG A 109 27.814 -19.456 3.493 1.00 0.00 H new ATOM 0 HB3 ARG A 109 26.896 -20.855 2.972 1.00 0.00 H new ATOM 0 HG2 ARG A 109 28.773 -21.358 1.350 1.00 0.00 H new ATOM 0 HG3 ARG A 109 29.692 -20.086 2.131 1.00 0.00 H new ATOM 0 HD2 ARG A 109 29.291 -21.256 4.352 1.00 0.00 H new ATOM 0 HD3 ARG A 109 28.544 -22.573 3.469 1.00 0.00 H new ATOM 0 HE ARG A 109 31.203 -21.990 2.446 1.00 0.00 H new ATOM 0 HH11 ARG A 109 29.402 -23.791 4.933 1.00 0.00 H new ATOM 0 HH12 ARG A 109 30.755 -24.870 5.289 1.00 0.00 H new ATOM 0 HH21 ARG A 109 32.942 -23.358 2.973 1.00 0.00 H new ATOM 0 HH22 ARG A 109 32.740 -24.624 4.188 1.00 0.00 H new ATOM 1670 N ALA A 110 25.645 -18.091 3.215 1.00 0.00 N ATOM 1671 CA ALA A 110 24.505 -17.571 3.952 1.00 0.00 C ATOM 1672 C ALA A 110 23.585 -16.836 3.042 1.00 0.00 C ATOM 1673 O ALA A 110 22.411 -17.088 3.055 1.00 0.00 O ATOM 1674 CB ALA A 110 24.976 -16.654 5.075 1.00 0.00 C ATOM 0 H ALA A 110 26.536 -17.820 3.631 1.00 0.00 H new ATOM 0 HA ALA A 110 23.964 -18.411 4.387 1.00 0.00 H new ATOM 0 HB1 ALA A 110 24.112 -16.272 5.619 1.00 0.00 H new ATOM 0 HB2 ALA A 110 25.616 -17.213 5.757 1.00 0.00 H new ATOM 0 HB3 ALA A 110 25.537 -15.820 4.653 1.00 0.00 H new ATOM 1680 N ALA A 111 24.167 -15.989 2.204 1.00 0.00 N ATOM 1681 CA ALA A 111 23.461 -15.182 1.218 1.00 0.00 C ATOM 1682 C ALA A 111 22.485 -16.017 0.442 1.00 0.00 C ATOM 1683 O ALA A 111 21.277 -15.761 0.407 1.00 0.00 O ATOM 1684 CB ALA A 111 24.480 -14.563 0.255 1.00 0.00 C ATOM 0 H ALA A 111 25.176 -15.840 2.191 1.00 0.00 H new ATOM 0 HA ALA A 111 22.908 -14.399 1.737 1.00 0.00 H new ATOM 0 HB1 ALA A 111 23.959 -13.957 -0.486 1.00 0.00 H new ATOM 0 HB2 ALA A 111 25.174 -13.935 0.814 1.00 0.00 H new ATOM 0 HB3 ALA A 111 25.033 -15.356 -0.248 1.00 0.00 H new ATOM 1690 N GLU A 112 22.985 -17.058 -0.088 1.00 0.00 N ATOM 1691 CA GLU A 112 22.230 -17.886 -0.960 1.00 0.00 C ATOM 1692 C GLU A 112 21.287 -18.800 -0.217 1.00 0.00 C ATOM 1693 O GLU A 112 20.235 -19.169 -0.722 1.00 0.00 O ATOM 1694 CB GLU A 112 23.154 -18.624 -1.872 1.00 0.00 C ATOM 1695 CG GLU A 112 23.801 -17.743 -2.925 1.00 0.00 C ATOM 1696 CD GLU A 112 24.665 -18.526 -3.866 1.00 0.00 C ATOM 1697 OE1 GLU A 112 24.191 -19.538 -4.412 1.00 0.00 O ATOM 1698 OE2 GLU A 112 25.823 -18.136 -4.112 1.00 0.00 O ATOM 0 H GLU A 112 23.943 -17.372 0.067 1.00 0.00 H new ATOM 0 HA GLU A 112 21.585 -17.252 -1.568 1.00 0.00 H new ATOM 0 HB2 GLU A 112 23.935 -19.099 -1.278 1.00 0.00 H new ATOM 0 HB3 GLU A 112 22.601 -19.422 -2.368 1.00 0.00 H new ATOM 0 HG2 GLU A 112 23.025 -17.227 -3.491 1.00 0.00 H new ATOM 0 HG3 GLU A 112 24.402 -16.976 -2.436 1.00 0.00 H new ATOM 1705 N SER A 113 21.620 -19.091 0.985 1.00 0.00 N ATOM 1706 CA SER A 113 20.792 -19.900 1.822 1.00 0.00 C ATOM 1707 C SER A 113 19.772 -18.983 2.511 1.00 0.00 C ATOM 1708 O SER A 113 18.976 -19.408 3.347 1.00 0.00 O ATOM 1709 CB SER A 113 21.698 -20.652 2.816 1.00 0.00 C ATOM 1710 OG SER A 113 20.980 -21.515 3.687 1.00 0.00 O ATOM 0 H SER A 113 22.483 -18.775 1.428 1.00 0.00 H new ATOM 0 HA SER A 113 20.235 -20.649 1.259 1.00 0.00 H new ATOM 0 HB2 SER A 113 22.431 -21.236 2.259 1.00 0.00 H new ATOM 0 HB3 SER A 113 22.254 -19.927 3.411 1.00 0.00 H new ATOM 0 HG SER A 113 20.075 -21.164 3.822 1.00 0.00 H new ATOM 1716 N GLU A 114 19.805 -17.740 2.116 1.00 0.00 N ATOM 1717 CA GLU A 114 18.949 -16.725 2.605 1.00 0.00 C ATOM 1718 C GLU A 114 18.201 -16.081 1.526 1.00 0.00 C ATOM 1719 O GLU A 114 17.598 -15.034 1.742 1.00 0.00 O ATOM 1720 CB GLU A 114 19.720 -15.703 3.365 1.00 0.00 C ATOM 1721 CG GLU A 114 19.804 -16.082 4.807 1.00 0.00 C ATOM 1722 CD GLU A 114 20.575 -15.164 5.724 1.00 0.00 C ATOM 1723 OE1 GLU A 114 21.806 -15.285 5.791 1.00 0.00 O ATOM 1724 OE2 GLU A 114 19.940 -14.389 6.493 1.00 0.00 O ATOM 0 H GLU A 114 20.463 -17.405 1.413 1.00 0.00 H new ATOM 0 HA GLU A 114 18.234 -17.204 3.275 1.00 0.00 H new ATOM 0 HB2 GLU A 114 20.723 -15.610 2.948 1.00 0.00 H new ATOM 0 HB3 GLU A 114 19.241 -14.729 3.266 1.00 0.00 H new ATOM 0 HG2 GLU A 114 18.788 -16.167 5.192 1.00 0.00 H new ATOM 0 HG3 GLU A 114 20.252 -17.074 4.869 1.00 0.00 H new ATOM 1731 N LYS A 115 18.224 -16.700 0.349 1.00 0.00 N ATOM 1732 CA LYS A 115 17.480 -16.247 -0.769 1.00 0.00 C ATOM 1733 C LYS A 115 17.984 -14.928 -1.348 1.00 0.00 C ATOM 1734 O LYS A 115 17.309 -14.312 -2.174 1.00 0.00 O ATOM 1735 CB LYS A 115 16.050 -16.142 -0.345 1.00 0.00 C ATOM 1736 CG LYS A 115 15.319 -17.464 -0.230 1.00 0.00 C ATOM 1737 CD LYS A 115 13.911 -17.278 0.342 1.00 0.00 C ATOM 1738 CE LYS A 115 13.062 -16.335 -0.518 1.00 0.00 C ATOM 1739 NZ LYS A 115 11.718 -16.114 0.058 1.00 0.00 N ATOM 0 H LYS A 115 18.774 -17.539 0.167 1.00 0.00 H new ATOM 0 HA LYS A 115 17.598 -16.966 -1.580 1.00 0.00 H new ATOM 0 HB2 LYS A 115 16.009 -15.636 0.619 1.00 0.00 H new ATOM 0 HB3 LYS A 115 15.520 -15.512 -1.059 1.00 0.00 H new ATOM 0 HG2 LYS A 115 15.255 -17.932 -1.212 1.00 0.00 H new ATOM 0 HG3 LYS A 115 15.886 -18.140 0.409 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.417 -18.247 0.413 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.981 -16.881 1.355 1.00 0.00 H new ATOM 0 HE2 LYS A 115 13.574 -15.378 -0.619 1.00 0.00 H new ATOM 0 HE3 LYS A 115 12.962 -16.751 -1.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.179 -15.471 -0.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.218 -17.023 0.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.811 -15.693 1.004 1.00 0.00 H new ATOM 1752 N VAL A 116 19.154 -14.503 -0.941 1.00 0.00 N ATOM 1753 CA VAL A 116 19.692 -13.239 -1.427 1.00 0.00 C ATOM 1754 C VAL A 116 21.079 -13.366 -2.024 1.00 0.00 C ATOM 1755 O VAL A 116 22.033 -13.619 -1.326 1.00 0.00 O ATOM 1756 CB VAL A 116 19.674 -12.142 -0.329 1.00 0.00 C ATOM 1757 CG1 VAL A 116 18.274 -11.581 -0.185 1.00 0.00 C ATOM 1758 CG2 VAL A 116 20.134 -12.712 1.020 1.00 0.00 C ATOM 0 H VAL A 116 19.753 -15.001 -0.282 1.00 0.00 H new ATOM 0 HA VAL A 116 19.025 -12.934 -2.234 1.00 0.00 H new ATOM 0 HB VAL A 116 20.360 -11.349 -0.627 1.00 0.00 H new ATOM 0 HG11 VAL A 116 18.268 -10.812 0.587 1.00 0.00 H new ATOM 0 HG12 VAL A 116 17.957 -11.146 -1.133 1.00 0.00 H new ATOM 0 HG13 VAL A 116 17.588 -12.381 0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 116 20.113 -11.925 1.774 1.00 0.00 H new ATOM 0 HG22 VAL A 116 19.467 -13.520 1.320 1.00 0.00 H new ATOM 0 HG23 VAL A 116 21.149 -13.097 0.925 1.00 0.00 H new ATOM 1768 N ASP A 117 21.213 -13.168 -3.319 1.00 0.00 N ATOM 1769 CA ASP A 117 22.542 -13.228 -3.888 1.00 0.00 C ATOM 1770 C ASP A 117 23.100 -11.838 -3.931 1.00 0.00 C ATOM 1771 O ASP A 117 22.384 -10.858 -4.161 1.00 0.00 O ATOM 1772 CB ASP A 117 22.641 -13.923 -5.274 1.00 0.00 C ATOM 1773 CG ASP A 117 22.176 -13.094 -6.455 1.00 0.00 C ATOM 1774 OD1 ASP A 117 20.972 -13.118 -6.770 1.00 0.00 O ATOM 1775 OD2 ASP A 117 23.022 -12.463 -7.127 1.00 0.00 O ATOM 0 H ASP A 117 20.455 -12.972 -3.973 1.00 0.00 H new ATOM 0 HA ASP A 117 23.136 -13.871 -3.238 1.00 0.00 H new ATOM 0 HB2 ASP A 117 23.678 -14.213 -5.442 1.00 0.00 H new ATOM 0 HB3 ASP A 117 22.054 -14.841 -5.243 1.00 0.00 H new ATOM 1780 N ILE A 118 24.341 -11.756 -3.645 1.00 0.00 N ATOM 1781 CA ILE A 118 25.037 -10.517 -3.519 1.00 0.00 C ATOM 1782 C ILE A 118 25.857 -10.242 -4.756 1.00 0.00 C ATOM 1783 O ILE A 118 26.365 -11.177 -5.395 1.00 0.00 O ATOM 1784 CB ILE A 118 25.920 -10.553 -2.258 1.00 0.00 C ATOM 1785 CG1 ILE A 118 26.752 -11.857 -2.240 1.00 0.00 C ATOM 1786 CG2 ILE A 118 25.043 -10.432 -1.007 1.00 0.00 C ATOM 1787 CD1 ILE A 118 27.540 -12.082 -0.990 1.00 0.00 C ATOM 0 H ILE A 118 24.930 -12.573 -3.485 1.00 0.00 H new ATOM 0 HA ILE A 118 24.317 -9.705 -3.417 1.00 0.00 H new ATOM 0 HB ILE A 118 26.611 -9.710 -2.268 1.00 0.00 H new ATOM 0 HG12 ILE A 118 26.079 -12.702 -2.386 1.00 0.00 H new ATOM 0 HG13 ILE A 118 27.437 -11.845 -3.087 1.00 0.00 H new ATOM 0 HG21 ILE A 118 25.672 -10.458 -0.117 1.00 0.00 H new ATOM 0 HG22 ILE A 118 24.495 -9.490 -1.036 1.00 0.00 H new ATOM 0 HG23 ILE A 118 24.337 -11.262 -0.976 1.00 0.00 H new ATOM 0 HD11 ILE A 118 28.090 -13.020 -1.070 1.00 0.00 H new ATOM 0 HD12 ILE A 118 28.242 -11.260 -0.850 1.00 0.00 H new ATOM 0 HD13 ILE A 118 26.863 -12.130 -0.137 1.00 0.00 H new ATOM 1799 N ARG A 119 25.958 -8.984 -5.127 1.00 0.00 N ATOM 1800 CA ARG A 119 26.692 -8.630 -6.314 1.00 0.00 C ATOM 1801 C ARG A 119 27.799 -7.663 -5.954 1.00 0.00 C ATOM 1802 O ARG A 119 27.572 -6.666 -5.253 1.00 0.00 O ATOM 1803 CB ARG A 119 25.772 -8.049 -7.405 1.00 0.00 C ATOM 1804 CG ARG A 119 24.525 -8.890 -7.675 1.00 0.00 C ATOM 1805 CD ARG A 119 23.843 -8.501 -8.976 1.00 0.00 C ATOM 1806 NE ARG A 119 24.615 -8.956 -10.148 1.00 0.00 N ATOM 1807 CZ ARG A 119 24.340 -8.659 -11.424 1.00 0.00 C ATOM 1808 NH1 ARG A 119 23.373 -7.789 -11.717 1.00 0.00 N ATOM 1809 NH2 ARG A 119 25.047 -9.226 -12.405 1.00 0.00 N ATOM 0 H ARG A 119 25.544 -8.198 -4.626 1.00 0.00 H new ATOM 0 HA ARG A 119 27.133 -9.535 -6.730 1.00 0.00 H new ATOM 0 HB2 ARG A 119 25.465 -7.045 -7.111 1.00 0.00 H new ATOM 0 HB3 ARG A 119 26.339 -7.950 -8.330 1.00 0.00 H new ATOM 0 HG2 ARG A 119 24.800 -9.944 -7.712 1.00 0.00 H new ATOM 0 HG3 ARG A 119 23.823 -8.772 -6.849 1.00 0.00 H new ATOM 0 HD2 ARG A 119 22.843 -8.934 -9.007 1.00 0.00 H new ATOM 0 HD3 ARG A 119 23.723 -7.418 -9.016 1.00 0.00 H new ATOM 0 HE ARG A 119 25.427 -9.547 -9.971 1.00 0.00 H new ATOM 0 HH11 ARG A 119 22.840 -7.347 -10.968 1.00 0.00 H new ATOM 0 HH12 ARG A 119 23.166 -7.565 -12.690 1.00 0.00 H new ATOM 0 HH21 ARG A 119 25.794 -9.883 -12.181 1.00 0.00 H new ATOM 0 HH22 ARG A 119 24.840 -9.002 -13.378 1.00 0.00 H new ATOM 1822 N LEU A 120 28.997 -7.979 -6.377 1.00 0.00 N ATOM 1823 CA LEU A 120 30.172 -7.196 -6.070 1.00 0.00 C ATOM 1824 C LEU A 120 31.292 -7.535 -7.007 1.00 0.00 C ATOM 1825 O LEU A 120 31.252 -8.588 -7.638 1.00 0.00 O ATOM 1826 CB LEU A 120 30.649 -7.360 -4.573 1.00 0.00 C ATOM 1827 CG LEU A 120 30.762 -8.781 -3.901 1.00 0.00 C ATOM 1828 CD1 LEU A 120 29.408 -9.364 -3.543 1.00 0.00 C ATOM 1829 CD2 LEU A 120 31.551 -9.785 -4.732 1.00 0.00 C ATOM 0 H LEU A 120 29.188 -8.799 -6.953 1.00 0.00 H new ATOM 0 HA LEU A 120 29.889 -6.152 -6.202 1.00 0.00 H new ATOM 0 HB2 LEU A 120 31.632 -6.895 -4.500 1.00 0.00 H new ATOM 0 HB3 LEU A 120 29.971 -6.770 -3.957 1.00 0.00 H new ATOM 0 HG LEU A 120 31.320 -8.604 -2.981 1.00 0.00 H new ATOM 0 HD11 LEU A 120 29.543 -10.343 -3.083 1.00 0.00 H new ATOM 0 HD12 LEU A 120 28.900 -8.701 -2.842 1.00 0.00 H new ATOM 0 HD13 LEU A 120 28.806 -9.467 -4.446 1.00 0.00 H new ATOM 0 HD21 LEU A 120 31.588 -10.741 -4.209 1.00 0.00 H new ATOM 0 HD22 LEU A 120 31.065 -9.919 -5.698 1.00 0.00 H new ATOM 0 HD23 LEU A 120 32.565 -9.415 -4.884 1.00 0.00 H new