USER MOD reduce.3.24.130724 H: found=0, std=0, add=783, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 780 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -122:sc= -0.614 (180deg=-0.813) USER MOD Single : A 2 THR OG1 : rot 159:sc= -4.85! USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 88:sc= 0.665 USER MOD Single : A 32 LYS NZ :NH3+ -167:sc=-0.00584 (180deg=-0.109) USER MOD Single : A 33 GLN : amide:sc= -2.78 K(o=-2.8,f=-6!) USER MOD Single : A 35 GLN : amide:sc= -1.98! K(o=-2!,f=-1.4) USER MOD Single : A 36 TYR OH : rot 8:sc= -2.47! USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 HIS : no HE2:sc= -0.551 K(o=-0.55,f=-4.1!) USER MOD Single : A 55 THR OG1 : rot -40:sc= -0.124 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -114:sc= -0.565 USER MOD Single : A 72 SER OG : rot 99:sc= 0.648 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot -57:sc= 1.09 USER MOD Single : A 90 LYS NZ :NH3+ 137:sc= 0.714 (180deg=0.0265) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.627 0.820 0.424 1.00 0.00 N ATOM 2 CA MET A 1 1.808 0.413 -0.965 1.00 0.00 C ATOM 3 C MET A 1 2.525 -0.931 -1.048 1.00 0.00 C ATOM 4 O MET A 1 2.228 -1.752 -1.917 1.00 0.00 O ATOM 5 CB MET A 1 2.601 1.475 -1.730 1.00 0.00 C ATOM 6 CG MET A 1 4.002 1.697 -1.186 1.00 0.00 C ATOM 7 SD MET A 1 4.664 3.320 -1.610 1.00 0.00 S ATOM 8 CE MET A 1 5.322 3.842 -0.028 1.00 0.00 C ATOM 0 H1 MET A 1 0.614 0.959 0.616 1.00 0.00 H new ATOM 0 H2 MET A 1 2.000 0.081 1.054 1.00 0.00 H new ATOM 0 H3 MET A 1 2.137 1.710 0.594 1.00 0.00 H new ATOM 0 HA MET A 1 0.823 0.308 -1.419 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.669 1.181 -2.777 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.054 2.418 -1.698 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.988 1.587 -0.102 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.665 0.925 -1.576 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.767 4.832 -0.128 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.518 3.878 0.707 1.00 0.00 H new ATOM 0 HE3 MET A 1 6.083 3.134 0.301 1.00 0.00 H new ATOM 18 N THR A 2 3.470 -1.150 -0.140 1.00 0.00 N ATOM 19 CA THR A 2 4.230 -2.394 -0.112 1.00 0.00 C ATOM 20 C THR A 2 4.078 -3.101 1.229 1.00 0.00 C ATOM 21 O THR A 2 3.945 -2.471 2.279 1.00 0.00 O ATOM 22 CB THR A 2 5.726 -2.144 -0.382 1.00 0.00 C ATOM 23 OG1 THR A 2 6.495 -3.277 0.039 1.00 0.00 O ATOM 24 CG2 THR A 2 6.207 -0.899 0.347 1.00 0.00 C ATOM 0 H THR A 2 3.728 -0.482 0.586 1.00 0.00 H new ATOM 0 HA THR A 2 3.827 -3.029 -0.901 1.00 0.00 H new ATOM 0 HB THR A 2 5.859 -1.992 -1.453 1.00 0.00 H new ATOM 0 HG1 THR A 2 7.361 -3.274 -0.420 1.00 0.00 H new ATOM 0 HG21 THR A 2 7.266 -0.743 0.141 1.00 0.00 H new ATOM 0 HG22 THR A 2 5.639 -0.034 0.004 1.00 0.00 H new ATOM 0 HG23 THR A 2 6.061 -1.026 1.420 1.00 0.00 H new ATOM 32 N PRO A 3 4.099 -4.442 1.198 1.00 0.00 N ATOM 33 CA PRO A 3 3.966 -5.264 2.404 1.00 0.00 C ATOM 34 C PRO A 3 5.190 -5.169 3.309 1.00 0.00 C ATOM 35 O PRO A 3 5.077 -5.252 4.532 1.00 0.00 O ATOM 36 CB PRO A 3 3.818 -6.684 1.852 1.00 0.00 C ATOM 37 CG PRO A 3 4.486 -6.643 0.521 1.00 0.00 C ATOM 38 CD PRO A 3 4.254 -5.259 -0.017 1.00 0.00 C ATOM 0 HA PRO A 3 3.129 -4.944 3.024 1.00 0.00 H new ATOM 0 HB2 PRO A 3 4.289 -7.415 2.509 1.00 0.00 H new ATOM 0 HB3 PRO A 3 2.769 -6.966 1.760 1.00 0.00 H new ATOM 0 HG2 PRO A 3 5.552 -6.852 0.613 1.00 0.00 H new ATOM 0 HG3 PRO A 3 4.070 -7.396 -0.148 1.00 0.00 H new ATOM 0 HD2 PRO A 3 5.092 -4.919 -0.626 1.00 0.00 H new ATOM 0 HD3 PRO A 3 3.365 -5.216 -0.646 1.00 0.00 H new ATOM 46 N ILE A 4 6.358 -4.994 2.699 1.00 0.00 N ATOM 47 CA ILE A 4 7.602 -4.886 3.450 1.00 0.00 C ATOM 48 C ILE A 4 7.489 -3.840 4.554 1.00 0.00 C ATOM 49 O ILE A 4 8.108 -3.969 5.610 1.00 0.00 O ATOM 50 CB ILE A 4 8.784 -4.523 2.532 1.00 0.00 C ATOM 51 CG1 ILE A 4 10.107 -4.658 3.289 1.00 0.00 C ATOM 52 CG2 ILE A 4 8.619 -3.110 1.991 1.00 0.00 C ATOM 53 CD1 ILE A 4 11.242 -5.176 2.435 1.00 0.00 C ATOM 0 H ILE A 4 6.468 -4.924 1.687 1.00 0.00 H new ATOM 0 HA ILE A 4 7.787 -5.863 3.897 1.00 0.00 H new ATOM 0 HB ILE A 4 8.797 -5.215 1.690 1.00 0.00 H new ATOM 0 HG12 ILE A 4 10.384 -3.686 3.696 1.00 0.00 H new ATOM 0 HG13 ILE A 4 9.965 -5.329 4.136 1.00 0.00 H new ATOM 0 HG21 ILE A 4 9.462 -2.867 1.344 1.00 0.00 H new ATOM 0 HG22 ILE A 4 7.693 -3.045 1.420 1.00 0.00 H new ATOM 0 HG23 ILE A 4 8.584 -2.404 2.821 1.00 0.00 H new ATOM 0 HD11 ILE A 4 12.148 -5.246 3.037 1.00 0.00 H new ATOM 0 HD12 ILE A 4 10.986 -6.163 2.049 1.00 0.00 H new ATOM 0 HD13 ILE A 4 11.412 -4.493 1.602 1.00 0.00 H new ATOM 65 N GLU A 5 6.694 -2.805 4.301 1.00 0.00 N ATOM 66 CA GLU A 5 6.499 -1.737 5.275 1.00 0.00 C ATOM 67 C GLU A 5 5.587 -2.195 6.410 1.00 0.00 C ATOM 68 O GLU A 5 5.837 -1.898 7.579 1.00 0.00 O ATOM 69 CB GLU A 5 5.906 -0.500 4.596 1.00 0.00 C ATOM 70 CG GLU A 5 6.605 0.795 4.974 1.00 0.00 C ATOM 71 CD GLU A 5 5.995 2.006 4.296 1.00 0.00 C ATOM 72 OE1 GLU A 5 6.471 3.132 4.553 1.00 0.00 O ATOM 73 OE2 GLU A 5 5.041 1.829 3.509 1.00 0.00 O ATOM 0 H GLU A 5 6.175 -2.683 3.431 1.00 0.00 H new ATOM 0 HA GLU A 5 7.472 -1.481 5.695 1.00 0.00 H new ATOM 0 HB2 GLU A 5 5.958 -0.629 3.515 1.00 0.00 H new ATOM 0 HB3 GLU A 5 4.851 -0.423 4.857 1.00 0.00 H new ATOM 0 HG2 GLU A 5 6.558 0.927 6.055 1.00 0.00 H new ATOM 0 HG3 GLU A 5 7.659 0.726 4.706 1.00 0.00 H new ATOM 80 N TYR A 6 4.530 -2.917 6.056 1.00 0.00 N ATOM 81 CA TYR A 6 3.579 -3.414 7.044 1.00 0.00 C ATOM 82 C TYR A 6 4.250 -4.392 8.002 1.00 0.00 C ATOM 83 O TYR A 6 4.139 -4.259 9.222 1.00 0.00 O ATOM 84 CB TYR A 6 2.398 -4.092 6.348 1.00 0.00 C ATOM 85 CG TYR A 6 1.559 -3.147 5.519 1.00 0.00 C ATOM 86 CD1 TYR A 6 1.105 -3.514 4.258 1.00 0.00 C ATOM 87 CD2 TYR A 6 1.221 -1.886 5.995 1.00 0.00 C ATOM 88 CE1 TYR A 6 0.339 -2.653 3.496 1.00 0.00 C ATOM 89 CE2 TYR A 6 0.455 -1.019 5.240 1.00 0.00 C ATOM 90 CZ TYR A 6 0.016 -1.407 3.992 1.00 0.00 C ATOM 91 OH TYR A 6 -0.747 -0.546 3.236 1.00 0.00 O ATOM 0 H TYR A 6 4.310 -3.171 5.093 1.00 0.00 H new ATOM 0 HA TYR A 6 3.214 -2.564 7.620 1.00 0.00 H new ATOM 0 HB2 TYR A 6 2.774 -4.889 5.706 1.00 0.00 H new ATOM 0 HB3 TYR A 6 1.765 -4.562 7.101 1.00 0.00 H new ATOM 0 HD1 TYR A 6 1.355 -4.489 3.867 1.00 0.00 H new ATOM 0 HD2 TYR A 6 1.563 -1.578 6.972 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -0.005 -2.954 2.517 1.00 0.00 H new ATOM 0 HE2 TYR A 6 0.201 -0.042 5.625 1.00 0.00 H new ATOM 0 HH TYR A 6 -0.885 0.289 3.730 1.00 0.00 H new ATOM 101 N ILE A 7 4.947 -5.375 7.442 1.00 0.00 N ATOM 102 CA ILE A 7 5.638 -6.376 8.246 1.00 0.00 C ATOM 103 C ILE A 7 6.766 -5.746 9.057 1.00 0.00 C ATOM 104 O ILE A 7 7.020 -6.140 10.196 1.00 0.00 O ATOM 105 CB ILE A 7 6.217 -7.501 7.369 1.00 0.00 C ATOM 106 CG1 ILE A 7 7.197 -6.925 6.344 1.00 0.00 C ATOM 107 CG2 ILE A 7 5.098 -8.258 6.671 1.00 0.00 C ATOM 108 CD1 ILE A 7 8.645 -7.024 6.771 1.00 0.00 C ATOM 0 H ILE A 7 5.048 -5.500 6.435 1.00 0.00 H new ATOM 0 HA ILE A 7 4.899 -6.801 8.925 1.00 0.00 H new ATOM 0 HB ILE A 7 6.757 -8.199 8.009 1.00 0.00 H new ATOM 0 HG12 ILE A 7 7.069 -7.449 5.397 1.00 0.00 H new ATOM 0 HG13 ILE A 7 6.950 -5.879 6.165 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.524 -9.050 6.055 1.00 0.00 H new ATOM 0 HG22 ILE A 7 4.434 -8.695 7.417 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.533 -7.572 6.040 1.00 0.00 H new ATOM 0 HD11 ILE A 7 9.283 -6.597 5.997 1.00 0.00 H new ATOM 0 HD12 ILE A 7 8.788 -6.476 7.702 1.00 0.00 H new ATOM 0 HD13 ILE A 7 8.909 -8.071 6.922 1.00 0.00 H new ATOM 120 N ASP A 8 7.438 -4.766 8.463 1.00 0.00 N ATOM 121 CA ASP A 8 8.537 -4.079 9.131 1.00 0.00 C ATOM 122 C ASP A 8 8.025 -3.240 10.298 1.00 0.00 C ATOM 123 O ASP A 8 8.700 -3.100 11.318 1.00 0.00 O ATOM 124 CB ASP A 8 9.290 -3.192 8.139 1.00 0.00 C ATOM 125 CG ASP A 8 10.330 -2.320 8.816 1.00 0.00 C ATOM 126 OD1 ASP A 8 11.004 -2.813 9.745 1.00 0.00 O ATOM 127 OD2 ASP A 8 10.471 -1.146 8.415 1.00 0.00 O ATOM 0 H ASP A 8 7.241 -4.430 7.520 1.00 0.00 H new ATOM 0 HA ASP A 8 9.220 -4.833 9.522 1.00 0.00 H new ATOM 0 HB2 ASP A 8 9.776 -3.819 7.392 1.00 0.00 H new ATOM 0 HB3 ASP A 8 8.578 -2.559 7.609 1.00 0.00 H new ATOM 132 N ARG A 9 6.829 -2.683 10.139 1.00 0.00 N ATOM 133 CA ARG A 9 6.228 -1.855 11.177 1.00 0.00 C ATOM 134 C ARG A 9 6.006 -2.660 12.454 1.00 0.00 C ATOM 135 O ARG A 9 6.318 -2.200 13.552 1.00 0.00 O ATOM 136 CB ARG A 9 4.898 -1.275 10.690 1.00 0.00 C ATOM 137 CG ARG A 9 4.350 -0.175 11.585 1.00 0.00 C ATOM 138 CD ARG A 9 5.042 1.153 11.324 1.00 0.00 C ATOM 139 NE ARG A 9 4.356 2.266 11.976 1.00 0.00 N ATOM 140 CZ ARG A 9 4.776 3.525 11.916 1.00 0.00 C ATOM 141 NH1 ARG A 9 5.873 3.829 11.237 1.00 0.00 N ATOM 142 NH2 ARG A 9 4.097 4.482 12.535 1.00 0.00 N ATOM 0 H ARG A 9 6.257 -2.790 9.301 1.00 0.00 H new ATOM 0 HA ARG A 9 6.915 -1.038 11.398 1.00 0.00 H new ATOM 0 HB2 ARG A 9 5.030 -0.880 9.683 1.00 0.00 H new ATOM 0 HB3 ARG A 9 4.164 -2.078 10.624 1.00 0.00 H new ATOM 0 HG2 ARG A 9 3.279 -0.067 11.416 1.00 0.00 H new ATOM 0 HG3 ARG A 9 4.481 -0.456 12.630 1.00 0.00 H new ATOM 0 HD2 ARG A 9 6.071 1.102 11.681 1.00 0.00 H new ATOM 0 HD3 ARG A 9 5.086 1.334 10.250 1.00 0.00 H new ATOM 0 HE ARG A 9 3.508 2.065 12.506 1.00 0.00 H new ATOM 0 HH11 ARG A 9 6.397 3.096 10.759 1.00 0.00 H new ATOM 0 HH12 ARG A 9 6.194 4.796 11.192 1.00 0.00 H new ATOM 0 HH21 ARG A 9 3.252 4.251 13.057 1.00 0.00 H new ATOM 0 HH22 ARG A 9 4.420 5.448 12.488 1.00 0.00 H new ATOM 156 N ALA A 10 5.465 -3.865 12.302 1.00 0.00 N ATOM 157 CA ALA A 10 5.203 -4.734 13.442 1.00 0.00 C ATOM 158 C ALA A 10 6.454 -4.910 14.297 1.00 0.00 C ATOM 159 O ALA A 10 6.371 -5.016 15.521 1.00 0.00 O ATOM 160 CB ALA A 10 4.691 -6.087 12.967 1.00 0.00 C ATOM 0 H ALA A 10 5.200 -4.261 11.400 1.00 0.00 H new ATOM 0 HA ALA A 10 4.437 -4.263 14.058 1.00 0.00 H new ATOM 0 HB1 ALA A 10 4.499 -6.726 13.829 1.00 0.00 H new ATOM 0 HB2 ALA A 10 3.768 -5.950 12.405 1.00 0.00 H new ATOM 0 HB3 ALA A 10 5.439 -6.555 12.327 1.00 0.00 H new ATOM 166 N LEU A 11 7.611 -4.942 13.645 1.00 0.00 N ATOM 167 CA LEU A 11 8.880 -5.106 14.346 1.00 0.00 C ATOM 168 C LEU A 11 9.006 -4.100 15.485 1.00 0.00 C ATOM 169 O LEU A 11 9.472 -4.436 16.574 1.00 0.00 O ATOM 170 CB LEU A 11 10.048 -4.941 13.372 1.00 0.00 C ATOM 171 CG LEU A 11 11.228 -5.893 13.572 1.00 0.00 C ATOM 172 CD1 LEU A 11 11.145 -7.058 12.597 1.00 0.00 C ATOM 173 CD2 LEU A 11 12.546 -5.150 13.408 1.00 0.00 C ATOM 0 H LEU A 11 7.697 -4.857 12.632 1.00 0.00 H new ATOM 0 HA LEU A 11 8.907 -6.110 14.769 1.00 0.00 H new ATOM 0 HB2 LEU A 11 9.670 -5.071 12.358 1.00 0.00 H new ATOM 0 HB3 LEU A 11 10.416 -3.918 13.447 1.00 0.00 H new ATOM 0 HG LEU A 11 11.182 -6.291 14.586 1.00 0.00 H new ATOM 0 HD11 LEU A 11 11.993 -7.725 12.754 1.00 0.00 H new ATOM 0 HD12 LEU A 11 10.217 -7.605 12.762 1.00 0.00 H new ATOM 0 HD13 LEU A 11 11.166 -6.679 11.575 1.00 0.00 H new ATOM 0 HD21 LEU A 11 13.375 -5.843 13.554 1.00 0.00 H new ATOM 0 HD22 LEU A 11 12.601 -4.724 12.406 1.00 0.00 H new ATOM 0 HD23 LEU A 11 12.607 -4.351 14.146 1.00 0.00 H new ATOM 185 N ALA A 12 8.587 -2.866 15.227 1.00 0.00 N ATOM 186 CA ALA A 12 8.650 -1.812 16.232 1.00 0.00 C ATOM 187 C ALA A 12 7.748 -2.132 17.420 1.00 0.00 C ATOM 188 O ALA A 12 8.165 -2.029 18.574 1.00 0.00 O ATOM 189 CB ALA A 12 8.263 -0.474 15.619 1.00 0.00 C ATOM 0 H ALA A 12 8.200 -2.571 14.330 1.00 0.00 H new ATOM 0 HA ALA A 12 9.676 -1.750 16.594 1.00 0.00 H new ATOM 0 HB1 ALA A 12 8.314 0.304 16.381 1.00 0.00 H new ATOM 0 HB2 ALA A 12 8.950 -0.233 14.808 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.247 -0.533 15.229 1.00 0.00 H new ATOM 195 N LEU A 13 6.511 -2.520 17.130 1.00 0.00 N ATOM 196 CA LEU A 13 5.550 -2.854 18.175 1.00 0.00 C ATOM 197 C LEU A 13 5.999 -4.086 18.954 1.00 0.00 C ATOM 198 O LEU A 13 5.788 -4.180 20.164 1.00 0.00 O ATOM 199 CB LEU A 13 4.169 -3.099 17.565 1.00 0.00 C ATOM 200 CG LEU A 13 3.582 -1.947 16.748 1.00 0.00 C ATOM 201 CD1 LEU A 13 2.537 -2.463 15.771 1.00 0.00 C ATOM 202 CD2 LEU A 13 2.981 -0.894 17.667 1.00 0.00 C ATOM 0 H LEU A 13 6.150 -2.611 16.180 1.00 0.00 H new ATOM 0 HA LEU A 13 5.493 -2.012 18.864 1.00 0.00 H new ATOM 0 HB2 LEU A 13 4.228 -3.979 16.925 1.00 0.00 H new ATOM 0 HB3 LEU A 13 3.475 -3.337 18.371 1.00 0.00 H new ATOM 0 HG LEU A 13 4.387 -1.485 16.176 1.00 0.00 H new ATOM 0 HD11 LEU A 13 2.131 -1.629 15.199 1.00 0.00 H new ATOM 0 HD12 LEU A 13 2.997 -3.180 15.091 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.733 -2.951 16.322 1.00 0.00 H new ATOM 0 HD21 LEU A 13 2.568 -0.082 17.069 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.188 -1.343 18.266 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.755 -0.502 18.326 1.00 0.00 H new ATOM 214 N VAL A 14 6.623 -5.028 18.254 1.00 0.00 N ATOM 215 CA VAL A 14 7.106 -6.253 18.881 1.00 0.00 C ATOM 216 C VAL A 14 8.185 -5.952 19.915 1.00 0.00 C ATOM 217 O VAL A 14 8.170 -6.495 21.020 1.00 0.00 O ATOM 218 CB VAL A 14 7.671 -7.233 17.836 1.00 0.00 C ATOM 219 CG1 VAL A 14 8.221 -8.479 18.514 1.00 0.00 C ATOM 220 CG2 VAL A 14 6.602 -7.599 16.817 1.00 0.00 C ATOM 0 H VAL A 14 6.806 -4.966 17.252 1.00 0.00 H new ATOM 0 HA VAL A 14 6.251 -6.714 19.376 1.00 0.00 H new ATOM 0 HB VAL A 14 8.490 -6.743 17.310 1.00 0.00 H new ATOM 0 HG11 VAL A 14 8.616 -9.160 17.760 1.00 0.00 H new ATOM 0 HG12 VAL A 14 9.019 -8.197 19.201 1.00 0.00 H new ATOM 0 HG13 VAL A 14 7.423 -8.974 19.067 1.00 0.00 H new ATOM 0 HG21 VAL A 14 7.018 -8.292 16.086 1.00 0.00 H new ATOM 0 HG22 VAL A 14 5.761 -8.070 17.325 1.00 0.00 H new ATOM 0 HG23 VAL A 14 6.260 -6.698 16.309 1.00 0.00 H new ATOM 230 N VAL A 15 9.122 -5.083 19.550 1.00 0.00 N ATOM 231 CA VAL A 15 10.209 -4.708 20.446 1.00 0.00 C ATOM 232 C VAL A 15 9.674 -4.273 21.806 1.00 0.00 C ATOM 233 O VAL A 15 10.290 -4.534 22.839 1.00 0.00 O ATOM 234 CB VAL A 15 11.058 -3.569 19.852 1.00 0.00 C ATOM 235 CG1 VAL A 15 12.194 -3.202 20.796 1.00 0.00 C ATOM 236 CG2 VAL A 15 11.596 -3.963 18.485 1.00 0.00 C ATOM 0 H VAL A 15 9.150 -4.625 18.639 1.00 0.00 H new ATOM 0 HA VAL A 15 10.836 -5.591 20.571 1.00 0.00 H new ATOM 0 HB VAL A 15 10.423 -2.692 19.728 1.00 0.00 H new ATOM 0 HG11 VAL A 15 12.783 -2.395 20.360 1.00 0.00 H new ATOM 0 HG12 VAL A 15 11.782 -2.875 21.751 1.00 0.00 H new ATOM 0 HG13 VAL A 15 12.831 -4.072 20.954 1.00 0.00 H new ATOM 0 HG21 VAL A 15 12.194 -3.146 18.080 1.00 0.00 H new ATOM 0 HG22 VAL A 15 12.217 -4.854 18.581 1.00 0.00 H new ATOM 0 HG23 VAL A 15 10.764 -4.172 17.813 1.00 0.00 H new ATOM 246 N ASP A 16 8.524 -3.608 21.798 1.00 0.00 N ATOM 247 CA ASP A 16 7.905 -3.137 23.032 1.00 0.00 C ATOM 248 C ASP A 16 7.425 -4.310 23.881 1.00 0.00 C ATOM 249 O ASP A 16 7.520 -4.281 25.108 1.00 0.00 O ATOM 250 CB ASP A 16 6.732 -2.207 22.716 1.00 0.00 C ATOM 251 CG ASP A 16 6.282 -1.412 23.926 1.00 0.00 C ATOM 252 OD1 ASP A 16 7.153 -0.867 24.636 1.00 0.00 O ATOM 253 OD2 ASP A 16 5.059 -1.335 24.162 1.00 0.00 O ATOM 0 H ASP A 16 8.002 -3.383 20.951 1.00 0.00 H new ATOM 0 HA ASP A 16 8.655 -2.585 23.598 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.021 -1.520 21.920 1.00 0.00 H new ATOM 0 HB3 ASP A 16 5.896 -2.796 22.340 1.00 0.00 H new ATOM 258 N ARG A 17 6.908 -5.341 23.219 1.00 0.00 N ATOM 259 CA ARG A 17 6.411 -6.523 23.913 1.00 0.00 C ATOM 260 C ARG A 17 7.565 -7.408 24.373 1.00 0.00 C ATOM 261 O ARG A 17 7.524 -7.985 25.461 1.00 0.00 O ATOM 262 CB ARG A 17 5.474 -7.319 23.003 1.00 0.00 C ATOM 263 CG ARG A 17 4.010 -7.216 23.396 1.00 0.00 C ATOM 264 CD ARG A 17 3.750 -7.857 24.751 1.00 0.00 C ATOM 265 NE ARG A 17 2.627 -7.234 25.445 1.00 0.00 N ATOM 266 CZ ARG A 17 1.995 -7.794 26.471 1.00 0.00 C ATOM 267 NH1 ARG A 17 2.375 -8.983 26.919 1.00 0.00 N ATOM 268 NH2 ARG A 17 0.981 -7.165 27.050 1.00 0.00 N ATOM 0 H ARG A 17 6.823 -5.381 22.203 1.00 0.00 H new ATOM 0 HA ARG A 17 5.857 -6.192 24.792 1.00 0.00 H new ATOM 0 HB2 ARG A 17 5.592 -6.967 21.978 1.00 0.00 H new ATOM 0 HB3 ARG A 17 5.772 -8.367 23.017 1.00 0.00 H new ATOM 0 HG2 ARG A 17 3.713 -6.168 23.425 1.00 0.00 H new ATOM 0 HG3 ARG A 17 3.394 -7.701 22.639 1.00 0.00 H new ATOM 0 HD2 ARG A 17 3.548 -8.920 24.616 1.00 0.00 H new ATOM 0 HD3 ARG A 17 4.646 -7.778 25.367 1.00 0.00 H new ATOM 0 HE ARG A 17 2.310 -6.319 25.125 1.00 0.00 H new ATOM 0 HH11 ARG A 17 3.154 -9.470 26.476 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.888 -9.411 27.707 1.00 0.00 H new ATOM 0 HH21 ARG A 17 0.686 -6.251 26.708 1.00 0.00 H new ATOM 0 HH22 ARG A 17 0.496 -7.596 27.837 1.00 0.00 H new ATOM 282 N LEU A 18 8.593 -7.513 23.538 1.00 0.00 N ATOM 283 CA LEU A 18 9.759 -8.329 23.858 1.00 0.00 C ATOM 284 C LEU A 18 10.310 -7.974 25.235 1.00 0.00 C ATOM 285 O LEU A 18 10.510 -8.848 26.078 1.00 0.00 O ATOM 286 CB LEU A 18 10.845 -8.140 22.797 1.00 0.00 C ATOM 287 CG LEU A 18 10.990 -9.269 21.776 1.00 0.00 C ATOM 288 CD1 LEU A 18 11.594 -10.503 22.427 1.00 0.00 C ATOM 289 CD2 LEU A 18 9.642 -9.599 21.152 1.00 0.00 C ATOM 0 H LEU A 18 8.643 -7.043 22.634 1.00 0.00 H new ATOM 0 HA LEU A 18 9.449 -9.374 23.869 1.00 0.00 H new ATOM 0 HB2 LEU A 18 10.642 -7.214 22.259 1.00 0.00 H new ATOM 0 HB3 LEU A 18 11.801 -8.010 23.304 1.00 0.00 H new ATOM 0 HG LEU A 18 11.662 -8.935 20.986 1.00 0.00 H new ATOM 0 HD11 LEU A 18 11.690 -11.296 21.685 1.00 0.00 H new ATOM 0 HD12 LEU A 18 12.579 -10.259 22.826 1.00 0.00 H new ATOM 0 HD13 LEU A 18 10.948 -10.840 23.237 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.764 -10.404 20.428 1.00 0.00 H new ATOM 0 HD22 LEU A 18 8.948 -9.913 21.931 1.00 0.00 H new ATOM 0 HD23 LEU A 18 9.248 -8.716 20.649 1.00 0.00 H new ATOM 301 N ALA A 19 10.552 -6.687 25.457 1.00 0.00 N ATOM 302 CA ALA A 19 11.075 -6.216 26.734 1.00 0.00 C ATOM 303 C ALA A 19 10.167 -6.631 27.886 1.00 0.00 C ATOM 304 O ALA A 19 10.639 -6.945 28.979 1.00 0.00 O ATOM 305 CB ALA A 19 11.244 -4.704 26.710 1.00 0.00 C ATOM 0 H ALA A 19 10.394 -5.951 24.769 1.00 0.00 H new ATOM 0 HA ALA A 19 12.050 -6.677 26.891 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.635 -4.366 27.670 1.00 0.00 H new ATOM 0 HB2 ALA A 19 11.940 -4.428 25.917 1.00 0.00 H new ATOM 0 HB3 ALA A 19 10.279 -4.233 26.526 1.00 0.00 H new ATOM 311 N ARG A 20 8.862 -6.629 27.635 1.00 0.00 N ATOM 312 CA ARG A 20 7.888 -7.004 28.653 1.00 0.00 C ATOM 313 C ARG A 20 7.930 -8.505 28.919 1.00 0.00 C ATOM 314 O ARG A 20 7.744 -8.951 30.052 1.00 0.00 O ATOM 315 CB ARG A 20 6.480 -6.591 28.219 1.00 0.00 C ATOM 316 CG ARG A 20 6.181 -5.118 28.444 1.00 0.00 C ATOM 317 CD ARG A 20 6.140 -4.778 29.925 1.00 0.00 C ATOM 318 NE ARG A 20 5.684 -3.410 30.161 1.00 0.00 N ATOM 319 CZ ARG A 20 5.412 -2.924 31.366 1.00 0.00 C ATOM 320 NH1 ARG A 20 5.549 -3.689 32.440 1.00 0.00 N ATOM 321 NH2 ARG A 20 5.001 -1.669 31.499 1.00 0.00 N ATOM 0 H ARG A 20 8.455 -6.372 26.736 1.00 0.00 H new ATOM 0 HA ARG A 20 8.144 -6.482 29.575 1.00 0.00 H new ATOM 0 HB2 ARG A 20 6.353 -6.821 27.161 1.00 0.00 H new ATOM 0 HB3 ARG A 20 5.751 -7.189 28.765 1.00 0.00 H new ATOM 0 HG2 ARG A 20 6.941 -4.512 27.951 1.00 0.00 H new ATOM 0 HG3 ARG A 20 5.225 -4.865 27.985 1.00 0.00 H new ATOM 0 HD2 ARG A 20 5.477 -5.475 30.438 1.00 0.00 H new ATOM 0 HD3 ARG A 20 7.133 -4.908 30.354 1.00 0.00 H new ATOM 0 HE ARG A 20 5.568 -2.795 29.356 1.00 0.00 H new ATOM 0 HH11 ARG A 20 5.864 -4.654 32.342 1.00 0.00 H new ATOM 0 HH12 ARG A 20 5.339 -3.312 33.364 1.00 0.00 H new ATOM 0 HH21 ARG A 20 4.894 -1.077 30.675 1.00 0.00 H new ATOM 0 HH22 ARG A 20 4.792 -1.296 32.425 1.00 0.00 H new ATOM 335 N TYR A 21 8.174 -9.281 27.868 1.00 0.00 N ATOM 336 CA TYR A 21 8.237 -10.732 27.988 1.00 0.00 C ATOM 337 C TYR A 21 9.466 -11.285 27.273 1.00 0.00 C ATOM 338 O TYR A 21 9.373 -11.915 26.219 1.00 0.00 O ATOM 339 CB TYR A 21 6.970 -11.368 27.413 1.00 0.00 C ATOM 340 CG TYR A 21 5.773 -11.269 28.330 1.00 0.00 C ATOM 341 CD1 TYR A 21 5.114 -10.060 28.517 1.00 0.00 C ATOM 342 CD2 TYR A 21 5.300 -12.384 29.012 1.00 0.00 C ATOM 343 CE1 TYR A 21 4.020 -9.964 29.355 1.00 0.00 C ATOM 344 CE2 TYR A 21 4.206 -12.298 29.850 1.00 0.00 C ATOM 345 CZ TYR A 21 3.570 -11.086 30.019 1.00 0.00 C ATOM 346 OH TYR A 21 2.480 -10.996 30.855 1.00 0.00 O ATOM 0 H TYR A 21 8.331 -8.929 26.924 1.00 0.00 H new ATOM 0 HA TYR A 21 8.312 -10.980 29.047 1.00 0.00 H new ATOM 0 HB2 TYR A 21 6.731 -10.888 26.464 1.00 0.00 H new ATOM 0 HB3 TYR A 21 7.166 -12.418 27.198 1.00 0.00 H new ATOM 0 HD1 TYR A 21 5.463 -9.180 27.998 1.00 0.00 H new ATOM 0 HD2 TYR A 21 5.797 -13.334 28.884 1.00 0.00 H new ATOM 0 HE1 TYR A 21 3.520 -9.016 29.489 1.00 0.00 H new ATOM 0 HE2 TYR A 21 3.850 -13.175 30.370 1.00 0.00 H new ATOM 0 HH TYR A 21 2.292 -11.876 31.244 1.00 0.00 H new ATOM 356 N PRO A 22 10.648 -11.044 27.859 1.00 0.00 N ATOM 357 CA PRO A 22 11.920 -11.509 27.297 1.00 0.00 C ATOM 358 C PRO A 22 12.074 -13.023 27.386 1.00 0.00 C ATOM 359 O PRO A 22 12.776 -13.535 28.257 1.00 0.00 O ATOM 360 CB PRO A 22 12.968 -10.812 28.168 1.00 0.00 C ATOM 361 CG PRO A 22 12.275 -10.554 29.462 1.00 0.00 C ATOM 362 CD PRO A 22 10.835 -10.299 29.116 1.00 0.00 C ATOM 0 HA PRO A 22 12.006 -11.277 26.235 1.00 0.00 H new ATOM 0 HB2 PRO A 22 13.847 -11.441 28.308 1.00 0.00 H new ATOM 0 HB3 PRO A 22 13.309 -9.884 27.710 1.00 0.00 H new ATOM 0 HG2 PRO A 22 12.370 -11.408 30.133 1.00 0.00 H new ATOM 0 HG3 PRO A 22 12.711 -9.696 29.974 1.00 0.00 H new ATOM 0 HD2 PRO A 22 10.165 -10.656 29.898 1.00 0.00 H new ATOM 0 HD3 PRO A 22 10.635 -9.235 28.986 1.00 0.00 H new ATOM 370 N GLY A 23 11.413 -13.735 26.479 1.00 0.00 N ATOM 371 CA GLY A 23 11.490 -15.184 26.473 1.00 0.00 C ATOM 372 C GLY A 23 10.145 -15.836 26.218 1.00 0.00 C ATOM 373 O GLY A 23 9.822 -16.862 26.816 1.00 0.00 O ATOM 0 H GLY A 23 10.825 -13.334 25.748 1.00 0.00 H new ATOM 0 HA2 GLY A 23 12.196 -15.504 25.707 1.00 0.00 H new ATOM 0 HA3 GLY A 23 11.881 -15.528 27.431 1.00 0.00 H new ATOM 377 N TYR A 24 9.359 -15.238 25.330 1.00 0.00 N ATOM 378 CA TYR A 24 8.039 -15.764 25.001 1.00 0.00 C ATOM 379 C TYR A 24 8.086 -16.589 23.718 1.00 0.00 C ATOM 380 O TYR A 24 8.493 -16.097 22.666 1.00 0.00 O ATOM 381 CB TYR A 24 7.035 -14.621 24.849 1.00 0.00 C ATOM 382 CG TYR A 24 5.709 -14.886 25.525 1.00 0.00 C ATOM 383 CD1 TYR A 24 4.516 -14.799 24.816 1.00 0.00 C ATOM 384 CD2 TYR A 24 5.648 -15.222 26.871 1.00 0.00 C ATOM 385 CE1 TYR A 24 3.302 -15.040 25.430 1.00 0.00 C ATOM 386 CE2 TYR A 24 4.438 -15.466 27.492 1.00 0.00 C ATOM 387 CZ TYR A 24 3.268 -15.373 26.768 1.00 0.00 C ATOM 388 OH TYR A 24 2.061 -15.614 27.383 1.00 0.00 O ATOM 0 H TYR A 24 9.613 -14.389 24.825 1.00 0.00 H new ATOM 0 HA TYR A 24 7.720 -16.412 25.817 1.00 0.00 H new ATOM 0 HB2 TYR A 24 7.469 -13.710 25.263 1.00 0.00 H new ATOM 0 HB3 TYR A 24 6.863 -14.439 23.788 1.00 0.00 H new ATOM 0 HD1 TYR A 24 4.539 -14.539 23.768 1.00 0.00 H new ATOM 0 HD2 TYR A 24 6.562 -15.294 27.442 1.00 0.00 H new ATOM 0 HE1 TYR A 24 2.384 -14.968 24.865 1.00 0.00 H new ATOM 0 HE2 TYR A 24 4.409 -15.728 28.539 1.00 0.00 H new ATOM 0 HH TYR A 24 2.213 -15.837 28.325 1.00 0.00 H new ATOM 398 N GLU A 25 7.666 -17.846 23.816 1.00 0.00 N ATOM 399 CA GLU A 25 7.660 -18.740 22.664 1.00 0.00 C ATOM 400 C GLU A 25 6.826 -18.157 21.527 1.00 0.00 C ATOM 401 O GLU A 25 7.210 -18.229 20.360 1.00 0.00 O ATOM 402 CB GLU A 25 7.114 -20.114 23.059 1.00 0.00 C ATOM 403 CG GLU A 25 8.158 -21.029 23.677 1.00 0.00 C ATOM 404 CD GLU A 25 9.126 -21.585 22.651 1.00 0.00 C ATOM 405 OE1 GLU A 25 8.745 -21.677 21.465 1.00 0.00 O ATOM 406 OE2 GLU A 25 10.264 -21.929 23.033 1.00 0.00 O ATOM 0 H GLU A 25 7.326 -18.268 24.680 1.00 0.00 H new ATOM 0 HA GLU A 25 8.688 -18.851 22.318 1.00 0.00 H new ATOM 0 HB2 GLU A 25 6.295 -19.981 23.766 1.00 0.00 H new ATOM 0 HB3 GLU A 25 6.697 -20.597 22.176 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.715 -20.479 24.436 1.00 0.00 H new ATOM 0 HG3 GLU A 25 7.658 -21.854 24.184 1.00 0.00 H new ATOM 413 N VAL A 26 5.681 -17.580 21.877 1.00 0.00 N ATOM 414 CA VAL A 26 4.792 -16.983 20.887 1.00 0.00 C ATOM 415 C VAL A 26 5.437 -15.768 20.230 1.00 0.00 C ATOM 416 O VAL A 26 5.238 -15.513 19.042 1.00 0.00 O ATOM 417 CB VAL A 26 3.452 -16.561 21.519 1.00 0.00 C ATOM 418 CG1 VAL A 26 2.490 -16.065 20.450 1.00 0.00 C ATOM 419 CG2 VAL A 26 2.844 -17.717 22.300 1.00 0.00 C ATOM 0 H VAL A 26 5.347 -17.513 22.838 1.00 0.00 H new ATOM 0 HA VAL A 26 4.605 -17.744 20.130 1.00 0.00 H new ATOM 0 HB VAL A 26 3.640 -15.742 22.213 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.549 -15.771 20.915 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.925 -15.206 19.939 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.305 -16.861 19.729 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.898 -17.401 22.740 1.00 0.00 H new ATOM 0 HG22 VAL A 26 2.669 -18.558 21.629 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.529 -18.021 23.092 1.00 0.00 H new ATOM 429 N LEU A 27 6.210 -15.021 21.011 1.00 0.00 N ATOM 430 CA LEU A 27 6.886 -13.831 20.505 1.00 0.00 C ATOM 431 C LEU A 27 7.986 -14.208 19.519 1.00 0.00 C ATOM 432 O LEU A 27 8.035 -13.695 18.400 1.00 0.00 O ATOM 433 CB LEU A 27 7.477 -13.026 21.663 1.00 0.00 C ATOM 434 CG LEU A 27 6.481 -12.212 22.492 1.00 0.00 C ATOM 435 CD1 LEU A 27 7.161 -11.630 23.721 1.00 0.00 C ATOM 436 CD2 LEU A 27 5.863 -11.107 21.648 1.00 0.00 C ATOM 0 H LEU A 27 6.384 -15.218 21.997 1.00 0.00 H new ATOM 0 HA LEU A 27 6.150 -13.219 19.983 1.00 0.00 H new ATOM 0 HB2 LEU A 27 7.997 -13.714 22.329 1.00 0.00 H new ATOM 0 HB3 LEU A 27 8.226 -12.345 21.260 1.00 0.00 H new ATOM 0 HG LEU A 27 5.684 -12.877 22.824 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.438 -11.054 24.299 1.00 0.00 H new ATOM 0 HD12 LEU A 27 7.555 -12.439 24.336 1.00 0.00 H new ATOM 0 HD13 LEU A 27 7.978 -10.979 23.411 1.00 0.00 H new ATOM 0 HD21 LEU A 27 5.157 -10.538 22.253 1.00 0.00 H new ATOM 0 HD22 LEU A 27 6.648 -10.443 21.286 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.340 -11.547 20.799 1.00 0.00 H new ATOM 448 N LEU A 28 8.868 -15.109 19.940 1.00 0.00 N ATOM 449 CA LEU A 28 9.968 -15.557 19.093 1.00 0.00 C ATOM 450 C LEU A 28 9.445 -16.320 17.880 1.00 0.00 C ATOM 451 O LEU A 28 10.005 -16.227 16.787 1.00 0.00 O ATOM 452 CB LEU A 28 10.925 -16.442 19.892 1.00 0.00 C ATOM 453 CG LEU A 28 10.290 -17.622 20.630 1.00 0.00 C ATOM 454 CD1 LEU A 28 10.222 -18.843 19.726 1.00 0.00 C ATOM 455 CD2 LEU A 28 11.069 -17.939 21.899 1.00 0.00 C ATOM 0 H LEU A 28 8.842 -15.543 20.863 1.00 0.00 H new ATOM 0 HA LEU A 28 10.505 -14.676 18.742 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.683 -16.830 19.211 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.441 -15.818 20.622 1.00 0.00 H new ATOM 0 HG LEU A 28 9.274 -17.346 20.910 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.767 -19.672 20.268 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.621 -18.612 18.847 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.229 -19.122 19.414 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.603 -18.781 22.411 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.097 -18.195 21.641 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.066 -17.068 22.555 1.00 0.00 H new ATOM 467 N SER A 29 8.367 -17.071 18.079 1.00 0.00 N ATOM 468 CA SER A 29 7.769 -17.851 17.002 1.00 0.00 C ATOM 469 C SER A 29 7.065 -16.942 15.999 1.00 0.00 C ATOM 470 O SER A 29 7.219 -17.099 14.788 1.00 0.00 O ATOM 471 CB SER A 29 6.777 -18.868 17.570 1.00 0.00 C ATOM 472 OG SER A 29 7.452 -19.934 18.215 1.00 0.00 O ATOM 0 H SER A 29 7.890 -17.156 18.976 1.00 0.00 H new ATOM 0 HA SER A 29 8.568 -18.383 16.485 1.00 0.00 H new ATOM 0 HB2 SER A 29 6.111 -18.375 18.277 1.00 0.00 H new ATOM 0 HB3 SER A 29 6.154 -19.261 16.766 1.00 0.00 H new ATOM 0 HG SER A 29 7.610 -19.701 19.154 1.00 0.00 H new ATOM 478 N ALA A 30 6.291 -15.992 16.513 1.00 0.00 N ATOM 479 CA ALA A 30 5.564 -15.056 15.664 1.00 0.00 C ATOM 480 C ALA A 30 6.519 -14.095 14.964 1.00 0.00 C ATOM 481 O ALA A 30 6.483 -13.951 13.742 1.00 0.00 O ATOM 482 CB ALA A 30 4.543 -14.283 16.485 1.00 0.00 C ATOM 0 H ALA A 30 6.151 -15.850 17.513 1.00 0.00 H new ATOM 0 HA ALA A 30 5.040 -15.629 14.899 1.00 0.00 H new ATOM 0 HB1 ALA A 30 4.007 -13.588 15.839 1.00 0.00 H new ATOM 0 HB2 ALA A 30 3.835 -14.979 16.934 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.054 -13.727 17.271 1.00 0.00 H new ATOM 488 N GLU A 31 7.372 -13.441 15.746 1.00 0.00 N ATOM 489 CA GLU A 31 8.335 -12.492 15.199 1.00 0.00 C ATOM 490 C GLU A 31 9.148 -13.129 14.075 1.00 0.00 C ATOM 491 O GLU A 31 9.544 -12.458 13.122 1.00 0.00 O ATOM 492 CB GLU A 31 9.273 -11.991 16.299 1.00 0.00 C ATOM 493 CG GLU A 31 10.341 -12.997 16.694 1.00 0.00 C ATOM 494 CD GLU A 31 11.235 -12.492 17.809 1.00 0.00 C ATOM 495 OE1 GLU A 31 12.427 -12.865 17.829 1.00 0.00 O ATOM 496 OE2 GLU A 31 10.744 -11.724 18.662 1.00 0.00 O ATOM 0 H GLU A 31 7.416 -13.551 16.759 1.00 0.00 H new ATOM 0 HA GLU A 31 7.781 -11.647 14.791 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.757 -11.074 15.962 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.683 -11.736 17.179 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.862 -13.924 17.009 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.952 -13.234 15.823 1.00 0.00 H new ATOM 503 N LYS A 32 9.393 -14.430 14.194 1.00 0.00 N ATOM 504 CA LYS A 32 10.157 -15.159 13.189 1.00 0.00 C ATOM 505 C LYS A 32 9.423 -15.175 11.852 1.00 0.00 C ATOM 506 O LYS A 32 10.046 -15.150 10.792 1.00 0.00 O ATOM 507 CB LYS A 32 10.417 -16.593 13.658 1.00 0.00 C ATOM 508 CG LYS A 32 11.726 -16.760 14.408 1.00 0.00 C ATOM 509 CD LYS A 32 11.908 -18.185 14.903 1.00 0.00 C ATOM 510 CE LYS A 32 13.376 -18.514 15.129 1.00 0.00 C ATOM 511 NZ LYS A 32 14.107 -18.700 13.845 1.00 0.00 N ATOM 0 H LYS A 32 9.073 -15.001 14.977 1.00 0.00 H new ATOM 0 HA LYS A 32 11.111 -14.649 13.053 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.596 -16.910 14.302 1.00 0.00 H new ATOM 0 HB3 LYS A 32 10.417 -17.255 12.792 1.00 0.00 H new ATOM 0 HG2 LYS A 32 12.557 -16.492 13.755 1.00 0.00 H new ATOM 0 HG3 LYS A 32 11.751 -16.074 15.255 1.00 0.00 H new ATOM 0 HD2 LYS A 32 11.356 -18.321 15.833 1.00 0.00 H new ATOM 0 HD3 LYS A 32 11.486 -18.880 14.177 1.00 0.00 H new ATOM 0 HE2 LYS A 32 13.844 -17.712 15.700 1.00 0.00 H new ATOM 0 HE3 LYS A 32 13.457 -19.421 15.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 15.034 -19.133 14.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 13.555 -19.320 13.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 14.243 -17.777 13.386 1.00 0.00 H new ATOM 525 N GLN A 33 8.096 -15.217 11.912 1.00 0.00 N ATOM 526 CA GLN A 33 7.278 -15.235 10.705 1.00 0.00 C ATOM 527 C GLN A 33 7.566 -14.017 9.833 1.00 0.00 C ATOM 528 O GLN A 33 7.973 -14.150 8.678 1.00 0.00 O ATOM 529 CB GLN A 33 5.793 -15.276 11.070 1.00 0.00 C ATOM 530 CG GLN A 33 4.884 -15.577 9.890 1.00 0.00 C ATOM 531 CD GLN A 33 5.358 -16.764 9.076 1.00 0.00 C ATOM 532 OE1 GLN A 33 5.863 -16.607 7.963 1.00 0.00 O ATOM 533 NE2 GLN A 33 5.199 -17.962 9.626 1.00 0.00 N ATOM 0 H GLN A 33 7.565 -15.239 12.782 1.00 0.00 H new ATOM 0 HA GLN A 33 7.531 -16.132 10.139 1.00 0.00 H new ATOM 0 HB2 GLN A 33 5.637 -16.032 11.840 1.00 0.00 H new ATOM 0 HB3 GLN A 33 5.507 -14.317 11.503 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.875 -15.771 10.254 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.828 -14.699 9.246 1.00 0.00 H new ATOM 0 HE21 GLN A 33 4.776 -18.047 10.550 1.00 0.00 H new ATOM 0 HE22 GLN A 33 5.500 -18.798 9.124 1.00 0.00 H new ATOM 542 N LEU A 34 7.352 -12.832 10.393 1.00 0.00 N ATOM 543 CA LEU A 34 7.589 -11.589 9.666 1.00 0.00 C ATOM 544 C LEU A 34 9.009 -11.545 9.111 1.00 0.00 C ATOM 545 O LEU A 34 9.259 -10.936 8.071 1.00 0.00 O ATOM 546 CB LEU A 34 7.349 -10.387 10.581 1.00 0.00 C ATOM 547 CG LEU A 34 8.541 -9.937 11.426 1.00 0.00 C ATOM 548 CD1 LEU A 34 9.362 -8.897 10.680 1.00 0.00 C ATOM 549 CD2 LEU A 34 8.070 -9.388 12.764 1.00 0.00 C ATOM 0 H LEU A 34 7.015 -12.705 11.347 1.00 0.00 H new ATOM 0 HA LEU A 34 6.891 -11.547 8.830 1.00 0.00 H new ATOM 0 HB2 LEU A 34 7.027 -9.546 9.966 1.00 0.00 H new ATOM 0 HB3 LEU A 34 6.523 -10.626 11.252 1.00 0.00 H new ATOM 0 HG LEU A 34 9.175 -10.803 11.615 1.00 0.00 H new ATOM 0 HD11 LEU A 34 10.206 -8.589 11.297 1.00 0.00 H new ATOM 0 HD12 LEU A 34 9.731 -9.325 9.748 1.00 0.00 H new ATOM 0 HD13 LEU A 34 8.738 -8.031 10.459 1.00 0.00 H new ATOM 0 HD21 LEU A 34 8.932 -9.073 13.352 1.00 0.00 H new ATOM 0 HD22 LEU A 34 7.413 -8.534 12.596 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.526 -10.163 13.304 1.00 0.00 H new ATOM 561 N GLN A 35 9.933 -12.195 9.811 1.00 0.00 N ATOM 562 CA GLN A 35 11.327 -12.230 9.387 1.00 0.00 C ATOM 563 C GLN A 35 11.491 -13.070 8.124 1.00 0.00 C ATOM 564 O GLN A 35 12.307 -12.754 7.258 1.00 0.00 O ATOM 565 CB GLN A 35 12.208 -12.791 10.504 1.00 0.00 C ATOM 566 CG GLN A 35 12.120 -12.003 11.802 1.00 0.00 C ATOM 567 CD GLN A 35 13.234 -10.984 11.942 1.00 0.00 C ATOM 568 OE1 GLN A 35 14.395 -11.272 11.649 1.00 0.00 O ATOM 569 NE2 GLN A 35 12.885 -9.785 12.393 1.00 0.00 N ATOM 0 H GLN A 35 9.741 -12.704 10.674 1.00 0.00 H new ATOM 0 HA GLN A 35 11.639 -11.209 9.166 1.00 0.00 H new ATOM 0 HB2 GLN A 35 11.922 -13.825 10.696 1.00 0.00 H new ATOM 0 HB3 GLN A 35 13.244 -12.804 10.166 1.00 0.00 H new ATOM 0 HG2 GLN A 35 11.158 -11.493 11.848 1.00 0.00 H new ATOM 0 HG3 GLN A 35 12.156 -12.693 12.645 1.00 0.00 H new ATOM 0 HE21 GLN A 35 11.911 -9.591 12.623 1.00 0.00 H new ATOM 0 HE22 GLN A 35 13.591 -9.058 12.509 1.00 0.00 H new ATOM 578 N TYR A 36 10.710 -14.141 8.027 1.00 0.00 N ATOM 579 CA TYR A 36 10.771 -15.028 6.872 1.00 0.00 C ATOM 580 C TYR A 36 10.236 -14.333 5.623 1.00 0.00 C ATOM 581 O TYR A 36 10.932 -14.226 4.613 1.00 0.00 O ATOM 582 CB TYR A 36 9.972 -16.304 7.140 1.00 0.00 C ATOM 583 CG TYR A 36 9.686 -17.113 5.895 1.00 0.00 C ATOM 584 CD1 TYR A 36 10.678 -17.343 4.949 1.00 0.00 C ATOM 585 CD2 TYR A 36 8.424 -17.646 5.663 1.00 0.00 C ATOM 586 CE1 TYR A 36 10.421 -18.080 3.809 1.00 0.00 C ATOM 587 CE2 TYR A 36 8.158 -18.386 4.528 1.00 0.00 C ATOM 588 CZ TYR A 36 9.160 -18.600 3.604 1.00 0.00 C ATOM 589 OH TYR A 36 8.899 -19.335 2.470 1.00 0.00 O ATOM 0 H TYR A 36 10.028 -14.415 8.734 1.00 0.00 H new ATOM 0 HA TYR A 36 11.815 -15.290 6.702 1.00 0.00 H new ATOM 0 HB2 TYR A 36 10.521 -16.925 7.848 1.00 0.00 H new ATOM 0 HB3 TYR A 36 9.028 -16.038 7.615 1.00 0.00 H new ATOM 0 HD1 TYR A 36 11.667 -16.939 5.108 1.00 0.00 H new ATOM 0 HD2 TYR A 36 7.637 -17.478 6.383 1.00 0.00 H new ATOM 0 HE1 TYR A 36 11.203 -18.248 3.083 1.00 0.00 H new ATOM 0 HE2 TYR A 36 7.172 -18.795 4.365 1.00 0.00 H new ATOM 0 HH TYR A 36 9.736 -19.499 1.987 1.00 0.00 H new ATOM 599 N ILE A 37 8.996 -13.863 5.701 1.00 0.00 N ATOM 600 CA ILE A 37 8.368 -13.177 4.578 1.00 0.00 C ATOM 601 C ILE A 37 9.222 -12.007 4.102 1.00 0.00 C ATOM 602 O ILE A 37 9.280 -11.713 2.908 1.00 0.00 O ATOM 603 CB ILE A 37 6.966 -12.658 4.949 1.00 0.00 C ATOM 604 CG1 ILE A 37 6.073 -13.815 5.400 1.00 0.00 C ATOM 605 CG2 ILE A 37 6.342 -11.928 3.769 1.00 0.00 C ATOM 606 CD1 ILE A 37 5.545 -13.657 6.809 1.00 0.00 C ATOM 0 H ILE A 37 8.406 -13.944 6.529 1.00 0.00 H new ATOM 0 HA ILE A 37 8.275 -13.907 3.774 1.00 0.00 H new ATOM 0 HB ILE A 37 7.062 -11.955 5.776 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.231 -13.903 4.713 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.637 -14.746 5.334 1.00 0.00 H new ATOM 0 HG21 ILE A 37 5.352 -11.567 4.047 1.00 0.00 H new ATOM 0 HG22 ILE A 37 6.971 -11.083 3.490 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.256 -12.610 2.923 1.00 0.00 H new ATOM 0 HD11 ILE A 37 4.920 -14.513 7.061 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.381 -13.600 7.506 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.953 -12.744 6.876 1.00 0.00 H new ATOM 618 N ARG A 38 9.884 -11.343 5.044 1.00 0.00 N ATOM 619 CA ARG A 38 10.736 -10.204 4.720 1.00 0.00 C ATOM 620 C ARG A 38 11.975 -10.654 3.951 1.00 0.00 C ATOM 621 O ARG A 38 12.322 -10.076 2.921 1.00 0.00 O ATOM 622 CB ARG A 38 11.152 -9.473 5.997 1.00 0.00 C ATOM 623 CG ARG A 38 12.209 -8.404 5.770 1.00 0.00 C ATOM 624 CD ARG A 38 12.608 -7.729 7.073 1.00 0.00 C ATOM 625 NE ARG A 38 13.692 -6.769 6.883 1.00 0.00 N ATOM 626 CZ ARG A 38 14.396 -6.247 7.881 1.00 0.00 C ATOM 627 NH1 ARG A 38 14.131 -6.592 9.134 1.00 0.00 N ATOM 628 NH2 ARG A 38 15.367 -5.379 7.627 1.00 0.00 N ATOM 0 H ARG A 38 9.847 -11.574 6.037 1.00 0.00 H new ATOM 0 HA ARG A 38 10.166 -9.522 4.089 1.00 0.00 H new ATOM 0 HB2 ARG A 38 10.272 -9.012 6.445 1.00 0.00 H new ATOM 0 HB3 ARG A 38 11.531 -10.200 6.715 1.00 0.00 H new ATOM 0 HG2 ARG A 38 13.088 -8.853 5.307 1.00 0.00 H new ATOM 0 HG3 ARG A 38 11.829 -7.657 5.074 1.00 0.00 H new ATOM 0 HD2 ARG A 38 11.743 -7.219 7.497 1.00 0.00 H new ATOM 0 HD3 ARG A 38 12.917 -8.486 7.794 1.00 0.00 H new ATOM 0 HE ARG A 38 13.921 -6.484 5.931 1.00 0.00 H new ATOM 0 HH11 ARG A 38 13.386 -7.259 9.332 1.00 0.00 H new ATOM 0 HH12 ARG A 38 14.673 -6.190 9.899 1.00 0.00 H new ATOM 0 HH21 ARG A 38 15.573 -5.112 6.664 1.00 0.00 H new ATOM 0 HH22 ARG A 38 15.907 -4.979 8.394 1.00 0.00 H new ATOM 642 N SER A 39 12.638 -11.687 4.460 1.00 0.00 N ATOM 643 CA SER A 39 13.841 -12.211 3.824 1.00 0.00 C ATOM 644 C SER A 39 13.554 -12.640 2.389 1.00 0.00 C ATOM 645 O SER A 39 14.173 -12.148 1.445 1.00 0.00 O ATOM 646 CB SER A 39 14.391 -13.395 4.622 1.00 0.00 C ATOM 647 OG SER A 39 15.757 -13.622 4.322 1.00 0.00 O ATOM 0 H SER A 39 12.363 -12.178 5.311 1.00 0.00 H new ATOM 0 HA SER A 39 14.587 -11.417 3.805 1.00 0.00 H new ATOM 0 HB2 SER A 39 14.277 -13.203 5.689 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.812 -14.290 4.396 1.00 0.00 H new ATOM 0 HG SER A 39 16.085 -14.382 4.846 1.00 0.00 H new ATOM 653 N VAL A 40 12.609 -13.562 2.231 1.00 0.00 N ATOM 654 CA VAL A 40 12.237 -14.059 0.912 1.00 0.00 C ATOM 655 C VAL A 40 11.932 -12.909 -0.042 1.00 0.00 C ATOM 656 O VAL A 40 12.211 -12.989 -1.239 1.00 0.00 O ATOM 657 CB VAL A 40 11.012 -14.989 0.986 1.00 0.00 C ATOM 658 CG1 VAL A 40 9.811 -14.245 1.550 1.00 0.00 C ATOM 659 CG2 VAL A 40 10.697 -15.565 -0.385 1.00 0.00 C ATOM 0 H VAL A 40 12.087 -13.980 3.001 1.00 0.00 H new ATOM 0 HA VAL A 40 13.089 -14.624 0.535 1.00 0.00 H new ATOM 0 HB VAL A 40 11.245 -15.816 1.657 1.00 0.00 H new ATOM 0 HG11 VAL A 40 8.955 -14.918 1.595 1.00 0.00 H new ATOM 0 HG12 VAL A 40 10.043 -13.886 2.553 1.00 0.00 H new ATOM 0 HG13 VAL A 40 9.573 -13.398 0.907 1.00 0.00 H new ATOM 0 HG21 VAL A 40 9.829 -16.220 -0.314 1.00 0.00 H new ATOM 0 HG22 VAL A 40 10.483 -14.753 -1.080 1.00 0.00 H new ATOM 0 HG23 VAL A 40 11.553 -16.136 -0.745 1.00 0.00 H new ATOM 669 N LEU A 41 11.357 -11.839 0.496 1.00 0.00 N ATOM 670 CA LEU A 41 11.013 -10.670 -0.307 1.00 0.00 C ATOM 671 C LEU A 41 12.212 -10.198 -1.122 1.00 0.00 C ATOM 672 O LEU A 41 12.064 -9.737 -2.255 1.00 0.00 O ATOM 673 CB LEU A 41 10.515 -9.537 0.593 1.00 0.00 C ATOM 674 CG LEU A 41 9.446 -8.624 -0.007 1.00 0.00 C ATOM 675 CD1 LEU A 41 8.795 -7.780 1.077 1.00 0.00 C ATOM 676 CD2 LEU A 41 10.047 -7.736 -1.087 1.00 0.00 C ATOM 0 H LEU A 41 11.119 -11.756 1.484 1.00 0.00 H new ATOM 0 HA LEU A 41 10.218 -10.954 -0.996 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.118 -9.975 1.509 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.370 -8.924 0.878 1.00 0.00 H new ATOM 0 HG LEU A 41 8.678 -9.248 -0.464 1.00 0.00 H new ATOM 0 HD11 LEU A 41 8.037 -7.136 0.631 1.00 0.00 H new ATOM 0 HD12 LEU A 41 8.329 -8.432 1.815 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.552 -7.165 1.563 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.271 -7.093 -1.503 1.00 0.00 H new ATOM 0 HD22 LEU A 41 10.836 -7.120 -0.655 1.00 0.00 H new ATOM 0 HD23 LEU A 41 10.465 -8.358 -1.878 1.00 0.00 H new ATOM 688 N LEU A 42 13.401 -10.318 -0.541 1.00 0.00 N ATOM 689 CA LEU A 42 14.627 -9.905 -1.214 1.00 0.00 C ATOM 690 C LEU A 42 15.361 -11.109 -1.795 1.00 0.00 C ATOM 691 O LEU A 42 15.952 -11.029 -2.872 1.00 0.00 O ATOM 692 CB LEU A 42 15.540 -9.158 -0.241 1.00 0.00 C ATOM 693 CG LEU A 42 15.182 -7.696 0.028 1.00 0.00 C ATOM 694 CD1 LEU A 42 15.162 -6.904 -1.271 1.00 0.00 C ATOM 695 CD2 LEU A 42 13.839 -7.597 0.736 1.00 0.00 C ATOM 0 H LEU A 42 13.542 -10.698 0.395 1.00 0.00 H new ATOM 0 HA LEU A 42 14.356 -9.238 -2.032 1.00 0.00 H new ATOM 0 HB2 LEU A 42 15.539 -9.692 0.709 1.00 0.00 H new ATOM 0 HB3 LEU A 42 16.558 -9.197 -0.628 1.00 0.00 H new ATOM 0 HG LEU A 42 15.945 -7.269 0.679 1.00 0.00 H new ATOM 0 HD11 LEU A 42 14.905 -5.866 -1.060 1.00 0.00 H new ATOM 0 HD12 LEU A 42 16.146 -6.947 -1.738 1.00 0.00 H new ATOM 0 HD13 LEU A 42 14.421 -7.331 -1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 42 13.601 -6.549 0.919 1.00 0.00 H new ATOM 0 HD22 LEU A 42 13.065 -8.041 0.111 1.00 0.00 H new ATOM 0 HD23 LEU A 42 13.888 -8.129 1.686 1.00 0.00 H new ATOM 707 N ASP A 43 15.317 -12.226 -1.076 1.00 0.00 N ATOM 708 CA ASP A 43 15.975 -13.448 -1.521 1.00 0.00 C ATOM 709 C ASP A 43 15.138 -14.162 -2.578 1.00 0.00 C ATOM 710 O ASP A 43 13.991 -14.534 -2.329 1.00 0.00 O ATOM 711 CB ASP A 43 16.223 -14.381 -0.334 1.00 0.00 C ATOM 712 CG ASP A 43 17.397 -15.312 -0.565 1.00 0.00 C ATOM 713 OD1 ASP A 43 18.337 -15.296 0.257 1.00 0.00 O ATOM 714 OD2 ASP A 43 17.375 -16.057 -1.567 1.00 0.00 O ATOM 0 H ASP A 43 14.832 -12.310 -0.182 1.00 0.00 H new ATOM 0 HA ASP A 43 16.932 -13.175 -1.965 1.00 0.00 H new ATOM 0 HB2 ASP A 43 16.406 -13.786 0.560 1.00 0.00 H new ATOM 0 HB3 ASP A 43 15.326 -14.971 -0.146 1.00 0.00 H new ATOM 719 N ARG A 44 15.719 -14.349 -3.759 1.00 0.00 N ATOM 720 CA ARG A 44 15.026 -15.015 -4.855 1.00 0.00 C ATOM 721 C ARG A 44 15.252 -16.524 -4.803 1.00 0.00 C ATOM 722 O ARG A 44 14.356 -17.307 -5.118 1.00 0.00 O ATOM 723 CB ARG A 44 15.502 -14.463 -6.199 1.00 0.00 C ATOM 724 CG ARG A 44 15.021 -13.049 -6.481 1.00 0.00 C ATOM 725 CD ARG A 44 13.574 -13.035 -6.948 1.00 0.00 C ATOM 726 NE ARG A 44 13.450 -13.396 -8.357 1.00 0.00 N ATOM 727 CZ ARG A 44 12.369 -13.146 -9.087 1.00 0.00 C ATOM 728 NH1 ARG A 44 11.325 -12.536 -8.544 1.00 0.00 N ATOM 729 NH2 ARG A 44 12.332 -13.506 -10.364 1.00 0.00 N ATOM 0 H ARG A 44 16.668 -14.048 -3.981 1.00 0.00 H new ATOM 0 HA ARG A 44 13.959 -14.820 -4.749 1.00 0.00 H new ATOM 0 HB2 ARG A 44 16.592 -14.479 -6.223 1.00 0.00 H new ATOM 0 HB3 ARG A 44 15.156 -15.121 -6.996 1.00 0.00 H new ATOM 0 HG2 ARG A 44 15.119 -12.444 -5.580 1.00 0.00 H new ATOM 0 HG3 ARG A 44 15.654 -12.593 -7.242 1.00 0.00 H new ATOM 0 HD2 ARG A 44 12.991 -13.730 -6.343 1.00 0.00 H new ATOM 0 HD3 ARG A 44 13.152 -12.043 -6.790 1.00 0.00 H new ATOM 0 HE ARG A 44 14.236 -13.866 -8.805 1.00 0.00 H new ATOM 0 HH11 ARG A 44 11.351 -12.257 -7.563 1.00 0.00 H new ATOM 0 HH12 ARG A 44 10.496 -12.345 -9.107 1.00 0.00 H new ATOM 0 HH21 ARG A 44 13.134 -13.975 -10.785 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.502 -13.314 -10.924 1.00 0.00 H new ATOM 743 N SER A 45 16.456 -16.923 -4.406 1.00 0.00 N ATOM 744 CA SER A 45 16.801 -18.337 -4.318 1.00 0.00 C ATOM 745 C SER A 45 15.904 -19.054 -3.314 1.00 0.00 C ATOM 746 O SER A 45 15.510 -20.202 -3.524 1.00 0.00 O ATOM 747 CB SER A 45 18.269 -18.501 -3.917 1.00 0.00 C ATOM 748 OG SER A 45 19.116 -18.454 -5.052 1.00 0.00 O ATOM 0 H SER A 45 17.208 -16.288 -4.140 1.00 0.00 H new ATOM 0 HA SER A 45 16.648 -18.785 -5.300 1.00 0.00 H new ATOM 0 HB2 SER A 45 18.548 -17.713 -3.218 1.00 0.00 H new ATOM 0 HB3 SER A 45 18.404 -19.450 -3.398 1.00 0.00 H new ATOM 0 HG SER A 45 20.048 -18.559 -4.769 1.00 0.00 H new ATOM 754 N LEU A 46 15.586 -18.370 -2.220 1.00 0.00 N ATOM 755 CA LEU A 46 14.735 -18.940 -1.181 1.00 0.00 C ATOM 756 C LEU A 46 13.444 -19.491 -1.777 1.00 0.00 C ATOM 757 O LEU A 46 12.946 -18.983 -2.782 1.00 0.00 O ATOM 758 CB LEU A 46 14.412 -17.884 -0.123 1.00 0.00 C ATOM 759 CG LEU A 46 15.457 -17.694 0.977 1.00 0.00 C ATOM 760 CD1 LEU A 46 15.053 -16.562 1.908 1.00 0.00 C ATOM 761 CD2 LEU A 46 15.650 -18.986 1.758 1.00 0.00 C ATOM 0 H LEU A 46 15.905 -17.420 -2.030 1.00 0.00 H new ATOM 0 HA LEU A 46 15.276 -19.761 -0.712 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.265 -16.928 -0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 46 13.464 -18.147 0.346 1.00 0.00 H new ATOM 0 HG LEU A 46 16.405 -17.430 0.509 1.00 0.00 H new ATOM 0 HD11 LEU A 46 15.809 -16.442 2.684 1.00 0.00 H new ATOM 0 HD12 LEU A 46 14.967 -15.636 1.339 1.00 0.00 H new ATOM 0 HD13 LEU A 46 14.093 -16.795 2.369 1.00 0.00 H new ATOM 0 HD21 LEU A 46 16.397 -18.832 2.537 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.705 -19.280 2.215 1.00 0.00 H new ATOM 0 HD23 LEU A 46 15.986 -19.773 1.083 1.00 0.00 H new ATOM 773 N ASP A 47 12.906 -20.531 -1.149 1.00 0.00 N ATOM 774 CA ASP A 47 11.670 -21.150 -1.615 1.00 0.00 C ATOM 775 C ASP A 47 10.533 -20.133 -1.649 1.00 0.00 C ATOM 776 O ASP A 47 10.436 -19.267 -0.780 1.00 0.00 O ATOM 777 CB ASP A 47 11.293 -22.326 -0.713 1.00 0.00 C ATOM 778 CG ASP A 47 12.150 -23.550 -0.969 1.00 0.00 C ATOM 779 OD1 ASP A 47 13.201 -23.411 -1.629 1.00 0.00 O ATOM 780 OD2 ASP A 47 11.769 -24.647 -0.509 1.00 0.00 O ATOM 0 H ASP A 47 13.306 -20.963 -0.316 1.00 0.00 H new ATOM 0 HA ASP A 47 11.835 -21.518 -2.628 1.00 0.00 H new ATOM 0 HB2 ASP A 47 11.394 -22.027 0.330 1.00 0.00 H new ATOM 0 HB3 ASP A 47 10.245 -22.580 -0.871 1.00 0.00 H new ATOM 785 N ARG A 48 9.676 -20.246 -2.659 1.00 0.00 N ATOM 786 CA ARG A 48 8.548 -19.335 -2.808 1.00 0.00 C ATOM 787 C ARG A 48 7.246 -20.010 -2.386 1.00 0.00 C ATOM 788 O ARG A 48 6.359 -19.372 -1.819 1.00 0.00 O ATOM 789 CB ARG A 48 8.440 -18.855 -4.256 1.00 0.00 C ATOM 790 CG ARG A 48 9.339 -17.672 -4.574 1.00 0.00 C ATOM 791 CD ARG A 48 10.689 -18.125 -5.108 1.00 0.00 C ATOM 792 NE ARG A 48 10.613 -18.541 -6.505 1.00 0.00 N ATOM 793 CZ ARG A 48 11.563 -19.241 -7.117 1.00 0.00 C ATOM 794 NH1 ARG A 48 12.655 -19.601 -6.456 1.00 0.00 N ATOM 795 NH2 ARG A 48 11.421 -19.582 -8.391 1.00 0.00 N ATOM 0 H ARG A 48 9.742 -20.959 -3.385 1.00 0.00 H new ATOM 0 HA ARG A 48 8.719 -18.475 -2.160 1.00 0.00 H new ATOM 0 HB2 ARG A 48 8.690 -19.680 -4.923 1.00 0.00 H new ATOM 0 HB3 ARG A 48 7.406 -18.580 -4.463 1.00 0.00 H new ATOM 0 HG2 ARG A 48 8.852 -17.031 -5.309 1.00 0.00 H new ATOM 0 HG3 ARG A 48 9.485 -17.073 -3.675 1.00 0.00 H new ATOM 0 HD2 ARG A 48 11.409 -17.312 -5.010 1.00 0.00 H new ATOM 0 HD3 ARG A 48 11.059 -18.953 -4.503 1.00 0.00 H new ATOM 0 HE ARG A 48 9.785 -18.280 -7.041 1.00 0.00 H new ATOM 0 HH11 ARG A 48 12.767 -19.341 -5.476 1.00 0.00 H new ATOM 0 HH12 ARG A 48 13.383 -20.138 -6.927 1.00 0.00 H new ATOM 0 HH21 ARG A 48 10.582 -19.307 -8.902 1.00 0.00 H new ATOM 0 HH22 ARG A 48 12.151 -20.119 -8.860 1.00 0.00 H new ATOM 809 N SER A 49 7.138 -21.305 -2.668 1.00 0.00 N ATOM 810 CA SER A 49 5.942 -22.065 -2.322 1.00 0.00 C ATOM 811 C SER A 49 5.741 -22.103 -0.810 1.00 0.00 C ATOM 812 O SER A 49 4.612 -22.086 -0.323 1.00 0.00 O ATOM 813 CB SER A 49 6.042 -23.490 -2.871 1.00 0.00 C ATOM 814 OG SER A 49 4.762 -24.088 -2.972 1.00 0.00 O ATOM 0 H SER A 49 7.864 -21.849 -3.135 1.00 0.00 H new ATOM 0 HA SER A 49 5.082 -21.569 -2.773 1.00 0.00 H new ATOM 0 HB2 SER A 49 6.517 -23.473 -3.852 1.00 0.00 H new ATOM 0 HB3 SER A 49 6.677 -24.090 -2.220 1.00 0.00 H new ATOM 0 HG SER A 49 4.853 -24.997 -3.327 1.00 0.00 H new ATOM 820 N ALA A 50 6.846 -22.155 -0.074 1.00 0.00 N ATOM 821 CA ALA A 50 6.793 -22.194 1.382 1.00 0.00 C ATOM 822 C ALA A 50 5.919 -21.071 1.929 1.00 0.00 C ATOM 823 O ALA A 50 5.226 -21.243 2.933 1.00 0.00 O ATOM 824 CB ALA A 50 8.196 -22.105 1.964 1.00 0.00 C ATOM 0 H ALA A 50 7.789 -22.171 -0.462 1.00 0.00 H new ATOM 0 HA ALA A 50 6.348 -23.143 1.680 1.00 0.00 H new ATOM 0 HB1 ALA A 50 8.141 -22.135 3.052 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.792 -22.945 1.607 1.00 0.00 H new ATOM 0 HB3 ALA A 50 8.662 -21.171 1.650 1.00 0.00 H new ATOM 830 N LEU A 51 5.956 -19.921 1.265 1.00 0.00 N ATOM 831 CA LEU A 51 5.167 -18.769 1.685 1.00 0.00 C ATOM 832 C LEU A 51 3.702 -19.151 1.874 1.00 0.00 C ATOM 833 O LEU A 51 3.026 -18.639 2.767 1.00 0.00 O ATOM 834 CB LEU A 51 5.283 -17.643 0.656 1.00 0.00 C ATOM 835 CG LEU A 51 6.584 -16.839 0.684 1.00 0.00 C ATOM 836 CD1 LEU A 51 6.863 -16.228 -0.680 1.00 0.00 C ATOM 837 CD2 LEU A 51 6.518 -15.757 1.752 1.00 0.00 C ATOM 0 H LEU A 51 6.524 -19.762 0.433 1.00 0.00 H new ATOM 0 HA LEU A 51 5.559 -18.421 2.641 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.167 -18.074 -0.339 1.00 0.00 H new ATOM 0 HB3 LEU A 51 4.451 -16.955 0.805 1.00 0.00 H new ATOM 0 HG LEU A 51 7.402 -17.516 0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 51 7.792 -15.660 -0.641 1.00 0.00 H new ATOM 0 HD12 LEU A 51 6.953 -17.021 -1.422 1.00 0.00 H new ATOM 0 HD13 LEU A 51 6.043 -15.565 -0.956 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.452 -15.195 1.758 1.00 0.00 H new ATOM 0 HD22 LEU A 51 5.689 -15.083 1.536 1.00 0.00 H new ATOM 0 HD23 LEU A 51 6.366 -16.218 2.728 1.00 0.00 H new ATOM 849 N HIS A 52 3.218 -20.055 1.028 1.00 0.00 N ATOM 850 CA HIS A 52 1.834 -20.509 1.104 1.00 0.00 C ATOM 851 C HIS A 52 1.673 -21.587 2.171 1.00 0.00 C ATOM 852 O HIS A 52 0.647 -21.657 2.847 1.00 0.00 O ATOM 853 CB HIS A 52 1.376 -21.045 -0.252 1.00 0.00 C ATOM 854 CG HIS A 52 1.631 -20.101 -1.387 1.00 0.00 C ATOM 855 ND1 HIS A 52 1.722 -20.510 -2.701 1.00 0.00 N ATOM 856 CD2 HIS A 52 1.812 -18.760 -1.399 1.00 0.00 C ATOM 857 CE1 HIS A 52 1.950 -19.462 -3.471 1.00 0.00 C ATOM 858 NE2 HIS A 52 2.009 -18.387 -2.706 1.00 0.00 N ATOM 0 H HIS A 52 3.763 -20.487 0.282 1.00 0.00 H new ATOM 0 HA HIS A 52 1.213 -19.656 1.378 1.00 0.00 H new ATOM 0 HB2 HIS A 52 1.886 -21.987 -0.452 1.00 0.00 H new ATOM 0 HB3 HIS A 52 0.309 -21.264 -0.205 1.00 0.00 H new ATOM 0 HD1 HIS A 52 1.628 -21.472 -3.027 1.00 0.00 H new ATOM 0 HD2 HIS A 52 1.803 -18.105 -0.540 1.00 0.00 H new ATOM 0 HE1 HIS A 52 2.068 -19.481 -4.544 1.00 0.00 H new ATOM 866 N ARG A 53 2.694 -22.426 2.317 1.00 0.00 N ATOM 867 CA ARG A 53 2.664 -23.502 3.300 1.00 0.00 C ATOM 868 C ARG A 53 2.485 -22.945 4.709 1.00 0.00 C ATOM 869 O ARG A 53 1.667 -23.441 5.485 1.00 0.00 O ATOM 870 CB ARG A 53 3.951 -24.325 3.225 1.00 0.00 C ATOM 871 CG ARG A 53 3.788 -25.756 3.711 1.00 0.00 C ATOM 872 CD ARG A 53 3.151 -26.636 2.646 1.00 0.00 C ATOM 873 NE ARG A 53 2.982 -28.013 3.104 1.00 0.00 N ATOM 874 CZ ARG A 53 3.977 -28.889 3.182 1.00 0.00 C ATOM 875 NH1 ARG A 53 5.207 -28.533 2.835 1.00 0.00 N ATOM 876 NH2 ARG A 53 3.744 -30.124 3.608 1.00 0.00 N ATOM 0 H ARG A 53 3.552 -22.381 1.767 1.00 0.00 H new ATOM 0 HA ARG A 53 1.815 -24.146 3.072 1.00 0.00 H new ATOM 0 HB2 ARG A 53 4.304 -24.338 2.194 1.00 0.00 H new ATOM 0 HB3 ARG A 53 4.721 -23.834 3.819 1.00 0.00 H new ATOM 0 HG2 ARG A 53 4.762 -26.162 3.985 1.00 0.00 H new ATOM 0 HG3 ARG A 53 3.173 -25.768 4.611 1.00 0.00 H new ATOM 0 HD2 ARG A 53 2.181 -26.224 2.368 1.00 0.00 H new ATOM 0 HD3 ARG A 53 3.770 -26.626 1.749 1.00 0.00 H new ATOM 0 HE ARG A 53 2.048 -28.318 3.379 1.00 0.00 H new ATOM 0 HH11 ARG A 53 5.390 -27.585 2.507 1.00 0.00 H new ATOM 0 HH12 ARG A 53 5.970 -29.208 2.896 1.00 0.00 H new ATOM 0 HH21 ARG A 53 2.800 -30.401 3.876 1.00 0.00 H new ATOM 0 HH22 ARG A 53 4.509 -30.796 3.667 1.00 0.00 H new ATOM 890 N LEU A 54 3.255 -21.913 5.035 1.00 0.00 N ATOM 891 CA LEU A 54 3.183 -21.289 6.351 1.00 0.00 C ATOM 892 C LEU A 54 1.742 -20.934 6.707 1.00 0.00 C ATOM 893 O LEU A 54 0.917 -20.685 5.827 1.00 0.00 O ATOM 894 CB LEU A 54 4.053 -20.031 6.390 1.00 0.00 C ATOM 895 CG LEU A 54 3.439 -18.771 5.781 1.00 0.00 C ATOM 896 CD1 LEU A 54 2.677 -17.985 6.836 1.00 0.00 C ATOM 897 CD2 LEU A 54 4.518 -17.906 5.145 1.00 0.00 C ATOM 0 H LEU A 54 3.937 -21.490 4.405 1.00 0.00 H new ATOM 0 HA LEU A 54 3.555 -22.004 7.085 1.00 0.00 H new ATOM 0 HB2 LEU A 54 4.307 -19.821 7.429 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.987 -20.243 5.870 1.00 0.00 H new ATOM 0 HG LEU A 54 2.737 -19.072 5.004 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.247 -17.091 6.384 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.879 -18.604 7.246 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.358 -17.695 7.636 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.063 -17.013 4.716 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.245 -17.614 5.903 1.00 0.00 H new ATOM 0 HD23 LEU A 54 5.020 -18.470 4.359 1.00 0.00 H new ATOM 909 N THR A 55 1.446 -20.912 8.003 1.00 0.00 N ATOM 910 CA THR A 55 0.107 -20.588 8.475 1.00 0.00 C ATOM 911 C THR A 55 0.131 -20.137 9.931 1.00 0.00 C ATOM 912 O THR A 55 -0.417 -20.805 10.809 1.00 0.00 O ATOM 913 CB THR A 55 -0.844 -21.792 8.339 1.00 0.00 C ATOM 914 OG1 THR A 55 -0.524 -22.538 7.160 1.00 0.00 O ATOM 915 CG2 THR A 55 -2.293 -21.333 8.277 1.00 0.00 C ATOM 0 H THR A 55 2.117 -21.115 8.744 1.00 0.00 H new ATOM 0 HA THR A 55 -0.259 -19.773 7.851 1.00 0.00 H new ATOM 0 HB THR A 55 -0.718 -22.427 9.216 1.00 0.00 H new ATOM 0 HG1 THR A 55 -0.310 -21.920 6.430 1.00 0.00 H new ATOM 0 HG21 THR A 55 -2.946 -22.201 8.181 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.542 -20.791 9.189 1.00 0.00 H new ATOM 0 HG23 THR A 55 -2.431 -20.678 7.416 1.00 0.00 H new ATOM 923 N LEU A 56 0.770 -18.999 10.183 1.00 0.00 N ATOM 924 CA LEU A 56 0.865 -18.458 11.534 1.00 0.00 C ATOM 925 C LEU A 56 -0.157 -17.346 11.749 1.00 0.00 C ATOM 926 O LEU A 56 -0.999 -17.089 10.889 1.00 0.00 O ATOM 927 CB LEU A 56 2.276 -17.925 11.793 1.00 0.00 C ATOM 928 CG LEU A 56 2.963 -18.434 13.061 1.00 0.00 C ATOM 929 CD1 LEU A 56 3.069 -19.951 13.039 1.00 0.00 C ATOM 930 CD2 LEU A 56 4.340 -17.803 13.211 1.00 0.00 C ATOM 0 H LEU A 56 1.230 -18.434 9.469 1.00 0.00 H new ATOM 0 HA LEU A 56 0.652 -19.263 12.237 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.902 -18.180 10.938 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.229 -16.837 11.841 1.00 0.00 H new ATOM 0 HG LEU A 56 2.357 -18.146 13.920 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.560 -20.295 13.949 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.071 -20.385 12.980 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.652 -20.262 12.172 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.814 -18.176 14.118 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.954 -18.060 12.348 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.239 -16.720 13.274 1.00 0.00 H new ATOM 942 N GLY A 57 -0.076 -16.689 12.902 1.00 0.00 N ATOM 943 CA GLY A 57 -0.999 -15.611 13.208 1.00 0.00 C ATOM 944 C GLY A 57 -2.216 -16.090 13.974 1.00 0.00 C ATOM 945 O GLY A 57 -2.723 -15.387 14.848 1.00 0.00 O ATOM 0 H GLY A 57 0.612 -16.884 13.629 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.482 -14.849 13.792 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.321 -15.138 12.280 1.00 0.00 H new ATOM 949 N SER A 58 -2.686 -17.289 13.645 1.00 0.00 N ATOM 950 CA SER A 58 -3.855 -17.859 14.306 1.00 0.00 C ATOM 951 C SER A 58 -3.682 -17.848 15.821 1.00 0.00 C ATOM 952 O SER A 58 -4.658 -17.771 16.568 1.00 0.00 O ATOM 953 CB SER A 58 -4.096 -19.289 13.818 1.00 0.00 C ATOM 954 OG SER A 58 -4.650 -19.296 12.514 1.00 0.00 O ATOM 0 H SER A 58 -2.276 -17.884 12.925 1.00 0.00 H new ATOM 0 HA SER A 58 -4.720 -17.246 14.053 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.156 -19.841 13.820 1.00 0.00 H new ATOM 0 HB3 SER A 58 -4.769 -19.803 14.505 1.00 0.00 H new ATOM 0 HG SER A 58 -4.793 -20.221 12.224 1.00 0.00 H new ATOM 960 N ILE A 59 -2.433 -17.927 16.268 1.00 0.00 N ATOM 961 CA ILE A 59 -2.131 -17.926 17.694 1.00 0.00 C ATOM 962 C ILE A 59 -2.117 -16.507 18.252 1.00 0.00 C ATOM 963 O ILE A 59 -2.510 -16.275 19.395 1.00 0.00 O ATOM 964 CB ILE A 59 -0.772 -18.592 17.982 1.00 0.00 C ATOM 965 CG1 ILE A 59 0.352 -17.835 17.272 1.00 0.00 C ATOM 966 CG2 ILE A 59 -0.793 -20.049 17.548 1.00 0.00 C ATOM 967 CD1 ILE A 59 1.716 -18.461 17.460 1.00 0.00 C ATOM 0 H ILE A 59 -1.614 -17.992 15.663 1.00 0.00 H new ATOM 0 HA ILE A 59 -2.919 -18.499 18.184 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.587 -18.556 19.056 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.128 -17.785 16.206 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.378 -16.810 17.641 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.174 -20.505 17.758 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.571 -20.580 18.095 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.997 -20.107 16.479 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.463 -17.871 16.929 1.00 0.00 H new ATOM 0 HD12 ILE A 59 1.961 -18.487 18.522 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.708 -19.477 17.065 1.00 0.00 H new ATOM 979 N ALA A 60 -1.665 -15.561 17.436 1.00 0.00 N ATOM 980 CA ALA A 60 -1.604 -14.163 17.846 1.00 0.00 C ATOM 981 C ALA A 60 -2.997 -13.543 17.889 1.00 0.00 C ATOM 982 O ALA A 60 -3.328 -12.799 18.813 1.00 0.00 O ATOM 983 CB ALA A 60 -0.702 -13.376 16.907 1.00 0.00 C ATOM 0 H ALA A 60 -1.336 -15.737 16.487 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.185 -14.123 18.852 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.666 -12.334 17.225 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.303 -13.797 16.930 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -1.096 -13.432 15.892 1.00 0.00 H new ATOM 989 N VAL A 61 -3.809 -13.852 16.884 1.00 0.00 N ATOM 990 CA VAL A 61 -5.166 -13.325 16.807 1.00 0.00 C ATOM 991 C VAL A 61 -5.981 -13.726 18.032 1.00 0.00 C ATOM 992 O VAL A 61 -6.995 -13.103 18.348 1.00 0.00 O ATOM 993 CB VAL A 61 -5.889 -13.818 15.539 1.00 0.00 C ATOM 994 CG1 VAL A 61 -6.197 -15.304 15.644 1.00 0.00 C ATOM 995 CG2 VAL A 61 -7.160 -13.017 15.306 1.00 0.00 C ATOM 0 H VAL A 61 -3.551 -14.465 16.111 1.00 0.00 H new ATOM 0 HA VAL A 61 -5.082 -12.239 16.769 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.230 -13.668 14.684 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -6.708 -15.635 14.740 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.267 -15.861 15.760 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.837 -15.483 16.508 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -7.658 -13.378 14.406 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -7.826 -13.134 16.161 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -6.909 -11.963 15.183 1.00 0.00 H new ATOM 1005 N LYS A 62 -5.531 -14.770 18.719 1.00 0.00 N ATOM 1006 CA LYS A 62 -6.217 -15.255 19.911 1.00 0.00 C ATOM 1007 C LYS A 62 -5.481 -14.821 21.176 1.00 0.00 C ATOM 1008 O LYS A 62 -6.066 -14.200 22.062 1.00 0.00 O ATOM 1009 CB LYS A 62 -6.333 -16.780 19.874 1.00 0.00 C ATOM 1010 CG LYS A 62 -7.459 -17.326 20.735 1.00 0.00 C ATOM 1011 CD LYS A 62 -8.793 -17.269 20.010 1.00 0.00 C ATOM 1012 CE LYS A 62 -9.956 -17.211 20.988 1.00 0.00 C ATOM 1013 NZ LYS A 62 -10.229 -18.538 21.605 1.00 0.00 N ATOM 0 H LYS A 62 -4.694 -15.297 18.471 1.00 0.00 H new ATOM 0 HA LYS A 62 -7.217 -14.822 19.926 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -6.488 -17.099 18.843 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -5.390 -17.216 20.205 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -7.239 -18.357 21.013 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -7.522 -16.753 21.660 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -8.818 -16.394 19.360 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -8.898 -18.145 19.369 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -9.736 -16.485 21.771 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -10.849 -16.861 20.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -11.028 -18.456 22.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -10.464 -19.225 20.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -9.386 -18.861 22.121 1.00 0.00 H new ATOM 1027 N GLU A 63 -4.196 -15.153 21.250 1.00 0.00 N ATOM 1028 CA GLU A 63 -3.382 -14.796 22.406 1.00 0.00 C ATOM 1029 C GLU A 63 -3.232 -13.282 22.520 1.00 0.00 C ATOM 1030 O GLU A 63 -3.581 -12.688 23.540 1.00 0.00 O ATOM 1031 CB GLU A 63 -2.002 -15.450 22.307 1.00 0.00 C ATOM 1032 CG GLU A 63 -1.995 -16.920 22.693 1.00 0.00 C ATOM 1033 CD GLU A 63 -2.942 -17.749 21.847 1.00 0.00 C ATOM 1034 OE1 GLU A 63 -4.156 -17.748 22.142 1.00 0.00 O ATOM 1035 OE2 GLU A 63 -2.471 -18.399 20.891 1.00 0.00 O ATOM 0 H GLU A 63 -3.697 -15.668 20.524 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.887 -15.162 23.300 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.634 -15.350 21.286 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -1.307 -14.911 22.951 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -0.984 -17.314 22.592 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.271 -17.018 23.743 1.00 0.00 H new ATOM 1042 N PHE A 64 -2.709 -12.664 21.466 1.00 0.00 N ATOM 1043 CA PHE A 64 -2.511 -11.219 21.448 1.00 0.00 C ATOM 1044 C PHE A 64 -3.706 -10.515 20.812 1.00 0.00 C ATOM 1045 O PHE A 64 -3.553 -9.496 20.137 1.00 0.00 O ATOM 1046 CB PHE A 64 -1.233 -10.868 20.685 1.00 0.00 C ATOM 1047 CG PHE A 64 0.024 -11.274 21.401 1.00 0.00 C ATOM 1048 CD1 PHE A 64 0.960 -12.085 20.781 1.00 0.00 C ATOM 1049 CD2 PHE A 64 0.268 -10.843 22.695 1.00 0.00 C ATOM 1050 CE1 PHE A 64 2.117 -12.460 21.437 1.00 0.00 C ATOM 1051 CE2 PHE A 64 1.424 -11.214 23.357 1.00 0.00 C ATOM 1052 CZ PHE A 64 2.349 -12.025 22.727 1.00 0.00 C ATOM 0 H PHE A 64 -2.415 -13.141 20.614 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.416 -10.877 22.479 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.258 -11.352 19.709 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.209 -9.793 20.507 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.783 -12.429 19.772 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.453 -10.210 23.192 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.839 -13.092 20.942 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.604 -10.870 24.365 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.252 -12.318 23.243 1.00 0.00 H new ATOM 1062 N ASP A 65 -4.895 -11.065 21.032 1.00 0.00 N ATOM 1063 CA ASP A 65 -6.117 -10.490 20.481 1.00 0.00 C ATOM 1064 C ASP A 65 -6.418 -9.138 21.120 1.00 0.00 C ATOM 1065 O ASP A 65 -6.536 -8.127 20.429 1.00 0.00 O ATOM 1066 CB ASP A 65 -7.295 -11.442 20.695 1.00 0.00 C ATOM 1067 CG ASP A 65 -8.443 -11.165 19.744 1.00 0.00 C ATOM 1068 OD1 ASP A 65 -8.244 -10.396 18.780 1.00 0.00 O ATOM 1069 OD2 ASP A 65 -9.541 -11.717 19.964 1.00 0.00 O ATOM 0 H ASP A 65 -5.039 -11.908 21.588 1.00 0.00 H new ATOM 0 HA ASP A 65 -5.969 -10.341 19.411 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -6.957 -12.470 20.562 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -7.648 -11.353 21.722 1.00 0.00 H new ATOM 1074 N GLU A 66 -6.540 -9.129 22.444 1.00 0.00 N ATOM 1075 CA GLU A 66 -6.829 -7.901 23.175 1.00 0.00 C ATOM 1076 C GLU A 66 -5.590 -7.403 23.914 1.00 0.00 C ATOM 1077 O GLU A 66 -5.337 -6.200 23.987 1.00 0.00 O ATOM 1078 CB GLU A 66 -7.971 -8.128 24.167 1.00 0.00 C ATOM 1079 CG GLU A 66 -9.351 -7.933 23.562 1.00 0.00 C ATOM 1080 CD GLU A 66 -9.586 -6.510 23.091 1.00 0.00 C ATOM 1081 OE1 GLU A 66 -9.623 -5.601 23.947 1.00 0.00 O ATOM 1082 OE2 GLU A 66 -9.732 -6.307 21.868 1.00 0.00 O ATOM 0 H GLU A 66 -6.443 -9.957 23.031 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.130 -7.142 22.453 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -7.898 -9.140 24.566 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.852 -7.444 25.007 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -9.475 -8.615 22.721 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -10.108 -8.197 24.300 1.00 0.00 H new ATOM 1089 N THR A 67 -4.820 -8.338 24.462 1.00 0.00 N ATOM 1090 CA THR A 67 -3.609 -7.997 25.197 1.00 0.00 C ATOM 1091 C THR A 67 -2.675 -7.139 24.351 1.00 0.00 C ATOM 1092 O THR A 67 -1.996 -6.250 24.865 1.00 0.00 O ATOM 1093 CB THR A 67 -2.854 -9.259 25.654 1.00 0.00 C ATOM 1094 OG1 THR A 67 -2.897 -10.255 24.625 1.00 0.00 O ATOM 1095 CG2 THR A 67 -3.458 -9.818 26.933 1.00 0.00 C ATOM 0 H THR A 67 -5.014 -9.338 24.410 1.00 0.00 H new ATOM 0 HA THR A 67 -3.922 -7.432 26.075 1.00 0.00 H new ATOM 0 HB THR A 67 -1.818 -8.984 25.851 1.00 0.00 H new ATOM 0 HG1 THR A 67 -3.416 -11.026 24.937 1.00 0.00 H new ATOM 0 HG21 THR A 67 -2.908 -10.709 27.236 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.397 -9.068 27.722 1.00 0.00 H new ATOM 0 HG23 THR A 67 -4.502 -10.078 26.759 1.00 0.00 H new ATOM 1103 N ASP A 68 -2.647 -7.410 23.050 1.00 0.00 N ATOM 1104 CA ASP A 68 -1.798 -6.661 22.132 1.00 0.00 C ATOM 1105 C ASP A 68 -2.282 -6.818 20.694 1.00 0.00 C ATOM 1106 O ASP A 68 -1.766 -7.627 19.923 1.00 0.00 O ATOM 1107 CB ASP A 68 -0.346 -7.130 22.248 1.00 0.00 C ATOM 1108 CG ASP A 68 0.645 -5.998 22.061 1.00 0.00 C ATOM 1109 OD1 ASP A 68 1.518 -5.824 22.937 1.00 0.00 O ATOM 1110 OD2 ASP A 68 0.547 -5.287 21.040 1.00 0.00 O ATOM 0 H ASP A 68 -3.203 -8.143 22.608 1.00 0.00 H new ATOM 0 HA ASP A 68 -1.854 -5.607 22.403 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -0.192 -7.586 23.226 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.156 -7.902 21.502 1.00 0.00 H new ATOM 1115 N PRO A 69 -3.299 -6.026 20.322 1.00 0.00 N ATOM 1116 CA PRO A 69 -3.876 -6.059 18.975 1.00 0.00 C ATOM 1117 C PRO A 69 -2.926 -5.497 17.923 1.00 0.00 C ATOM 1118 O PRO A 69 -2.954 -5.909 16.764 1.00 0.00 O ATOM 1119 CB PRO A 69 -5.119 -5.174 19.100 1.00 0.00 C ATOM 1120 CG PRO A 69 -4.815 -4.252 20.230 1.00 0.00 C ATOM 1121 CD PRO A 69 -3.964 -5.038 21.188 1.00 0.00 C ATOM 0 HA PRO A 69 -4.091 -7.077 18.649 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -5.307 -4.623 18.179 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -6.010 -5.769 19.303 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -4.289 -3.364 19.879 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -5.731 -3.910 20.712 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -3.242 -4.401 21.699 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -4.566 -5.520 21.958 1.00 0.00 H new ATOM 1129 N GLU A 70 -2.085 -4.553 18.336 1.00 0.00 N ATOM 1130 CA GLU A 70 -1.126 -3.935 17.428 1.00 0.00 C ATOM 1131 C GLU A 70 -0.235 -4.989 16.778 1.00 0.00 C ATOM 1132 O GLU A 70 0.156 -4.859 15.617 1.00 0.00 O ATOM 1133 CB GLU A 70 -0.265 -2.915 18.176 1.00 0.00 C ATOM 1134 CG GLU A 70 -0.970 -1.593 18.429 1.00 0.00 C ATOM 1135 CD GLU A 70 -2.192 -1.743 19.315 1.00 0.00 C ATOM 1136 OE1 GLU A 70 -2.027 -2.133 20.491 1.00 0.00 O ATOM 1137 OE2 GLU A 70 -3.312 -1.472 18.834 1.00 0.00 O ATOM 0 H GLU A 70 -2.049 -4.200 19.292 1.00 0.00 H new ATOM 0 HA GLU A 70 -1.685 -3.423 16.645 1.00 0.00 H new ATOM 0 HB2 GLU A 70 0.042 -3.342 19.131 1.00 0.00 H new ATOM 0 HB3 GLU A 70 0.643 -2.729 17.603 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -0.272 -0.897 18.894 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -1.268 -1.157 17.476 1.00 0.00 H new ATOM 1144 N LEU A 71 0.085 -6.034 17.534 1.00 0.00 N ATOM 1145 CA LEU A 71 0.931 -7.111 17.033 1.00 0.00 C ATOM 1146 C LEU A 71 0.123 -8.087 16.183 1.00 0.00 C ATOM 1147 O LEU A 71 0.608 -8.591 15.170 1.00 0.00 O ATOM 1148 CB LEU A 71 1.588 -7.854 18.198 1.00 0.00 C ATOM 1149 CG LEU A 71 2.565 -7.040 19.047 1.00 0.00 C ATOM 1150 CD1 LEU A 71 3.252 -7.931 20.071 1.00 0.00 C ATOM 1151 CD2 LEU A 71 3.593 -6.350 18.162 1.00 0.00 C ATOM 0 H LEU A 71 -0.229 -6.158 18.497 1.00 0.00 H new ATOM 0 HA LEU A 71 1.707 -6.670 16.408 1.00 0.00 H new ATOM 0 HB2 LEU A 71 0.802 -8.235 18.850 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.118 -8.719 17.799 1.00 0.00 H new ATOM 0 HG LEU A 71 2.003 -6.274 19.581 1.00 0.00 H new ATOM 0 HD11 LEU A 71 3.944 -7.335 20.666 1.00 0.00 H new ATOM 0 HD12 LEU A 71 2.503 -8.378 20.725 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.802 -8.719 19.557 1.00 0.00 H new ATOM 0 HD21 LEU A 71 4.280 -5.775 18.783 1.00 0.00 H new ATOM 0 HD22 LEU A 71 4.151 -7.099 17.601 1.00 0.00 H new ATOM 0 HD23 LEU A 71 3.085 -5.681 17.468 1.00 0.00 H new ATOM 1163 N SER A 72 -1.111 -8.348 16.602 1.00 0.00 N ATOM 1164 CA SER A 72 -1.985 -9.265 15.881 1.00 0.00 C ATOM 1165 C SER A 72 -2.341 -8.708 14.506 1.00 0.00 C ATOM 1166 O SER A 72 -2.183 -9.385 13.490 1.00 0.00 O ATOM 1167 CB SER A 72 -3.262 -9.524 16.684 1.00 0.00 C ATOM 1168 OG SER A 72 -3.030 -10.462 17.720 1.00 0.00 O ATOM 0 H SER A 72 -1.528 -7.937 17.437 1.00 0.00 H new ATOM 0 HA SER A 72 -1.451 -10.206 15.746 1.00 0.00 H new ATOM 0 HB2 SER A 72 -3.624 -8.588 17.110 1.00 0.00 H new ATOM 0 HB3 SER A 72 -4.044 -9.895 16.021 1.00 0.00 H new ATOM 0 HG SER A 72 -2.892 -9.987 18.566 1.00 0.00 H new ATOM 1174 N ARG A 73 -2.821 -7.469 14.482 1.00 0.00 N ATOM 1175 CA ARG A 73 -3.200 -6.819 13.233 1.00 0.00 C ATOM 1176 C ARG A 73 -2.031 -6.801 12.253 1.00 0.00 C ATOM 1177 O ARG A 73 -2.221 -6.905 11.042 1.00 0.00 O ATOM 1178 CB ARG A 73 -3.679 -5.391 13.501 1.00 0.00 C ATOM 1179 CG ARG A 73 -5.151 -5.300 13.867 1.00 0.00 C ATOM 1180 CD ARG A 73 -5.551 -3.875 14.216 1.00 0.00 C ATOM 1181 NE ARG A 73 -6.979 -3.762 14.501 1.00 0.00 N ATOM 1182 CZ ARG A 73 -7.583 -2.614 14.785 1.00 0.00 C ATOM 1183 NH1 ARG A 73 -6.886 -1.486 14.822 1.00 0.00 N ATOM 1184 NH2 ARG A 73 -8.886 -2.591 15.033 1.00 0.00 N ATOM 0 H ARG A 73 -2.957 -6.895 15.314 1.00 0.00 H new ATOM 0 HA ARG A 73 -4.015 -7.390 12.788 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -3.085 -4.964 14.309 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -3.496 -4.783 12.615 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -5.757 -5.655 13.034 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -5.358 -5.955 14.713 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -4.981 -3.540 15.083 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -5.293 -3.213 13.389 1.00 0.00 H new ATOM 0 HE ARG A 73 -7.543 -4.611 14.481 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -5.884 -1.499 14.632 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -7.352 -0.605 15.040 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -9.426 -3.456 15.006 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -9.348 -1.708 15.251 1.00 0.00 H new ATOM 1198 N ALA A 74 -0.821 -6.667 12.787 1.00 0.00 N ATOM 1199 CA ALA A 74 0.379 -6.636 11.960 1.00 0.00 C ATOM 1200 C ALA A 74 0.813 -8.044 11.569 1.00 0.00 C ATOM 1201 O ALA A 74 1.348 -8.261 10.481 1.00 0.00 O ATOM 1202 CB ALA A 74 1.505 -5.918 12.690 1.00 0.00 C ATOM 0 H ALA A 74 -0.646 -6.578 13.788 1.00 0.00 H new ATOM 0 HA ALA A 74 0.146 -6.089 11.046 1.00 0.00 H new ATOM 0 HB1 ALA A 74 2.395 -5.902 12.061 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.200 -4.895 12.913 1.00 0.00 H new ATOM 0 HB3 ALA A 74 1.727 -6.441 13.620 1.00 0.00 H new ATOM 1208 N LEU A 75 0.579 -8.999 12.462 1.00 0.00 N ATOM 1209 CA LEU A 75 0.947 -10.389 12.211 1.00 0.00 C ATOM 1210 C LEU A 75 0.052 -11.003 11.139 1.00 0.00 C ATOM 1211 O LEU A 75 0.531 -11.454 10.099 1.00 0.00 O ATOM 1212 CB LEU A 75 0.850 -11.204 13.501 1.00 0.00 C ATOM 1213 CG LEU A 75 2.176 -11.538 14.186 1.00 0.00 C ATOM 1214 CD1 LEU A 75 3.037 -10.292 14.317 1.00 0.00 C ATOM 1215 CD2 LEU A 75 1.929 -12.165 15.550 1.00 0.00 C ATOM 0 H LEU A 75 0.136 -8.837 13.366 1.00 0.00 H new ATOM 0 HA LEU A 75 1.977 -10.408 11.854 1.00 0.00 H new ATOM 0 HB2 LEU A 75 0.227 -10.655 14.208 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.333 -12.138 13.279 1.00 0.00 H new ATOM 0 HG LEU A 75 2.710 -12.260 13.569 1.00 0.00 H new ATOM 0 HD11 LEU A 75 3.976 -10.549 14.807 1.00 0.00 H new ATOM 0 HD12 LEU A 75 3.243 -9.886 13.327 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.510 -9.546 14.912 1.00 0.00 H new ATOM 0 HD21 LEU A 75 2.884 -12.396 16.023 1.00 0.00 H new ATOM 0 HD22 LEU A 75 1.374 -11.467 16.176 1.00 0.00 H new ATOM 0 HD23 LEU A 75 1.352 -13.082 15.430 1.00 0.00 H new ATOM 1227 N LYS A 76 -1.251 -11.015 11.399 1.00 0.00 N ATOM 1228 CA LYS A 76 -2.215 -11.571 10.456 1.00 0.00 C ATOM 1229 C LYS A 76 -2.094 -10.895 9.094 1.00 0.00 C ATOM 1230 O LYS A 76 -2.283 -11.530 8.057 1.00 0.00 O ATOM 1231 CB LYS A 76 -3.638 -11.408 10.995 1.00 0.00 C ATOM 1232 CG LYS A 76 -4.113 -9.965 11.030 1.00 0.00 C ATOM 1233 CD LYS A 76 -5.079 -9.725 12.178 1.00 0.00 C ATOM 1234 CE LYS A 76 -6.314 -10.606 12.061 1.00 0.00 C ATOM 1235 NZ LYS A 76 -7.561 -9.857 12.379 1.00 0.00 N ATOM 0 H LYS A 76 -1.664 -10.646 12.255 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.999 -12.633 10.335 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -4.321 -11.992 10.377 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.686 -11.822 12.002 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -3.255 -9.301 11.130 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -4.599 -9.718 10.086 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -4.577 -9.924 13.125 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -5.378 -8.677 12.190 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -6.379 -11.008 11.050 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -6.219 -11.456 12.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -8.380 -10.492 12.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -7.510 -9.495 13.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -7.665 -9.060 11.719 1.00 0.00 H new ATOM 1249 N ASP A 77 -1.778 -9.605 9.105 1.00 0.00 N ATOM 1250 CA ASP A 77 -1.630 -8.844 7.870 1.00 0.00 C ATOM 1251 C ASP A 77 -0.267 -9.100 7.234 1.00 0.00 C ATOM 1252 O ASP A 77 -0.117 -9.025 6.015 1.00 0.00 O ATOM 1253 CB ASP A 77 -1.807 -7.349 8.142 1.00 0.00 C ATOM 1254 CG ASP A 77 -3.247 -6.981 8.441 1.00 0.00 C ATOM 1255 OD1 ASP A 77 -4.119 -7.869 8.341 1.00 0.00 O ATOM 1256 OD2 ASP A 77 -3.501 -5.805 8.776 1.00 0.00 O ATOM 0 H ASP A 77 -1.619 -9.064 9.955 1.00 0.00 H new ATOM 0 HA ASP A 77 -2.403 -9.173 7.175 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -1.179 -7.059 8.984 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -1.462 -6.782 7.277 1.00 0.00 H new ATOM 1261 N ALA A 78 0.722 -9.402 8.068 1.00 0.00 N ATOM 1262 CA ALA A 78 2.072 -9.670 7.587 1.00 0.00 C ATOM 1263 C ALA A 78 2.092 -10.874 6.652 1.00 0.00 C ATOM 1264 O ALA A 78 2.495 -10.766 5.494 1.00 0.00 O ATOM 1265 CB ALA A 78 3.015 -9.893 8.760 1.00 0.00 C ATOM 0 H ALA A 78 0.614 -9.467 9.080 1.00 0.00 H new ATOM 0 HA ALA A 78 2.411 -8.800 7.024 1.00 0.00 H new ATOM 0 HB1 ALA A 78 4.019 -10.092 8.387 1.00 0.00 H new ATOM 0 HB2 ALA A 78 3.031 -9.002 9.388 1.00 0.00 H new ATOM 0 HB3 ALA A 78 2.671 -10.745 9.347 1.00 0.00 H new ATOM 1271 N TYR A 79 1.657 -12.021 7.163 1.00 0.00 N ATOM 1272 CA TYR A 79 1.628 -13.247 6.374 1.00 0.00 C ATOM 1273 C TYR A 79 0.583 -13.158 5.266 1.00 0.00 C ATOM 1274 O TYR A 79 0.745 -13.743 4.195 1.00 0.00 O ATOM 1275 CB TYR A 79 1.335 -14.449 7.272 1.00 0.00 C ATOM 1276 CG TYR A 79 -0.137 -14.777 7.383 1.00 0.00 C ATOM 1277 CD1 TYR A 79 -0.709 -15.768 6.595 1.00 0.00 C ATOM 1278 CD2 TYR A 79 -0.955 -14.096 8.276 1.00 0.00 C ATOM 1279 CE1 TYR A 79 -2.053 -16.071 6.693 1.00 0.00 C ATOM 1280 CE2 TYR A 79 -2.300 -14.393 8.381 1.00 0.00 C ATOM 1281 CZ TYR A 79 -2.845 -15.381 7.588 1.00 0.00 C ATOM 1282 OH TYR A 79 -4.184 -15.679 7.689 1.00 0.00 O ATOM 0 H TYR A 79 1.320 -12.127 8.120 1.00 0.00 H new ATOM 0 HA TYR A 79 2.608 -13.376 5.914 1.00 0.00 H new ATOM 0 HB2 TYR A 79 1.864 -15.319 6.884 1.00 0.00 H new ATOM 0 HB3 TYR A 79 1.731 -14.253 8.268 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -0.092 -16.311 5.894 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -0.532 -13.321 8.899 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -2.482 -16.844 6.072 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -2.922 -13.854 9.081 1.00 0.00 H new ATOM 0 HH TYR A 79 -4.597 -15.103 8.366 1.00 0.00 H new ATOM 1292 N TYR A 80 -0.490 -12.421 5.533 1.00 0.00 N ATOM 1293 CA TYR A 80 -1.564 -12.256 4.561 1.00 0.00 C ATOM 1294 C TYR A 80 -1.015 -11.791 3.216 1.00 0.00 C ATOM 1295 O TYR A 80 -1.151 -12.480 2.205 1.00 0.00 O ATOM 1296 CB TYR A 80 -2.597 -11.253 5.077 1.00 0.00 C ATOM 1297 CG TYR A 80 -3.633 -10.865 4.046 1.00 0.00 C ATOM 1298 CD1 TYR A 80 -4.761 -11.649 3.837 1.00 0.00 C ATOM 1299 CD2 TYR A 80 -3.482 -9.716 3.279 1.00 0.00 C ATOM 1300 CE1 TYR A 80 -5.710 -11.299 2.895 1.00 0.00 C ATOM 1301 CE2 TYR A 80 -4.426 -9.358 2.336 1.00 0.00 C ATOM 1302 CZ TYR A 80 -5.538 -10.153 2.148 1.00 0.00 C ATOM 1303 OH TYR A 80 -6.480 -9.800 1.209 1.00 0.00 O ATOM 0 H TYR A 80 -0.639 -11.929 6.414 1.00 0.00 H new ATOM 0 HA TYR A 80 -2.045 -13.224 4.421 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -3.102 -11.678 5.945 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -2.081 -10.355 5.417 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -4.899 -12.547 4.421 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -2.612 -9.092 3.423 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -6.581 -11.920 2.745 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -4.294 -8.461 1.749 1.00 0.00 H new ATOM 0 HH TYR A 80 -6.209 -8.966 0.771 1.00 0.00 H new ATOM 1313 N VAL A 81 -0.393 -10.616 3.212 1.00 0.00 N ATOM 1314 CA VAL A 81 0.180 -10.058 1.993 1.00 0.00 C ATOM 1315 C VAL A 81 1.244 -10.982 1.412 1.00 0.00 C ATOM 1316 O VAL A 81 1.387 -11.093 0.196 1.00 0.00 O ATOM 1317 CB VAL A 81 0.802 -8.672 2.249 1.00 0.00 C ATOM 1318 CG1 VAL A 81 -0.277 -7.655 2.587 1.00 0.00 C ATOM 1319 CG2 VAL A 81 1.838 -8.751 3.360 1.00 0.00 C ATOM 0 H VAL A 81 -0.273 -10.032 4.040 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.636 -9.955 1.278 1.00 0.00 H new ATOM 0 HB VAL A 81 1.303 -8.344 1.338 1.00 0.00 H new ATOM 0 HG11 VAL A 81 0.182 -6.683 2.764 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -0.978 -7.579 1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -0.809 -7.974 3.483 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.267 -7.763 3.528 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.363 -9.101 4.276 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.627 -9.446 3.073 1.00 0.00 H new ATOM 1329 N GLY A 82 1.989 -11.644 2.292 1.00 0.00 N ATOM 1330 CA GLY A 82 3.031 -12.551 1.848 1.00 0.00 C ATOM 1331 C GLY A 82 2.502 -13.640 0.935 1.00 0.00 C ATOM 1332 O GLY A 82 3.070 -13.899 -0.126 1.00 0.00 O ATOM 0 H GLY A 82 1.889 -11.568 3.304 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.802 -11.985 1.325 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.505 -13.008 2.717 1.00 0.00 H new ATOM 1336 N ILE A 83 1.413 -14.279 1.349 1.00 0.00 N ATOM 1337 CA ILE A 83 0.808 -15.346 0.561 1.00 0.00 C ATOM 1338 C ILE A 83 0.561 -14.896 -0.875 1.00 0.00 C ATOM 1339 O ILE A 83 0.712 -15.676 -1.815 1.00 0.00 O ATOM 1340 CB ILE A 83 -0.523 -15.815 1.177 1.00 0.00 C ATOM 1341 CG1 ILE A 83 -0.299 -16.328 2.601 1.00 0.00 C ATOM 1342 CG2 ILE A 83 -1.155 -16.896 0.312 1.00 0.00 C ATOM 1343 CD1 ILE A 83 -1.538 -16.266 3.467 1.00 0.00 C ATOM 0 H ILE A 83 0.932 -14.077 2.225 1.00 0.00 H new ATOM 0 HA ILE A 83 1.512 -16.178 0.562 1.00 0.00 H new ATOM 0 HB ILE A 83 -1.205 -14.966 1.220 1.00 0.00 H new ATOM 0 HG12 ILE A 83 0.052 -17.359 2.556 1.00 0.00 H new ATOM 0 HG13 ILE A 83 0.492 -15.742 3.070 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.095 -17.217 0.760 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -1.346 -16.499 -0.685 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.478 -17.747 0.240 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -1.306 -16.645 4.462 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -1.878 -15.233 3.542 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -2.324 -16.875 3.021 1.00 0.00 H new ATOM 1355 N ARG A 84 0.182 -13.633 -1.037 1.00 0.00 N ATOM 1356 CA ARG A 84 -0.086 -13.078 -2.358 1.00 0.00 C ATOM 1357 C ARG A 84 1.199 -12.976 -3.175 1.00 0.00 C ATOM 1358 O ARG A 84 1.251 -13.406 -4.328 1.00 0.00 O ATOM 1359 CB ARG A 84 -0.736 -11.699 -2.234 1.00 0.00 C ATOM 1360 CG ARG A 84 -2.251 -11.747 -2.128 1.00 0.00 C ATOM 1361 CD ARG A 84 -2.699 -12.484 -0.876 1.00 0.00 C ATOM 1362 NE ARG A 84 -4.154 -12.567 -0.780 1.00 0.00 N ATOM 1363 CZ ARG A 84 -4.791 -13.425 0.008 1.00 0.00 C ATOM 1364 NH1 ARG A 84 -4.105 -14.270 0.766 1.00 0.00 N ATOM 1365 NH2 ARG A 84 -6.117 -13.440 0.040 1.00 0.00 N ATOM 0 H ARG A 84 0.053 -12.974 -0.269 1.00 0.00 H new ATOM 0 HA ARG A 84 -0.772 -13.749 -2.874 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -0.335 -11.195 -1.355 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -0.460 -11.097 -3.100 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -2.648 -10.732 -2.116 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -2.663 -12.240 -3.009 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -2.278 -13.489 -0.877 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -2.306 -11.975 0.004 1.00 0.00 H new ATOM 0 HE ARG A 84 -4.712 -11.931 -1.350 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -3.085 -14.262 0.745 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -4.597 -14.928 1.370 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.649 -12.792 -0.541 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -6.605 -14.100 0.646 1.00 0.00 H new ATOM 1379 N THR A 85 2.235 -12.402 -2.570 1.00 0.00 N ATOM 1380 CA THR A 85 3.518 -12.241 -3.241 1.00 0.00 C ATOM 1381 C THR A 85 4.082 -13.587 -3.680 1.00 0.00 C ATOM 1382 O THR A 85 4.578 -13.729 -4.797 1.00 0.00 O ATOM 1383 CB THR A 85 4.544 -11.541 -2.330 1.00 0.00 C ATOM 1384 OG1 THR A 85 4.954 -12.427 -1.282 1.00 0.00 O ATOM 1385 CG2 THR A 85 3.957 -10.273 -1.728 1.00 0.00 C ATOM 0 H THR A 85 2.210 -12.041 -1.616 1.00 0.00 H new ATOM 0 HA THR A 85 3.339 -11.621 -4.119 1.00 0.00 H new ATOM 0 HB THR A 85 5.409 -11.270 -2.935 1.00 0.00 H new ATOM 0 HG1 THR A 85 4.167 -12.727 -0.781 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.700 -9.796 -1.089 1.00 0.00 H new ATOM 0 HG22 THR A 85 3.673 -9.588 -2.527 1.00 0.00 H new ATOM 0 HG23 THR A 85 3.077 -10.525 -1.136 1.00 0.00 H new ATOM 1393 N GLY A 86 4.001 -14.576 -2.794 1.00 0.00 N ATOM 1394 CA GLY A 86 4.506 -15.899 -3.110 1.00 0.00 C ATOM 1395 C GLY A 86 3.864 -16.483 -4.352 1.00 0.00 C ATOM 1396 O GLY A 86 4.507 -17.211 -5.108 1.00 0.00 O ATOM 0 H GLY A 86 3.594 -14.484 -1.863 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.585 -15.848 -3.252 1.00 0.00 H new ATOM 0 HA3 GLY A 86 4.327 -16.564 -2.265 1.00 0.00 H new ATOM 1400 N ARG A 87 2.591 -16.166 -4.563 1.00 0.00 N ATOM 1401 CA ARG A 87 1.860 -16.667 -5.721 1.00 0.00 C ATOM 1402 C ARG A 87 2.071 -15.762 -6.931 1.00 0.00 C ATOM 1403 O ARG A 87 1.949 -16.199 -8.075 1.00 0.00 O ATOM 1404 CB ARG A 87 0.367 -16.771 -5.403 1.00 0.00 C ATOM 1405 CG ARG A 87 -0.431 -17.513 -6.462 1.00 0.00 C ATOM 1406 CD ARG A 87 -0.346 -19.019 -6.271 1.00 0.00 C ATOM 1407 NE ARG A 87 0.832 -19.588 -6.919 1.00 0.00 N ATOM 1408 CZ ARG A 87 1.117 -20.885 -6.920 1.00 0.00 C ATOM 1409 NH1 ARG A 87 0.311 -21.744 -6.311 1.00 0.00 N ATOM 1410 NH2 ARG A 87 2.208 -21.326 -7.531 1.00 0.00 N ATOM 0 H ARG A 87 2.044 -15.564 -3.947 1.00 0.00 H new ATOM 0 HA ARG A 87 2.244 -17.659 -5.959 1.00 0.00 H new ATOM 0 HB2 ARG A 87 0.243 -17.277 -4.446 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -0.042 -15.767 -5.289 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -1.474 -17.198 -6.420 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -0.058 -17.249 -7.452 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -0.320 -19.248 -5.206 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -1.244 -19.487 -6.676 1.00 0.00 H new ATOM 0 HE ARG A 87 1.472 -18.954 -7.398 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -0.530 -21.409 -5.841 1.00 0.00 H new ATOM 0 HH12 ARG A 87 0.532 -22.740 -6.313 1.00 0.00 H new ATOM 0 HH21 ARG A 87 2.830 -20.669 -8.001 1.00 0.00 H new ATOM 0 HH22 ARG A 87 2.425 -22.323 -7.531 1.00 0.00 H new ATOM 1424 N GLY A 88 2.389 -14.498 -6.670 1.00 0.00 N ATOM 1425 CA GLY A 88 2.611 -13.551 -7.747 1.00 0.00 C ATOM 1426 C GLY A 88 1.468 -12.567 -7.900 1.00 0.00 C ATOM 1427 O GLY A 88 1.155 -12.136 -9.010 1.00 0.00 O ATOM 0 H GLY A 88 2.497 -14.113 -5.732 1.00 0.00 H new ATOM 0 HA2 GLY A 88 3.535 -13.004 -7.560 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.746 -14.094 -8.682 1.00 0.00 H new ATOM 1431 N LEU A 89 0.842 -12.212 -6.783 1.00 0.00 N ATOM 1432 CA LEU A 89 -0.274 -11.273 -6.797 1.00 0.00 C ATOM 1433 C LEU A 89 0.126 -9.940 -6.174 1.00 0.00 C ATOM 1434 O LEU A 89 1.249 -9.779 -5.694 1.00 0.00 O ATOM 1435 CB LEU A 89 -1.470 -11.862 -6.046 1.00 0.00 C ATOM 1436 CG LEU A 89 -2.447 -12.689 -6.882 1.00 0.00 C ATOM 1437 CD1 LEU A 89 -3.100 -11.825 -7.950 1.00 0.00 C ATOM 1438 CD2 LEU A 89 -1.736 -13.876 -7.514 1.00 0.00 C ATOM 0 H LEU A 89 1.088 -12.560 -5.857 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.555 -11.097 -7.835 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.093 -12.489 -5.238 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -2.022 -11.044 -5.583 1.00 0.00 H new ATOM 0 HG LEU A 89 -3.228 -13.068 -6.223 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -3.792 -12.431 -8.535 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -3.644 -11.009 -7.475 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.332 -11.415 -8.606 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.447 -14.453 -8.105 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -0.934 -13.518 -8.159 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -1.317 -14.508 -6.731 1.00 0.00 H new ATOM 1450 N LYS A 90 -0.799 -8.987 -6.184 1.00 0.00 N ATOM 1451 CA LYS A 90 -0.545 -7.668 -5.616 1.00 0.00 C ATOM 1452 C LYS A 90 -1.487 -7.386 -4.451 1.00 0.00 C ATOM 1453 O LYS A 90 -2.658 -7.765 -4.480 1.00 0.00 O ATOM 1454 CB LYS A 90 -0.707 -6.589 -6.689 1.00 0.00 C ATOM 1455 CG LYS A 90 -0.178 -5.228 -6.269 1.00 0.00 C ATOM 1456 CD LYS A 90 -0.928 -4.101 -6.958 1.00 0.00 C ATOM 1457 CE LYS A 90 -0.689 -2.768 -6.266 1.00 0.00 C ATOM 1458 NZ LYS A 90 -1.467 -2.651 -5.002 1.00 0.00 N ATOM 0 H LYS A 90 -1.732 -9.103 -6.579 1.00 0.00 H new ATOM 0 HA LYS A 90 0.479 -7.652 -5.244 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -0.189 -6.907 -7.593 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.763 -6.496 -6.943 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -0.269 -5.119 -5.188 1.00 0.00 H new ATOM 0 HG3 LYS A 90 0.883 -5.160 -6.508 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.611 -4.034 -7.999 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.995 -4.323 -6.964 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.374 -2.657 -6.050 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -0.964 -1.955 -6.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.866 -2.237 -4.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.294 -2.040 -5.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.785 -3.594 -4.702 1.00 0.00 H new ATOM 1472 N VAL A 91 -0.969 -6.717 -3.425 1.00 0.00 N ATOM 1473 CA VAL A 91 -1.765 -6.382 -2.250 1.00 0.00 C ATOM 1474 C VAL A 91 -2.932 -5.472 -2.618 1.00 0.00 C ATOM 1475 O VAL A 91 -2.746 -4.435 -3.256 1.00 0.00 O ATOM 1476 CB VAL A 91 -0.910 -5.692 -1.171 1.00 0.00 C ATOM 1477 CG1 VAL A 91 -0.244 -4.446 -1.734 1.00 0.00 C ATOM 1478 CG2 VAL A 91 -1.760 -5.350 0.043 1.00 0.00 C ATOM 0 H VAL A 91 -0.002 -6.396 -3.384 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.151 -7.320 -1.851 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.127 -6.382 -0.855 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.356 -3.972 -0.957 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.398 -4.723 -2.570 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.008 -3.749 -2.079 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.140 -4.863 0.796 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -2.565 -4.678 -0.254 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -2.185 -6.264 0.459 1.00 0.00 H new ATOM 1488 N ASP A 92 -4.133 -5.866 -2.211 1.00 0.00 N ATOM 1489 CA ASP A 92 -5.331 -5.085 -2.497 1.00 0.00 C ATOM 1490 C ASP A 92 -5.974 -4.585 -1.206 1.00 0.00 C ATOM 1491 O ASP A 92 -7.199 -4.548 -1.084 1.00 0.00 O ATOM 1492 CB ASP A 92 -6.335 -5.922 -3.290 1.00 0.00 C ATOM 1493 CG ASP A 92 -6.598 -7.271 -2.650 1.00 0.00 C ATOM 1494 OD1 ASP A 92 -7.660 -7.428 -2.010 1.00 0.00 O ATOM 1495 OD2 ASP A 92 -5.743 -8.170 -2.788 1.00 0.00 O ATOM 0 H ASP A 92 -4.303 -6.721 -1.682 1.00 0.00 H new ATOM 0 HA ASP A 92 -5.038 -4.222 -3.095 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -7.274 -5.374 -3.375 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -5.960 -6.071 -4.303 1.00 0.00 H new ATOM 1500 N LEU A 93 -5.140 -4.202 -0.246 1.00 0.00 N ATOM 1501 CA LEU A 93 -5.626 -3.704 1.036 1.00 0.00 C ATOM 1502 C LEU A 93 -5.780 -2.187 1.009 1.00 0.00 C ATOM 1503 O LEU A 93 -5.191 -1.494 0.179 1.00 0.00 O ATOM 1504 CB LEU A 93 -4.671 -4.112 2.159 1.00 0.00 C ATOM 1505 CG LEU A 93 -4.901 -5.497 2.766 1.00 0.00 C ATOM 1506 CD1 LEU A 93 -3.583 -6.244 2.906 1.00 0.00 C ATOM 1507 CD2 LEU A 93 -5.595 -5.379 4.115 1.00 0.00 C ATOM 0 H LEU A 93 -4.124 -4.227 -0.331 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.605 -4.146 1.222 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.652 -4.070 1.775 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -4.742 -3.372 2.956 1.00 0.00 H new ATOM 0 HG LEU A 93 -5.547 -6.064 2.096 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -3.766 -7.227 3.340 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -3.125 -6.360 1.924 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.913 -5.681 3.555 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -5.751 -6.374 4.532 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -4.974 -4.794 4.794 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.558 -4.885 3.987 1.00 0.00 H new ATOM 1519 N PRO A 94 -6.587 -1.657 1.940 1.00 0.00 N ATOM 1520 CA PRO A 94 -6.834 -0.216 2.046 1.00 0.00 C ATOM 1521 C PRO A 94 -5.608 0.548 2.534 1.00 0.00 C ATOM 1522 O PRO A 94 -4.779 0.985 1.735 1.00 0.00 O ATOM 1523 CB PRO A 94 -7.965 -0.125 3.073 1.00 0.00 C ATOM 1524 CG PRO A 94 -7.832 -1.361 3.894 1.00 0.00 C ATOM 1525 CD PRO A 94 -7.320 -2.424 2.961 1.00 0.00 C ATOM 0 HA PRO A 94 -7.079 0.228 1.081 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -7.871 0.770 3.687 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -8.939 -0.076 2.586 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -7.143 -1.206 4.724 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -8.791 -1.649 4.325 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -6.670 -3.131 3.476 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -8.135 -3.000 2.523 1.00 0.00 H new TER 1533 PRO A 94