USER MOD reduce.3.24.130724 H: found=0, std=0, add=633, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 627 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 26 GLN : amide:sc= 1.37 K(o=1.6,f=-2.8) USER MOD Set 1.2: A 50 LYS NZ :NH3+ -166:sc= 0.21 (180deg=-0.21) USER MOD Single : A 1 MET CE :methyl -177:sc= 0 (180deg=-0.0226) USER MOD Single : A 1 MET N :NH3+ -113:sc= 0.0147 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.0171 USER MOD Single : A 6 SER OG : rot 180:sc= 0.00131 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 47:sc= 1.23 USER MOD Single : A 15 LYS NZ :NH3+ 145:sc= 0.901 (180deg=0.318) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 24 GLN : amide:sc=-0.00738 X(o=-0.0074,f=-0.0074) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 90:sc= 1.25 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc=-0.00218 X(o=-0.0022,f=-0.25) USER MOD Single : A 49 SER OG : rot 70:sc= 1 USER MOD Single : A 52 SER OG : rot 75:sc= 0.487 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -0.0939 K(o=-0.094,f=-1.1) USER MOD Single : A 57 TYR OH : rot 180:sc=-0.00224 USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 THR OG1 : rot -63:sc= 0.235 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ -173:sc= 1.15 (180deg=1.12) USER MOD Single : A 78 HIS : no HE2:sc= 0.395 K(o=0.39,f=-1.5) USER MOD Single : A 79 HIS : no HD1:sc=-0.00618 X(o=-0.0062,f=-0.0062) USER MOD Single : A 80 HIS : no HD1:sc= -0.0282 X(o=-0.028,f=-0.058) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=-0.0058) USER MOD Single : A 82 HIS : no HD1:sc= -0.0555 X(o=-0.056,f=-0.056) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.329 2.324 12.553 1.00 10.00 N ATOM 2 CA MET A 1 -15.688 3.544 11.991 1.00 10.00 C ATOM 3 C MET A 1 -14.486 3.162 11.125 1.00 10.00 C ATOM 4 O MET A 1 -13.761 2.220 11.452 1.00 10.00 O ATOM 5 CB MET A 1 -15.240 4.536 13.086 1.00 10.00 C ATOM 6 CG MET A 1 -16.414 5.148 13.869 1.00 10.00 C ATOM 7 SD MET A 1 -15.956 6.450 15.053 1.00 10.00 S ATOM 8 CE MET A 1 -15.029 5.489 16.284 1.00 10.00 C ATOM 0 H1 MET A 1 -17.276 2.207 12.138 1.00 10.00 H new ATOM 0 H2 MET A 1 -15.747 1.492 12.329 1.00 10.00 H new ATOM 0 H3 MET A 1 -16.413 2.420 13.585 1.00 10.00 H new ATOM 0 HA MET A 1 -16.442 4.043 11.382 1.00 10.00 H new ATOM 0 HB2 MET A 1 -14.576 4.023 13.782 1.00 10.00 H new ATOM 0 HB3 MET A 1 -14.662 5.337 12.626 1.00 10.00 H new ATOM 0 HG2 MET A 1 -17.129 5.561 13.157 1.00 10.00 H new ATOM 0 HG3 MET A 1 -16.925 4.351 14.409 1.00 10.00 H new ATOM 0 HE1 MET A 1 -14.727 6.142 17.103 1.00 10.00 H new ATOM 0 HE2 MET A 1 -15.660 4.689 16.671 1.00 10.00 H new ATOM 0 HE3 MET A 1 -14.143 5.059 15.818 1.00 10.00 H new ATOM 20 N ALA A 2 -14.261 3.880 10.019 1.00 10.00 N ATOM 21 CA ALA A 2 -13.093 3.691 9.151 1.00 10.00 C ATOM 22 C ALA A 2 -11.767 4.032 9.813 1.00 10.00 C ATOM 23 O ALA A 2 -11.661 4.839 10.743 1.00 10.00 O ATOM 24 CB ALA A 2 -13.213 4.606 7.917 1.00 10.00 C ATOM 0 H ALA A 2 -14.891 4.616 9.698 1.00 10.00 H new ATOM 0 HA ALA A 2 -13.091 2.631 8.898 1.00 10.00 H new ATOM 0 HB1 ALA A 2 -12.345 4.465 7.273 1.00 10.00 H new ATOM 0 HB2 ALA A 2 -14.119 4.355 7.365 1.00 10.00 H new ATOM 0 HB3 ALA A 2 -13.260 5.646 8.239 1.00 10.00 H new ATOM 30 N THR A 3 -10.741 3.425 9.236 1.00 10.00 N ATOM 31 CA THR A 3 -9.355 3.748 9.494 1.00 10.00 C ATOM 32 C THR A 3 -8.946 4.916 8.615 1.00 10.00 C ATOM 33 O THR A 3 -9.495 5.104 7.519 1.00 10.00 O ATOM 34 CB THR A 3 -8.451 2.571 9.189 1.00 10.00 C ATOM 35 OG1 THR A 3 -8.748 1.963 7.945 1.00 10.00 O ATOM 36 CG2 THR A 3 -8.669 1.545 10.295 1.00 10.00 C ATOM 0 H THR A 3 -10.858 2.673 8.557 1.00 10.00 H new ATOM 0 HA THR A 3 -9.254 4.002 10.549 1.00 10.00 H new ATOM 0 HB THR A 3 -7.421 2.924 9.136 1.00 10.00 H new ATOM 0 HG1 THR A 3 -8.137 1.212 7.794 1.00 10.00 H new ATOM 0 HG21 THR A 3 -8.035 0.676 10.116 1.00 10.00 H new ATOM 0 HG22 THR A 3 -8.414 1.988 11.258 1.00 10.00 H new ATOM 0 HG23 THR A 3 -9.714 1.236 10.304 1.00 10.00 H new ATOM 44 N PRO A 4 -8.012 5.742 9.100 1.00 10.00 N ATOM 45 CA PRO A 4 -7.718 6.991 8.436 1.00 10.00 C ATOM 46 C PRO A 4 -7.191 6.834 7.002 1.00 10.00 C ATOM 47 O PRO A 4 -6.320 6.007 6.721 1.00 10.00 O ATOM 48 CB PRO A 4 -6.761 7.743 9.353 1.00 10.00 C ATOM 49 CG PRO A 4 -6.916 7.061 10.714 1.00 10.00 C ATOM 50 CD PRO A 4 -7.354 5.651 10.393 1.00 10.00 C ATOM 0 HA PRO A 4 -8.637 7.557 8.283 1.00 10.00 H new ATOM 0 HB2 PRO A 4 -5.734 7.680 8.992 1.00 10.00 H new ATOM 0 HB3 PRO A 4 -7.015 8.802 9.409 1.00 10.00 H new ATOM 0 HG2 PRO A 4 -5.977 7.067 11.268 1.00 10.00 H new ATOM 0 HG3 PRO A 4 -7.654 7.573 11.331 1.00 10.00 H new ATOM 0 HD2 PRO A 4 -6.501 4.973 10.354 1.00 10.00 H new ATOM 0 HD3 PRO A 4 -8.033 5.266 11.154 1.00 10.00 H new ATOM 58 N TRP A 5 -7.720 7.656 6.090 1.00 10.00 N ATOM 59 CA TRP A 5 -7.441 7.622 4.645 1.00 10.00 C ATOM 60 C TRP A 5 -6.020 8.069 4.262 1.00 10.00 C ATOM 61 O TRP A 5 -5.679 8.025 3.084 1.00 10.00 O ATOM 62 CB TRP A 5 -8.484 8.493 3.923 1.00 10.00 C ATOM 63 CG TRP A 5 -9.939 8.180 4.158 1.00 10.00 C ATOM 64 CD1 TRP A 5 -10.451 7.020 4.634 1.00 10.00 C ATOM 65 CD2 TRP A 5 -11.091 9.047 3.914 1.00 10.00 C ATOM 66 NE1 TRP A 5 -11.827 7.115 4.716 1.00 10.00 N ATOM 67 CE2 TRP A 5 -12.278 8.343 4.284 1.00 10.00 C ATOM 68 CE3 TRP A 5 -11.256 10.359 3.415 1.00 10.00 C ATOM 69 CZ2 TRP A 5 -13.557 8.910 4.171 1.00 10.00 C ATOM 70 CZ3 TRP A 5 -12.535 10.938 3.296 1.00 10.00 C ATOM 71 CH2 TRP A 5 -13.683 10.218 3.674 1.00 10.00 C ATOM 0 H TRP A 5 -8.379 8.392 6.344 1.00 10.00 H new ATOM 0 HA TRP A 5 -7.508 6.580 4.333 1.00 10.00 H new ATOM 0 HB2 TRP A 5 -8.313 9.530 4.212 1.00 10.00 H new ATOM 0 HB3 TRP A 5 -8.295 8.425 2.852 1.00 10.00 H new ATOM 0 HD1 TRP A 5 -9.871 6.151 4.908 1.00 10.00 H new ATOM 0 HE1 TRP A 5 -12.434 6.368 5.055 1.00 10.00 H new ATOM 0 HE3 TRP A 5 -10.387 10.928 3.120 1.00 10.00 H new ATOM 0 HZ2 TRP A 5 -14.432 8.348 4.462 1.00 10.00 H new ATOM 0 HZ3 TRP A 5 -12.635 11.942 2.912 1.00 10.00 H new ATOM 0 HH2 TRP A 5 -14.660 10.670 3.582 1.00 10.00 H new ATOM 82 N SER A 6 -5.187 8.506 5.212 1.00 10.00 N ATOM 83 CA SER A 6 -3.878 9.161 5.013 1.00 10.00 C ATOM 84 C SER A 6 -2.885 8.461 4.064 1.00 10.00 C ATOM 85 O SER A 6 -2.021 9.128 3.491 1.00 10.00 O ATOM 86 CB SER A 6 -3.210 9.376 6.377 1.00 10.00 C ATOM 87 OG SER A 6 -4.104 10.034 7.267 1.00 10.00 O ATOM 0 H SER A 6 -5.417 8.409 6.201 1.00 10.00 H new ATOM 0 HA SER A 6 -4.117 10.097 4.508 1.00 10.00 H new ATOM 0 HB2 SER A 6 -2.909 8.416 6.797 1.00 10.00 H new ATOM 0 HB3 SER A 6 -2.304 9.970 6.256 1.00 10.00 H new ATOM 0 HG SER A 6 -3.666 10.164 8.134 1.00 10.00 H new ATOM 93 N GLY A 7 -3.017 7.147 3.844 1.00 10.00 N ATOM 94 CA GLY A 7 -2.218 6.369 2.880 1.00 10.00 C ATOM 95 C GLY A 7 -2.698 6.437 1.416 1.00 10.00 C ATOM 96 O GLY A 7 -2.070 5.839 0.540 1.00 10.00 O ATOM 0 H GLY A 7 -3.700 6.577 4.343 1.00 10.00 H new ATOM 0 HA2 GLY A 7 -1.186 6.719 2.923 1.00 10.00 H new ATOM 0 HA3 GLY A 7 -2.214 5.326 3.195 1.00 10.00 H new ATOM 100 N TYR A 8 -3.794 7.155 1.142 1.00 10.00 N ATOM 101 CA TYR A 8 -4.438 7.308 -0.166 1.00 10.00 C ATOM 102 C TYR A 8 -4.983 8.730 -0.422 1.00 10.00 C ATOM 103 O TYR A 8 -4.975 9.224 -1.551 1.00 10.00 O ATOM 104 CB TYR A 8 -5.574 6.275 -0.284 1.00 10.00 C ATOM 105 CG TYR A 8 -5.755 5.749 -1.696 1.00 10.00 C ATOM 106 CD1 TYR A 8 -4.817 4.842 -2.226 1.00 10.00 C ATOM 107 CD2 TYR A 8 -6.840 6.180 -2.486 1.00 10.00 C ATOM 108 CE1 TYR A 8 -4.960 4.364 -3.543 1.00 10.00 C ATOM 109 CE2 TYR A 8 -6.987 5.704 -3.805 1.00 10.00 C ATOM 110 CZ TYR A 8 -6.046 4.794 -4.337 1.00 10.00 C ATOM 111 OH TYR A 8 -6.177 4.328 -5.610 1.00 10.00 O ATOM 0 H TYR A 8 -4.283 7.675 1.871 1.00 10.00 H new ATOM 0 HA TYR A 8 -3.676 7.138 -0.926 1.00 10.00 H new ATOM 0 HB2 TYR A 8 -5.368 5.439 0.385 1.00 10.00 H new ATOM 0 HB3 TYR A 8 -6.507 6.729 0.051 1.00 10.00 H new ATOM 0 HD1 TYR A 8 -3.986 4.512 -1.621 1.00 10.00 H new ATOM 0 HD2 TYR A 8 -7.560 6.876 -2.080 1.00 10.00 H new ATOM 0 HE1 TYR A 8 -4.239 3.668 -3.946 1.00 10.00 H new ATOM 0 HE2 TYR A 8 -7.819 6.035 -4.409 1.00 10.00 H new ATOM 0 HH TYR A 8 -6.976 4.719 -6.021 1.00 10.00 H new ATOM 121 N LEU A 9 -5.402 9.406 0.653 1.00 10.00 N ATOM 122 CA LEU A 9 -5.885 10.787 0.736 1.00 10.00 C ATOM 123 C LEU A 9 -5.061 11.777 -0.090 1.00 10.00 C ATOM 124 O LEU A 9 -5.609 12.562 -0.862 1.00 10.00 O ATOM 125 CB LEU A 9 -5.850 11.151 2.240 1.00 10.00 C ATOM 126 CG LEU A 9 -6.116 12.621 2.606 1.00 10.00 C ATOM 127 CD1 LEU A 9 -7.546 13.009 2.269 1.00 10.00 C ATOM 128 CD2 LEU A 9 -5.895 12.836 4.102 1.00 10.00 C ATOM 0 H LEU A 9 -5.412 8.959 1.570 1.00 10.00 H new ATOM 0 HA LEU A 9 -6.888 10.855 0.314 1.00 10.00 H new ATOM 0 HB2 LEU A 9 -6.586 10.534 2.756 1.00 10.00 H new ATOM 0 HB3 LEU A 9 -4.872 10.875 2.633 1.00 10.00 H new ATOM 0 HG LEU A 9 -5.427 13.240 2.031 1.00 10.00 H new ATOM 0 HD11 LEU A 9 -7.712 14.053 2.536 1.00 10.00 H new ATOM 0 HD12 LEU A 9 -7.717 12.876 1.201 1.00 10.00 H new ATOM 0 HD13 LEU A 9 -8.236 12.377 2.828 1.00 10.00 H new ATOM 0 HD21 LEU A 9 -6.086 13.880 4.352 1.00 10.00 H new ATOM 0 HD22 LEU A 9 -6.576 12.198 4.666 1.00 10.00 H new ATOM 0 HD23 LEU A 9 -4.866 12.584 4.358 1.00 10.00 H new ATOM 140 N ASP A 10 -3.741 11.721 0.061 1.00 10.00 N ATOM 141 CA ASP A 10 -2.786 12.700 -0.473 1.00 10.00 C ATOM 142 C ASP A 10 -2.560 12.602 -2.005 1.00 10.00 C ATOM 143 O ASP A 10 -1.619 13.180 -2.547 1.00 10.00 O ATOM 144 CB ASP A 10 -1.479 12.544 0.327 1.00 10.00 C ATOM 145 CG ASP A 10 -0.475 13.695 0.119 1.00 10.00 C ATOM 146 OD1 ASP A 10 -0.848 14.872 0.341 1.00 10.00 O ATOM 147 OD2 ASP A 10 0.709 13.420 -0.194 1.00 10.00 O ATOM 0 H ASP A 10 -3.286 10.968 0.576 1.00 10.00 H new ATOM 0 HA ASP A 10 -3.200 13.701 -0.348 1.00 10.00 H new ATOM 0 HB2 ASP A 10 -1.721 12.474 1.388 1.00 10.00 H new ATOM 0 HB3 ASP A 10 -1.003 11.605 0.045 1.00 10.00 H new ATOM 152 N ASP A 11 -3.428 11.879 -2.720 1.00 10.00 N ATOM 153 CA ASP A 11 -3.503 11.845 -4.191 1.00 10.00 C ATOM 154 C ASP A 11 -4.958 11.839 -4.724 1.00 10.00 C ATOM 155 O ASP A 11 -5.194 11.735 -5.928 1.00 10.00 O ATOM 156 CB ASP A 11 -2.694 10.635 -4.690 1.00 10.00 C ATOM 157 CG ASP A 11 -2.433 10.654 -6.207 1.00 10.00 C ATOM 158 OD1 ASP A 11 -1.905 11.667 -6.725 1.00 10.00 O ATOM 159 OD2 ASP A 11 -2.697 9.627 -6.882 1.00 10.00 O ATOM 0 H ASP A 11 -4.124 11.279 -2.278 1.00 10.00 H new ATOM 0 HA ASP A 11 -3.069 12.764 -4.586 1.00 10.00 H new ATOM 0 HB2 ASP A 11 -1.739 10.605 -4.165 1.00 10.00 H new ATOM 0 HB3 ASP A 11 -3.228 9.720 -4.433 1.00 10.00 H new ATOM 164 N VAL A 12 -5.939 12.007 -3.828 1.00 10.00 N ATOM 165 CA VAL A 12 -7.373 12.145 -4.102 1.00 10.00 C ATOM 166 C VAL A 12 -7.860 13.522 -3.663 1.00 10.00 C ATOM 167 O VAL A 12 -8.358 14.309 -4.467 1.00 10.00 O ATOM 168 CB VAL A 12 -8.161 11.032 -3.376 1.00 10.00 C ATOM 169 CG1 VAL A 12 -9.679 11.210 -3.490 1.00 10.00 C ATOM 170 CG2 VAL A 12 -7.772 9.652 -3.908 1.00 10.00 C ATOM 0 H VAL A 12 -5.738 12.053 -2.829 1.00 10.00 H new ATOM 0 HA VAL A 12 -7.542 12.045 -5.174 1.00 10.00 H new ATOM 0 HB VAL A 12 -7.894 11.110 -2.322 1.00 10.00 H new ATOM 0 HG11 VAL A 12 -10.181 10.400 -2.962 1.00 10.00 H new ATOM 0 HG12 VAL A 12 -9.968 12.164 -3.049 1.00 10.00 H new ATOM 0 HG13 VAL A 12 -9.969 11.193 -4.540 1.00 10.00 H new ATOM 0 HG21 VAL A 12 -8.340 8.885 -3.381 1.00 10.00 H new ATOM 0 HG22 VAL A 12 -7.992 9.598 -4.974 1.00 10.00 H new ATOM 0 HG23 VAL A 12 -6.706 9.488 -3.748 1.00 10.00 H new ATOM 180 N SER A 13 -7.638 13.838 -2.389 1.00 10.00 N ATOM 181 CA SER A 13 -7.848 15.149 -1.802 1.00 10.00 C ATOM 182 C SER A 13 -6.806 16.144 -2.261 1.00 10.00 C ATOM 183 O SER A 13 -7.136 17.249 -2.677 1.00 10.00 O ATOM 184 CB SER A 13 -7.785 15.014 -0.284 1.00 10.00 C ATOM 185 OG SER A 13 -7.933 16.255 0.381 1.00 10.00 O ATOM 0 H SER A 13 -7.293 13.156 -1.714 1.00 10.00 H new ATOM 0 HA SER A 13 -8.822 15.520 -2.122 1.00 10.00 H new ATOM 0 HB2 SER A 13 -8.568 14.332 0.049 1.00 10.00 H new ATOM 0 HB3 SER A 13 -6.832 14.567 -0.002 1.00 10.00 H new ATOM 0 HG SER A 13 -8.693 16.742 -0.001 1.00 10.00 H new ATOM 191 N ALA A 14 -5.535 15.754 -2.279 1.00 10.00 N ATOM 192 CA ALA A 14 -4.504 16.687 -2.699 1.00 10.00 C ATOM 193 C ALA A 14 -4.621 17.076 -4.190 1.00 10.00 C ATOM 194 O ALA A 14 -4.315 18.203 -4.582 1.00 10.00 O ATOM 195 CB ALA A 14 -3.142 16.138 -2.356 1.00 10.00 C ATOM 0 H ALA A 14 -5.204 14.826 -2.016 1.00 10.00 H new ATOM 0 HA ALA A 14 -4.649 17.616 -2.147 1.00 10.00 H new ATOM 0 HB1 ALA A 14 -2.375 16.844 -2.674 1.00 10.00 H new ATOM 0 HB2 ALA A 14 -3.071 15.987 -1.279 1.00 10.00 H new ATOM 0 HB3 ALA A 14 -2.994 15.186 -2.867 1.00 10.00 H new ATOM 201 N LYS A 15 -5.144 16.146 -5.005 1.00 10.00 N ATOM 202 CA LYS A 15 -5.558 16.332 -6.400 1.00 10.00 C ATOM 203 C LYS A 15 -6.726 17.326 -6.560 1.00 10.00 C ATOM 204 O LYS A 15 -6.912 17.874 -7.647 1.00 10.00 O ATOM 205 CB LYS A 15 -5.852 14.936 -6.979 1.00 10.00 C ATOM 206 CG LYS A 15 -6.141 14.929 -8.485 1.00 10.00 C ATOM 207 CD LYS A 15 -6.060 13.507 -9.051 1.00 10.00 C ATOM 208 CE LYS A 15 -6.344 13.534 -10.556 1.00 10.00 C ATOM 209 NZ LYS A 15 -6.140 12.197 -11.175 1.00 10.00 N ATOM 0 H LYS A 15 -5.297 15.189 -4.687 1.00 10.00 H new ATOM 0 HA LYS A 15 -4.755 16.801 -6.968 1.00 10.00 H new ATOM 0 HB2 LYS A 15 -5.000 14.286 -6.781 1.00 10.00 H new ATOM 0 HB3 LYS A 15 -6.707 14.510 -6.454 1.00 10.00 H new ATOM 0 HG2 LYS A 15 -7.132 15.343 -8.671 1.00 10.00 H new ATOM 0 HG3 LYS A 15 -5.426 15.571 -9.000 1.00 10.00 H new ATOM 0 HD2 LYS A 15 -5.072 13.087 -8.865 1.00 10.00 H new ATOM 0 HD3 LYS A 15 -6.780 12.863 -8.547 1.00 10.00 H new ATOM 0 HE2 LYS A 15 -7.369 13.863 -10.728 1.00 10.00 H new ATOM 0 HE3 LYS A 15 -5.691 14.262 -11.037 1.00 10.00 H new ATOM 0 HZ1 LYS A 15 -6.834 12.057 -11.936 1.00 10.00 H new ATOM 0 HZ2 LYS A 15 -5.179 12.139 -11.568 1.00 10.00 H new ATOM 0 HZ3 LYS A 15 -6.264 11.458 -10.454 1.00 10.00 H new ATOM 223 N PHE A 16 -7.474 17.600 -5.484 1.00 10.00 N ATOM 224 CA PHE A 16 -8.564 18.571 -5.404 1.00 10.00 C ATOM 225 C PHE A 16 -8.211 19.874 -4.679 1.00 10.00 C ATOM 226 O PHE A 16 -8.802 20.912 -4.954 1.00 10.00 O ATOM 227 CB PHE A 16 -9.851 17.879 -4.893 1.00 10.00 C ATOM 228 CG PHE A 16 -10.174 17.516 -3.441 1.00 10.00 C ATOM 229 CD1 PHE A 16 -9.800 18.287 -2.319 1.00 10.00 C ATOM 230 CD2 PHE A 16 -11.004 16.393 -3.232 1.00 10.00 C ATOM 231 CE1 PHE A 16 -10.225 17.929 -1.025 1.00 10.00 C ATOM 232 CE2 PHE A 16 -11.423 16.027 -1.940 1.00 10.00 C ATOM 233 CZ PHE A 16 -11.020 16.788 -0.832 1.00 10.00 C ATOM 0 H PHE A 16 -7.323 17.120 -4.597 1.00 10.00 H new ATOM 0 HA PHE A 16 -8.760 18.924 -6.417 1.00 10.00 H new ATOM 0 HB2 PHE A 16 -10.674 18.511 -5.226 1.00 10.00 H new ATOM 0 HB3 PHE A 16 -9.921 16.945 -5.450 1.00 10.00 H new ATOM 0 HD1 PHE A 16 -9.181 19.161 -2.455 1.00 10.00 H new ATOM 0 HD2 PHE A 16 -11.323 15.804 -4.079 1.00 10.00 H new ATOM 0 HE1 PHE A 16 -9.938 18.534 -0.178 1.00 10.00 H new ATOM 0 HE2 PHE A 16 -12.054 15.162 -1.801 1.00 10.00 H new ATOM 0 HZ PHE A 16 -11.320 16.497 0.164 1.00 10.00 H new ATOM 243 N ASP A 17 -7.202 19.838 -3.813 1.00 10.00 N ATOM 244 CA ASP A 17 -6.833 20.879 -2.841 1.00 10.00 C ATOM 245 C ASP A 17 -6.906 22.349 -3.281 1.00 10.00 C ATOM 246 O ASP A 17 -7.453 23.173 -2.550 1.00 10.00 O ATOM 247 CB ASP A 17 -5.458 20.545 -2.245 1.00 10.00 C ATOM 248 CG ASP A 17 -5.045 21.529 -1.136 1.00 10.00 C ATOM 249 OD1 ASP A 17 -5.550 21.401 0.006 1.00 10.00 O ATOM 250 OD2 ASP A 17 -4.195 22.412 -1.397 1.00 10.00 O ATOM 0 H ASP A 17 -6.577 19.033 -3.763 1.00 10.00 H new ATOM 0 HA ASP A 17 -7.628 20.837 -2.097 1.00 10.00 H new ATOM 0 HB2 ASP A 17 -5.476 19.533 -1.841 1.00 10.00 H new ATOM 0 HB3 ASP A 17 -4.709 20.559 -3.037 1.00 10.00 H new ATOM 255 N THR A 18 -6.392 22.702 -4.458 1.00 10.00 N ATOM 256 CA THR A 18 -6.385 24.094 -4.932 1.00 10.00 C ATOM 257 C THR A 18 -7.673 24.498 -5.670 1.00 10.00 C ATOM 258 O THR A 18 -8.118 25.643 -5.577 1.00 10.00 O ATOM 259 CB THR A 18 -5.121 24.378 -5.758 1.00 10.00 C ATOM 260 OG1 THR A 18 -4.814 25.756 -5.729 1.00 10.00 O ATOM 261 CG2 THR A 18 -5.261 23.962 -7.218 1.00 10.00 C ATOM 0 H THR A 18 -5.970 22.040 -5.109 1.00 10.00 H new ATOM 0 HA THR A 18 -6.360 24.730 -4.047 1.00 10.00 H new ATOM 0 HB THR A 18 -4.326 23.787 -5.303 1.00 10.00 H new ATOM 0 HG1 THR A 18 -4.006 25.922 -6.258 1.00 10.00 H new ATOM 0 HG21 THR A 18 -4.337 24.187 -7.751 1.00 10.00 H new ATOM 0 HG22 THR A 18 -5.460 22.892 -7.274 1.00 10.00 H new ATOM 0 HG23 THR A 18 -6.086 24.509 -7.675 1.00 10.00 H new ATOM 269 N GLY A 19 -8.323 23.552 -6.361 1.00 10.00 N ATOM 270 CA GLY A 19 -9.591 23.779 -7.066 1.00 10.00 C ATOM 271 C GLY A 19 -10.770 23.806 -6.096 1.00 10.00 C ATOM 272 O GLY A 19 -11.620 24.695 -6.177 1.00 10.00 O ATOM 0 H GLY A 19 -7.978 22.596 -6.447 1.00 10.00 H new ATOM 0 HA2 GLY A 19 -9.543 24.723 -7.609 1.00 10.00 H new ATOM 0 HA3 GLY A 19 -9.744 22.993 -7.805 1.00 10.00 H new ATOM 276 N VAL A 20 -10.764 22.899 -5.113 1.00 10.00 N ATOM 277 CA VAL A 20 -11.680 22.916 -3.975 1.00 10.00 C ATOM 278 C VAL A 20 -11.590 24.229 -3.243 1.00 10.00 C ATOM 279 O VAL A 20 -12.616 24.769 -2.863 1.00 10.00 O ATOM 280 CB VAL A 20 -11.463 21.729 -3.009 1.00 10.00 C ATOM 281 CG1 VAL A 20 -10.677 22.018 -1.725 1.00 10.00 C ATOM 282 CG2 VAL A 20 -12.832 21.190 -2.584 1.00 10.00 C ATOM 0 H VAL A 20 -10.108 22.118 -5.089 1.00 10.00 H new ATOM 0 HA VAL A 20 -12.686 22.804 -4.379 1.00 10.00 H new ATOM 0 HB VAL A 20 -10.856 21.026 -3.579 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.595 21.105 -1.135 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -9.680 22.375 -1.982 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.197 22.780 -1.144 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -12.697 20.351 -1.901 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -13.394 21.978 -2.083 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -13.381 20.856 -3.465 1.00 10.00 H new ATOM 292 N ASP A 21 -10.383 24.769 -3.091 1.00 10.00 N ATOM 293 CA ASP A 21 -10.142 26.009 -2.384 1.00 10.00 C ATOM 294 C ASP A 21 -10.647 27.247 -3.123 1.00 10.00 C ATOM 295 O ASP A 21 -11.038 28.200 -2.461 1.00 10.00 O ATOM 296 CB ASP A 21 -8.676 26.078 -1.979 1.00 10.00 C ATOM 297 CG ASP A 21 -8.232 27.456 -1.459 1.00 10.00 C ATOM 298 OD1 ASP A 21 -8.480 27.757 -0.267 1.00 10.00 O ATOM 299 OD2 ASP A 21 -7.604 28.224 -2.226 1.00 10.00 O ATOM 0 H ASP A 21 -9.535 24.344 -3.465 1.00 10.00 H new ATOM 0 HA ASP A 21 -10.742 26.010 -1.474 1.00 10.00 H new ATOM 0 HB2 ASP A 21 -8.488 25.332 -1.206 1.00 10.00 H new ATOM 0 HB3 ASP A 21 -8.060 25.810 -2.837 1.00 10.00 H new ATOM 304 N ASN A 22 -10.765 27.235 -4.452 1.00 10.00 N ATOM 305 CA ASN A 22 -11.460 28.305 -5.162 1.00 10.00 C ATOM 306 C ASN A 22 -12.967 28.298 -4.880 1.00 10.00 C ATOM 307 O ASN A 22 -13.635 29.331 -4.989 1.00 10.00 O ATOM 308 CB ASN A 22 -11.288 28.140 -6.676 1.00 10.00 C ATOM 309 CG ASN A 22 -9.861 28.314 -7.172 1.00 10.00 C ATOM 310 OD1 ASN A 22 -9.076 29.097 -6.655 1.00 10.00 O ATOM 311 ND2 ASN A 22 -9.486 27.610 -8.218 1.00 10.00 N ATOM 0 H ASN A 22 -10.391 26.501 -5.053 1.00 10.00 H new ATOM 0 HA ASN A 22 -11.023 29.240 -4.811 1.00 10.00 H new ATOM 0 HB2 ASN A 22 -11.641 27.149 -6.963 1.00 10.00 H new ATOM 0 HB3 ASN A 22 -11.926 28.864 -7.182 1.00 10.00 H new ATOM 0 HD21 ASN A 22 -8.544 27.718 -8.595 1.00 10.00 H new ATOM 0 HD22 ASN A 22 -10.137 26.956 -8.652 1.00 10.00 H new ATOM 318 N LEU A 23 -13.518 27.128 -4.559 1.00 10.00 N ATOM 319 CA LEU A 23 -14.865 26.985 -4.059 1.00 10.00 C ATOM 320 C LEU A 23 -14.976 27.285 -2.558 1.00 10.00 C ATOM 321 O LEU A 23 -15.847 28.041 -2.147 1.00 10.00 O ATOM 322 CB LEU A 23 -15.452 25.646 -4.515 1.00 10.00 C ATOM 323 CG LEU A 23 -16.789 25.852 -5.259 1.00 10.00 C ATOM 324 CD1 LEU A 23 -17.802 26.594 -4.410 1.00 10.00 C ATOM 325 CD2 LEU A 23 -16.877 26.569 -6.605 1.00 10.00 C ATOM 0 H LEU A 23 -13.022 26.241 -4.645 1.00 10.00 H new ATOM 0 HA LEU A 23 -15.498 27.754 -4.502 1.00 10.00 H new ATOM 0 HB2 LEU A 23 -14.743 25.138 -5.168 1.00 10.00 H new ATOM 0 HB3 LEU A 23 -15.608 25.000 -3.651 1.00 10.00 H new ATOM 0 HG LEU A 23 -16.968 24.797 -5.465 1.00 10.00 H new ATOM 0 HD11 LEU A 23 -18.728 26.717 -4.972 1.00 10.00 H new ATOM 0 HD12 LEU A 23 -18.002 26.025 -3.502 1.00 10.00 H new ATOM 0 HD13 LEU A 23 -17.406 27.574 -4.144 1.00 10.00 H new ATOM 0 HD21 LEU A 23 -17.915 26.595 -6.936 1.00 10.00 H new ATOM 0 HD22 LEU A 23 -16.504 27.588 -6.500 1.00 10.00 H new ATOM 0 HD23 LEU A 23 -16.275 26.036 -7.341 1.00 10.00 H new ATOM 337 N GLN A 24 -14.042 26.782 -1.754 1.00 10.00 N ATOM 338 CA GLN A 24 -13.914 27.003 -0.318 1.00 10.00 C ATOM 339 C GLN A 24 -13.770 28.482 0.011 1.00 10.00 C ATOM 340 O GLN A 24 -14.455 28.961 0.899 1.00 10.00 O ATOM 341 CB GLN A 24 -12.681 26.267 0.217 1.00 10.00 C ATOM 342 CG GLN A 24 -12.670 26.078 1.728 1.00 10.00 C ATOM 343 CD GLN A 24 -13.680 25.047 2.225 1.00 10.00 C ATOM 344 OE1 GLN A 24 -13.598 23.862 1.934 1.00 10.00 O ATOM 345 NE2 GLN A 24 -14.663 25.451 3.002 1.00 10.00 N ATOM 0 H GLN A 24 -13.308 26.171 -2.112 1.00 10.00 H new ATOM 0 HA GLN A 24 -14.822 26.623 0.151 1.00 10.00 H new ATOM 0 HB2 GLN A 24 -12.621 25.289 -0.260 1.00 10.00 H new ATOM 0 HB3 GLN A 24 -11.788 26.819 -0.075 1.00 10.00 H new ATOM 0 HG2 GLN A 24 -11.671 25.774 2.040 1.00 10.00 H new ATOM 0 HG3 GLN A 24 -12.876 27.035 2.207 1.00 10.00 H new ATOM 0 HE21 GLN A 24 -14.743 26.437 3.252 1.00 10.00 H new ATOM 0 HE22 GLN A 24 -15.345 24.778 3.354 1.00 10.00 H new ATOM 354 N THR A 25 -12.911 29.218 -0.696 1.00 10.00 N ATOM 355 CA THR A 25 -12.721 30.659 -0.533 1.00 10.00 C ATOM 356 C THR A 25 -14.049 31.374 -0.729 1.00 10.00 C ATOM 357 O THR A 25 -14.506 32.113 0.132 1.00 10.00 O ATOM 358 CB THR A 25 -11.590 31.162 -1.448 1.00 10.00 C ATOM 359 OG1 THR A 25 -11.134 32.420 -1.003 1.00 10.00 O ATOM 360 CG2 THR A 25 -11.909 31.260 -2.934 1.00 10.00 C ATOM 0 H THR A 25 -12.312 28.816 -1.417 1.00 10.00 H new ATOM 0 HA THR A 25 -12.395 30.888 0.482 1.00 10.00 H new ATOM 0 HB THR A 25 -10.827 30.388 -1.367 1.00 10.00 H new ATOM 0 HG1 THR A 25 -10.413 32.733 -1.589 1.00 10.00 H new ATOM 0 HG21 THR A 25 -11.034 31.626 -3.471 1.00 10.00 H new ATOM 0 HG22 THR A 25 -12.182 30.275 -3.313 1.00 10.00 H new ATOM 0 HG23 THR A 25 -12.740 31.949 -3.083 1.00 10.00 H new ATOM 368 N GLN A 26 -14.759 30.995 -1.786 1.00 10.00 N ATOM 369 CA GLN A 26 -16.117 31.429 -2.084 1.00 10.00 C ATOM 370 C GLN A 26 -17.140 31.126 -0.979 1.00 10.00 C ATOM 371 O GLN A 26 -17.842 32.039 -0.540 1.00 10.00 O ATOM 372 CB GLN A 26 -16.529 30.815 -3.435 1.00 10.00 C ATOM 373 CG GLN A 26 -16.615 31.876 -4.536 1.00 10.00 C ATOM 374 CD GLN A 26 -16.854 31.260 -5.910 1.00 10.00 C ATOM 375 OE1 GLN A 26 -17.906 31.429 -6.514 1.00 10.00 O ATOM 376 NE2 GLN A 26 -15.923 30.498 -6.446 1.00 10.00 N ATOM 0 H GLN A 26 -14.389 30.352 -2.486 1.00 10.00 H new ATOM 0 HA GLN A 26 -16.116 32.518 -2.141 1.00 10.00 H new ATOM 0 HB2 GLN A 26 -15.808 30.050 -3.722 1.00 10.00 H new ATOM 0 HB3 GLN A 26 -17.494 30.320 -3.331 1.00 10.00 H new ATOM 0 HG2 GLN A 26 -17.422 32.572 -4.306 1.00 10.00 H new ATOM 0 HG3 GLN A 26 -15.691 32.454 -4.554 1.00 10.00 H new ATOM 0 HE21 GLN A 26 -15.042 30.348 -5.955 1.00 10.00 H new ATOM 0 HE22 GLN A 26 -16.083 30.058 -7.352 1.00 10.00 H new ATOM 385 N VAL A 27 -17.234 29.883 -0.490 1.00 10.00 N ATOM 386 CA VAL A 27 -18.153 29.548 0.604 1.00 10.00 C ATOM 387 C VAL A 27 -17.758 30.259 1.889 1.00 10.00 C ATOM 388 O VAL A 27 -18.602 30.723 2.644 1.00 10.00 O ATOM 389 CB VAL A 27 -18.314 28.044 0.908 1.00 10.00 C ATOM 390 CG1 VAL A 27 -18.240 27.163 -0.338 1.00 10.00 C ATOM 391 CG2 VAL A 27 -17.382 27.402 1.938 1.00 10.00 C ATOM 0 H VAL A 27 -16.686 29.095 -0.834 1.00 10.00 H new ATOM 0 HA VAL A 27 -19.120 29.893 0.237 1.00 10.00 H new ATOM 0 HB VAL A 27 -19.309 28.072 1.352 1.00 10.00 H new ATOM 0 HG11 VAL A 27 -18.361 26.118 -0.052 1.00 10.00 H new ATOM 0 HG12 VAL A 27 -19.034 27.444 -1.030 1.00 10.00 H new ATOM 0 HG13 VAL A 27 -17.273 27.298 -0.822 1.00 10.00 H new ATOM 0 HG21 VAL A 27 -17.623 26.344 2.037 1.00 10.00 H new ATOM 0 HG22 VAL A 27 -16.348 27.510 1.610 1.00 10.00 H new ATOM 0 HG23 VAL A 27 -17.510 27.895 2.902 1.00 10.00 H new ATOM 401 N THR A 28 -16.459 30.370 2.136 1.00 10.00 N ATOM 402 CA THR A 28 -15.920 31.041 3.302 1.00 10.00 C ATOM 403 C THR A 28 -16.188 32.526 3.245 1.00 10.00 C ATOM 404 O THR A 28 -16.284 33.165 4.278 1.00 10.00 O ATOM 405 CB THR A 28 -14.415 30.881 3.446 1.00 10.00 C ATOM 406 OG1 THR A 28 -14.024 29.525 3.435 1.00 10.00 O ATOM 407 CG2 THR A 28 -13.955 31.452 4.770 1.00 10.00 C ATOM 0 H THR A 28 -15.742 29.988 1.519 1.00 10.00 H new ATOM 0 HA THR A 28 -16.419 30.571 4.149 1.00 10.00 H new ATOM 0 HB THR A 28 -13.968 31.404 2.601 1.00 10.00 H new ATOM 0 HG1 THR A 28 -13.839 29.245 2.514 1.00 10.00 H new ATOM 0 HG21 THR A 28 -12.876 31.332 4.863 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.208 32.511 4.817 1.00 10.00 H new ATOM 0 HG23 THR A 28 -14.450 30.924 5.585 1.00 10.00 H new ATOM 415 N GLU A 29 -16.314 33.117 2.067 1.00 10.00 N ATOM 416 CA GLU A 29 -16.683 34.507 1.969 1.00 10.00 C ATOM 417 C GLU A 29 -18.198 34.703 2.180 1.00 10.00 C ATOM 418 O GLU A 29 -18.618 35.741 2.679 1.00 10.00 O ATOM 419 CB GLU A 29 -16.158 35.111 0.686 1.00 10.00 C ATOM 420 CG GLU A 29 -14.637 35.298 0.745 1.00 10.00 C ATOM 421 CD GLU A 29 -14.109 36.009 -0.517 1.00 10.00 C ATOM 422 OE1 GLU A 29 -14.156 35.421 -1.625 1.00 10.00 O ATOM 423 OE2 GLU A 29 -13.646 37.171 -0.410 1.00 10.00 O ATOM 0 H GLU A 29 -16.165 32.651 1.172 1.00 10.00 H new ATOM 0 HA GLU A 29 -16.206 35.058 2.779 1.00 10.00 H new ATOM 0 HB2 GLU A 29 -16.416 34.467 -0.155 1.00 10.00 H new ATOM 0 HB3 GLU A 29 -16.639 36.073 0.510 1.00 10.00 H new ATOM 0 HG2 GLU A 29 -14.374 35.879 1.629 1.00 10.00 H new ATOM 0 HG3 GLU A 29 -14.153 34.327 0.847 1.00 10.00 H new ATOM 430 N ALA A 30 -19.041 33.713 1.863 1.00 10.00 N ATOM 431 CA ALA A 30 -20.448 33.707 2.269 1.00 10.00 C ATOM 432 C ALA A 30 -20.534 33.581 3.797 1.00 10.00 C ATOM 433 O ALA A 30 -21.311 34.261 4.466 1.00 10.00 O ATOM 434 CB ALA A 30 -21.173 32.536 1.603 1.00 10.00 C ATOM 0 H ALA A 30 -18.766 32.896 1.319 1.00 10.00 H new ATOM 0 HA ALA A 30 -20.923 34.637 1.957 1.00 10.00 H new ATOM 0 HB1 ALA A 30 -22.220 32.535 1.908 1.00 10.00 H new ATOM 0 HB2 ALA A 30 -21.111 32.638 0.520 1.00 10.00 H new ATOM 0 HB3 ALA A 30 -20.706 31.599 1.906 1.00 10.00 H new ATOM 440 N LEU A 31 -19.662 32.749 4.356 1.00 10.00 N ATOM 441 CA LEU A 31 -19.416 32.623 5.772 1.00 10.00 C ATOM 442 C LEU A 31 -18.764 33.867 6.390 1.00 10.00 C ATOM 443 O LEU A 31 -19.028 34.157 7.541 1.00 10.00 O ATOM 444 CB LEU A 31 -18.528 31.406 5.978 1.00 10.00 C ATOM 445 CG LEU A 31 -18.359 31.042 7.448 1.00 10.00 C ATOM 446 CD1 LEU A 31 -19.552 30.231 7.934 1.00 10.00 C ATOM 447 CD2 LEU A 31 -17.051 30.284 7.565 1.00 10.00 C ATOM 0 H LEU A 31 -19.085 32.118 3.800 1.00 10.00 H new ATOM 0 HA LEU A 31 -20.375 32.511 6.279 1.00 10.00 H new ATOM 0 HB2 LEU A 31 -18.954 30.556 5.444 1.00 10.00 H new ATOM 0 HB3 LEU A 31 -17.548 31.598 5.541 1.00 10.00 H new ATOM 0 HG LEU A 31 -18.323 31.928 8.082 1.00 10.00 H new ATOM 0 HD11 LEU A 31 -19.416 29.979 8.986 1.00 10.00 H new ATOM 0 HD12 LEU A 31 -20.463 30.818 7.816 1.00 10.00 H new ATOM 0 HD13 LEU A 31 -19.632 29.315 7.349 1.00 10.00 H new ATOM 0 HD21 LEU A 31 -16.886 30.001 8.605 1.00 10.00 H new ATOM 0 HD22 LEU A 31 -17.094 29.387 6.947 1.00 10.00 H new ATOM 0 HD23 LEU A 31 -16.231 30.918 7.227 1.00 10.00 H new ATOM 459 N ASP A 32 -17.960 34.650 5.676 1.00 10.00 N ATOM 460 CA ASP A 32 -17.439 35.932 6.147 1.00 10.00 C ATOM 461 C ASP A 32 -18.613 36.865 6.480 1.00 10.00 C ATOM 462 O ASP A 32 -18.560 37.626 7.448 1.00 10.00 O ATOM 463 CB ASP A 32 -16.451 36.516 5.119 1.00 10.00 C ATOM 464 CG ASP A 32 -16.067 37.973 5.425 1.00 10.00 C ATOM 465 OD1 ASP A 32 -15.251 38.205 6.349 1.00 10.00 O ATOM 466 OD2 ASP A 32 -16.561 38.883 4.716 1.00 10.00 O ATOM 0 H ASP A 32 -17.646 34.408 4.736 1.00 10.00 H new ATOM 0 HA ASP A 32 -16.868 35.802 7.067 1.00 10.00 H new ATOM 0 HB2 ASP A 32 -15.549 35.904 5.099 1.00 10.00 H new ATOM 0 HB3 ASP A 32 -16.894 36.463 4.125 1.00 10.00 H new ATOM 471 N LYS A 33 -19.725 36.711 5.745 1.00 10.00 N ATOM 472 CA LYS A 33 -21.001 37.331 6.032 1.00 10.00 C ATOM 473 C LYS A 33 -21.710 36.630 7.197 1.00 10.00 C ATOM 474 O LYS A 33 -22.276 37.278 8.073 1.00 10.00 O ATOM 475 CB LYS A 33 -21.893 37.409 4.792 1.00 10.00 C ATOM 476 CG LYS A 33 -21.291 37.551 3.390 1.00 10.00 C ATOM 477 CD LYS A 33 -20.059 38.451 3.251 1.00 10.00 C ATOM 478 CE LYS A 33 -19.719 38.649 1.776 1.00 10.00 C ATOM 479 NZ LYS A 33 -18.506 39.494 1.620 1.00 10.00 N ATOM 0 H LYS A 33 -19.748 36.128 4.908 1.00 10.00 H new ATOM 0 HA LYS A 33 -20.799 38.357 6.339 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -22.508 36.509 4.785 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -22.566 38.254 4.937 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -21.026 36.556 3.033 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -22.066 37.932 2.725 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -20.249 39.416 3.721 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -19.212 38.004 3.771 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -19.556 37.681 1.303 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -20.561 39.116 1.264 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -18.295 39.615 0.609 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -18.674 40.425 2.052 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -17.700 39.034 2.090 1.00 10.00 H new ATOM 493 N LEU A 34 -21.719 35.296 7.213 1.00 10.00 N ATOM 494 CA LEU A 34 -22.448 34.498 8.209 1.00 10.00 C ATOM 495 C LEU A 34 -21.772 34.552 9.590 1.00 10.00 C ATOM 496 O LEU A 34 -22.367 34.277 10.617 1.00 10.00 O ATOM 497 CB LEU A 34 -22.666 33.080 7.677 1.00 10.00 C ATOM 498 CG LEU A 34 -24.093 32.532 7.870 1.00 10.00 C ATOM 499 CD1 LEU A 34 -24.261 31.321 7.005 1.00 10.00 C ATOM 500 CD2 LEU A 34 -24.556 32.025 9.218 1.00 10.00 C ATOM 0 H LEU A 34 -21.216 34.730 6.529 1.00 10.00 H new ATOM 0 HA LEU A 34 -23.435 34.932 8.368 1.00 10.00 H new ATOM 0 HB2 LEU A 34 -22.426 33.065 6.614 1.00 10.00 H new ATOM 0 HB3 LEU A 34 -21.964 32.409 8.172 1.00 10.00 H new ATOM 0 HG LEU A 34 -24.672 33.430 7.655 1.00 10.00 H new ATOM 0 HD11 LEU A 34 -25.267 30.921 7.131 1.00 10.00 H new ATOM 0 HD12 LEU A 34 -24.107 31.595 5.961 1.00 10.00 H new ATOM 0 HD13 LEU A 34 -23.531 30.564 7.293 1.00 10.00 H new ATOM 0 HD21 LEU A 34 -25.588 31.683 9.143 1.00 10.00 H new ATOM 0 HD22 LEU A 34 -23.922 31.196 9.533 1.00 10.00 H new ATOM 0 HD23 LEU A 34 -24.492 32.829 9.951 1.00 10.00 H new ATOM 512 N ALA A 35 -20.501 34.912 9.627 1.00 10.00 N ATOM 513 CA ALA A 35 -19.749 35.238 10.816 1.00 10.00 C ATOM 514 C ALA A 35 -20.042 36.710 11.262 1.00 10.00 C ATOM 515 O ALA A 35 -19.877 37.046 12.436 1.00 10.00 O ATOM 516 CB ALA A 35 -18.283 34.898 10.497 1.00 10.00 C ATOM 0 H ALA A 35 -19.939 34.987 8.779 1.00 10.00 H new ATOM 0 HA ALA A 35 -20.037 34.658 11.693 1.00 10.00 H new ATOM 0 HB1 ALA A 35 -17.660 35.124 11.363 1.00 10.00 H new ATOM 0 HB2 ALA A 35 -18.199 33.838 10.257 1.00 10.00 H new ATOM 0 HB3 ALA A 35 -17.949 35.491 9.645 1.00 10.00 H new ATOM 522 N ALA A 36 -20.493 37.583 10.335 1.00 10.00 N ATOM 523 CA ALA A 36 -20.881 38.996 10.533 1.00 10.00 C ATOM 524 C ALA A 36 -22.305 39.246 11.096 1.00 10.00 C ATOM 525 O ALA A 36 -22.462 39.953 12.096 1.00 10.00 O ATOM 526 CB ALA A 36 -20.671 39.764 9.208 1.00 10.00 C ATOM 0 H ALA A 36 -20.603 37.299 9.362 1.00 10.00 H new ATOM 0 HA ALA A 36 -20.228 39.370 11.322 1.00 10.00 H new ATOM 0 HB1 ALA A 36 -20.954 40.808 9.344 1.00 10.00 H new ATOM 0 HB2 ALA A 36 -19.622 39.708 8.917 1.00 10.00 H new ATOM 0 HB3 ALA A 36 -21.288 39.319 8.428 1.00 10.00 H new ATOM 532 N LYS A 37 -23.340 38.677 10.460 1.00 10.00 N ATOM 533 CA LYS A 37 -24.793 38.841 10.763 1.00 10.00 C ATOM 534 C LYS A 37 -25.509 37.477 10.621 1.00 10.00 C ATOM 535 O LYS A 37 -26.545 37.369 9.967 1.00 10.00 O ATOM 536 CB LYS A 37 -25.345 39.822 9.725 1.00 10.00 C ATOM 537 CG LYS A 37 -26.698 40.470 10.052 1.00 10.00 C ATOM 538 CD LYS A 37 -27.284 41.112 8.782 1.00 10.00 C ATOM 539 CE LYS A 37 -26.555 42.381 8.311 1.00 10.00 C ATOM 540 NZ LYS A 37 -26.770 43.532 9.229 1.00 10.00 N ATOM 0 H LYS A 37 -23.189 38.049 9.670 1.00 10.00 H new ATOM 0 HA LYS A 37 -24.949 39.207 11.778 1.00 10.00 H new ATOM 0 HB2 LYS A 37 -24.612 40.616 9.581 1.00 10.00 H new ATOM 0 HB3 LYS A 37 -25.438 39.297 8.774 1.00 10.00 H new ATOM 0 HG2 LYS A 37 -27.386 39.721 10.444 1.00 10.00 H new ATOM 0 HG3 LYS A 37 -26.573 41.225 10.829 1.00 10.00 H new ATOM 0 HD2 LYS A 37 -27.264 40.377 7.977 1.00 10.00 H new ATOM 0 HD3 LYS A 37 -28.330 41.357 8.964 1.00 10.00 H new ATOM 0 HE2 LYS A 37 -25.487 42.176 8.234 1.00 10.00 H new ATOM 0 HE3 LYS A 37 -26.902 42.646 7.312 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 -26.259 44.363 8.869 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 -27.786 43.747 9.284 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 -26.415 43.291 10.177 1.00 10.00 H new ATOM 554 N PRO A 38 -24.974 36.418 11.234 1.00 10.00 N ATOM 555 CA PRO A 38 -25.321 35.035 10.983 1.00 10.00 C ATOM 556 C PRO A 38 -26.590 34.597 10.267 1.00 10.00 C ATOM 557 O PRO A 38 -26.564 34.425 9.051 1.00 10.00 O ATOM 558 CB PRO A 38 -24.907 34.205 12.192 1.00 10.00 C ATOM 559 CG PRO A 38 -24.120 35.167 13.088 1.00 10.00 C ATOM 560 CD PRO A 38 -24.004 36.478 12.310 1.00 10.00 C ATOM 0 HA PRO A 38 -24.739 34.814 10.088 1.00 10.00 H new ATOM 0 HB2 PRO A 38 -25.777 33.805 12.712 1.00 10.00 H new ATOM 0 HB3 PRO A 38 -24.295 33.354 11.894 1.00 10.00 H new ATOM 0 HG2 PRO A 38 -24.633 35.322 14.037 1.00 10.00 H new ATOM 0 HG3 PRO A 38 -23.134 34.764 13.320 1.00 10.00 H new ATOM 0 HD2 PRO A 38 -24.201 37.331 12.960 1.00 10.00 H new ATOM 0 HD3 PRO A 38 -22.996 36.604 11.914 1.00 10.00 H new ATOM 568 N SER A 39 -27.687 34.354 10.969 1.00 10.00 N ATOM 569 CA SER A 39 -28.852 33.725 10.370 1.00 10.00 C ATOM 570 C SER A 39 -29.673 34.666 9.479 1.00 10.00 C ATOM 571 O SER A 39 -30.780 34.298 9.088 1.00 10.00 O ATOM 572 CB SER A 39 -29.653 32.954 11.409 1.00 10.00 C ATOM 573 OG SER A 39 -30.156 33.809 12.427 1.00 10.00 O ATOM 0 H SER A 39 -27.794 34.584 11.957 1.00 10.00 H new ATOM 0 HA SER A 39 -28.493 32.980 9.660 1.00 10.00 H new ATOM 0 HB2 SER A 39 -30.482 32.441 10.922 1.00 10.00 H new ATOM 0 HB3 SER A 39 -29.023 32.186 11.858 1.00 10.00 H new ATOM 0 HG SER A 39 -30.666 33.280 13.076 1.00 10.00 H new ATOM 579 N ASP A 40 -29.145 35.866 9.165 1.00 10.00 N ATOM 580 CA ASP A 40 -29.663 36.767 8.127 1.00 10.00 C ATOM 581 C ASP A 40 -29.851 35.904 6.873 1.00 10.00 C ATOM 582 O ASP A 40 -28.870 35.506 6.249 1.00 10.00 O ATOM 583 CB ASP A 40 -28.741 37.970 7.882 1.00 10.00 C ATOM 584 CG ASP A 40 -29.262 38.804 6.700 1.00 10.00 C ATOM 585 OD1 ASP A 40 -30.195 39.614 6.910 1.00 10.00 O ATOM 586 OD2 ASP A 40 -28.772 38.626 5.560 1.00 10.00 O ATOM 0 H ASP A 40 -28.325 36.241 9.642 1.00 10.00 H new ATOM 0 HA ASP A 40 -30.608 37.214 8.435 1.00 10.00 H new ATOM 0 HB2 ASP A 40 -28.691 38.588 8.779 1.00 10.00 H new ATOM 0 HB3 ASP A 40 -27.728 37.625 7.675 1.00 10.00 H new ATOM 591 N PRO A 41 -31.082 35.560 6.481 1.00 10.00 N ATOM 592 CA PRO A 41 -31.276 34.525 5.481 1.00 10.00 C ATOM 593 C PRO A 41 -30.764 34.843 4.086 1.00 10.00 C ATOM 594 O PRO A 41 -30.448 33.922 3.340 1.00 10.00 O ATOM 595 CB PRO A 41 -32.772 34.250 5.497 1.00 10.00 C ATOM 596 CG PRO A 41 -33.375 35.581 5.953 1.00 10.00 C ATOM 597 CD PRO A 41 -32.346 36.100 6.948 1.00 10.00 C ATOM 0 HA PRO A 41 -30.673 33.654 5.738 1.00 10.00 H new ATOM 0 HB2 PRO A 41 -33.137 33.960 4.512 1.00 10.00 H new ATOM 0 HB3 PRO A 41 -33.024 33.440 6.181 1.00 10.00 H new ATOM 0 HG2 PRO A 41 -33.512 36.269 5.119 1.00 10.00 H new ATOM 0 HG3 PRO A 41 -34.352 35.444 6.417 1.00 10.00 H new ATOM 0 HD2 PRO A 41 -32.328 37.190 6.968 1.00 10.00 H new ATOM 0 HD3 PRO A 41 -32.570 35.766 7.961 1.00 10.00 H new ATOM 605 N ALA A 42 -30.639 36.115 3.723 1.00 10.00 N ATOM 606 CA ALA A 42 -30.109 36.506 2.436 1.00 10.00 C ATOM 607 C ALA A 42 -28.599 36.204 2.300 1.00 10.00 C ATOM 608 O ALA A 42 -28.175 35.696 1.258 1.00 10.00 O ATOM 609 CB ALA A 42 -30.475 37.978 2.243 1.00 10.00 C ATOM 0 H ALA A 42 -30.905 36.899 4.318 1.00 10.00 H new ATOM 0 HA ALA A 42 -30.550 35.916 1.633 1.00 10.00 H new ATOM 0 HB1 ALA A 42 -30.096 38.324 1.281 1.00 10.00 H new ATOM 0 HB2 ALA A 42 -31.559 38.090 2.267 1.00 10.00 H new ATOM 0 HB3 ALA A 42 -30.031 38.571 3.043 1.00 10.00 H new ATOM 615 N LEU A 43 -27.793 36.427 3.350 1.00 10.00 N ATOM 616 CA LEU A 43 -26.395 35.988 3.405 1.00 10.00 C ATOM 617 C LEU A 43 -26.245 34.501 3.775 1.00 10.00 C ATOM 618 O LEU A 43 -25.432 33.806 3.166 1.00 10.00 O ATOM 619 CB LEU A 43 -25.598 36.942 4.314 1.00 10.00 C ATOM 620 CG LEU A 43 -25.768 36.748 5.818 1.00 10.00 C ATOM 621 CD1 LEU A 43 -24.854 35.682 6.363 1.00 10.00 C ATOM 622 CD2 LEU A 43 -25.284 37.930 6.636 1.00 10.00 C ATOM 0 H LEU A 43 -28.098 36.921 4.189 1.00 10.00 H new ATOM 0 HA LEU A 43 -25.968 36.047 2.404 1.00 10.00 H new ATOM 0 HB2 LEU A 43 -24.540 36.838 4.074 1.00 10.00 H new ATOM 0 HB3 LEU A 43 -25.882 37.965 4.067 1.00 10.00 H new ATOM 0 HG LEU A 43 -26.835 36.544 5.905 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -25.012 35.581 7.437 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -25.070 34.732 5.874 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -23.817 35.960 6.174 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -25.434 37.725 7.696 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -24.224 38.095 6.445 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -25.846 38.821 6.356 1.00 10.00 H new ATOM 634 N LEU A 44 -27.012 33.991 4.750 1.00 10.00 N ATOM 635 CA LEU A 44 -26.941 32.588 5.178 1.00 10.00 C ATOM 636 C LEU A 44 -27.339 31.706 4.011 1.00 10.00 C ATOM 637 O LEU A 44 -26.599 30.788 3.718 1.00 10.00 O ATOM 638 CB LEU A 44 -27.697 32.371 6.519 1.00 10.00 C ATOM 639 CG LEU A 44 -28.563 31.129 6.804 1.00 10.00 C ATOM 640 CD1 LEU A 44 -29.664 30.804 5.796 1.00 10.00 C ATOM 641 CD2 LEU A 44 -27.738 29.868 6.945 1.00 10.00 C ATOM 0 H LEU A 44 -27.700 34.542 5.264 1.00 10.00 H new ATOM 0 HA LEU A 44 -25.924 32.289 5.431 1.00 10.00 H new ATOM 0 HB2 LEU A 44 -26.946 32.411 7.308 1.00 10.00 H new ATOM 0 HB3 LEU A 44 -28.345 33.237 6.652 1.00 10.00 H new ATOM 0 HG LEU A 44 -29.043 31.427 7.737 1.00 10.00 H new ATOM 0 HD11 LEU A 44 -30.197 29.908 6.115 1.00 10.00 H new ATOM 0 HD12 LEU A 44 -30.362 31.639 5.737 1.00 10.00 H new ATOM 0 HD13 LEU A 44 -29.220 30.632 4.815 1.00 10.00 H new ATOM 0 HD21 LEU A 44 -28.397 29.023 7.145 1.00 10.00 H new ATOM 0 HD22 LEU A 44 -27.187 29.688 6.022 1.00 10.00 H new ATOM 0 HD23 LEU A 44 -27.035 29.983 7.770 1.00 10.00 H new ATOM 653 N ALA A 45 -28.388 31.981 3.239 1.00 10.00 N ATOM 654 CA ALA A 45 -28.717 31.095 2.137 1.00 10.00 C ATOM 655 C ALA A 45 -27.741 31.232 0.958 1.00 10.00 C ATOM 656 O ALA A 45 -27.627 30.302 0.161 1.00 10.00 O ATOM 657 CB ALA A 45 -30.187 31.213 1.775 1.00 10.00 C ATOM 0 H ALA A 45 -29.005 32.785 3.353 1.00 10.00 H new ATOM 0 HA ALA A 45 -28.576 30.065 2.464 1.00 10.00 H new ATOM 0 HB1 ALA A 45 -30.413 30.541 0.947 1.00 10.00 H new ATOM 0 HB2 ALA A 45 -30.797 30.944 2.637 1.00 10.00 H new ATOM 0 HB3 ALA A 45 -30.408 32.239 1.480 1.00 10.00 H new ATOM 663 N ALA A 46 -26.994 32.339 0.850 1.00 10.00 N ATOM 664 CA ALA A 46 -25.879 32.426 -0.084 1.00 10.00 C ATOM 665 C ALA A 46 -24.737 31.499 0.379 1.00 10.00 C ATOM 666 O ALA A 46 -24.094 30.851 -0.446 1.00 10.00 O ATOM 667 CB ALA A 46 -25.406 33.868 -0.245 1.00 10.00 C ATOM 0 H ALA A 46 -27.147 33.184 1.401 1.00 10.00 H new ATOM 0 HA ALA A 46 -26.214 32.092 -1.066 1.00 10.00 H new ATOM 0 HB1 ALA A 46 -24.573 33.902 -0.948 1.00 10.00 H new ATOM 0 HB2 ALA A 46 -26.225 34.479 -0.623 1.00 10.00 H new ATOM 0 HB3 ALA A 46 -25.081 34.254 0.721 1.00 10.00 H new ATOM 673 N TYR A 47 -24.525 31.364 1.696 1.00 10.00 N ATOM 674 CA TYR A 47 -23.645 30.352 2.274 1.00 10.00 C ATOM 675 C TYR A 47 -24.167 28.975 1.933 1.00 10.00 C ATOM 676 O TYR A 47 -23.436 28.206 1.327 1.00 10.00 O ATOM 677 CB TYR A 47 -23.517 30.493 3.790 1.00 10.00 C ATOM 678 CG TYR A 47 -22.574 29.494 4.448 1.00 10.00 C ATOM 679 CD1 TYR A 47 -21.222 29.425 4.076 1.00 10.00 C ATOM 680 CD2 TYR A 47 -23.081 28.555 5.372 1.00 10.00 C ATOM 681 CE1 TYR A 47 -20.380 28.431 4.611 1.00 10.00 C ATOM 682 CE2 TYR A 47 -22.242 27.568 5.926 1.00 10.00 C ATOM 683 CZ TYR A 47 -20.885 27.500 5.542 1.00 10.00 C ATOM 684 OH TYR A 47 -20.063 26.546 6.058 1.00 10.00 O ATOM 0 H TYR A 47 -24.967 31.964 2.393 1.00 10.00 H new ATOM 0 HA TYR A 47 -22.652 30.496 1.848 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -23.172 31.501 4.019 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -24.506 30.385 4.235 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -20.824 30.141 3.373 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -24.122 28.594 5.657 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -19.345 28.382 4.307 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -22.637 26.864 6.644 1.00 10.00 H new ATOM 0 HH TYR A 47 -20.566 25.985 6.685 1.00 10.00 H new ATOM 694 N GLN A 48 -25.449 28.720 2.211 1.00 10.00 N ATOM 695 CA GLN A 48 -26.136 27.478 1.877 1.00 10.00 C ATOM 696 C GLN A 48 -26.025 27.129 0.381 1.00 10.00 C ATOM 697 O GLN A 48 -25.952 25.958 0.005 1.00 10.00 O ATOM 698 CB GLN A 48 -27.607 27.496 2.319 1.00 10.00 C ATOM 699 CG GLN A 48 -27.916 27.785 3.790 1.00 10.00 C ATOM 700 CD GLN A 48 -27.271 26.795 4.757 1.00 10.00 C ATOM 701 OE1 GLN A 48 -26.203 27.020 5.306 1.00 10.00 O ATOM 702 NE2 GLN A 48 -27.887 25.656 5.001 1.00 10.00 N ATOM 0 H GLN A 48 -26.050 29.393 2.687 1.00 10.00 H new ATOM 0 HA GLN A 48 -25.626 26.694 2.437 1.00 10.00 H new ATOM 0 HB2 GLN A 48 -28.127 28.241 1.717 1.00 10.00 H new ATOM 0 HB3 GLN A 48 -28.041 26.527 2.072 1.00 10.00 H new ATOM 0 HG2 GLN A 48 -27.575 28.791 4.033 1.00 10.00 H new ATOM 0 HG3 GLN A 48 -28.996 27.770 3.935 1.00 10.00 H new ATOM 0 HE21 GLN A 48 -28.779 25.452 4.551 1.00 10.00 H new ATOM 0 HE22 GLN A 48 -27.471 24.978 5.640 1.00 10.00 H new ATOM 711 N SER A 49 -25.952 28.148 -0.479 1.00 10.00 N ATOM 712 CA SER A 49 -25.755 27.997 -1.912 1.00 10.00 C ATOM 713 C SER A 49 -24.329 27.619 -2.267 1.00 10.00 C ATOM 714 O SER A 49 -24.102 26.660 -2.998 1.00 10.00 O ATOM 715 CB SER A 49 -26.093 29.303 -2.665 1.00 10.00 C ATOM 716 OG SER A 49 -27.472 29.606 -2.555 1.00 10.00 O ATOM 0 H SER A 49 -26.031 29.122 -0.185 1.00 10.00 H new ATOM 0 HA SER A 49 -26.427 27.194 -2.215 1.00 10.00 H new ATOM 0 HB2 SER A 49 -25.502 30.125 -2.260 1.00 10.00 H new ATOM 0 HB3 SER A 49 -25.821 29.203 -3.716 1.00 10.00 H new ATOM 0 HG SER A 49 -27.676 29.871 -1.634 1.00 10.00 H new ATOM 722 N LYS A 50 -23.345 28.347 -1.739 1.00 10.00 N ATOM 723 CA LYS A 50 -21.926 28.115 -2.004 1.00 10.00 C ATOM 724 C LYS A 50 -21.441 26.796 -1.415 1.00 10.00 C ATOM 725 O LYS A 50 -20.666 26.099 -2.051 1.00 10.00 O ATOM 726 CB LYS A 50 -21.141 29.344 -1.524 1.00 10.00 C ATOM 727 CG LYS A 50 -21.492 30.563 -2.398 1.00 10.00 C ATOM 728 CD LYS A 50 -20.352 30.947 -3.328 1.00 10.00 C ATOM 729 CE LYS A 50 -20.020 29.856 -4.352 1.00 10.00 C ATOM 730 NZ LYS A 50 -20.362 30.275 -5.739 1.00 10.00 N ATOM 0 H LYS A 50 -23.515 29.127 -1.105 1.00 10.00 H new ATOM 0 HA LYS A 50 -21.755 28.001 -3.074 1.00 10.00 H new ATOM 0 HB2 LYS A 50 -21.378 29.553 -0.481 1.00 10.00 H new ATOM 0 HB3 LYS A 50 -20.070 29.145 -1.574 1.00 10.00 H new ATOM 0 HG2 LYS A 50 -22.382 30.342 -2.988 1.00 10.00 H new ATOM 0 HG3 LYS A 50 -21.737 31.410 -1.757 1.00 10.00 H new ATOM 0 HD2 LYS A 50 -20.614 31.864 -3.855 1.00 10.00 H new ATOM 0 HD3 LYS A 50 -19.464 31.163 -2.735 1.00 10.00 H new ATOM 0 HE2 LYS A 50 -18.958 29.617 -4.296 1.00 10.00 H new ATOM 0 HE3 LYS A 50 -20.565 28.946 -4.103 1.00 10.00 H new ATOM 0 HZ1 LYS A 50 -20.350 29.445 -6.365 1.00 10.00 H new ATOM 0 HZ2 LYS A 50 -21.310 30.702 -5.749 1.00 10.00 H new ATOM 0 HZ3 LYS A 50 -19.665 30.971 -6.073 1.00 10.00 H new ATOM 744 N LEU A 51 -21.983 26.416 -0.267 1.00 10.00 N ATOM 745 CA LEU A 51 -21.893 25.127 0.409 1.00 10.00 C ATOM 746 C LEU A 51 -22.308 24.002 -0.546 1.00 10.00 C ATOM 747 O LEU A 51 -21.642 22.970 -0.630 1.00 10.00 O ATOM 748 CB LEU A 51 -22.827 25.315 1.626 1.00 10.00 C ATOM 749 CG LEU A 51 -23.323 24.128 2.461 1.00 10.00 C ATOM 750 CD1 LEU A 51 -24.010 24.712 3.698 1.00 10.00 C ATOM 751 CD2 LEU A 51 -24.393 23.296 1.744 1.00 10.00 C ATOM 0 H LEU A 51 -22.555 27.068 0.269 1.00 10.00 H new ATOM 0 HA LEU A 51 -20.892 24.837 0.729 1.00 10.00 H new ATOM 0 HB2 LEU A 51 -22.317 25.991 2.312 1.00 10.00 H new ATOM 0 HB3 LEU A 51 -23.713 25.837 1.265 1.00 10.00 H new ATOM 0 HG LEU A 51 -22.465 23.490 2.673 1.00 10.00 H new ATOM 0 HD11 LEU A 51 -24.381 23.901 4.325 1.00 10.00 H new ATOM 0 HD12 LEU A 51 -23.295 25.310 4.263 1.00 10.00 H new ATOM 0 HD13 LEU A 51 -24.844 25.341 3.388 1.00 10.00 H new ATOM 0 HD21 LEU A 51 -24.703 22.471 2.386 1.00 10.00 H new ATOM 0 HD22 LEU A 51 -25.254 23.926 1.520 1.00 10.00 H new ATOM 0 HD23 LEU A 51 -23.983 22.899 0.815 1.00 10.00 H new ATOM 763 N SER A 52 -23.364 24.226 -1.327 1.00 10.00 N ATOM 764 CA SER A 52 -23.782 23.322 -2.387 1.00 10.00 C ATOM 765 C SER A 52 -22.879 23.391 -3.616 1.00 10.00 C ATOM 766 O SER A 52 -22.493 22.350 -4.136 1.00 10.00 O ATOM 767 CB SER A 52 -25.222 23.573 -2.816 1.00 10.00 C ATOM 768 OG SER A 52 -26.130 23.516 -1.724 1.00 10.00 O ATOM 0 H SER A 52 -23.957 25.051 -1.237 1.00 10.00 H new ATOM 0 HA SER A 52 -23.702 22.323 -1.957 1.00 10.00 H new ATOM 0 HB2 SER A 52 -25.291 24.551 -3.292 1.00 10.00 H new ATOM 0 HB3 SER A 52 -25.510 22.834 -3.563 1.00 10.00 H new ATOM 0 HG SER A 52 -26.042 24.328 -1.182 1.00 10.00 H new ATOM 774 N GLU A 53 -22.473 24.584 -4.060 1.00 10.00 N ATOM 775 CA GLU A 53 -21.560 24.747 -5.187 1.00 10.00 C ATOM 776 C GLU A 53 -20.205 24.067 -4.951 1.00 10.00 C ATOM 777 O GLU A 53 -19.576 23.562 -5.873 1.00 10.00 O ATOM 778 CB GLU A 53 -21.227 26.192 -5.498 1.00 10.00 C ATOM 779 CG GLU A 53 -22.205 27.197 -6.065 1.00 10.00 C ATOM 780 CD GLU A 53 -22.939 26.703 -7.326 1.00 10.00 C ATOM 781 OE1 GLU A 53 -22.296 26.594 -8.398 1.00 10.00 O ATOM 782 OE2 GLU A 53 -24.165 26.454 -7.259 1.00 10.00 O ATOM 0 H GLU A 53 -22.772 25.466 -3.644 1.00 10.00 H new ATOM 0 HA GLU A 53 -22.107 24.290 -6.012 1.00 10.00 H new ATOM 0 HB2 GLU A 53 -20.858 26.623 -4.567 1.00 10.00 H new ATOM 0 HB3 GLU A 53 -20.387 26.165 -6.192 1.00 10.00 H new ATOM 0 HG2 GLU A 53 -22.941 27.445 -5.301 1.00 10.00 H new ATOM 0 HG3 GLU A 53 -21.670 28.116 -6.303 1.00 10.00 H new ATOM 789 N TYR A 54 -19.725 24.080 -3.713 1.00 10.00 N ATOM 790 CA TYR A 54 -18.491 23.427 -3.307 1.00 10.00 C ATOM 791 C TYR A 54 -18.647 21.907 -3.366 1.00 10.00 C ATOM 792 O TYR A 54 -17.736 21.214 -3.819 1.00 10.00 O ATOM 793 CB TYR A 54 -18.042 23.986 -1.952 1.00 10.00 C ATOM 794 CG TYR A 54 -17.449 23.008 -0.988 1.00 10.00 C ATOM 795 CD1 TYR A 54 -16.065 22.788 -0.988 1.00 10.00 C ATOM 796 CD2 TYR A 54 -18.279 22.365 -0.062 1.00 10.00 C ATOM 797 CE1 TYR A 54 -15.502 21.941 -0.024 1.00 10.00 C ATOM 798 CE2 TYR A 54 -17.726 21.511 0.896 1.00 10.00 C ATOM 799 CZ TYR A 54 -16.324 21.316 0.945 1.00 10.00 C ATOM 800 OH TYR A 54 -15.774 20.539 1.919 1.00 10.00 O ATOM 0 H TYR A 54 -20.197 24.558 -2.946 1.00 10.00 H new ATOM 0 HA TYR A 54 -17.682 23.649 -4.003 1.00 10.00 H new ATOM 0 HB2 TYR A 54 -17.309 24.772 -2.134 1.00 10.00 H new ATOM 0 HB3 TYR A 54 -18.902 24.456 -1.475 1.00 10.00 H new ATOM 0 HD1 TYR A 54 -15.438 23.267 -1.725 1.00 10.00 H new ATOM 0 HD2 TYR A 54 -19.346 22.529 -0.088 1.00 10.00 H new ATOM 0 HE1 TYR A 54 -14.437 21.764 -0.020 1.00 10.00 H new ATOM 0 HE2 TYR A 54 -18.367 21.000 1.599 1.00 10.00 H new ATOM 0 HH TYR A 54 -16.483 20.190 2.499 1.00 10.00 H new ATOM 810 N ASN A 55 -19.834 21.393 -3.032 1.00 10.00 N ATOM 811 CA ASN A 55 -20.170 20.000 -3.257 1.00 10.00 C ATOM 812 C ASN A 55 -20.397 19.677 -4.760 1.00 10.00 C ATOM 813 O ASN A 55 -20.240 18.529 -5.150 1.00 10.00 O ATOM 814 CB ASN A 55 -21.393 19.592 -2.425 1.00 10.00 C ATOM 815 CG ASN A 55 -21.194 18.308 -1.629 1.00 10.00 C ATOM 816 OD1 ASN A 55 -20.104 17.954 -1.199 1.00 10.00 O ATOM 817 ND2 ASN A 55 -22.250 17.560 -1.400 1.00 10.00 N ATOM 0 H ASN A 55 -20.582 21.936 -2.600 1.00 10.00 H new ATOM 0 HA ASN A 55 -19.311 19.413 -2.931 1.00 10.00 H new ATOM 0 HB2 ASN A 55 -21.639 20.401 -1.737 1.00 10.00 H new ATOM 0 HB3 ASN A 55 -22.248 19.468 -3.090 1.00 10.00 H new ATOM 0 HD21 ASN A 55 -22.156 16.694 -0.869 1.00 10.00 H new ATOM 0 HD22 ASN A 55 -23.163 17.845 -1.753 1.00 10.00 H new ATOM 824 N LEU A 56 -20.762 20.646 -5.615 1.00 10.00 N ATOM 825 CA LEU A 56 -20.808 20.549 -7.086 1.00 10.00 C ATOM 826 C LEU A 56 -19.403 20.533 -7.684 1.00 10.00 C ATOM 827 O LEU A 56 -19.138 19.739 -8.585 1.00 10.00 O ATOM 828 CB LEU A 56 -21.583 21.738 -7.679 1.00 10.00 C ATOM 829 CG LEU A 56 -23.086 21.561 -7.951 1.00 10.00 C ATOM 830 CD1 LEU A 56 -23.866 20.761 -6.906 1.00 10.00 C ATOM 831 CD2 LEU A 56 -23.701 22.958 -8.047 1.00 10.00 C ATOM 0 H LEU A 56 -21.048 21.567 -5.283 1.00 10.00 H new ATOM 0 HA LEU A 56 -21.312 19.615 -7.334 1.00 10.00 H new ATOM 0 HB2 LEU A 56 -21.464 22.584 -7.002 1.00 10.00 H new ATOM 0 HB3 LEU A 56 -21.104 22.012 -8.619 1.00 10.00 H new ATOM 0 HG LEU A 56 -23.161 20.979 -8.869 1.00 10.00 H new ATOM 0 HD11 LEU A 56 -24.914 20.701 -7.201 1.00 10.00 H new ATOM 0 HD12 LEU A 56 -23.451 19.756 -6.833 1.00 10.00 H new ATOM 0 HD13 LEU A 56 -23.790 21.256 -5.938 1.00 10.00 H new ATOM 0 HD21 LEU A 56 -24.770 22.872 -8.240 1.00 10.00 H new ATOM 0 HD22 LEU A 56 -23.543 23.490 -7.109 1.00 10.00 H new ATOM 0 HD23 LEU A 56 -23.228 23.508 -8.860 1.00 10.00 H new ATOM 843 N TYR A 57 -18.493 21.357 -7.157 1.00 10.00 N ATOM 844 CA TYR A 57 -17.074 21.272 -7.467 1.00 10.00 C ATOM 845 C TYR A 57 -16.610 19.821 -7.193 1.00 10.00 C ATOM 846 O TYR A 57 -15.909 19.206 -7.992 1.00 10.00 O ATOM 847 CB TYR A 57 -16.265 22.361 -6.732 1.00 10.00 C ATOM 848 CG TYR A 57 -14.803 21.976 -6.717 1.00 10.00 C ATOM 849 CD1 TYR A 57 -14.393 21.019 -5.778 1.00 10.00 C ATOM 850 CD2 TYR A 57 -13.963 22.319 -7.793 1.00 10.00 C ATOM 851 CE1 TYR A 57 -13.208 20.295 -5.979 1.00 10.00 C ATOM 852 CE2 TYR A 57 -12.729 21.659 -7.953 1.00 10.00 C ATOM 853 CZ TYR A 57 -12.362 20.623 -7.064 1.00 10.00 C ATOM 854 OH TYR A 57 -11.213 19.931 -7.276 1.00 10.00 O ATOM 0 H TYR A 57 -18.727 22.103 -6.501 1.00 10.00 H new ATOM 0 HA TYR A 57 -16.890 21.483 -8.521 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -16.394 23.323 -7.228 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -16.632 22.477 -5.712 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -14.991 20.838 -4.897 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -14.263 23.085 -8.493 1.00 10.00 H new ATOM 0 HE1 TYR A 57 -12.943 19.491 -5.308 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -12.064 21.944 -8.754 1.00 10.00 H new ATOM 0 HH TYR A 57 -10.756 20.290 -8.065 1.00 10.00 H new ATOM 864 N ARG A 58 -17.095 19.243 -6.086 1.00 10.00 N ATOM 865 CA ARG A 58 -16.909 17.857 -5.644 1.00 10.00 C ATOM 866 C ARG A 58 -17.651 16.818 -6.489 1.00 10.00 C ATOM 867 O ARG A 58 -17.151 15.716 -6.656 1.00 10.00 O ATOM 868 CB ARG A 58 -17.406 17.770 -4.187 1.00 10.00 C ATOM 869 CG ARG A 58 -16.412 17.279 -3.145 1.00 10.00 C ATOM 870 CD ARG A 58 -15.410 18.402 -2.843 1.00 10.00 C ATOM 871 NE ARG A 58 -14.469 18.052 -1.763 1.00 10.00 N ATOM 872 CZ ARG A 58 -14.736 18.077 -0.469 1.00 10.00 C ATOM 873 NH1 ARG A 58 -15.947 18.218 -0.011 1.00 10.00 N ATOM 874 NH2 ARG A 58 -13.781 17.968 0.404 1.00 10.00 N ATOM 0 H ARG A 58 -17.669 19.771 -5.429 1.00 10.00 H new ATOM 0 HA ARG A 58 -15.850 17.619 -5.748 1.00 10.00 H new ATOM 0 HB2 ARG A 58 -17.750 18.760 -3.887 1.00 10.00 H new ATOM 0 HB3 ARG A 58 -18.274 17.111 -4.164 1.00 10.00 H new ATOM 0 HG2 ARG A 58 -16.935 16.986 -2.235 1.00 10.00 H new ATOM 0 HG3 ARG A 58 -15.889 16.396 -3.511 1.00 10.00 H new ATOM 0 HD2 ARG A 58 -14.848 18.634 -3.748 1.00 10.00 H new ATOM 0 HD3 ARG A 58 -15.955 19.304 -2.566 1.00 10.00 H new ATOM 0 HE ARG A 58 -13.530 17.766 -2.039 1.00 10.00 H new ATOM 0 HH11 ARG A 58 -16.729 18.314 -0.659 1.00 10.00 H new ATOM 0 HH12 ARG A 58 -16.113 18.233 0.995 1.00 10.00 H new ATOM 0 HH21 ARG A 58 -12.815 17.862 0.093 1.00 10.00 H new ATOM 0 HH22 ARG A 58 -13.996 17.988 1.401 1.00 10.00 H new ATOM 888 N ASN A 59 -18.825 17.147 -7.024 1.00 10.00 N ATOM 889 CA ASN A 59 -19.614 16.303 -7.922 1.00 10.00 C ATOM 890 C ASN A 59 -18.866 16.099 -9.247 1.00 10.00 C ATOM 891 O ASN A 59 -18.719 14.988 -9.752 1.00 10.00 O ATOM 892 CB ASN A 59 -21.001 16.939 -8.151 1.00 10.00 C ATOM 893 CG ASN A 59 -21.930 16.004 -8.907 1.00 10.00 C ATOM 894 OD1 ASN A 59 -21.999 16.010 -10.127 1.00 10.00 O ATOM 895 ND2 ASN A 59 -22.668 15.167 -8.213 1.00 10.00 N ATOM 0 H ASN A 59 -19.271 18.045 -6.837 1.00 10.00 H new ATOM 0 HA ASN A 59 -19.760 15.323 -7.467 1.00 10.00 H new ATOM 0 HB2 ASN A 59 -21.447 17.196 -7.190 1.00 10.00 H new ATOM 0 HB3 ASN A 59 -20.888 17.869 -8.709 1.00 10.00 H new ATOM 0 HD21 ASN A 59 -23.297 14.523 -8.693 1.00 10.00 H new ATOM 0 HD22 ASN A 59 -22.611 15.161 -7.195 1.00 10.00 H new ATOM 902 N ALA A 60 -18.311 17.193 -9.760 1.00 10.00 N ATOM 903 CA ALA A 60 -17.388 17.236 -10.871 1.00 10.00 C ATOM 904 C ALA A 60 -16.087 16.504 -10.549 1.00 10.00 C ATOM 905 O ALA A 60 -15.694 15.601 -11.284 1.00 10.00 O ATOM 906 CB ALA A 60 -17.194 18.725 -11.181 1.00 10.00 C ATOM 0 H ALA A 60 -18.509 18.121 -9.385 1.00 10.00 H new ATOM 0 HA ALA A 60 -17.771 16.715 -11.748 1.00 10.00 H new ATOM 0 HB1 ALA A 60 -16.503 18.836 -12.017 1.00 10.00 H new ATOM 0 HB2 ALA A 60 -18.154 19.170 -11.442 1.00 10.00 H new ATOM 0 HB3 ALA A 60 -16.787 19.229 -10.304 1.00 10.00 H new ATOM 912 N GLN A 61 -15.516 16.758 -9.372 1.00 10.00 N ATOM 913 CA GLN A 61 -14.397 16.023 -8.788 1.00 10.00 C ATOM 914 C GLN A 61 -14.807 14.727 -8.061 1.00 10.00 C ATOM 915 O GLN A 61 -14.296 14.342 -7.009 1.00 10.00 O ATOM 916 CB GLN A 61 -13.547 16.967 -7.974 1.00 10.00 C ATOM 917 CG GLN A 61 -12.108 16.443 -7.801 1.00 10.00 C ATOM 918 CD GLN A 61 -11.093 16.988 -8.811 1.00 10.00 C ATOM 919 OE1 GLN A 61 -11.407 17.504 -9.876 1.00 10.00 O ATOM 920 NE2 GLN A 61 -9.816 16.868 -8.517 1.00 10.00 N ATOM 0 H GLN A 61 -15.837 17.518 -8.772 1.00 10.00 H new ATOM 0 HA GLN A 61 -13.776 15.641 -9.598 1.00 10.00 H new ATOM 0 HB2 GLN A 61 -13.522 17.943 -8.459 1.00 10.00 H new ATOM 0 HB3 GLN A 61 -14.001 17.110 -6.994 1.00 10.00 H new ATOM 0 HG2 GLN A 61 -11.766 16.690 -6.796 1.00 10.00 H new ATOM 0 HG3 GLN A 61 -12.122 15.356 -7.874 1.00 10.00 H new ATOM 0 HE21 GLN A 61 -9.534 16.441 -7.635 1.00 10.00 H new ATOM 0 HE22 GLN A 61 -9.108 17.202 -9.171 1.00 10.00 H new ATOM 929 N SER A 62 -15.773 14.080 -8.694 1.00 10.00 N ATOM 930 CA SER A 62 -16.299 12.735 -8.490 1.00 10.00 C ATOM 931 C SER A 62 -16.560 12.099 -9.864 1.00 10.00 C ATOM 932 O SER A 62 -16.202 10.951 -10.105 1.00 10.00 O ATOM 933 CB SER A 62 -17.521 12.734 -7.576 1.00 10.00 C ATOM 934 OG SER A 62 -18.007 11.414 -7.393 1.00 10.00 O ATOM 0 H SER A 62 -16.269 14.541 -9.457 1.00 10.00 H new ATOM 0 HA SER A 62 -15.564 12.124 -7.966 1.00 10.00 H new ATOM 0 HB2 SER A 62 -17.260 13.168 -6.611 1.00 10.00 H new ATOM 0 HB3 SER A 62 -18.304 13.359 -8.006 1.00 10.00 H new ATOM 0 HG SER A 62 -18.789 11.432 -6.803 1.00 10.00 H new ATOM 940 N ASN A 63 -17.005 12.893 -10.841 1.00 10.00 N ATOM 941 CA ASN A 63 -17.176 12.506 -12.235 1.00 10.00 C ATOM 942 C ASN A 63 -15.870 12.090 -12.914 1.00 10.00 C ATOM 943 O ASN A 63 -15.733 10.995 -13.445 1.00 10.00 O ATOM 944 CB ASN A 63 -17.823 13.700 -12.961 1.00 10.00 C ATOM 945 CG ASN A 63 -18.461 13.291 -14.277 1.00 10.00 C ATOM 946 OD1 ASN A 63 -17.811 13.212 -15.309 1.00 10.00 O ATOM 947 ND2 ASN A 63 -19.745 13.011 -14.285 1.00 10.00 N ATOM 0 H ASN A 63 -17.266 13.864 -10.670 1.00 10.00 H new ATOM 0 HA ASN A 63 -17.810 11.621 -12.283 1.00 10.00 H new ATOM 0 HB2 ASN A 63 -18.579 14.149 -12.317 1.00 10.00 H new ATOM 0 HB3 ASN A 63 -17.068 14.463 -13.147 1.00 10.00 H new ATOM 0 HD21 ASN A 63 -20.200 12.727 -15.153 1.00 10.00 H new ATOM 0 HD22 ASN A 63 -20.287 13.077 -13.423 1.00 10.00 H new ATOM 954 N THR A 64 -14.886 12.972 -12.818 1.00 10.00 N ATOM 955 CA THR A 64 -13.510 12.815 -13.311 1.00 10.00 C ATOM 956 C THR A 64 -12.748 11.644 -12.717 1.00 10.00 C ATOM 957 O THR A 64 -12.019 10.907 -13.367 1.00 10.00 O ATOM 958 CB THR A 64 -12.772 14.118 -13.040 1.00 10.00 C ATOM 959 OG1 THR A 64 -11.466 14.137 -13.559 1.00 10.00 O ATOM 960 CG2 THR A 64 -12.747 14.469 -11.556 1.00 10.00 C ATOM 0 H THR A 64 -15.028 13.876 -12.367 1.00 10.00 H new ATOM 0 HA THR A 64 -13.570 12.589 -14.376 1.00 10.00 H new ATOM 0 HB THR A 64 -13.345 14.880 -13.569 1.00 10.00 H new ATOM 0 HG1 THR A 64 -10.928 13.447 -13.118 1.00 10.00 H new ATOM 0 HG21 THR A 64 -12.210 15.406 -11.413 1.00 10.00 H new ATOM 0 HG22 THR A 64 -13.768 14.577 -11.190 1.00 10.00 H new ATOM 0 HG23 THR A 64 -12.245 13.675 -11.003 1.00 10.00 H new ATOM 968 N VAL A 65 -13.003 11.418 -11.451 1.00 10.00 N ATOM 969 CA VAL A 65 -12.546 10.304 -10.639 1.00 10.00 C ATOM 970 C VAL A 65 -13.081 8.987 -11.216 1.00 10.00 C ATOM 971 O VAL A 65 -12.326 8.060 -11.507 1.00 10.00 O ATOM 972 CB VAL A 65 -13.046 10.556 -9.214 1.00 10.00 C ATOM 973 CG1 VAL A 65 -12.194 9.795 -8.208 1.00 10.00 C ATOM 974 CG2 VAL A 65 -13.065 12.049 -8.833 1.00 10.00 C ATOM 0 H VAL A 65 -13.584 12.060 -10.912 1.00 10.00 H new ATOM 0 HA VAL A 65 -11.459 10.224 -10.634 1.00 10.00 H new ATOM 0 HB VAL A 65 -14.075 10.198 -9.187 1.00 10.00 H new ATOM 0 HG11 VAL A 65 -12.563 9.986 -7.200 1.00 10.00 H new ATOM 0 HG12 VAL A 65 -12.249 8.727 -8.419 1.00 10.00 H new ATOM 0 HG13 VAL A 65 -11.158 10.127 -8.284 1.00 10.00 H new ATOM 0 HG21 VAL A 65 -13.429 12.159 -7.812 1.00 10.00 H new ATOM 0 HG22 VAL A 65 -12.056 12.456 -8.905 1.00 10.00 H new ATOM 0 HG23 VAL A 65 -13.723 12.590 -9.513 1.00 10.00 H new ATOM 984 N LYS A 66 -14.386 8.973 -11.514 1.00 10.00 N ATOM 985 CA LYS A 66 -15.131 7.956 -12.262 1.00 10.00 C ATOM 986 C LYS A 66 -14.784 7.902 -13.771 1.00 10.00 C ATOM 987 O LYS A 66 -15.353 7.095 -14.504 1.00 10.00 O ATOM 988 CB LYS A 66 -16.638 8.169 -12.003 1.00 10.00 C ATOM 989 CG LYS A 66 -17.187 7.344 -10.824 1.00 10.00 C ATOM 990 CD LYS A 66 -16.572 7.662 -9.450 1.00 10.00 C ATOM 991 CE LYS A 66 -17.227 6.870 -8.308 1.00 10.00 C ATOM 992 NZ LYS A 66 -16.934 5.413 -8.373 1.00 10.00 N ATOM 0 H LYS A 66 -14.996 9.734 -11.214 1.00 10.00 H new ATOM 0 HA LYS A 66 -14.830 6.974 -11.897 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -16.818 9.226 -11.810 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -17.193 7.911 -12.905 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -18.264 7.499 -10.765 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -17.028 6.287 -11.038 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -15.505 7.441 -9.474 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -16.672 8.729 -9.250 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -16.879 7.263 -7.353 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -18.306 7.020 -8.340 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -17.401 4.929 -7.579 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -17.290 5.027 -9.271 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -15.907 5.263 -8.314 1.00 10.00 H new ATOM 1006 N VAL A 67 -13.797 8.682 -14.223 1.00 10.00 N ATOM 1007 CA VAL A 67 -13.235 8.749 -15.576 1.00 10.00 C ATOM 1008 C VAL A 67 -11.786 8.287 -15.602 1.00 10.00 C ATOM 1009 O VAL A 67 -11.371 7.599 -16.528 1.00 10.00 O ATOM 1010 CB VAL A 67 -13.436 10.161 -16.115 1.00 10.00 C ATOM 1011 CG1 VAL A 67 -12.521 10.550 -17.255 1.00 10.00 C ATOM 1012 CG2 VAL A 67 -14.896 10.304 -16.482 1.00 10.00 C ATOM 0 H VAL A 67 -13.331 9.339 -13.598 1.00 10.00 H new ATOM 0 HA VAL A 67 -13.759 8.058 -16.237 1.00 10.00 H new ATOM 0 HB VAL A 67 -13.156 10.863 -15.329 1.00 10.00 H new ATOM 0 HG11 VAL A 67 -12.742 11.571 -17.567 1.00 10.00 H new ATOM 0 HG12 VAL A 67 -11.484 10.488 -16.926 1.00 10.00 H new ATOM 0 HG13 VAL A 67 -12.677 9.872 -18.094 1.00 10.00 H new ATOM 0 HG21 VAL A 67 -15.077 11.305 -16.873 1.00 10.00 H new ATOM 0 HG22 VAL A 67 -15.154 9.566 -17.242 1.00 10.00 H new ATOM 0 HG23 VAL A 67 -15.511 10.143 -15.597 1.00 10.00 H new ATOM 1022 N PHE A 68 -11.017 8.583 -14.559 1.00 10.00 N ATOM 1023 CA PHE A 68 -9.719 7.968 -14.330 1.00 10.00 C ATOM 1024 C PHE A 68 -9.980 6.475 -14.023 1.00 10.00 C ATOM 1025 O PHE A 68 -9.152 5.615 -14.286 1.00 10.00 O ATOM 1026 CB PHE A 68 -9.010 8.702 -13.194 1.00 10.00 C ATOM 1027 CG PHE A 68 -8.529 10.102 -13.542 1.00 10.00 C ATOM 1028 CD1 PHE A 68 -7.561 10.292 -14.547 1.00 10.00 C ATOM 1029 CD2 PHE A 68 -9.052 11.224 -12.869 1.00 10.00 C ATOM 1030 CE1 PHE A 68 -7.145 11.590 -14.897 1.00 10.00 C ATOM 1031 CE2 PHE A 68 -8.655 12.523 -13.233 1.00 10.00 C ATOM 1032 CZ PHE A 68 -7.702 12.707 -14.249 1.00 10.00 C ATOM 0 H PHE A 68 -11.281 9.262 -13.845 1.00 10.00 H new ATOM 0 HA PHE A 68 -9.061 8.036 -15.196 1.00 10.00 H new ATOM 0 HB2 PHE A 68 -9.688 8.767 -12.343 1.00 10.00 H new ATOM 0 HB3 PHE A 68 -8.154 8.108 -12.875 1.00 10.00 H new ATOM 0 HD1 PHE A 68 -7.136 9.437 -15.052 1.00 10.00 H new ATOM 0 HD2 PHE A 68 -9.763 11.085 -12.068 1.00 10.00 H new ATOM 0 HE1 PHE A 68 -6.397 11.728 -15.664 1.00 10.00 H new ATOM 0 HE2 PHE A 68 -9.082 13.379 -12.732 1.00 10.00 H new ATOM 0 HZ PHE A 68 -7.398 13.704 -14.532 1.00 10.00 H new ATOM 1042 N LYS A 69 -11.180 6.132 -13.535 1.00 10.00 N ATOM 1043 CA LYS A 69 -11.691 4.762 -13.446 1.00 10.00 C ATOM 1044 C LYS A 69 -11.739 4.132 -14.848 1.00 10.00 C ATOM 1045 O LYS A 69 -11.467 2.950 -15.017 1.00 10.00 O ATOM 1046 CB LYS A 69 -13.100 4.839 -12.812 1.00 10.00 C ATOM 1047 CG LYS A 69 -14.023 3.626 -13.053 1.00 10.00 C ATOM 1048 CD LYS A 69 -14.946 3.826 -14.276 1.00 10.00 C ATOM 1049 CE LYS A 69 -15.337 2.488 -14.914 1.00 10.00 C ATOM 1050 NZ LYS A 69 -16.104 2.684 -16.175 1.00 10.00 N ATOM 0 H LYS A 69 -11.841 6.824 -13.181 1.00 10.00 H new ATOM 0 HA LYS A 69 -11.044 4.135 -12.833 1.00 10.00 H new ATOM 0 HB2 LYS A 69 -12.985 4.973 -11.736 1.00 10.00 H new ATOM 0 HB3 LYS A 69 -13.599 5.730 -13.193 1.00 10.00 H new ATOM 0 HG2 LYS A 69 -13.415 2.733 -13.201 1.00 10.00 H new ATOM 0 HG3 LYS A 69 -14.632 3.453 -12.165 1.00 10.00 H new ATOM 0 HD2 LYS A 69 -15.845 4.360 -13.970 1.00 10.00 H new ATOM 0 HD3 LYS A 69 -14.442 4.448 -15.015 1.00 10.00 H new ATOM 0 HE2 LYS A 69 -14.438 1.907 -15.121 1.00 10.00 H new ATOM 0 HE3 LYS A 69 -15.935 1.910 -14.210 1.00 10.00 H new ATOM 0 HZ1 LYS A 69 -16.453 1.765 -16.515 1.00 10.00 H new ATOM 0 HZ2 LYS A 69 -16.910 3.316 -15.996 1.00 10.00 H new ATOM 0 HZ3 LYS A 69 -15.485 3.108 -16.895 1.00 10.00 H new ATOM 1064 N ASP A 70 -12.075 4.934 -15.859 1.00 10.00 N ATOM 1065 CA ASP A 70 -12.125 4.561 -17.268 1.00 10.00 C ATOM 1066 C ASP A 70 -10.740 4.477 -17.918 1.00 10.00 C ATOM 1067 O ASP A 70 -10.518 3.651 -18.803 1.00 10.00 O ATOM 1068 CB ASP A 70 -13.106 5.457 -18.036 1.00 10.00 C ATOM 1069 CG ASP A 70 -14.008 4.619 -18.953 1.00 10.00 C ATOM 1070 OD1 ASP A 70 -14.838 3.849 -18.408 1.00 10.00 O ATOM 1071 OD2 ASP A 70 -13.902 4.734 -20.197 1.00 10.00 O ATOM 0 H ASP A 70 -12.332 5.909 -15.707 1.00 10.00 H new ATOM 0 HA ASP A 70 -12.513 3.544 -17.322 1.00 10.00 H new ATOM 0 HB2 ASP A 70 -13.719 6.020 -17.332 1.00 10.00 H new ATOM 0 HB3 ASP A 70 -12.552 6.185 -18.629 1.00 10.00 H new ATOM 1076 N ILE A 71 -9.784 5.272 -17.428 1.00 10.00 N ATOM 1077 CA ILE A 71 -8.377 5.143 -17.789 1.00 10.00 C ATOM 1078 C ILE A 71 -7.788 3.869 -17.174 1.00 10.00 C ATOM 1079 O ILE A 71 -7.190 3.052 -17.860 1.00 10.00 O ATOM 1080 CB ILE A 71 -7.607 6.465 -17.478 1.00 10.00 C ATOM 1081 CG1 ILE A 71 -6.708 6.827 -18.675 1.00 10.00 C ATOM 1082 CG2 ILE A 71 -6.757 6.542 -16.187 1.00 10.00 C ATOM 1083 CD1 ILE A 71 -5.429 5.992 -18.679 1.00 10.00 C ATOM 0 H ILE A 71 -9.970 6.026 -16.767 1.00 10.00 H new ATOM 0 HA ILE A 71 -8.266 5.011 -18.865 1.00 10.00 H new ATOM 0 HB ILE A 71 -8.415 7.175 -17.298 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -7.254 6.665 -19.605 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -6.454 7.886 -18.635 1.00 10.00 H new ATOM 0 HG21 ILE A 71 -6.288 7.523 -16.118 1.00 10.00 H new ATOM 0 HG22 ILE A 71 -7.398 6.385 -15.319 1.00 10.00 H new ATOM 0 HG23 ILE A 71 -5.986 5.772 -16.213 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -4.815 6.271 -19.536 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -4.873 6.174 -17.760 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -5.685 4.935 -18.745 1.00 10.00 H new ATOM 1095 N ASP A 72 -8.067 3.611 -15.904 1.00 10.00 N ATOM 1096 CA ASP A 72 -7.748 2.375 -15.195 1.00 10.00 C ATOM 1097 C ASP A 72 -8.427 1.131 -15.792 1.00 10.00 C ATOM 1098 O ASP A 72 -7.847 0.052 -15.786 1.00 10.00 O ATOM 1099 CB ASP A 72 -8.098 2.594 -13.737 1.00 10.00 C ATOM 1100 CG ASP A 72 -7.890 1.353 -12.855 1.00 10.00 C ATOM 1101 OD1 ASP A 72 -6.719 1.003 -12.576 1.00 10.00 O ATOM 1102 OD2 ASP A 72 -8.897 0.761 -12.397 1.00 10.00 O ATOM 0 H ASP A 72 -8.545 4.289 -15.310 1.00 10.00 H new ATOM 0 HA ASP A 72 -6.685 2.158 -15.300 1.00 10.00 H new ATOM 0 HB2 ASP A 72 -7.492 3.411 -13.346 1.00 10.00 H new ATOM 0 HB3 ASP A 72 -9.139 2.908 -13.666 1.00 10.00 H new ATOM 1107 N ALA A 73 -9.611 1.261 -16.388 1.00 10.00 N ATOM 1108 CA ALA A 73 -10.222 0.195 -17.182 1.00 10.00 C ATOM 1109 C ALA A 73 -9.344 -0.175 -18.408 1.00 10.00 C ATOM 1110 O ALA A 73 -9.342 -1.325 -18.852 1.00 10.00 O ATOM 1111 CB ALA A 73 -11.646 0.604 -17.582 1.00 10.00 C ATOM 0 H ALA A 73 -10.175 2.109 -16.334 1.00 10.00 H new ATOM 0 HA ALA A 73 -10.288 -0.709 -16.576 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -12.100 -0.191 -18.174 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -12.241 0.774 -16.685 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -11.609 1.520 -18.172 1.00 10.00 H new ATOM 1117 N ALA A 74 -8.543 0.767 -18.924 1.00 10.00 N ATOM 1118 CA ALA A 74 -7.509 0.532 -19.922 1.00 10.00 C ATOM 1119 C ALA A 74 -6.277 -0.194 -19.328 1.00 10.00 C ATOM 1120 O ALA A 74 -5.721 -1.084 -19.970 1.00 10.00 O ATOM 1121 CB ALA A 74 -7.128 1.866 -20.594 1.00 10.00 C ATOM 0 H ALA A 74 -8.605 1.746 -18.643 1.00 10.00 H new ATOM 0 HA ALA A 74 -7.909 -0.138 -20.683 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -6.354 1.689 -21.341 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -8.007 2.294 -21.076 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -6.754 2.559 -19.841 1.00 10.00 H new ATOM 1127 N ILE A 75 -5.888 0.131 -18.085 1.00 10.00 N ATOM 1128 CA ILE A 75 -4.878 -0.593 -17.290 1.00 10.00 C ATOM 1129 C ILE A 75 -5.329 -2.047 -17.034 1.00 10.00 C ATOM 1130 O ILE A 75 -4.525 -2.970 -17.146 1.00 10.00 O ATOM 1131 CB ILE A 75 -4.556 0.133 -15.943 1.00 10.00 C ATOM 1132 CG1 ILE A 75 -3.730 1.440 -16.025 1.00 10.00 C ATOM 1133 CG2 ILE A 75 -3.771 -0.783 -14.978 1.00 10.00 C ATOM 1134 CD1 ILE A 75 -4.194 2.576 -16.937 1.00 10.00 C ATOM 0 H ILE A 75 -6.279 0.931 -17.588 1.00 10.00 H new ATOM 0 HA ILE A 75 -3.957 -0.609 -17.873 1.00 10.00 H new ATOM 0 HB ILE A 75 -5.557 0.388 -15.596 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -3.658 1.843 -15.015 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -2.720 1.168 -16.333 1.00 10.00 H new ATOM 0 HG21 ILE A 75 -3.565 -0.245 -14.053 1.00 10.00 H new ATOM 0 HG22 ILE A 75 -4.363 -1.671 -14.757 1.00 10.00 H new ATOM 0 HG23 ILE A 75 -2.831 -1.080 -15.442 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -3.494 3.409 -16.866 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -4.234 2.222 -17.967 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -5.185 2.908 -16.629 1.00 10.00 H new ATOM 1146 N LEU A 76 -6.612 -2.276 -16.740 1.00 10.00 N ATOM 1147 CA LEU A 76 -7.242 -3.599 -16.606 1.00 10.00 C ATOM 1148 C LEU A 76 -7.032 -4.451 -17.870 1.00 10.00 C ATOM 1149 O LEU A 76 -6.561 -5.585 -17.783 1.00 10.00 O ATOM 1150 CB LEU A 76 -8.743 -3.399 -16.292 1.00 10.00 C ATOM 1151 CG LEU A 76 -9.150 -3.616 -14.827 1.00 10.00 C ATOM 1152 CD1 LEU A 76 -8.387 -2.745 -13.829 1.00 10.00 C ATOM 1153 CD2 LEU A 76 -10.645 -3.336 -14.656 1.00 10.00 C ATOM 0 H LEU A 76 -7.271 -1.514 -16.581 1.00 10.00 H new ATOM 0 HA LEU A 76 -6.774 -4.146 -15.788 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -9.025 -2.387 -16.582 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -9.320 -4.082 -16.916 1.00 10.00 H new ATOM 0 HG LEU A 76 -8.903 -4.655 -14.607 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -8.734 -2.960 -12.818 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -7.321 -2.960 -13.899 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -8.561 -1.693 -14.056 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -10.928 -3.492 -13.615 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -10.857 -2.305 -14.939 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -11.217 -4.012 -15.292 1.00 10.00 H new ATOM 1165 N GLU A 77 -7.279 -3.872 -19.047 1.00 10.00 N ATOM 1166 CA GLU A 77 -6.972 -4.436 -20.369 1.00 10.00 C ATOM 1167 C GLU A 77 -5.457 -4.554 -20.690 1.00 10.00 C ATOM 1168 O GLU A 77 -5.078 -4.945 -21.797 1.00 10.00 O ATOM 1169 CB GLU A 77 -7.725 -3.643 -21.449 1.00 10.00 C ATOM 1170 CG GLU A 77 -9.243 -3.861 -21.373 1.00 10.00 C ATOM 1171 CD GLU A 77 -9.664 -5.307 -21.701 1.00 10.00 C ATOM 1172 OE1 GLU A 77 -9.601 -5.708 -22.890 1.00 10.00 O ATOM 1173 OE2 GLU A 77 -10.085 -6.047 -20.780 1.00 10.00 O ATOM 0 H GLU A 77 -7.719 -2.954 -19.110 1.00 10.00 H new ATOM 0 HA GLU A 77 -7.319 -5.469 -20.357 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -7.506 -2.581 -21.337 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.365 -3.941 -22.434 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -9.591 -3.606 -20.372 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -9.737 -3.179 -22.065 1.00 10.00 H new ATOM 1180 N HIS A 78 -4.583 -4.236 -19.725 1.00 10.00 N ATOM 1181 CA HIS A 78 -3.116 -4.272 -19.813 1.00 10.00 C ATOM 1182 C HIS A 78 -2.468 -5.103 -18.676 1.00 10.00 C ATOM 1183 O HIS A 78 -1.242 -5.249 -18.637 1.00 10.00 O ATOM 1184 CB HIS A 78 -2.590 -2.818 -19.786 1.00 10.00 C ATOM 1185 CG HIS A 78 -1.311 -2.605 -20.563 1.00 10.00 C ATOM 1186 ND1 HIS A 78 -0.143 -3.318 -20.420 1.00 10.00 N ATOM 1187 CD2 HIS A 78 -1.085 -1.656 -21.523 1.00 10.00 C ATOM 1188 CE1 HIS A 78 0.768 -2.821 -21.273 1.00 10.00 C ATOM 1189 NE2 HIS A 78 0.238 -1.799 -21.972 1.00 10.00 N ATOM 0 H HIS A 78 -4.901 -3.928 -18.806 1.00 10.00 H new ATOM 0 HA HIS A 78 -2.840 -4.765 -20.745 1.00 10.00 H new ATOM 0 HB2 HIS A 78 -3.359 -2.158 -20.187 1.00 10.00 H new ATOM 0 HB3 HIS A 78 -2.425 -2.523 -18.750 1.00 10.00 H new ATOM 0 HD1 HIS A 78 0.006 -4.094 -19.775 1.00 10.00 H new ATOM 0 HD2 HIS A 78 -1.799 -0.925 -21.874 1.00 10.00 H new ATOM 0 HE1 HIS A 78 1.778 -3.187 -21.382 1.00 10.00 H new ATOM 1197 N HIS A 79 -3.262 -5.659 -17.750 1.00 10.00 N ATOM 1198 CA HIS A 79 -2.780 -6.277 -16.504 1.00 10.00 C ATOM 1199 C HIS A 79 -3.603 -7.517 -16.095 1.00 10.00 C ATOM 1200 O HIS A 79 -4.097 -7.630 -14.971 1.00 10.00 O ATOM 1201 CB HIS A 79 -2.719 -5.187 -15.417 1.00 10.00 C ATOM 1202 CG HIS A 79 -1.927 -5.588 -14.196 1.00 10.00 C ATOM 1203 ND1 HIS A 79 -0.568 -5.806 -14.140 1.00 10.00 N ATOM 1204 CD2 HIS A 79 -2.418 -5.783 -12.932 1.00 10.00 C ATOM 1205 CE1 HIS A 79 -0.246 -6.128 -12.875 1.00 10.00 C ATOM 1206 NE2 HIS A 79 -1.344 -6.127 -12.098 1.00 10.00 N ATOM 0 H HIS A 79 -4.277 -5.693 -17.847 1.00 10.00 H new ATOM 0 HA HIS A 79 -1.776 -6.673 -16.656 1.00 10.00 H new ATOM 0 HB2 HIS A 79 -2.279 -4.286 -15.844 1.00 10.00 H new ATOM 0 HB3 HIS A 79 -3.734 -4.933 -15.113 1.00 10.00 H new ATOM 0 HD2 HIS A 79 -3.451 -5.688 -12.631 1.00 10.00 H new ATOM 0 HE1 HIS A 79 0.752 -6.355 -12.531 1.00 10.00 H new ATOM 0 HE2 HIS A 79 -1.387 -6.335 -11.100 1.00 10.00 H new ATOM 1214 N HIS A 80 -3.762 -8.466 -17.023 1.00 10.00 N ATOM 1215 CA HIS A 80 -4.436 -9.763 -16.828 1.00 10.00 C ATOM 1216 C HIS A 80 -3.618 -10.759 -15.962 1.00 10.00 C ATOM 1217 O HIS A 80 -3.368 -11.900 -16.358 1.00 10.00 O ATOM 1218 CB HIS A 80 -4.801 -10.342 -18.208 1.00 10.00 C ATOM 1219 CG HIS A 80 -5.683 -9.434 -19.032 1.00 10.00 C ATOM 1220 ND1 HIS A 80 -6.946 -8.999 -18.696 1.00 10.00 N ATOM 1221 CD2 HIS A 80 -5.382 -8.892 -20.252 1.00 10.00 C ATOM 1222 CE1 HIS A 80 -7.395 -8.208 -19.686 1.00 10.00 C ATOM 1223 NE2 HIS A 80 -6.474 -8.114 -20.663 1.00 10.00 N ATOM 0 H HIS A 80 -3.411 -8.351 -17.974 1.00 10.00 H new ATOM 0 HA HIS A 80 -5.347 -9.595 -16.254 1.00 10.00 H new ATOM 0 HB2 HIS A 80 -3.884 -10.544 -18.762 1.00 10.00 H new ATOM 0 HB3 HIS A 80 -5.307 -11.298 -18.069 1.00 10.00 H new ATOM 0 HD2 HIS A 80 -4.464 -9.038 -20.802 1.00 10.00 H new ATOM 0 HE1 HIS A 80 -8.357 -7.718 -19.696 1.00 10.00 H new ATOM 0 HE2 HIS A 80 -6.554 -7.583 -21.530 1.00 10.00 H new ATOM 1231 N HIS A 81 -3.149 -10.319 -14.788 1.00 10.00 N ATOM 1232 CA HIS A 81 -2.231 -11.055 -13.900 1.00 10.00 C ATOM 1233 C HIS A 81 -2.831 -12.298 -13.198 1.00 10.00 C ATOM 1234 O HIS A 81 -2.110 -13.022 -12.505 1.00 10.00 O ATOM 1235 CB HIS A 81 -1.656 -10.073 -12.863 1.00 10.00 C ATOM 1236 CG HIS A 81 -2.580 -9.773 -11.703 1.00 10.00 C ATOM 1237 ND1 HIS A 81 -2.542 -10.377 -10.465 1.00 10.00 N ATOM 1238 CD2 HIS A 81 -3.605 -8.865 -11.673 1.00 10.00 C ATOM 1239 CE1 HIS A 81 -3.514 -9.845 -9.705 1.00 10.00 C ATOM 1240 NE2 HIS A 81 -4.192 -8.913 -10.400 1.00 10.00 N ATOM 0 H HIS A 81 -3.406 -9.406 -14.413 1.00 10.00 H new ATOM 0 HA HIS A 81 -1.451 -11.464 -14.542 1.00 10.00 H new ATOM 0 HB2 HIS A 81 -0.724 -10.481 -12.472 1.00 10.00 H new ATOM 0 HB3 HIS A 81 -1.408 -9.138 -13.365 1.00 10.00 H new ATOM 0 HD2 HIS A 81 -3.908 -8.224 -12.487 1.00 10.00 H new ATOM 0 HE1 HIS A 81 -3.721 -10.125 -8.683 1.00 10.00 H new ATOM 0 HE2 HIS A 81 -4.977 -8.353 -10.067 1.00 10.00 H new ATOM 1248 N HIS A 82 -4.141 -12.536 -13.327 1.00 10.00 N ATOM 1249 CA HIS A 82 -4.858 -13.641 -12.680 1.00 10.00 C ATOM 1250 C HIS A 82 -4.360 -15.036 -13.123 1.00 10.00 C ATOM 1251 O HIS A 82 -3.979 -15.236 -14.282 1.00 10.00 O ATOM 1252 CB HIS A 82 -6.362 -13.504 -12.971 1.00 10.00 C ATOM 1253 CG HIS A 82 -6.947 -12.152 -12.637 1.00 10.00 C ATOM 1254 ND1 HIS A 82 -7.643 -11.333 -13.500 1.00 10.00 N ATOM 1255 CD2 HIS A 82 -6.909 -11.514 -11.425 1.00 10.00 C ATOM 1256 CE1 HIS A 82 -8.017 -10.231 -12.828 1.00 10.00 C ATOM 1257 NE2 HIS A 82 -7.593 -10.296 -11.553 1.00 10.00 N ATOM 0 H HIS A 82 -4.748 -11.950 -13.900 1.00 10.00 H new ATOM 0 HA HIS A 82 -4.663 -13.571 -11.610 1.00 10.00 H new ATOM 0 HB2 HIS A 82 -6.534 -13.709 -14.028 1.00 10.00 H new ATOM 0 HB3 HIS A 82 -6.899 -14.267 -12.407 1.00 10.00 H new ATOM 0 HD2 HIS A 82 -6.435 -11.884 -10.528 1.00 10.00 H new ATOM 0 HE1 HIS A 82 -8.578 -9.411 -13.251 1.00 10.00 H new ATOM 0 HE2 HIS A 82 -7.740 -9.598 -10.824 1.00 10.00 H new ATOM 1265 N HIS A 83 -4.437 -16.012 -12.209 1.00 10.00 N ATOM 1266 CA HIS A 83 -4.082 -17.428 -12.407 1.00 10.00 C ATOM 1267 C HIS A 83 -5.040 -18.359 -11.636 1.00 10.00 C ATOM 1268 O HIS A 83 -5.508 -19.356 -12.231 1.00 10.00 O ATOM 1269 CB HIS A 83 -2.625 -17.673 -11.973 1.00 10.00 C ATOM 1270 CG HIS A 83 -1.584 -17.039 -12.864 1.00 10.00 C ATOM 1271 ND1 HIS A 83 -1.308 -17.390 -14.167 1.00 10.00 N ATOM 1272 CD2 HIS A 83 -0.706 -16.043 -12.524 1.00 10.00 C ATOM 1273 CE1 HIS A 83 -0.295 -16.623 -14.605 1.00 10.00 C ATOM 1274 NE2 HIS A 83 0.114 -15.785 -13.634 1.00 10.00 N ATOM 1275 OXT HIS A 83 -5.328 -18.086 -10.446 1.00 10.00 O ATOM 0 H HIS A 83 -4.766 -15.828 -11.261 1.00 10.00 H new ATOM 0 HA HIS A 83 -4.179 -17.658 -13.468 1.00 10.00 H new ATOM 0 HB2 HIS A 83 -2.494 -17.295 -10.959 1.00 10.00 H new ATOM 0 HB3 HIS A 83 -2.447 -18.748 -11.938 1.00 10.00 H new ATOM 0 HD2 HIS A 83 -0.654 -15.543 -11.568 1.00 10.00 H new ATOM 0 HE1 HIS A 83 0.131 -16.672 -15.596 1.00 10.00 H new ATOM 0 HE2 HIS A 83 0.868 -15.100 -13.693 1.00 10.00 H new TER 1283 HIS A 83