USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 776 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 3 THR OG1 : rot 63:sc= 0.519 USER MOD Single : A 7 SER OG : rot 180:sc= -0.167 USER MOD Single : A 9 SER OG : rot 180:sc= -0.018 USER MOD Single : A 18 CYS SG : rot 180:sc= -0.0249 USER MOD Single : A 19 GLN : amide:sc= -0.119 K(o=-0.12,f=-1) USER MOD Single : A 23 SER OG : rot -130:sc= -1.01 USER MOD Single : A 25 SER OG : rot 180:sc= -0.0255 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= 0.948 K(o=0.95,f=-0.03) USER MOD Single : A 33 SER OG : rot -128:sc= 0.338 USER MOD Single : A 35 MET CE :methyl -161:sc= -0.779 (180deg=-2.83) USER MOD Single : A 36 SER OG : rot 170:sc= -0.296 USER MOD Single : A 37 LYS NZ :NH3+ 167:sc=-0.00329 (180deg=-0.0721) USER MOD Single : A 38 LYS NZ :NH3+ 142:sc= -0.992 (180deg=-1.4) USER MOD Single : A 39 SER OG : rot 49:sc= 1.22 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -37:sc= 0.186 USER MOD Single : A 42 GLN : amide:sc= -5.7! K(o=-5.7!,f=-1.5) USER MOD Single : A 44 LYS NZ :NH3+ 152:sc= -0.516 (180deg=-1.53) USER MOD Single : A 52 ASN : amide:sc= -0.375 X(o=-0.37,f=-0.33) USER MOD Single : A 54 GLN : amide:sc= -0.683 X(o=-0.68,f=-1.1) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 145:sc= -0.0773 (180deg=-0.646) USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.621 X(o=-0.62,f=-1) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.395 USER MOD Single : A 80 SER OG : rot 170:sc= 0 USER MOD Single : A 82 THR OG1 : rot -97:sc= 0.605 USER MOD Single : A 83 LYS NZ :NH3+ -159:sc= -0.0467 (180deg=-0.314) USER MOD Single : A 84 THR OG1 : rot -45:sc= 0.754 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -3.59 K(o=-3.6,f=-1.2) USER MOD Single : A 105 MET CE :methyl 177:sc= -3.07! (180deg=-3.14!) USER MOD Single : A 107 GLN : amide:sc= -5.46! C(o=-5.5!,f=-5.8!) USER MOD Single : A 108 SER OG : rot 43:sc= 0.0195 USER MOD ----------------------------------------------------------------- ATOM 31 N THR A 3 1.318 -4.641 -1.771 1.00 0.00 N ATOM 32 CA THR A 3 0.167 -5.527 -1.652 1.00 0.00 C ATOM 33 C THR A 3 -1.077 -4.758 -1.223 1.00 0.00 C ATOM 34 O THR A 3 -1.784 -5.166 -0.302 1.00 0.00 O ATOM 35 CB THR A 3 0.431 -6.658 -0.640 1.00 0.00 C ATOM 36 OG1 THR A 3 0.406 -6.138 0.694 1.00 0.00 O ATOM 37 CG2 THR A 3 1.774 -7.320 -0.907 1.00 0.00 C ATOM 0 HA THR A 3 0.000 -5.962 -2.637 1.00 0.00 H new ATOM 0 HB THR A 3 -0.354 -7.406 -0.752 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.487 -5.787 0.892 1.00 0.00 H new ATOM 0 HG21 THR A 3 1.939 -8.115 -0.180 1.00 0.00 H new ATOM 0 HG22 THR A 3 1.779 -7.741 -1.913 1.00 0.00 H new ATOM 0 HG23 THR A 3 2.569 -6.579 -0.820 1.00 0.00 H new ATOM 45 N ASP A 4 -1.339 -3.643 -1.897 1.00 0.00 N ATOM 46 CA ASP A 4 -2.500 -2.817 -1.586 1.00 0.00 C ATOM 47 C ASP A 4 -3.774 -3.434 -2.154 1.00 0.00 C ATOM 48 O ASP A 4 -4.599 -3.970 -1.413 1.00 0.00 O ATOM 49 CB ASP A 4 -2.311 -1.405 -2.143 1.00 0.00 C ATOM 50 CG ASP A 4 -3.526 -0.527 -1.919 1.00 0.00 C ATOM 51 OD1 ASP A 4 -4.336 -0.852 -1.026 1.00 0.00 O ATOM 52 OD2 ASP A 4 -3.668 0.485 -2.637 1.00 0.00 O ATOM 0 H ASP A 4 -0.763 -3.291 -2.662 1.00 0.00 H new ATOM 0 HA ASP A 4 -2.596 -2.762 -0.502 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -1.442 -0.945 -1.672 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -2.101 -1.464 -3.211 1.00 0.00 H new ATOM 57 N ILE A 5 -3.928 -3.355 -3.471 1.00 0.00 N ATOM 58 CA ILE A 5 -5.102 -3.906 -4.137 1.00 0.00 C ATOM 59 C ILE A 5 -5.281 -5.383 -3.802 1.00 0.00 C ATOM 60 O ILE A 5 -6.390 -5.916 -3.867 1.00 0.00 O ATOM 61 CB ILE A 5 -5.008 -3.746 -5.666 1.00 0.00 C ATOM 62 CG1 ILE A 5 -6.405 -3.590 -6.270 1.00 0.00 C ATOM 63 CG2 ILE A 5 -4.290 -4.938 -6.281 1.00 0.00 C ATOM 64 CD1 ILE A 5 -6.636 -2.244 -6.920 1.00 0.00 C ATOM 0 H ILE A 5 -3.255 -2.915 -4.098 1.00 0.00 H new ATOM 0 HA ILE A 5 -5.964 -3.346 -3.773 1.00 0.00 H new ATOM 0 HB ILE A 5 -4.433 -2.847 -5.888 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -6.561 -4.374 -7.011 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.149 -3.739 -5.487 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -4.232 -4.810 -7.362 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -3.283 -5.008 -5.869 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -4.840 -5.851 -6.053 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.647 -2.205 -7.326 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.512 -1.455 -6.178 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.915 -2.100 -7.725 1.00 0.00 H new ATOM 76 N LEU A 6 -4.184 -6.039 -3.441 1.00 0.00 N ATOM 77 CA LEU A 6 -4.219 -7.456 -3.093 1.00 0.00 C ATOM 78 C LEU A 6 -3.772 -7.673 -1.651 1.00 0.00 C ATOM 79 O LEU A 6 -3.703 -6.730 -0.863 1.00 0.00 O ATOM 80 CB LEU A 6 -3.326 -8.257 -4.042 1.00 0.00 C ATOM 81 CG LEU A 6 -3.991 -9.435 -4.754 1.00 0.00 C ATOM 82 CD1 LEU A 6 -4.978 -8.940 -5.799 1.00 0.00 C ATOM 83 CD2 LEU A 6 -2.941 -10.333 -5.393 1.00 0.00 C ATOM 0 H LEU A 6 -3.259 -5.613 -3.381 1.00 0.00 H new ATOM 0 HA LEU A 6 -5.247 -7.804 -3.192 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -2.931 -7.578 -4.797 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -2.474 -8.634 -3.476 1.00 0.00 H new ATOM 0 HG LEU A 6 -4.539 -10.019 -4.015 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -5.441 -9.793 -6.295 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -5.748 -8.339 -5.316 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -4.453 -8.333 -6.536 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -3.432 -11.166 -5.895 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -2.365 -9.760 -6.120 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -2.273 -10.717 -4.622 1.00 0.00 H new ATOM 95 N SER A 7 -3.469 -8.922 -1.313 1.00 0.00 N ATOM 96 CA SER A 7 -3.030 -9.264 0.035 1.00 0.00 C ATOM 97 C SER A 7 -1.640 -9.893 0.010 1.00 0.00 C ATOM 98 O SER A 7 -1.302 -10.679 -0.875 1.00 0.00 O ATOM 99 CB SER A 7 -4.025 -10.224 0.690 1.00 0.00 C ATOM 100 OG SER A 7 -4.251 -9.878 2.045 1.00 0.00 O ATOM 0 H SER A 7 -3.519 -9.714 -1.954 1.00 0.00 H new ATOM 0 HA SER A 7 -2.984 -8.345 0.620 1.00 0.00 H new ATOM 0 HB2 SER A 7 -4.968 -10.203 0.144 1.00 0.00 H new ATOM 0 HB3 SER A 7 -3.644 -11.244 0.630 1.00 0.00 H new ATOM 0 HG SER A 7 -4.892 -10.505 2.440 1.00 0.00 H new ATOM 106 N PRO A 8 -0.814 -9.540 1.006 1.00 0.00 N ATOM 107 CA PRO A 8 0.552 -10.058 1.123 1.00 0.00 C ATOM 108 C PRO A 8 0.582 -11.537 1.491 1.00 0.00 C ATOM 109 O PRO A 8 1.611 -12.199 1.357 1.00 0.00 O ATOM 110 CB PRO A 8 1.157 -9.214 2.248 1.00 0.00 C ATOM 111 CG PRO A 8 -0.011 -8.777 3.063 1.00 0.00 C ATOM 112 CD PRO A 8 -1.151 -8.608 2.096 1.00 0.00 C ATOM 0 HA PRO A 8 1.096 -9.989 0.181 1.00 0.00 H new ATOM 0 HB2 PRO A 8 1.861 -9.795 2.844 1.00 0.00 H new ATOM 0 HB3 PRO A 8 1.705 -8.359 1.851 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -0.253 -9.517 3.826 1.00 0.00 H new ATOM 0 HG3 PRO A 8 0.203 -7.842 3.581 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.108 -8.856 2.555 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -1.226 -7.581 1.738 1.00 0.00 H new ATOM 120 N SER A 9 -0.553 -12.050 1.955 1.00 0.00 N ATOM 121 CA SER A 9 -0.655 -13.451 2.346 1.00 0.00 C ATOM 122 C SER A 9 -1.189 -14.298 1.196 1.00 0.00 C ATOM 123 O SER A 9 -1.765 -15.365 1.411 1.00 0.00 O ATOM 124 CB SER A 9 -1.566 -13.596 3.567 1.00 0.00 C ATOM 125 OG SER A 9 -2.928 -13.664 3.182 1.00 0.00 O ATOM 0 H SER A 9 -1.415 -11.516 2.069 1.00 0.00 H new ATOM 0 HA SER A 9 0.344 -13.805 2.602 1.00 0.00 H new ATOM 0 HB2 SER A 9 -1.296 -14.495 4.121 1.00 0.00 H new ATOM 0 HB3 SER A 9 -1.416 -12.751 4.239 1.00 0.00 H new ATOM 0 HG SER A 9 -3.489 -13.758 3.980 1.00 0.00 H new ATOM 131 N ASP A 10 -0.994 -13.815 -0.026 1.00 0.00 N ATOM 132 CA ASP A 10 -1.454 -14.528 -1.213 1.00 0.00 C ATOM 133 C ASP A 10 -0.322 -14.690 -2.223 1.00 0.00 C ATOM 134 O ASP A 10 -0.236 -15.704 -2.916 1.00 0.00 O ATOM 135 CB ASP A 10 -2.627 -13.786 -1.857 1.00 0.00 C ATOM 136 CG ASP A 10 -3.700 -13.416 -0.852 1.00 0.00 C ATOM 137 OD1 ASP A 10 -3.784 -14.085 0.200 1.00 0.00 O ATOM 138 OD2 ASP A 10 -4.454 -12.457 -1.116 1.00 0.00 O ATOM 0 H ASP A 10 -0.521 -12.933 -0.221 1.00 0.00 H new ATOM 0 HA ASP A 10 -1.786 -15.519 -0.905 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -2.259 -12.881 -2.341 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -3.063 -14.410 -2.637 1.00 0.00 H new ATOM 143 N ILE A 11 0.542 -13.684 -2.301 1.00 0.00 N ATOM 144 CA ILE A 11 1.668 -13.715 -3.226 1.00 0.00 C ATOM 145 C ILE A 11 2.728 -14.712 -2.769 1.00 0.00 C ATOM 146 O ILE A 11 3.519 -15.204 -3.572 1.00 0.00 O ATOM 147 CB ILE A 11 2.316 -12.326 -3.372 1.00 0.00 C ATOM 148 CG1 ILE A 11 1.297 -11.317 -3.905 1.00 0.00 C ATOM 149 CG2 ILE A 11 3.527 -12.399 -4.290 1.00 0.00 C ATOM 150 CD1 ILE A 11 0.877 -10.284 -2.883 1.00 0.00 C ATOM 0 H ILE A 11 0.484 -12.837 -1.735 1.00 0.00 H new ATOM 0 HA ILE A 11 1.273 -14.026 -4.193 1.00 0.00 H new ATOM 0 HB ILE A 11 2.650 -11.993 -2.389 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.721 -10.808 -4.771 1.00 0.00 H new ATOM 0 HG13 ILE A 11 0.414 -11.854 -4.251 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.974 -11.409 -4.383 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.259 -13.090 -3.872 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.217 -12.751 -5.274 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.154 -9.602 -3.331 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.423 -10.783 -2.027 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.751 -9.721 -2.554 1.00 0.00 H new ATOM 162 N ALA A 12 2.734 -15.007 -1.473 1.00 0.00 N ATOM 163 CA ALA A 12 3.694 -15.949 -0.909 1.00 0.00 C ATOM 164 C ALA A 12 3.331 -17.385 -1.272 1.00 0.00 C ATOM 165 O ALA A 12 4.193 -18.263 -1.306 1.00 0.00 O ATOM 166 CB ALA A 12 3.767 -15.787 0.602 1.00 0.00 C ATOM 0 H ALA A 12 2.086 -14.608 -0.794 1.00 0.00 H new ATOM 0 HA ALA A 12 4.673 -15.730 -1.334 1.00 0.00 H new ATOM 0 HB1 ALA A 12 4.487 -16.496 1.010 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.081 -14.772 0.844 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.785 -15.977 1.036 1.00 0.00 H new ATOM 172 N ALA A 13 2.051 -17.617 -1.542 1.00 0.00 N ATOM 173 CA ALA A 13 1.575 -18.947 -1.904 1.00 0.00 C ATOM 174 C ALA A 13 2.252 -19.445 -3.176 1.00 0.00 C ATOM 175 O ALA A 13 2.255 -20.642 -3.461 1.00 0.00 O ATOM 176 CB ALA A 13 0.064 -18.938 -2.076 1.00 0.00 C ATOM 0 H ALA A 13 1.325 -16.901 -1.517 1.00 0.00 H new ATOM 0 HA ALA A 13 1.833 -19.631 -1.095 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -0.277 -19.937 -2.346 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.407 -18.634 -1.141 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -0.208 -18.236 -2.864 1.00 0.00 H new ATOM 182 N ALA A 14 2.824 -18.518 -3.939 1.00 0.00 N ATOM 183 CA ALA A 14 3.504 -18.863 -5.180 1.00 0.00 C ATOM 184 C ALA A 14 5.013 -18.688 -5.046 1.00 0.00 C ATOM 185 O ALA A 14 5.790 -19.375 -5.712 1.00 0.00 O ATOM 186 CB ALA A 14 2.973 -18.016 -6.327 1.00 0.00 C ATOM 0 H ALA A 14 2.829 -17.522 -3.718 1.00 0.00 H new ATOM 0 HA ALA A 14 3.303 -19.913 -5.395 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.491 -18.285 -7.248 1.00 0.00 H new ATOM 0 HB2 ALA A 14 1.904 -18.194 -6.446 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.143 -16.962 -6.110 1.00 0.00 H new ATOM 192 N LEU A 15 5.423 -17.766 -4.182 1.00 0.00 N ATOM 193 CA LEU A 15 6.840 -17.500 -3.961 1.00 0.00 C ATOM 194 C LEU A 15 7.503 -18.660 -3.224 1.00 0.00 C ATOM 195 O LEU A 15 8.728 -18.778 -3.208 1.00 0.00 O ATOM 196 CB LEU A 15 7.018 -16.207 -3.165 1.00 0.00 C ATOM 197 CG LEU A 15 6.733 -14.908 -3.921 1.00 0.00 C ATOM 198 CD1 LEU A 15 6.918 -13.707 -3.007 1.00 0.00 C ATOM 199 CD2 LEU A 15 7.632 -14.795 -5.143 1.00 0.00 C ATOM 0 H LEU A 15 4.794 -17.190 -3.623 1.00 0.00 H new ATOM 0 HA LEU A 15 7.320 -17.390 -4.933 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.364 -16.248 -2.294 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.042 -16.171 -2.794 1.00 0.00 H new ATOM 0 HG LEU A 15 5.696 -14.925 -4.258 1.00 0.00 H new ATOM 0 HD11 LEU A 15 6.711 -12.792 -3.562 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.232 -13.783 -2.163 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.944 -13.684 -2.639 1.00 0.00 H new ATOM 0 HD21 LEU A 15 7.416 -13.865 -5.669 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.676 -14.800 -4.829 1.00 0.00 H new ATOM 0 HD23 LEU A 15 7.450 -15.639 -5.808 1.00 0.00 H new ATOM 211 N ARG A 16 6.685 -19.514 -2.618 1.00 0.00 N ATOM 212 CA ARG A 16 7.192 -20.665 -1.881 1.00 0.00 C ATOM 213 C ARG A 16 6.802 -21.968 -2.572 1.00 0.00 C ATOM 214 O ARG A 16 7.439 -23.003 -2.373 1.00 0.00 O ATOM 215 CB ARG A 16 6.657 -20.655 -0.448 1.00 0.00 C ATOM 216 CG ARG A 16 7.377 -21.623 0.478 1.00 0.00 C ATOM 217 CD ARG A 16 6.652 -22.957 0.562 1.00 0.00 C ATOM 218 NE ARG A 16 5.641 -22.965 1.615 1.00 0.00 N ATOM 219 CZ ARG A 16 4.731 -23.923 1.753 1.00 0.00 C ATOM 220 NH1 ARG A 16 4.708 -24.946 0.910 1.00 0.00 N ATOM 221 NH2 ARG A 16 3.844 -23.860 2.737 1.00 0.00 N ATOM 0 H ARG A 16 5.668 -19.431 -2.623 1.00 0.00 H new ATOM 0 HA ARG A 16 8.280 -20.599 -1.856 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.744 -19.646 -0.044 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.595 -20.902 -0.464 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.394 -21.782 0.120 1.00 0.00 H new ATOM 0 HG3 ARG A 16 7.454 -21.186 1.474 1.00 0.00 H new ATOM 0 HD2 ARG A 16 6.179 -23.174 -0.396 1.00 0.00 H new ATOM 0 HD3 ARG A 16 7.375 -23.751 0.748 1.00 0.00 H new ATOM 0 HE ARG A 16 5.633 -22.193 2.281 1.00 0.00 H new ATOM 0 HH11 ARG A 16 5.390 -24.999 0.153 1.00 0.00 H new ATOM 0 HH12 ARG A 16 4.008 -25.680 1.018 1.00 0.00 H new ATOM 0 HH21 ARG A 16 3.860 -23.075 3.389 1.00 0.00 H new ATOM 0 HH22 ARG A 16 3.146 -24.596 2.842 1.00 0.00 H new ATOM 235 N ASP A 17 5.751 -21.910 -3.383 1.00 0.00 N ATOM 236 CA ASP A 17 5.276 -23.085 -4.104 1.00 0.00 C ATOM 237 C ASP A 17 5.906 -23.163 -5.491 1.00 0.00 C ATOM 238 O ASP A 17 5.925 -24.224 -6.116 1.00 0.00 O ATOM 239 CB ASP A 17 3.752 -23.055 -4.223 1.00 0.00 C ATOM 240 CG ASP A 17 3.180 -24.383 -4.678 1.00 0.00 C ATOM 241 OD1 ASP A 17 3.228 -25.350 -3.889 1.00 0.00 O ATOM 242 OD2 ASP A 17 2.685 -24.456 -5.822 1.00 0.00 O ATOM 0 H ASP A 17 5.212 -21.062 -3.557 1.00 0.00 H new ATOM 0 HA ASP A 17 5.571 -23.970 -3.541 1.00 0.00 H new ATOM 0 HB2 ASP A 17 3.320 -22.788 -3.258 1.00 0.00 H new ATOM 0 HB3 ASP A 17 3.461 -22.277 -4.928 1.00 0.00 H new ATOM 247 N CYS A 18 6.419 -22.034 -5.966 1.00 0.00 N ATOM 248 CA CYS A 18 7.048 -21.974 -7.281 1.00 0.00 C ATOM 249 C CYS A 18 8.541 -21.689 -7.157 1.00 0.00 C ATOM 250 O CYS A 18 9.165 -21.180 -8.088 1.00 0.00 O ATOM 251 CB CYS A 18 6.381 -20.898 -8.139 1.00 0.00 C ATOM 252 SG CYS A 18 4.575 -20.972 -8.145 1.00 0.00 S ATOM 0 H CYS A 18 6.412 -21.148 -5.461 1.00 0.00 H new ATOM 0 HA CYS A 18 6.920 -22.944 -7.762 1.00 0.00 H new ATOM 0 HB2 CYS A 18 6.692 -19.917 -7.779 1.00 0.00 H new ATOM 0 HB3 CYS A 18 6.741 -20.991 -9.164 1.00 0.00 H new ATOM 0 HG CYS A 18 4.104 -20.021 -8.896 1.00 0.00 H new ATOM 258 N GLN A 19 9.107 -22.019 -6.000 1.00 0.00 N ATOM 259 CA GLN A 19 10.527 -21.797 -5.754 1.00 0.00 C ATOM 260 C GLN A 19 11.380 -22.556 -6.764 1.00 0.00 C ATOM 261 O GLN A 19 12.527 -22.190 -7.023 1.00 0.00 O ATOM 262 CB GLN A 19 10.893 -22.228 -4.333 1.00 0.00 C ATOM 263 CG GLN A 19 10.811 -21.102 -3.315 1.00 0.00 C ATOM 264 CD GLN A 19 11.393 -21.487 -1.969 1.00 0.00 C ATOM 265 OE1 GLN A 19 12.307 -22.308 -1.887 1.00 0.00 O ATOM 266 NE2 GLN A 19 10.865 -20.896 -0.904 1.00 0.00 N ATOM 0 H GLN A 19 8.604 -22.441 -5.219 1.00 0.00 H new ATOM 0 HA GLN A 19 10.727 -20.731 -5.866 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.228 -23.035 -4.024 1.00 0.00 H new ATOM 0 HB3 GLN A 19 11.905 -22.632 -4.334 1.00 0.00 H new ATOM 0 HG2 GLN A 19 11.341 -20.231 -3.700 1.00 0.00 H new ATOM 0 HG3 GLN A 19 9.769 -20.810 -3.186 1.00 0.00 H new ATOM 0 HE21 GLN A 19 10.109 -20.221 -1.018 1.00 0.00 H new ATOM 0 HE22 GLN A 19 11.216 -21.117 0.028 1.00 0.00 H new ATOM 275 N ALA A 20 10.814 -23.616 -7.332 1.00 0.00 N ATOM 276 CA ALA A 20 11.522 -24.426 -8.315 1.00 0.00 C ATOM 277 C ALA A 20 11.935 -23.589 -9.521 1.00 0.00 C ATOM 278 O ALA A 20 11.399 -22.509 -9.771 1.00 0.00 O ATOM 279 CB ALA A 20 10.658 -25.598 -8.755 1.00 0.00 C ATOM 0 H ALA A 20 9.866 -23.934 -7.128 1.00 0.00 H new ATOM 0 HA ALA A 20 12.427 -24.812 -7.846 1.00 0.00 H new ATOM 0 HB1 ALA A 20 11.200 -26.194 -9.489 1.00 0.00 H new ATOM 0 HB2 ALA A 20 10.418 -26.217 -7.891 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.736 -25.224 -9.201 1.00 0.00 H new ATOM 285 N PRO A 21 12.912 -24.096 -10.287 1.00 0.00 N ATOM 286 CA PRO A 21 13.419 -23.411 -11.480 1.00 0.00 C ATOM 287 C PRO A 21 12.402 -23.395 -12.616 1.00 0.00 C ATOM 288 O PRO A 21 11.798 -24.419 -12.935 1.00 0.00 O ATOM 289 CB PRO A 21 14.645 -24.239 -11.871 1.00 0.00 C ATOM 290 CG PRO A 21 14.379 -25.596 -11.315 1.00 0.00 C ATOM 291 CD PRO A 21 13.597 -25.378 -10.049 1.00 0.00 C ATOM 0 HA PRO A 21 13.641 -22.362 -11.284 1.00 0.00 H new ATOM 0 HB2 PRO A 21 14.771 -24.272 -12.953 1.00 0.00 H new ATOM 0 HB3 PRO A 21 15.559 -23.813 -11.456 1.00 0.00 H new ATOM 0 HG2 PRO A 21 13.815 -26.204 -12.022 1.00 0.00 H new ATOM 0 HG3 PRO A 21 15.311 -26.124 -11.112 1.00 0.00 H new ATOM 0 HD2 PRO A 21 12.887 -26.186 -9.871 1.00 0.00 H new ATOM 0 HD3 PRO A 21 14.249 -25.329 -9.177 1.00 0.00 H new ATOM 299 N ASP A 22 12.218 -22.228 -13.223 1.00 0.00 N ATOM 300 CA ASP A 22 11.275 -22.080 -14.325 1.00 0.00 C ATOM 301 C ASP A 22 9.870 -22.495 -13.898 1.00 0.00 C ATOM 302 O ASP A 22 9.040 -22.858 -14.730 1.00 0.00 O ATOM 303 CB ASP A 22 11.724 -22.916 -15.525 1.00 0.00 C ATOM 304 CG ASP A 22 10.958 -22.573 -16.788 1.00 0.00 C ATOM 305 OD1 ASP A 22 10.265 -21.535 -16.799 1.00 0.00 O ATOM 306 OD2 ASP A 22 11.053 -23.344 -17.766 1.00 0.00 O ATOM 0 H ASP A 22 12.709 -21.371 -12.970 1.00 0.00 H new ATOM 0 HA ASP A 22 11.253 -21.029 -14.612 1.00 0.00 H new ATOM 0 HB2 ASP A 22 12.789 -22.759 -15.695 1.00 0.00 H new ATOM 0 HB3 ASP A 22 11.590 -23.974 -15.298 1.00 0.00 H new ATOM 311 N SER A 23 9.613 -22.439 -12.595 1.00 0.00 N ATOM 312 CA SER A 23 8.311 -22.814 -12.057 1.00 0.00 C ATOM 313 C SER A 23 7.488 -21.576 -11.714 1.00 0.00 C ATOM 314 O SER A 23 6.257 -21.617 -11.707 1.00 0.00 O ATOM 315 CB SER A 23 8.482 -23.686 -10.812 1.00 0.00 C ATOM 316 OG SER A 23 8.762 -25.030 -11.165 1.00 0.00 O ATOM 0 H SER A 23 10.289 -22.138 -11.893 1.00 0.00 H new ATOM 0 HA SER A 23 7.780 -23.383 -12.821 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.291 -23.292 -10.197 1.00 0.00 H new ATOM 0 HB3 SER A 23 7.575 -23.647 -10.209 1.00 0.00 H new ATOM 0 HG SER A 23 8.161 -25.629 -10.675 1.00 0.00 H new ATOM 322 N PHE A 24 8.176 -20.475 -11.431 1.00 0.00 N ATOM 323 CA PHE A 24 7.511 -19.224 -11.086 1.00 0.00 C ATOM 324 C PHE A 24 7.364 -18.330 -12.314 1.00 0.00 C ATOM 325 O PHE A 24 8.339 -18.052 -13.013 1.00 0.00 O ATOM 326 CB PHE A 24 8.293 -18.489 -9.996 1.00 0.00 C ATOM 327 CG PHE A 24 7.799 -17.094 -9.741 1.00 0.00 C ATOM 328 CD1 PHE A 24 6.803 -16.857 -8.808 1.00 0.00 C ATOM 329 CD2 PHE A 24 8.330 -16.019 -10.436 1.00 0.00 C ATOM 330 CE1 PHE A 24 6.346 -15.574 -8.571 1.00 0.00 C ATOM 331 CE2 PHE A 24 7.878 -14.734 -10.203 1.00 0.00 C ATOM 332 CZ PHE A 24 6.883 -14.511 -9.270 1.00 0.00 C ATOM 0 H PHE A 24 9.195 -20.424 -11.434 1.00 0.00 H new ATOM 0 HA PHE A 24 6.516 -19.462 -10.710 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.235 -19.061 -9.070 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.345 -18.447 -10.280 1.00 0.00 H new ATOM 0 HD1 PHE A 24 6.378 -17.685 -8.259 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.106 -16.187 -11.168 1.00 0.00 H new ATOM 0 HE1 PHE A 24 5.570 -15.403 -7.840 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.302 -13.905 -10.750 1.00 0.00 H new ATOM 0 HZ PHE A 24 6.526 -13.508 -9.088 1.00 0.00 H new ATOM 342 N SER A 25 6.139 -17.884 -12.571 1.00 0.00 N ATOM 343 CA SER A 25 5.863 -17.024 -13.716 1.00 0.00 C ATOM 344 C SER A 25 4.770 -16.012 -13.385 1.00 0.00 C ATOM 345 O SER A 25 3.994 -16.183 -12.445 1.00 0.00 O ATOM 346 CB SER A 25 5.444 -17.867 -14.923 1.00 0.00 C ATOM 347 OG SER A 25 5.872 -19.210 -14.780 1.00 0.00 O ATOM 0 H SER A 25 5.322 -18.104 -12.002 1.00 0.00 H new ATOM 0 HA SER A 25 6.776 -16.480 -13.959 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.360 -17.837 -15.033 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.868 -17.442 -15.833 1.00 0.00 H new ATOM 0 HG SER A 25 5.591 -19.728 -15.563 1.00 0.00 H new ATOM 353 N PRO A 26 4.707 -14.931 -14.177 1.00 0.00 N ATOM 354 CA PRO A 26 3.714 -13.869 -13.989 1.00 0.00 C ATOM 355 C PRO A 26 2.302 -14.328 -14.337 1.00 0.00 C ATOM 356 O PRO A 26 1.332 -13.926 -13.695 1.00 0.00 O ATOM 357 CB PRO A 26 4.176 -12.777 -14.956 1.00 0.00 C ATOM 358 CG PRO A 26 4.941 -13.501 -16.009 1.00 0.00 C ATOM 359 CD PRO A 26 5.600 -14.662 -15.316 1.00 0.00 C ATOM 0 HA PRO A 26 3.658 -13.542 -12.951 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.328 -12.240 -15.381 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.799 -12.039 -14.451 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.280 -13.845 -16.805 1.00 0.00 H new ATOM 0 HG3 PRO A 26 5.683 -12.849 -16.470 1.00 0.00 H new ATOM 0 HD2 PRO A 26 5.684 -15.527 -15.974 1.00 0.00 H new ATOM 0 HD3 PRO A 26 6.609 -14.413 -14.986 1.00 0.00 H new ATOM 367 N LYS A 27 2.194 -15.172 -15.358 1.00 0.00 N ATOM 368 CA LYS A 27 0.901 -15.687 -15.791 1.00 0.00 C ATOM 369 C LYS A 27 0.588 -17.015 -15.109 1.00 0.00 C ATOM 370 O LYS A 27 -0.090 -17.872 -15.676 1.00 0.00 O ATOM 371 CB LYS A 27 0.884 -15.866 -17.311 1.00 0.00 C ATOM 372 CG LYS A 27 -0.515 -15.944 -17.898 1.00 0.00 C ATOM 373 CD LYS A 27 -0.534 -16.748 -19.188 1.00 0.00 C ATOM 374 CE LYS A 27 0.342 -16.110 -20.255 1.00 0.00 C ATOM 375 NZ LYS A 27 -0.002 -16.597 -21.619 1.00 0.00 N ATOM 0 H LYS A 27 2.987 -15.514 -15.901 1.00 0.00 H new ATOM 0 HA LYS A 27 0.136 -14.964 -15.507 1.00 0.00 H new ATOM 0 HB2 LYS A 27 1.417 -15.035 -17.772 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.428 -16.775 -17.568 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.190 -16.400 -17.174 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -0.887 -14.938 -18.090 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -0.188 -17.763 -18.991 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -1.558 -16.826 -19.555 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.229 -15.026 -20.217 1.00 0.00 H new ATOM 0 HE3 LYS A 27 1.389 -16.329 -20.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.617 -16.139 -22.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.130 -17.628 -21.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -0.994 -16.365 -21.831 1.00 0.00 H new ATOM 389 N LYS A 28 1.085 -17.179 -13.888 1.00 0.00 N ATOM 390 CA LYS A 28 0.857 -18.401 -13.126 1.00 0.00 C ATOM 391 C LYS A 28 0.465 -18.081 -11.688 1.00 0.00 C ATOM 392 O LYS A 28 -0.412 -18.726 -11.114 1.00 0.00 O ATOM 393 CB LYS A 28 2.112 -19.278 -13.141 1.00 0.00 C ATOM 394 CG LYS A 28 1.931 -20.610 -12.434 1.00 0.00 C ATOM 395 CD LYS A 28 1.270 -21.637 -13.339 1.00 0.00 C ATOM 396 CE LYS A 28 0.861 -22.880 -12.565 1.00 0.00 C ATOM 397 NZ LYS A 28 0.323 -23.940 -13.462 1.00 0.00 N ATOM 0 H LYS A 28 1.649 -16.480 -13.404 1.00 0.00 H new ATOM 0 HA LYS A 28 0.036 -18.944 -13.595 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.405 -19.462 -14.175 1.00 0.00 H new ATOM 0 HB3 LYS A 28 2.931 -18.734 -12.670 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.901 -20.984 -12.106 1.00 0.00 H new ATOM 0 HG3 LYS A 28 1.325 -20.469 -11.539 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.392 -21.196 -13.811 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.957 -21.915 -14.139 1.00 0.00 H new ATOM 0 HE2 LYS A 28 1.722 -23.268 -12.020 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.107 -22.615 -11.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 0.056 -24.771 -12.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.513 -23.579 -13.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.051 -24.212 -14.154 1.00 0.00 H new ATOM 411 N PHE A 29 1.120 -17.079 -11.110 1.00 0.00 N ATOM 412 CA PHE A 29 0.840 -16.672 -9.738 1.00 0.00 C ATOM 413 C PHE A 29 -0.395 -15.777 -9.678 1.00 0.00 C ATOM 414 O PHE A 29 -1.007 -15.615 -8.622 1.00 0.00 O ATOM 415 CB PHE A 29 2.044 -15.939 -9.144 1.00 0.00 C ATOM 416 CG PHE A 29 2.050 -14.465 -9.431 1.00 0.00 C ATOM 417 CD1 PHE A 29 2.296 -13.996 -10.712 1.00 0.00 C ATOM 418 CD2 PHE A 29 1.809 -13.548 -8.421 1.00 0.00 C ATOM 419 CE1 PHE A 29 2.303 -12.640 -10.978 1.00 0.00 C ATOM 420 CE2 PHE A 29 1.814 -12.191 -8.681 1.00 0.00 C ATOM 421 CZ PHE A 29 2.061 -11.736 -9.962 1.00 0.00 C ATOM 0 H PHE A 29 1.849 -16.534 -11.571 1.00 0.00 H new ATOM 0 HA PHE A 29 0.646 -17.570 -9.152 1.00 0.00 H new ATOM 0 HB2 PHE A 29 2.055 -16.091 -8.065 1.00 0.00 H new ATOM 0 HB3 PHE A 29 2.959 -16.381 -9.538 1.00 0.00 H new ATOM 0 HD1 PHE A 29 2.484 -14.698 -11.511 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.615 -13.898 -7.418 1.00 0.00 H new ATOM 0 HE1 PHE A 29 2.498 -12.287 -11.980 1.00 0.00 H new ATOM 0 HE2 PHE A 29 1.625 -11.487 -7.884 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.065 -10.676 -10.168 1.00 0.00 H new ATOM 431 N PHE A 30 -0.754 -15.198 -10.818 1.00 0.00 N ATOM 432 CA PHE A 30 -1.915 -14.318 -10.896 1.00 0.00 C ATOM 433 C PHE A 30 -3.166 -15.020 -10.377 1.00 0.00 C ATOM 434 O PHE A 30 -4.043 -14.390 -9.787 1.00 0.00 O ATOM 435 CB PHE A 30 -2.136 -13.857 -12.338 1.00 0.00 C ATOM 436 CG PHE A 30 -2.761 -14.906 -13.214 1.00 0.00 C ATOM 437 CD1 PHE A 30 -2.070 -16.065 -13.530 1.00 0.00 C ATOM 438 CD2 PHE A 30 -4.038 -14.732 -13.721 1.00 0.00 C ATOM 439 CE1 PHE A 30 -2.642 -17.032 -14.334 1.00 0.00 C ATOM 440 CE2 PHE A 30 -4.616 -15.696 -14.526 1.00 0.00 C ATOM 441 CZ PHE A 30 -3.917 -16.847 -14.834 1.00 0.00 C ATOM 0 H PHE A 30 -0.258 -15.322 -11.701 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.722 -13.447 -10.269 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -2.772 -12.972 -12.335 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -1.179 -13.560 -12.767 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -1.073 -16.214 -13.143 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -4.588 -13.833 -13.485 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -2.093 -17.931 -14.571 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -5.613 -15.549 -14.914 1.00 0.00 H new ATOM 0 HZ PHE A 30 -4.366 -17.601 -15.464 1.00 0.00 H new ATOM 451 N GLN A 31 -3.240 -16.328 -10.602 1.00 0.00 N ATOM 452 CA GLN A 31 -4.384 -17.116 -10.159 1.00 0.00 C ATOM 453 C GLN A 31 -4.232 -17.520 -8.696 1.00 0.00 C ATOM 454 O GLN A 31 -5.204 -17.904 -8.045 1.00 0.00 O ATOM 455 CB GLN A 31 -4.540 -18.363 -11.031 1.00 0.00 C ATOM 456 CG GLN A 31 -3.684 -19.534 -10.576 1.00 0.00 C ATOM 457 CD GLN A 31 -3.367 -20.497 -11.704 1.00 0.00 C ATOM 458 OE1 GLN A 31 -4.266 -21.007 -12.372 1.00 0.00 O ATOM 459 NE2 GLN A 31 -2.081 -20.750 -11.921 1.00 0.00 N ATOM 0 H GLN A 31 -2.521 -16.864 -11.088 1.00 0.00 H new ATOM 0 HA GLN A 31 -5.278 -16.500 -10.256 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -5.587 -18.667 -11.032 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -4.281 -18.112 -12.059 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -2.753 -19.156 -10.153 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.201 -20.070 -9.780 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -1.369 -20.305 -11.342 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -1.806 -21.390 -12.666 1.00 0.00 H new ATOM 468 N ILE A 32 -3.009 -17.430 -8.186 1.00 0.00 N ATOM 469 CA ILE A 32 -2.731 -17.785 -6.800 1.00 0.00 C ATOM 470 C ILE A 32 -2.917 -16.586 -5.877 1.00 0.00 C ATOM 471 O ILE A 32 -3.744 -16.613 -4.965 1.00 0.00 O ATOM 472 CB ILE A 32 -1.300 -18.329 -6.634 1.00 0.00 C ATOM 473 CG1 ILE A 32 -1.137 -19.640 -7.407 1.00 0.00 C ATOM 474 CG2 ILE A 32 -0.978 -18.533 -5.161 1.00 0.00 C ATOM 475 CD1 ILE A 32 0.242 -19.823 -8.002 1.00 0.00 C ATOM 0 H ILE A 32 -2.194 -17.114 -8.712 1.00 0.00 H new ATOM 0 HA ILE A 32 -3.441 -18.565 -6.526 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.600 -17.599 -7.041 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.350 -20.475 -6.739 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.877 -19.675 -8.207 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.037 -18.918 -5.060 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.059 -17.581 -4.636 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.681 -19.246 -4.730 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.285 -20.773 -8.535 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.450 -19.008 -8.695 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.985 -19.820 -7.205 1.00 0.00 H new ATOM 487 N SER A 33 -2.144 -15.532 -6.122 1.00 0.00 N ATOM 488 CA SER A 33 -2.221 -14.323 -5.311 1.00 0.00 C ATOM 489 C SER A 33 -3.624 -13.725 -5.360 1.00 0.00 C ATOM 490 O SER A 33 -4.337 -13.702 -4.357 1.00 0.00 O ATOM 491 CB SER A 33 -1.199 -13.293 -5.796 1.00 0.00 C ATOM 492 OG SER A 33 -1.355 -13.032 -7.180 1.00 0.00 O ATOM 0 H SER A 33 -1.458 -15.491 -6.875 1.00 0.00 H new ATOM 0 HA SER A 33 -1.995 -14.592 -4.279 1.00 0.00 H new ATOM 0 HB2 SER A 33 -1.316 -12.367 -5.233 1.00 0.00 H new ATOM 0 HB3 SER A 33 -0.190 -13.658 -5.603 1.00 0.00 H new ATOM 0 HG SER A 33 -0.492 -13.136 -7.632 1.00 0.00 H new ATOM 498 N GLY A 34 -4.015 -13.242 -6.536 1.00 0.00 N ATOM 499 CA GLY A 34 -5.331 -12.651 -6.695 1.00 0.00 C ATOM 500 C GLY A 34 -5.386 -11.659 -7.839 1.00 0.00 C ATOM 501 O GLY A 34 -6.107 -10.664 -7.772 1.00 0.00 O ATOM 0 H GLY A 34 -3.444 -13.250 -7.381 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -6.062 -13.441 -6.867 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -5.615 -12.150 -5.770 1.00 0.00 H new ATOM 505 N MET A 35 -4.620 -11.928 -8.892 1.00 0.00 N ATOM 506 CA MET A 35 -4.585 -11.050 -10.055 1.00 0.00 C ATOM 507 C MET A 35 -5.431 -11.618 -11.191 1.00 0.00 C ATOM 508 O MET A 35 -5.489 -11.047 -12.280 1.00 0.00 O ATOM 509 CB MET A 35 -3.143 -10.852 -10.527 1.00 0.00 C ATOM 510 CG MET A 35 -2.265 -10.138 -9.513 1.00 0.00 C ATOM 511 SD MET A 35 -0.867 -9.293 -10.277 1.00 0.00 S ATOM 512 CE MET A 35 -0.435 -10.454 -11.570 1.00 0.00 C ATOM 0 H MET A 35 -4.016 -12.747 -8.963 1.00 0.00 H new ATOM 0 HA MET A 35 -5.001 -10.085 -9.764 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.706 -11.825 -10.752 1.00 0.00 H new ATOM 0 HB3 MET A 35 -3.148 -10.282 -11.456 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.866 -9.414 -8.964 1.00 0.00 H new ATOM 0 HG3 MET A 35 -1.894 -10.861 -8.786 1.00 0.00 H new ATOM 0 HE1 MET A 35 0.583 -10.261 -11.907 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.503 -11.471 -11.183 1.00 0.00 H new ATOM 0 HE3 MET A 35 -1.122 -10.338 -12.408 1.00 0.00 H new ATOM 522 N SER A 36 -6.084 -12.746 -10.929 1.00 0.00 N ATOM 523 CA SER A 36 -6.923 -13.394 -11.931 1.00 0.00 C ATOM 524 C SER A 36 -8.277 -12.700 -12.036 1.00 0.00 C ATOM 525 O SER A 36 -9.079 -13.006 -12.919 1.00 0.00 O ATOM 526 CB SER A 36 -7.119 -14.871 -11.585 1.00 0.00 C ATOM 527 OG SER A 36 -7.173 -15.063 -10.182 1.00 0.00 O ATOM 0 H SER A 36 -6.048 -13.230 -10.032 1.00 0.00 H new ATOM 0 HA SER A 36 -6.420 -13.318 -12.895 1.00 0.00 H new ATOM 0 HB2 SER A 36 -8.040 -15.236 -12.041 1.00 0.00 H new ATOM 0 HB3 SER A 36 -6.302 -15.458 -12.004 1.00 0.00 H new ATOM 0 HG SER A 36 -7.458 -15.980 -9.988 1.00 0.00 H new ATOM 533 N LYS A 37 -8.527 -11.763 -11.127 1.00 0.00 N ATOM 534 CA LYS A 37 -9.783 -11.023 -11.115 1.00 0.00 C ATOM 535 C LYS A 37 -9.560 -9.567 -11.512 1.00 0.00 C ATOM 536 O LYS A 37 -10.473 -8.744 -11.432 1.00 0.00 O ATOM 537 CB LYS A 37 -10.426 -11.091 -9.729 1.00 0.00 C ATOM 538 CG LYS A 37 -10.446 -12.490 -9.136 1.00 0.00 C ATOM 539 CD LYS A 37 -10.962 -12.483 -7.707 1.00 0.00 C ATOM 540 CE LYS A 37 -10.272 -13.541 -6.860 1.00 0.00 C ATOM 541 NZ LYS A 37 -8.870 -13.162 -6.532 1.00 0.00 N ATOM 0 H LYS A 37 -7.875 -11.498 -10.388 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.453 -11.482 -11.842 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -9.886 -10.427 -9.054 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -11.448 -10.718 -9.793 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.075 -13.136 -9.748 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.440 -12.910 -9.159 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -10.800 -11.500 -7.266 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.038 -12.660 -7.707 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -10.833 -13.690 -5.937 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.276 -14.492 -7.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -8.508 -13.787 -5.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -8.277 -13.258 -7.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -8.845 -12.176 -6.202 1.00 0.00 H new ATOM 555 N LYS A 38 -8.342 -9.255 -11.942 1.00 0.00 N ATOM 556 CA LYS A 38 -8.000 -7.899 -12.355 1.00 0.00 C ATOM 557 C LYS A 38 -8.855 -7.458 -13.539 1.00 0.00 C ATOM 558 O LYS A 38 -9.796 -8.150 -13.928 1.00 0.00 O ATOM 559 CB LYS A 38 -6.517 -7.816 -12.724 1.00 0.00 C ATOM 560 CG LYS A 38 -5.587 -8.257 -11.607 1.00 0.00 C ATOM 561 CD LYS A 38 -5.412 -7.166 -10.564 1.00 0.00 C ATOM 562 CE LYS A 38 -6.562 -7.158 -9.568 1.00 0.00 C ATOM 563 NZ LYS A 38 -6.085 -7.331 -8.168 1.00 0.00 N ATOM 0 H LYS A 38 -7.575 -9.923 -12.014 1.00 0.00 H new ATOM 0 HA LYS A 38 -8.198 -7.230 -11.518 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -6.335 -8.435 -13.603 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -6.277 -6.790 -13.001 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -5.986 -9.154 -11.133 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -4.616 -8.522 -12.024 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -4.471 -7.315 -10.034 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -5.350 -6.196 -11.057 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.108 -6.219 -9.652 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -7.261 -7.957 -9.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -6.650 -6.732 -7.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -6.187 -8.327 -7.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -5.084 -7.055 -8.106 1.00 0.00 H new ATOM 577 N SER A 39 -8.521 -6.304 -14.107 1.00 0.00 N ATOM 578 CA SER A 39 -9.260 -5.771 -15.245 1.00 0.00 C ATOM 579 C SER A 39 -8.547 -4.558 -15.835 1.00 0.00 C ATOM 580 O SER A 39 -9.185 -3.615 -16.303 1.00 0.00 O ATOM 581 CB SER A 39 -10.679 -5.386 -14.824 1.00 0.00 C ATOM 582 OG SER A 39 -11.577 -6.467 -15.010 1.00 0.00 O ATOM 0 H SER A 39 -7.744 -5.720 -13.798 1.00 0.00 H new ATOM 0 HA SER A 39 -9.313 -6.548 -16.008 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.682 -5.083 -13.777 1.00 0.00 H new ATOM 0 HB3 SER A 39 -11.014 -4.527 -15.405 1.00 0.00 H new ATOM 0 HG SER A 39 -11.200 -7.278 -14.609 1.00 0.00 H new ATOM 588 N SER A 40 -7.218 -4.590 -15.809 1.00 0.00 N ATOM 589 CA SER A 40 -6.417 -3.492 -16.337 1.00 0.00 C ATOM 590 C SER A 40 -6.723 -2.192 -15.601 1.00 0.00 C ATOM 591 O SER A 40 -6.437 -1.102 -16.097 1.00 0.00 O ATOM 592 CB SER A 40 -6.678 -3.317 -17.834 1.00 0.00 C ATOM 593 OG SER A 40 -5.847 -4.172 -18.601 1.00 0.00 O ATOM 0 H SER A 40 -6.674 -5.364 -15.428 1.00 0.00 H new ATOM 0 HA SER A 40 -5.366 -3.736 -16.184 1.00 0.00 H new ATOM 0 HB2 SER A 40 -7.724 -3.531 -18.051 1.00 0.00 H new ATOM 0 HB3 SER A 40 -6.499 -2.280 -18.119 1.00 0.00 H new ATOM 0 HG SER A 40 -6.035 -4.042 -19.554 1.00 0.00 H new ATOM 599 N SER A 41 -7.307 -2.315 -14.413 1.00 0.00 N ATOM 600 CA SER A 41 -7.656 -1.151 -13.608 1.00 0.00 C ATOM 601 C SER A 41 -7.013 -1.232 -12.227 1.00 0.00 C ATOM 602 O SER A 41 -7.107 -0.298 -11.431 1.00 0.00 O ATOM 603 CB SER A 41 -9.175 -1.038 -13.469 1.00 0.00 C ATOM 604 OG SER A 41 -9.550 0.239 -12.981 1.00 0.00 O ATOM 0 H SER A 41 -7.548 -3.210 -13.987 1.00 0.00 H new ATOM 0 HA SER A 41 -7.277 -0.263 -14.115 1.00 0.00 H new ATOM 0 HB2 SER A 41 -9.646 -1.213 -14.436 1.00 0.00 H new ATOM 0 HB3 SER A 41 -9.540 -1.811 -12.792 1.00 0.00 H new ATOM 0 HG SER A 41 -8.896 0.540 -12.316 1.00 0.00 H new ATOM 610 N GLN A 42 -6.359 -2.356 -11.951 1.00 0.00 N ATOM 611 CA GLN A 42 -5.700 -2.560 -10.666 1.00 0.00 C ATOM 612 C GLN A 42 -4.220 -2.876 -10.857 1.00 0.00 C ATOM 613 O GLN A 42 -3.413 -2.697 -9.944 1.00 0.00 O ATOM 614 CB GLN A 42 -6.380 -3.692 -9.894 1.00 0.00 C ATOM 615 CG GLN A 42 -7.871 -3.478 -9.689 1.00 0.00 C ATOM 616 CD GLN A 42 -8.715 -4.483 -10.448 1.00 0.00 C ATOM 617 OE1 GLN A 42 -9.712 -4.990 -9.932 1.00 0.00 O ATOM 618 NE2 GLN A 42 -8.319 -4.777 -11.681 1.00 0.00 N ATOM 0 H GLN A 42 -6.271 -3.139 -12.599 1.00 0.00 H new ATOM 0 HA GLN A 42 -5.784 -1.637 -10.093 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.226 -4.629 -10.429 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -5.899 -3.797 -8.921 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -8.101 -3.546 -8.626 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -8.137 -2.471 -10.009 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -7.487 -4.333 -12.069 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -8.847 -5.447 -12.240 1.00 0.00 H new ATOM 627 N LEU A 43 -3.870 -3.347 -12.049 1.00 0.00 N ATOM 628 CA LEU A 43 -2.487 -3.689 -12.360 1.00 0.00 C ATOM 629 C LEU A 43 -1.563 -2.501 -12.110 1.00 0.00 C ATOM 630 O LEU A 43 -0.769 -2.505 -11.169 1.00 0.00 O ATOM 631 CB LEU A 43 -2.369 -4.145 -13.815 1.00 0.00 C ATOM 632 CG LEU A 43 -3.377 -5.199 -14.273 1.00 0.00 C ATOM 633 CD1 LEU A 43 -3.026 -5.705 -15.663 1.00 0.00 C ATOM 634 CD2 LEU A 43 -3.428 -6.353 -13.281 1.00 0.00 C ATOM 0 H LEU A 43 -4.525 -3.501 -12.816 1.00 0.00 H new ATOM 0 HA LEU A 43 -2.184 -4.505 -11.704 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.471 -3.271 -14.458 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.365 -4.540 -13.970 1.00 0.00 H new ATOM 0 HG LEU A 43 -4.363 -4.737 -14.315 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.755 -6.454 -15.972 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.040 -4.873 -16.367 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.031 -6.151 -15.648 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.150 -7.094 -13.622 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.443 -6.813 -13.207 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.727 -5.978 -12.302 1.00 0.00 H new ATOM 646 N LYS A 44 -1.673 -1.484 -12.958 1.00 0.00 N ATOM 647 CA LYS A 44 -0.851 -0.287 -12.829 1.00 0.00 C ATOM 648 C LYS A 44 -1.087 0.392 -11.483 1.00 0.00 C ATOM 649 O LYS A 44 -0.258 1.175 -11.020 1.00 0.00 O ATOM 650 CB LYS A 44 -1.155 0.691 -13.966 1.00 0.00 C ATOM 651 CG LYS A 44 -2.330 1.610 -13.680 1.00 0.00 C ATOM 652 CD LYS A 44 -3.651 0.860 -13.730 1.00 0.00 C ATOM 653 CE LYS A 44 -4.063 0.553 -15.162 1.00 0.00 C ATOM 654 NZ LYS A 44 -3.724 -0.845 -15.549 1.00 0.00 N ATOM 0 H LYS A 44 -2.324 -1.465 -13.743 1.00 0.00 H new ATOM 0 HA LYS A 44 0.195 -0.587 -12.887 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -0.270 1.297 -14.160 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.360 0.126 -14.875 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -2.206 2.065 -12.697 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.344 2.421 -14.408 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.564 -0.070 -13.168 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.427 1.454 -13.246 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -5.136 0.711 -15.273 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.567 1.248 -15.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -4.389 -1.174 -16.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.755 -0.876 -15.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -3.792 -1.462 -14.715 1.00 0.00 H new ATOM 668 N GLU A 45 -2.222 0.086 -10.862 1.00 0.00 N ATOM 669 CA GLU A 45 -2.565 0.668 -9.569 1.00 0.00 C ATOM 670 C GLU A 45 -1.401 0.542 -8.590 1.00 0.00 C ATOM 671 O GLU A 45 -1.032 1.508 -7.921 1.00 0.00 O ATOM 672 CB GLU A 45 -3.807 -0.014 -8.992 1.00 0.00 C ATOM 673 CG GLU A 45 -4.544 0.832 -7.967 1.00 0.00 C ATOM 674 CD GLU A 45 -5.643 1.673 -8.587 1.00 0.00 C ATOM 675 OE1 GLU A 45 -6.728 1.119 -8.864 1.00 0.00 O ATOM 676 OE2 GLU A 45 -5.419 2.883 -8.795 1.00 0.00 O ATOM 0 H GLU A 45 -2.919 -0.560 -11.232 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.777 1.726 -9.720 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -4.489 -0.259 -9.807 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.512 -0.956 -8.529 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.975 0.181 -7.206 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -3.833 1.485 -7.462 1.00 0.00 H new ATOM 683 N ILE A 46 -0.829 -0.655 -8.511 1.00 0.00 N ATOM 684 CA ILE A 46 0.293 -0.907 -7.615 1.00 0.00 C ATOM 685 C ILE A 46 1.615 -0.508 -8.262 1.00 0.00 C ATOM 686 O ILE A 46 2.602 -0.249 -7.574 1.00 0.00 O ATOM 687 CB ILE A 46 0.362 -2.389 -7.204 1.00 0.00 C ATOM 688 CG1 ILE A 46 -1.008 -2.874 -6.727 1.00 0.00 C ATOM 689 CG2 ILE A 46 1.408 -2.589 -6.117 1.00 0.00 C ATOM 690 CD1 ILE A 46 -1.767 -3.663 -7.770 1.00 0.00 C ATOM 0 H ILE A 46 -1.124 -1.465 -9.056 1.00 0.00 H new ATOM 0 HA ILE A 46 0.129 -0.298 -6.726 1.00 0.00 H new ATOM 0 HB ILE A 46 0.652 -2.978 -8.074 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -0.876 -3.493 -5.840 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.606 -2.013 -6.429 1.00 0.00 H new ATOM 0 HG21 ILE A 46 1.445 -3.642 -5.837 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.384 -2.278 -6.490 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.145 -1.991 -5.245 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.729 -3.974 -7.362 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.930 -3.040 -8.650 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.190 -4.544 -8.051 1.00 0.00 H new ATOM 702 N PHE A 47 1.625 -0.459 -9.591 1.00 0.00 N ATOM 703 CA PHE A 47 2.826 -0.090 -10.332 1.00 0.00 C ATOM 704 C PHE A 47 4.073 -0.670 -9.671 1.00 0.00 C ATOM 705 O PHE A 47 5.099 0.001 -9.560 1.00 0.00 O ATOM 706 CB PHE A 47 2.946 1.432 -10.425 1.00 0.00 C ATOM 707 CG PHE A 47 2.812 2.127 -9.101 1.00 0.00 C ATOM 708 CD1 PHE A 47 1.569 2.529 -8.637 1.00 0.00 C ATOM 709 CD2 PHE A 47 3.928 2.378 -8.319 1.00 0.00 C ATOM 710 CE1 PHE A 47 1.442 3.168 -7.418 1.00 0.00 C ATOM 711 CE2 PHE A 47 3.806 3.016 -7.099 1.00 0.00 C ATOM 712 CZ PHE A 47 2.562 3.412 -6.648 1.00 0.00 C ATOM 0 H PHE A 47 0.816 -0.670 -10.176 1.00 0.00 H new ATOM 0 HA PHE A 47 2.743 -0.503 -11.337 1.00 0.00 H new ATOM 0 HB2 PHE A 47 3.911 1.686 -10.863 1.00 0.00 H new ATOM 0 HB3 PHE A 47 2.179 1.808 -11.103 1.00 0.00 H new ATOM 0 HD1 PHE A 47 0.690 2.341 -9.235 1.00 0.00 H new ATOM 0 HD2 PHE A 47 4.904 2.072 -8.667 1.00 0.00 H new ATOM 0 HE1 PHE A 47 0.468 3.476 -7.068 1.00 0.00 H new ATOM 0 HE2 PHE A 47 4.683 3.205 -6.498 1.00 0.00 H new ATOM 0 HZ PHE A 47 2.465 3.911 -5.695 1.00 0.00 H new ATOM 722 N ARG A 48 3.976 -1.922 -9.234 1.00 0.00 N ATOM 723 CA ARG A 48 5.094 -2.592 -8.582 1.00 0.00 C ATOM 724 C ARG A 48 5.136 -4.071 -8.959 1.00 0.00 C ATOM 725 O ARG A 48 5.827 -4.864 -8.320 1.00 0.00 O ATOM 726 CB ARG A 48 4.990 -2.445 -7.063 1.00 0.00 C ATOM 727 CG ARG A 48 5.691 -1.209 -6.522 1.00 0.00 C ATOM 728 CD ARG A 48 6.297 -1.468 -5.152 1.00 0.00 C ATOM 729 NE ARG A 48 5.506 -0.866 -4.081 1.00 0.00 N ATOM 730 CZ ARG A 48 5.568 0.420 -3.756 1.00 0.00 C ATOM 731 NH1 ARG A 48 6.379 1.236 -4.415 1.00 0.00 N ATOM 732 NH2 ARG A 48 4.817 0.893 -2.769 1.00 0.00 N ATOM 0 H ARG A 48 3.135 -2.492 -9.320 1.00 0.00 H new ATOM 0 HA ARG A 48 6.016 -2.121 -8.923 1.00 0.00 H new ATOM 0 HB2 ARG A 48 3.938 -2.408 -6.781 1.00 0.00 H new ATOM 0 HB3 ARG A 48 5.416 -3.330 -6.591 1.00 0.00 H new ATOM 0 HG2 ARG A 48 6.474 -0.901 -7.215 1.00 0.00 H new ATOM 0 HG3 ARG A 48 4.980 -0.385 -6.457 1.00 0.00 H new ATOM 0 HD2 ARG A 48 6.373 -2.543 -4.986 1.00 0.00 H new ATOM 0 HD3 ARG A 48 7.311 -1.068 -5.123 1.00 0.00 H new ATOM 0 HE ARG A 48 4.872 -1.466 -3.554 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.958 0.876 -5.174 1.00 0.00 H new ATOM 0 HH12 ARG A 48 6.424 2.223 -4.163 1.00 0.00 H new ATOM 0 HH21 ARG A 48 4.192 0.269 -2.260 1.00 0.00 H new ATOM 0 HH22 ARG A 48 4.865 1.881 -2.520 1.00 0.00 H new ATOM 746 N ILE A 49 4.391 -4.432 -9.998 1.00 0.00 N ATOM 747 CA ILE A 49 4.344 -5.814 -10.459 1.00 0.00 C ATOM 748 C ILE A 49 4.861 -5.935 -11.888 1.00 0.00 C ATOM 749 O ILE A 49 5.236 -7.020 -12.335 1.00 0.00 O ATOM 750 CB ILE A 49 2.913 -6.381 -10.394 1.00 0.00 C ATOM 751 CG1 ILE A 49 1.971 -5.547 -11.264 1.00 0.00 C ATOM 752 CG2 ILE A 49 2.422 -6.414 -8.954 1.00 0.00 C ATOM 753 CD1 ILE A 49 1.395 -4.344 -10.551 1.00 0.00 C ATOM 0 H ILE A 49 3.812 -3.787 -10.536 1.00 0.00 H new ATOM 0 HA ILE A 49 4.986 -6.390 -9.793 1.00 0.00 H new ATOM 0 HB ILE A 49 2.924 -7.401 -10.778 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.510 -5.210 -12.149 1.00 0.00 H new ATOM 0 HG13 ILE A 49 1.154 -6.180 -11.610 1.00 0.00 H new ATOM 0 HG21 ILE A 49 1.410 -6.817 -8.924 1.00 0.00 H new ATOM 0 HG22 ILE A 49 3.082 -7.046 -8.359 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.422 -5.403 -8.546 1.00 0.00 H new ATOM 0 HD11 ILE A 49 0.737 -3.800 -11.229 1.00 0.00 H new ATOM 0 HD12 ILE A 49 0.827 -4.674 -9.681 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.205 -3.690 -10.229 1.00 0.00 H new ATOM 765 N LEU A 50 4.881 -4.814 -12.601 1.00 0.00 N ATOM 766 CA LEU A 50 5.355 -4.793 -13.981 1.00 0.00 C ATOM 767 C LEU A 50 6.847 -4.482 -14.039 1.00 0.00 C ATOM 768 O LEU A 50 7.648 -5.313 -14.468 1.00 0.00 O ATOM 769 CB LEU A 50 4.575 -3.757 -14.793 1.00 0.00 C ATOM 770 CG LEU A 50 3.081 -3.650 -14.485 1.00 0.00 C ATOM 771 CD1 LEU A 50 2.539 -2.303 -14.937 1.00 0.00 C ATOM 772 CD2 LEU A 50 2.317 -4.785 -15.150 1.00 0.00 C ATOM 0 H LEU A 50 4.575 -3.908 -12.247 1.00 0.00 H new ATOM 0 HA LEU A 50 5.191 -5.781 -14.411 1.00 0.00 H new ATOM 0 HB2 LEU A 50 5.030 -2.780 -14.631 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.692 -3.991 -15.851 1.00 0.00 H new ATOM 0 HG LEU A 50 2.945 -3.730 -13.407 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.475 -2.244 -14.710 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.066 -1.505 -14.414 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.687 -2.193 -16.011 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.256 -4.693 -14.920 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.460 -4.736 -16.229 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.687 -5.740 -14.778 1.00 0.00 H new ATOM 784 N ASP A 51 7.214 -3.282 -13.603 1.00 0.00 N ATOM 785 CA ASP A 51 8.611 -2.863 -13.602 1.00 0.00 C ATOM 786 C ASP A 51 8.847 -1.762 -12.572 1.00 0.00 C ATOM 787 O ASP A 51 7.953 -0.970 -12.280 1.00 0.00 O ATOM 788 CB ASP A 51 9.019 -2.374 -14.993 1.00 0.00 C ATOM 789 CG ASP A 51 7.946 -1.527 -15.647 1.00 0.00 C ATOM 790 OD1 ASP A 51 6.918 -2.095 -16.071 1.00 0.00 O ATOM 791 OD2 ASP A 51 8.133 -0.295 -15.734 1.00 0.00 O ATOM 0 H ASP A 51 6.564 -2.582 -13.246 1.00 0.00 H new ATOM 0 HA ASP A 51 9.224 -3.724 -13.334 1.00 0.00 H new ATOM 0 HB2 ASP A 51 9.939 -1.794 -14.916 1.00 0.00 H new ATOM 0 HB3 ASP A 51 9.236 -3.233 -15.628 1.00 0.00 H new ATOM 796 N ASN A 52 10.058 -1.721 -12.025 1.00 0.00 N ATOM 797 CA ASN A 52 10.411 -0.719 -11.027 1.00 0.00 C ATOM 798 C ASN A 52 11.113 0.471 -11.675 1.00 0.00 C ATOM 799 O ASN A 52 12.056 1.030 -11.113 1.00 0.00 O ATOM 800 CB ASN A 52 11.311 -1.334 -9.953 1.00 0.00 C ATOM 801 CG ASN A 52 11.476 -0.428 -8.748 1.00 0.00 C ATOM 802 OD1 ASN A 52 10.512 -0.138 -8.039 1.00 0.00 O ATOM 803 ND2 ASN A 52 12.702 0.025 -8.511 1.00 0.00 N ATOM 0 H ASN A 52 10.810 -2.370 -12.256 1.00 0.00 H new ATOM 0 HA ASN A 52 9.491 -0.366 -10.562 1.00 0.00 H new ATOM 0 HB2 ASN A 52 10.890 -2.287 -9.633 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.291 -1.546 -10.382 1.00 0.00 H new ATOM 0 HD21 ASN A 52 12.874 0.639 -7.715 1.00 0.00 H new ATOM 0 HD22 ASN A 52 13.472 -0.241 -9.125 1.00 0.00 H new ATOM 810 N ASP A 53 10.647 0.852 -12.859 1.00 0.00 N ATOM 811 CA ASP A 53 11.229 1.977 -13.583 1.00 0.00 C ATOM 812 C ASP A 53 10.139 2.881 -14.149 1.00 0.00 C ATOM 813 O ASP A 53 10.195 4.102 -14.004 1.00 0.00 O ATOM 814 CB ASP A 53 12.128 1.472 -14.713 1.00 0.00 C ATOM 815 CG ASP A 53 13.517 1.106 -14.229 1.00 0.00 C ATOM 816 OD1 ASP A 53 13.629 0.182 -13.396 1.00 0.00 O ATOM 817 OD2 ASP A 53 14.491 1.742 -14.682 1.00 0.00 O ATOM 0 H ASP A 53 9.869 0.399 -13.338 1.00 0.00 H new ATOM 0 HA ASP A 53 11.829 2.557 -12.883 1.00 0.00 H new ATOM 0 HB2 ASP A 53 11.667 0.600 -15.178 1.00 0.00 H new ATOM 0 HB3 ASP A 53 12.205 2.240 -15.482 1.00 0.00 H new ATOM 822 N GLN A 54 9.148 2.273 -14.794 1.00 0.00 N ATOM 823 CA GLN A 54 8.046 3.025 -15.383 1.00 0.00 C ATOM 824 C GLN A 54 8.567 4.145 -16.277 1.00 0.00 C ATOM 825 O GLN A 54 7.971 5.219 -16.355 1.00 0.00 O ATOM 826 CB GLN A 54 7.153 3.606 -14.285 1.00 0.00 C ATOM 827 CG GLN A 54 5.673 3.329 -14.494 1.00 0.00 C ATOM 828 CD GLN A 54 5.352 1.847 -14.495 1.00 0.00 C ATOM 829 OE1 GLN A 54 5.423 1.186 -15.531 1.00 0.00 O ATOM 830 NE2 GLN A 54 4.996 1.317 -13.331 1.00 0.00 N ATOM 0 H GLN A 54 9.086 1.263 -14.922 1.00 0.00 H new ATOM 0 HA GLN A 54 7.459 2.340 -15.995 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.459 3.194 -13.323 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.309 4.684 -14.234 1.00 0.00 H new ATOM 0 HG2 GLN A 54 5.100 3.821 -13.707 1.00 0.00 H new ATOM 0 HG3 GLN A 54 5.355 3.767 -15.440 1.00 0.00 H new ATOM 0 HE21 GLN A 54 4.950 1.902 -12.497 1.00 0.00 H new ATOM 0 HE22 GLN A 54 4.768 0.325 -13.271 1.00 0.00 H new ATOM 839 N SER A 55 9.684 3.887 -16.950 1.00 0.00 N ATOM 840 CA SER A 55 10.288 4.875 -17.836 1.00 0.00 C ATOM 841 C SER A 55 9.839 4.658 -19.278 1.00 0.00 C ATOM 842 O SER A 55 9.892 5.572 -20.101 1.00 0.00 O ATOM 843 CB SER A 55 11.814 4.804 -17.749 1.00 0.00 C ATOM 844 OG SER A 55 12.328 3.798 -18.605 1.00 0.00 O ATOM 0 H SER A 55 10.189 3.002 -16.898 1.00 0.00 H new ATOM 0 HA SER A 55 9.958 5.863 -17.516 1.00 0.00 H new ATOM 0 HB2 SER A 55 12.242 5.769 -18.019 1.00 0.00 H new ATOM 0 HB3 SER A 55 12.114 4.599 -16.721 1.00 0.00 H new ATOM 0 HG SER A 55 13.305 3.774 -18.532 1.00 0.00 H new ATOM 850 N GLY A 56 9.397 3.440 -19.577 1.00 0.00 N ATOM 851 CA GLY A 56 8.945 3.124 -20.920 1.00 0.00 C ATOM 852 C GLY A 56 8.730 1.637 -21.124 1.00 0.00 C ATOM 853 O GLY A 56 7.596 1.182 -21.276 1.00 0.00 O ATOM 0 H GLY A 56 9.344 2.667 -18.914 1.00 0.00 H new ATOM 0 HA2 GLY A 56 8.014 3.654 -21.121 1.00 0.00 H new ATOM 0 HA3 GLY A 56 9.679 3.484 -21.641 1.00 0.00 H new ATOM 857 N PHE A 57 9.821 0.878 -21.129 1.00 0.00 N ATOM 858 CA PHE A 57 9.747 -0.565 -21.319 1.00 0.00 C ATOM 859 C PHE A 57 10.392 -1.302 -20.148 1.00 0.00 C ATOM 860 O PHE A 57 10.721 -0.698 -19.127 1.00 0.00 O ATOM 861 CB PHE A 57 10.432 -0.965 -22.627 1.00 0.00 C ATOM 862 CG PHE A 57 9.954 -0.184 -23.817 1.00 0.00 C ATOM 863 CD1 PHE A 57 8.877 -0.629 -24.567 1.00 0.00 C ATOM 864 CD2 PHE A 57 10.580 0.996 -24.186 1.00 0.00 C ATOM 865 CE1 PHE A 57 8.435 0.088 -25.663 1.00 0.00 C ATOM 866 CE2 PHE A 57 10.142 1.717 -25.281 1.00 0.00 C ATOM 867 CZ PHE A 57 9.068 1.263 -26.020 1.00 0.00 C ATOM 0 H PHE A 57 10.767 1.239 -21.004 1.00 0.00 H new ATOM 0 HA PHE A 57 8.695 -0.846 -21.367 1.00 0.00 H new ATOM 0 HB2 PHE A 57 11.508 -0.828 -22.521 1.00 0.00 H new ATOM 0 HB3 PHE A 57 10.262 -2.027 -22.807 1.00 0.00 H new ATOM 0 HD1 PHE A 57 8.377 -1.546 -24.292 1.00 0.00 H new ATOM 0 HD2 PHE A 57 11.420 1.357 -23.611 1.00 0.00 H new ATOM 0 HE1 PHE A 57 7.595 -0.270 -26.240 1.00 0.00 H new ATOM 0 HE2 PHE A 57 10.640 2.635 -25.558 1.00 0.00 H new ATOM 0 HZ PHE A 57 8.723 1.825 -26.875 1.00 0.00 H new ATOM 877 N ILE A 58 10.568 -2.609 -20.304 1.00 0.00 N ATOM 878 CA ILE A 58 11.173 -3.428 -19.261 1.00 0.00 C ATOM 879 C ILE A 58 12.301 -4.288 -19.823 1.00 0.00 C ATOM 880 O ILE A 58 12.303 -4.631 -21.004 1.00 0.00 O ATOM 881 CB ILE A 58 10.132 -4.342 -18.588 1.00 0.00 C ATOM 882 CG1 ILE A 58 8.865 -3.551 -18.256 1.00 0.00 C ATOM 883 CG2 ILE A 58 10.715 -4.971 -17.331 1.00 0.00 C ATOM 884 CD1 ILE A 58 7.770 -4.394 -17.642 1.00 0.00 C ATOM 0 H ILE A 58 10.300 -3.124 -21.143 1.00 0.00 H new ATOM 0 HA ILE A 58 11.578 -2.743 -18.516 1.00 0.00 H new ATOM 0 HB ILE A 58 9.868 -5.140 -19.282 1.00 0.00 H new ATOM 0 HG12 ILE A 58 9.120 -2.744 -17.569 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.487 -3.087 -19.167 1.00 0.00 H new ATOM 0 HG21 ILE A 58 9.968 -5.614 -16.866 1.00 0.00 H new ATOM 0 HG22 ILE A 58 11.591 -5.564 -17.594 1.00 0.00 H new ATOM 0 HG23 ILE A 58 11.004 -4.186 -16.632 1.00 0.00 H new ATOM 0 HD11 ILE A 58 6.903 -3.768 -17.433 1.00 0.00 H new ATOM 0 HD12 ILE A 58 7.487 -5.185 -18.336 1.00 0.00 H new ATOM 0 HD13 ILE A 58 8.130 -4.838 -16.714 1.00 0.00 H new ATOM 896 N GLU A 59 13.257 -4.633 -18.966 1.00 0.00 N ATOM 897 CA GLU A 59 14.390 -5.454 -19.377 1.00 0.00 C ATOM 898 C GLU A 59 14.683 -6.535 -18.340 1.00 0.00 C ATOM 899 O GLU A 59 14.193 -6.477 -17.213 1.00 0.00 O ATOM 900 CB GLU A 59 15.630 -4.583 -19.586 1.00 0.00 C ATOM 901 CG GLU A 59 16.708 -5.251 -20.423 1.00 0.00 C ATOM 902 CD GLU A 59 16.176 -5.793 -21.735 1.00 0.00 C ATOM 903 OE1 GLU A 59 16.182 -5.042 -22.733 1.00 0.00 O ATOM 904 OE2 GLU A 59 15.755 -6.968 -21.765 1.00 0.00 O ATOM 0 H GLU A 59 13.270 -4.357 -17.984 1.00 0.00 H new ATOM 0 HA GLU A 59 14.132 -5.938 -20.319 1.00 0.00 H new ATOM 0 HB2 GLU A 59 15.333 -3.652 -20.068 1.00 0.00 H new ATOM 0 HB3 GLU A 59 16.047 -4.320 -18.614 1.00 0.00 H new ATOM 0 HG2 GLU A 59 17.502 -4.533 -20.626 1.00 0.00 H new ATOM 0 HG3 GLU A 59 17.154 -6.065 -19.852 1.00 0.00 H new ATOM 911 N GLU A 60 15.484 -7.521 -18.732 1.00 0.00 N ATOM 912 CA GLU A 60 15.841 -8.615 -17.837 1.00 0.00 C ATOM 913 C GLU A 60 16.528 -8.089 -16.580 1.00 0.00 C ATOM 914 O GLU A 60 16.557 -8.760 -15.549 1.00 0.00 O ATOM 915 CB GLU A 60 16.757 -9.611 -18.553 1.00 0.00 C ATOM 916 CG GLU A 60 18.088 -9.015 -18.979 1.00 0.00 C ATOM 917 CD GLU A 60 18.877 -9.938 -19.887 1.00 0.00 C ATOM 918 OE1 GLU A 60 18.262 -10.564 -20.776 1.00 0.00 O ATOM 919 OE2 GLU A 60 20.109 -10.034 -19.710 1.00 0.00 O ATOM 0 H GLU A 60 15.897 -7.584 -19.662 1.00 0.00 H new ATOM 0 HA GLU A 60 14.923 -9.123 -17.542 1.00 0.00 H new ATOM 0 HB2 GLU A 60 16.942 -10.460 -17.895 1.00 0.00 H new ATOM 0 HB3 GLU A 60 16.243 -9.997 -19.433 1.00 0.00 H new ATOM 0 HG2 GLU A 60 17.911 -8.070 -19.493 1.00 0.00 H new ATOM 0 HG3 GLU A 60 18.681 -8.789 -18.093 1.00 0.00 H new ATOM 926 N ASP A 61 17.078 -6.884 -16.675 1.00 0.00 N ATOM 927 CA ASP A 61 17.765 -6.266 -15.546 1.00 0.00 C ATOM 928 C ASP A 61 16.765 -5.795 -14.494 1.00 0.00 C ATOM 929 O ASP A 61 17.150 -5.375 -13.404 1.00 0.00 O ATOM 930 CB ASP A 61 18.615 -5.087 -16.022 1.00 0.00 C ATOM 931 CG ASP A 61 19.586 -4.608 -14.961 1.00 0.00 C ATOM 932 OD1 ASP A 61 19.826 -5.360 -13.994 1.00 0.00 O ATOM 933 OD2 ASP A 61 20.105 -3.480 -15.097 1.00 0.00 O ATOM 0 H ASP A 61 17.062 -6.315 -17.522 1.00 0.00 H new ATOM 0 HA ASP A 61 18.416 -7.015 -15.094 1.00 0.00 H new ATOM 0 HB2 ASP A 61 19.170 -5.380 -16.913 1.00 0.00 H new ATOM 0 HB3 ASP A 61 17.961 -4.264 -16.310 1.00 0.00 H new ATOM 938 N GLU A 62 15.481 -5.870 -14.830 1.00 0.00 N ATOM 939 CA GLU A 62 14.427 -5.449 -13.914 1.00 0.00 C ATOM 940 C GLU A 62 13.538 -6.629 -13.530 1.00 0.00 C ATOM 941 O GLU A 62 12.412 -6.447 -13.064 1.00 0.00 O ATOM 942 CB GLU A 62 13.580 -4.344 -14.548 1.00 0.00 C ATOM 943 CG GLU A 62 14.030 -2.942 -14.172 1.00 0.00 C ATOM 944 CD GLU A 62 13.781 -1.934 -15.277 1.00 0.00 C ATOM 945 OE1 GLU A 62 12.614 -1.533 -15.464 1.00 0.00 O ATOM 946 OE2 GLU A 62 14.756 -1.546 -15.956 1.00 0.00 O ATOM 0 H GLU A 62 15.146 -6.218 -15.728 1.00 0.00 H new ATOM 0 HA GLU A 62 14.899 -5.062 -13.011 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.614 -4.449 -15.632 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.541 -4.476 -14.247 1.00 0.00 H new ATOM 0 HG2 GLU A 62 13.505 -2.625 -13.271 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.093 -2.958 -13.932 1.00 0.00 H new ATOM 953 N LEU A 63 14.051 -7.838 -13.729 1.00 0.00 N ATOM 954 CA LEU A 63 13.304 -9.049 -13.404 1.00 0.00 C ATOM 955 C LEU A 63 14.046 -9.883 -12.365 1.00 0.00 C ATOM 956 O LEU A 63 13.460 -10.334 -11.381 1.00 0.00 O ATOM 957 CB LEU A 63 13.066 -9.879 -14.667 1.00 0.00 C ATOM 958 CG LEU A 63 12.717 -9.092 -15.931 1.00 0.00 C ATOM 959 CD1 LEU A 63 12.563 -10.031 -17.118 1.00 0.00 C ATOM 960 CD2 LEU A 63 11.445 -8.283 -15.721 1.00 0.00 C ATOM 0 H LEU A 63 14.981 -8.006 -14.114 1.00 0.00 H new ATOM 0 HA LEU A 63 12.342 -8.753 -12.985 1.00 0.00 H new ATOM 0 HB2 LEU A 63 13.962 -10.467 -14.865 1.00 0.00 H new ATOM 0 HB3 LEU A 63 12.259 -10.584 -14.468 1.00 0.00 H new ATOM 0 HG LEU A 63 13.533 -8.401 -16.143 1.00 0.00 H new ATOM 0 HD11 LEU A 63 12.315 -9.454 -18.009 1.00 0.00 H new ATOM 0 HD12 LEU A 63 13.498 -10.567 -17.282 1.00 0.00 H new ATOM 0 HD13 LEU A 63 11.766 -10.746 -16.915 1.00 0.00 H new ATOM 0 HD21 LEU A 63 11.212 -7.729 -16.630 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.621 -8.956 -15.484 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.590 -7.584 -14.898 1.00 0.00 H new ATOM 972 N LYS A 64 15.340 -10.085 -12.590 1.00 0.00 N ATOM 973 CA LYS A 64 16.164 -10.863 -11.672 1.00 0.00 C ATOM 974 C LYS A 64 15.894 -10.462 -10.226 1.00 0.00 C ATOM 975 O LYS A 64 15.897 -11.305 -9.328 1.00 0.00 O ATOM 976 CB LYS A 64 17.647 -10.669 -11.998 1.00 0.00 C ATOM 977 CG LYS A 64 18.024 -11.105 -13.403 1.00 0.00 C ATOM 978 CD LYS A 64 19.417 -10.630 -13.780 1.00 0.00 C ATOM 979 CE LYS A 64 19.823 -11.131 -15.158 1.00 0.00 C ATOM 980 NZ LYS A 64 18.796 -10.812 -16.188 1.00 0.00 N ATOM 0 H LYS A 64 15.841 -9.721 -13.400 1.00 0.00 H new ATOM 0 HA LYS A 64 15.906 -11.915 -11.793 1.00 0.00 H new ATOM 0 HB2 LYS A 64 17.903 -9.617 -11.872 1.00 0.00 H new ATOM 0 HB3 LYS A 64 18.245 -11.231 -11.280 1.00 0.00 H new ATOM 0 HG2 LYS A 64 17.978 -12.192 -13.472 1.00 0.00 H new ATOM 0 HG3 LYS A 64 17.299 -10.710 -14.114 1.00 0.00 H new ATOM 0 HD2 LYS A 64 19.448 -9.541 -13.764 1.00 0.00 H new ATOM 0 HD3 LYS A 64 20.135 -10.980 -13.038 1.00 0.00 H new ATOM 0 HE2 LYS A 64 20.774 -10.681 -15.442 1.00 0.00 H new ATOM 0 HE3 LYS A 64 19.978 -12.209 -15.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 19.265 -10.601 -17.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 18.161 -11.627 -16.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 18.244 -9.985 -15.883 1.00 0.00 H new ATOM 994 N TYR A 65 15.659 -9.173 -10.007 1.00 0.00 N ATOM 995 CA TYR A 65 15.387 -8.662 -8.669 1.00 0.00 C ATOM 996 C TYR A 65 13.904 -8.351 -8.496 1.00 0.00 C ATOM 997 O TYR A 65 13.534 -7.281 -8.011 1.00 0.00 O ATOM 998 CB TYR A 65 16.218 -7.405 -8.402 1.00 0.00 C ATOM 999 CG TYR A 65 17.710 -7.636 -8.487 1.00 0.00 C ATOM 1000 CD1 TYR A 65 18.345 -7.757 -9.717 1.00 0.00 C ATOM 1001 CD2 TYR A 65 18.484 -7.732 -7.338 1.00 0.00 C ATOM 1002 CE1 TYR A 65 19.708 -7.969 -9.799 1.00 0.00 C ATOM 1003 CE2 TYR A 65 19.847 -7.942 -7.410 1.00 0.00 C ATOM 1004 CZ TYR A 65 20.454 -8.061 -8.643 1.00 0.00 C ATOM 1005 OH TYR A 65 21.812 -8.270 -8.720 1.00 0.00 O ATOM 0 H TYR A 65 15.651 -8.463 -10.739 1.00 0.00 H new ATOM 0 HA TYR A 65 15.664 -9.433 -7.950 1.00 0.00 H new ATOM 0 HB2 TYR A 65 15.937 -6.634 -9.120 1.00 0.00 H new ATOM 0 HB3 TYR A 65 15.974 -7.022 -7.411 1.00 0.00 H new ATOM 0 HD1 TYR A 65 17.763 -7.684 -10.624 1.00 0.00 H new ATOM 0 HD2 TYR A 65 18.012 -7.641 -6.371 1.00 0.00 H new ATOM 0 HE1 TYR A 65 20.186 -8.062 -10.763 1.00 0.00 H new ATOM 0 HE2 TYR A 65 20.434 -8.013 -6.506 1.00 0.00 H new ATOM 0 HH TYR A 65 22.189 -8.309 -7.816 1.00 0.00 H new ATOM 1015 N PHE A 66 13.058 -9.295 -8.895 1.00 0.00 N ATOM 1016 CA PHE A 66 11.614 -9.123 -8.784 1.00 0.00 C ATOM 1017 C PHE A 66 11.098 -9.688 -7.463 1.00 0.00 C ATOM 1018 O PHE A 66 10.541 -8.961 -6.639 1.00 0.00 O ATOM 1019 CB PHE A 66 10.906 -9.808 -9.955 1.00 0.00 C ATOM 1020 CG PHE A 66 9.448 -9.463 -10.060 1.00 0.00 C ATOM 1021 CD1 PHE A 66 8.496 -10.206 -9.381 1.00 0.00 C ATOM 1022 CD2 PHE A 66 9.030 -8.395 -10.837 1.00 0.00 C ATOM 1023 CE1 PHE A 66 7.154 -9.890 -9.476 1.00 0.00 C ATOM 1024 CE2 PHE A 66 7.689 -8.074 -10.936 1.00 0.00 C ATOM 1025 CZ PHE A 66 6.750 -8.822 -10.254 1.00 0.00 C ATOM 0 H PHE A 66 13.347 -10.186 -9.298 1.00 0.00 H new ATOM 0 HA PHE A 66 11.398 -8.055 -8.811 1.00 0.00 H new ATOM 0 HB2 PHE A 66 11.405 -9.530 -10.883 1.00 0.00 H new ATOM 0 HB3 PHE A 66 11.009 -10.888 -9.849 1.00 0.00 H new ATOM 0 HD1 PHE A 66 8.806 -11.041 -8.771 1.00 0.00 H new ATOM 0 HD2 PHE A 66 9.760 -7.806 -11.372 1.00 0.00 H new ATOM 0 HE1 PHE A 66 6.421 -10.477 -8.942 1.00 0.00 H new ATOM 0 HE2 PHE A 66 7.376 -7.239 -11.546 1.00 0.00 H new ATOM 0 HZ PHE A 66 5.702 -8.573 -10.329 1.00 0.00 H new ATOM 1035 N LEU A 67 11.288 -10.988 -7.269 1.00 0.00 N ATOM 1036 CA LEU A 67 10.842 -11.652 -6.049 1.00 0.00 C ATOM 1037 C LEU A 67 11.348 -10.916 -4.812 1.00 0.00 C ATOM 1038 O LEU A 67 10.702 -10.925 -3.765 1.00 0.00 O ATOM 1039 CB LEU A 67 11.328 -13.102 -6.027 1.00 0.00 C ATOM 1040 CG LEU A 67 11.009 -13.935 -7.269 1.00 0.00 C ATOM 1041 CD1 LEU A 67 11.379 -15.393 -7.043 1.00 0.00 C ATOM 1042 CD2 LEU A 67 9.538 -13.806 -7.635 1.00 0.00 C ATOM 0 H LEU A 67 11.748 -11.603 -7.940 1.00 0.00 H new ATOM 0 HA LEU A 67 9.752 -11.640 -6.036 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.408 -13.100 -5.883 1.00 0.00 H new ATOM 0 HB3 LEU A 67 10.892 -13.597 -5.160 1.00 0.00 H new ATOM 0 HG LEU A 67 11.603 -13.555 -8.100 1.00 0.00 H new ATOM 0 HD11 LEU A 67 11.145 -15.971 -7.937 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.445 -15.469 -6.831 1.00 0.00 H new ATOM 0 HD13 LEU A 67 10.812 -15.786 -6.199 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.330 -14.406 -8.521 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.924 -14.159 -6.806 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.304 -12.761 -7.841 1.00 0.00 H new ATOM 1054 N GLN A 68 12.507 -10.277 -4.943 1.00 0.00 N ATOM 1055 CA GLN A 68 13.098 -9.535 -3.836 1.00 0.00 C ATOM 1056 C GLN A 68 12.097 -8.547 -3.247 1.00 0.00 C ATOM 1057 O GLN A 68 12.154 -8.223 -2.060 1.00 0.00 O ATOM 1058 CB GLN A 68 14.350 -8.791 -4.304 1.00 0.00 C ATOM 1059 CG GLN A 68 15.588 -9.105 -3.479 1.00 0.00 C ATOM 1060 CD GLN A 68 16.836 -9.243 -4.328 1.00 0.00 C ATOM 1061 OE1 GLN A 68 17.763 -8.440 -4.225 1.00 0.00 O ATOM 1062 NE2 GLN A 68 16.866 -10.266 -5.174 1.00 0.00 N ATOM 0 H GLN A 68 13.054 -10.259 -5.804 1.00 0.00 H new ATOM 0 HA GLN A 68 13.376 -10.249 -3.061 1.00 0.00 H new ATOM 0 HB2 GLN A 68 14.544 -9.044 -5.346 1.00 0.00 H new ATOM 0 HB3 GLN A 68 14.161 -7.718 -4.266 1.00 0.00 H new ATOM 0 HG2 GLN A 68 15.739 -8.315 -2.743 1.00 0.00 H new ATOM 0 HG3 GLN A 68 15.426 -10.030 -2.925 1.00 0.00 H new ATOM 0 HE21 GLN A 68 16.075 -10.908 -5.227 1.00 0.00 H new ATOM 0 HE22 GLN A 68 17.680 -10.410 -5.771 1.00 0.00 H new ATOM 1071 N ARG A 69 11.180 -8.071 -4.083 1.00 0.00 N ATOM 1072 CA ARG A 69 10.167 -7.118 -3.645 1.00 0.00 C ATOM 1073 C ARG A 69 9.250 -7.743 -2.598 1.00 0.00 C ATOM 1074 O ARG A 69 9.332 -7.419 -1.413 1.00 0.00 O ATOM 1075 CB ARG A 69 9.341 -6.635 -4.838 1.00 0.00 C ATOM 1076 CG ARG A 69 10.078 -5.648 -5.729 1.00 0.00 C ATOM 1077 CD ARG A 69 9.925 -4.221 -5.226 1.00 0.00 C ATOM 1078 NE ARG A 69 10.926 -3.887 -4.216 1.00 0.00 N ATOM 1079 CZ ARG A 69 10.920 -2.755 -3.522 1.00 0.00 C ATOM 1080 NH1 ARG A 69 9.971 -1.853 -3.727 1.00 0.00 N ATOM 1081 NH2 ARG A 69 11.866 -2.523 -2.620 1.00 0.00 N ATOM 0 H ARG A 69 11.118 -8.330 -5.068 1.00 0.00 H new ATOM 0 HA ARG A 69 10.676 -6.266 -3.195 1.00 0.00 H new ATOM 0 HB2 ARG A 69 9.042 -7.497 -5.435 1.00 0.00 H new ATOM 0 HB3 ARG A 69 8.427 -6.168 -4.471 1.00 0.00 H new ATOM 0 HG2 ARG A 69 11.135 -5.910 -5.767 1.00 0.00 H new ATOM 0 HG3 ARG A 69 9.695 -5.719 -6.747 1.00 0.00 H new ATOM 0 HD2 ARG A 69 10.011 -3.530 -6.064 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.928 -4.090 -4.806 1.00 0.00 H new ATOM 0 HE ARG A 69 11.670 -4.560 -4.034 1.00 0.00 H new ATOM 0 HH11 ARG A 69 9.243 -2.027 -4.419 1.00 0.00 H new ATOM 0 HH12 ARG A 69 9.969 -0.984 -3.192 1.00 0.00 H new ATOM 0 HH21 ARG A 69 12.598 -3.215 -2.460 1.00 0.00 H new ATOM 0 HH22 ARG A 69 11.861 -1.653 -2.087 1.00 0.00 H new ATOM 1095 N PHE A 70 8.377 -8.641 -3.043 1.00 0.00 N ATOM 1096 CA PHE A 70 7.443 -9.310 -2.146 1.00 0.00 C ATOM 1097 C PHE A 70 8.189 -10.144 -1.108 1.00 0.00 C ATOM 1098 O PHE A 70 8.001 -9.968 0.096 1.00 0.00 O ATOM 1099 CB PHE A 70 6.488 -10.202 -2.941 1.00 0.00 C ATOM 1100 CG PHE A 70 5.664 -9.450 -3.947 1.00 0.00 C ATOM 1101 CD1 PHE A 70 6.149 -9.217 -5.224 1.00 0.00 C ATOM 1102 CD2 PHE A 70 4.404 -8.978 -3.616 1.00 0.00 C ATOM 1103 CE1 PHE A 70 5.392 -8.525 -6.151 1.00 0.00 C ATOM 1104 CE2 PHE A 70 3.643 -8.285 -4.539 1.00 0.00 C ATOM 1105 CZ PHE A 70 4.138 -8.059 -5.809 1.00 0.00 C ATOM 0 H PHE A 70 8.297 -8.922 -4.020 1.00 0.00 H new ATOM 0 HA PHE A 70 6.866 -8.545 -1.627 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.065 -10.970 -3.457 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.821 -10.716 -2.248 1.00 0.00 H new ATOM 0 HD1 PHE A 70 7.129 -9.580 -5.498 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.012 -9.154 -2.625 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.781 -8.349 -7.143 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.663 -7.921 -4.268 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.545 -7.519 -6.533 1.00 0.00 H new ATOM 1115 N GLU A 71 9.036 -11.051 -1.584 1.00 0.00 N ATOM 1116 CA GLU A 71 9.810 -11.912 -0.697 1.00 0.00 C ATOM 1117 C GLU A 71 10.501 -11.094 0.390 1.00 0.00 C ATOM 1118 O GLU A 71 10.646 -9.878 0.268 1.00 0.00 O ATOM 1119 CB GLU A 71 10.849 -12.702 -1.496 1.00 0.00 C ATOM 1120 CG GLU A 71 11.300 -13.981 -0.811 1.00 0.00 C ATOM 1121 CD GLU A 71 10.150 -14.930 -0.533 1.00 0.00 C ATOM 1122 OE1 GLU A 71 9.476 -14.758 0.504 1.00 0.00 O ATOM 1123 OE2 GLU A 71 9.924 -15.844 -1.353 1.00 0.00 O ATOM 0 H GLU A 71 9.204 -11.209 -2.578 1.00 0.00 H new ATOM 0 HA GLU A 71 9.123 -12.610 -0.219 1.00 0.00 H new ATOM 0 HB2 GLU A 71 10.432 -12.950 -2.472 1.00 0.00 H new ATOM 0 HB3 GLU A 71 11.718 -12.068 -1.672 1.00 0.00 H new ATOM 0 HG2 GLU A 71 12.038 -14.483 -1.437 1.00 0.00 H new ATOM 0 HG3 GLU A 71 11.795 -13.731 0.127 1.00 0.00 H new ATOM 1130 N SER A 72 10.924 -11.771 1.452 1.00 0.00 N ATOM 1131 CA SER A 72 11.596 -11.108 2.563 1.00 0.00 C ATOM 1132 C SER A 72 12.911 -10.482 2.107 1.00 0.00 C ATOM 1133 O SER A 72 13.214 -9.336 2.440 1.00 0.00 O ATOM 1134 CB SER A 72 11.858 -12.102 3.696 1.00 0.00 C ATOM 1135 OG SER A 72 11.909 -11.444 4.950 1.00 0.00 O ATOM 0 H SER A 72 10.813 -12.778 1.567 1.00 0.00 H new ATOM 0 HA SER A 72 10.943 -10.315 2.929 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.073 -12.858 3.710 1.00 0.00 H new ATOM 0 HB3 SER A 72 12.798 -12.623 3.517 1.00 0.00 H new ATOM 0 HG SER A 72 12.076 -12.101 5.658 1.00 0.00 H new ATOM 1141 N GLY A 73 13.688 -11.243 1.343 1.00 0.00 N ATOM 1142 CA GLY A 73 14.961 -10.747 0.853 1.00 0.00 C ATOM 1143 C GLY A 73 15.574 -11.657 -0.193 1.00 0.00 C ATOM 1144 O GLY A 73 16.640 -12.233 0.023 1.00 0.00 O ATOM 0 H GLY A 73 13.459 -12.194 1.054 1.00 0.00 H new ATOM 0 HA2 GLY A 73 14.821 -9.753 0.428 1.00 0.00 H new ATOM 0 HA3 GLY A 73 15.653 -10.642 1.689 1.00 0.00 H new ATOM 1148 N ALA A 74 14.898 -11.788 -1.330 1.00 0.00 N ATOM 1149 CA ALA A 74 15.382 -12.634 -2.413 1.00 0.00 C ATOM 1150 C ALA A 74 16.805 -12.255 -2.811 1.00 0.00 C ATOM 1151 O ALA A 74 17.357 -11.273 -2.316 1.00 0.00 O ATOM 1152 CB ALA A 74 14.453 -12.538 -3.614 1.00 0.00 C ATOM 0 H ALA A 74 14.013 -11.319 -1.524 1.00 0.00 H new ATOM 0 HA ALA A 74 15.394 -13.665 -2.058 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.827 -13.175 -4.415 1.00 0.00 H new ATOM 0 HB2 ALA A 74 13.453 -12.864 -3.328 1.00 0.00 H new ATOM 0 HB3 ALA A 74 14.412 -11.505 -3.961 1.00 0.00 H new ATOM 1158 N ARG A 75 17.392 -13.041 -3.708 1.00 0.00 N ATOM 1159 CA ARG A 75 18.752 -12.788 -4.171 1.00 0.00 C ATOM 1160 C ARG A 75 18.777 -12.545 -5.677 1.00 0.00 C ATOM 1161 O ARG A 75 19.143 -11.463 -6.135 1.00 0.00 O ATOM 1162 CB ARG A 75 19.660 -13.967 -3.819 1.00 0.00 C ATOM 1163 CG ARG A 75 18.917 -15.283 -3.660 1.00 0.00 C ATOM 1164 CD ARG A 75 18.435 -15.482 -2.232 1.00 0.00 C ATOM 1165 NE ARG A 75 18.043 -16.865 -1.973 1.00 0.00 N ATOM 1166 CZ ARG A 75 18.906 -17.873 -1.905 1.00 0.00 C ATOM 1167 NH1 ARG A 75 20.203 -17.652 -2.075 1.00 0.00 N ATOM 1168 NH2 ARG A 75 18.473 -19.104 -1.666 1.00 0.00 N ATOM 0 H ARG A 75 16.948 -13.857 -4.128 1.00 0.00 H new ATOM 0 HA ARG A 75 19.119 -11.893 -3.670 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.415 -14.078 -4.597 1.00 0.00 H new ATOM 0 HB3 ARG A 75 20.188 -13.744 -2.892 1.00 0.00 H new ATOM 0 HG2 ARG A 75 18.065 -15.305 -4.339 1.00 0.00 H new ATOM 0 HG3 ARG A 75 19.571 -16.108 -3.943 1.00 0.00 H new ATOM 0 HD2 ARG A 75 19.226 -15.194 -1.539 1.00 0.00 H new ATOM 0 HD3 ARG A 75 17.588 -14.823 -2.041 1.00 0.00 H new ATOM 0 HE ARG A 75 17.053 -17.068 -1.837 1.00 0.00 H new ATOM 0 HH11 ARG A 75 20.540 -16.707 -2.258 1.00 0.00 H new ATOM 0 HH12 ARG A 75 20.864 -18.427 -2.022 1.00 0.00 H new ATOM 0 HH21 ARG A 75 17.477 -19.278 -1.534 1.00 0.00 H new ATOM 0 HH22 ARG A 75 19.137 -19.877 -1.614 1.00 0.00 H new ATOM 1182 N VAL A 76 18.385 -13.559 -6.442 1.00 0.00 N ATOM 1183 CA VAL A 76 18.362 -13.455 -7.896 1.00 0.00 C ATOM 1184 C VAL A 76 17.532 -14.575 -8.514 1.00 0.00 C ATOM 1185 O VAL A 76 17.299 -15.609 -7.886 1.00 0.00 O ATOM 1186 CB VAL A 76 19.785 -13.501 -8.485 1.00 0.00 C ATOM 1187 CG1 VAL A 76 20.323 -12.094 -8.692 1.00 0.00 C ATOM 1188 CG2 VAL A 76 20.708 -14.307 -7.583 1.00 0.00 C ATOM 0 H VAL A 76 18.079 -14.462 -6.079 1.00 0.00 H new ATOM 0 HA VAL A 76 17.908 -12.494 -8.137 1.00 0.00 H new ATOM 0 HB VAL A 76 19.742 -13.994 -9.456 1.00 0.00 H new ATOM 0 HG11 VAL A 76 21.329 -12.147 -9.109 1.00 0.00 H new ATOM 0 HG12 VAL A 76 19.673 -11.554 -9.380 1.00 0.00 H new ATOM 0 HG13 VAL A 76 20.353 -11.572 -7.736 1.00 0.00 H new ATOM 0 HG21 VAL A 76 21.709 -14.330 -8.014 1.00 0.00 H new ATOM 0 HG22 VAL A 76 20.748 -13.845 -6.597 1.00 0.00 H new ATOM 0 HG23 VAL A 76 20.329 -15.325 -7.492 1.00 0.00 H new ATOM 1198 N LEU A 77 17.088 -14.363 -9.748 1.00 0.00 N ATOM 1199 CA LEU A 77 16.284 -15.355 -10.452 1.00 0.00 C ATOM 1200 C LEU A 77 17.105 -16.056 -11.530 1.00 0.00 C ATOM 1201 O LEU A 77 18.218 -15.638 -11.849 1.00 0.00 O ATOM 1202 CB LEU A 77 15.056 -14.693 -11.080 1.00 0.00 C ATOM 1203 CG LEU A 77 13.905 -14.372 -10.126 1.00 0.00 C ATOM 1204 CD1 LEU A 77 13.321 -13.003 -10.436 1.00 0.00 C ATOM 1205 CD2 LEU A 77 12.829 -15.444 -10.208 1.00 0.00 C ATOM 0 H LEU A 77 17.271 -13.513 -10.281 1.00 0.00 H new ATOM 0 HA LEU A 77 15.957 -16.101 -9.728 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.373 -13.767 -11.560 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.678 -15.346 -11.866 1.00 0.00 H new ATOM 0 HG LEU A 77 14.296 -14.356 -9.109 1.00 0.00 H new ATOM 0 HD11 LEU A 77 12.503 -12.792 -9.747 1.00 0.00 H new ATOM 0 HD12 LEU A 77 14.095 -12.244 -10.324 1.00 0.00 H new ATOM 0 HD13 LEU A 77 12.946 -12.991 -11.459 1.00 0.00 H new ATOM 0 HD21 LEU A 77 12.018 -15.199 -9.522 1.00 0.00 H new ATOM 0 HD22 LEU A 77 12.441 -15.493 -11.226 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.256 -16.409 -9.935 1.00 0.00 H new ATOM 1217 N THR A 78 16.547 -17.125 -12.090 1.00 0.00 N ATOM 1218 CA THR A 78 17.226 -17.884 -13.133 1.00 0.00 C ATOM 1219 C THR A 78 17.149 -17.164 -14.475 1.00 0.00 C ATOM 1220 O THR A 78 16.708 -16.018 -14.551 1.00 0.00 O ATOM 1221 CB THR A 78 16.624 -19.294 -13.285 1.00 0.00 C ATOM 1222 OG1 THR A 78 15.340 -19.213 -13.914 1.00 0.00 O ATOM 1223 CG2 THR A 78 16.489 -19.973 -11.930 1.00 0.00 C ATOM 0 H THR A 78 15.626 -17.485 -11.838 1.00 0.00 H new ATOM 0 HA THR A 78 18.269 -17.973 -12.830 1.00 0.00 H new ATOM 0 HB THR A 78 17.295 -19.887 -13.906 1.00 0.00 H new ATOM 0 HG1 THR A 78 14.965 -20.113 -14.009 1.00 0.00 H new ATOM 0 HG21 THR A 78 16.062 -20.967 -12.062 1.00 0.00 H new ATOM 0 HG22 THR A 78 17.472 -20.059 -11.467 1.00 0.00 H new ATOM 0 HG23 THR A 78 15.836 -19.380 -11.289 1.00 0.00 H new ATOM 1231 N ALA A 79 17.581 -17.845 -15.532 1.00 0.00 N ATOM 1232 CA ALA A 79 17.558 -17.271 -16.871 1.00 0.00 C ATOM 1233 C ALA A 79 16.257 -17.609 -17.592 1.00 0.00 C ATOM 1234 O ALA A 79 16.107 -17.337 -18.783 1.00 0.00 O ATOM 1235 CB ALA A 79 18.752 -17.762 -17.676 1.00 0.00 C ATOM 0 H ALA A 79 17.951 -18.794 -15.486 1.00 0.00 H new ATOM 0 HA ALA A 79 17.618 -16.187 -16.775 1.00 0.00 H new ATOM 0 HB1 ALA A 79 18.722 -17.325 -18.674 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.674 -17.464 -17.177 1.00 0.00 H new ATOM 0 HB3 ALA A 79 18.716 -18.849 -17.754 1.00 0.00 H new ATOM 1241 N SER A 80 15.319 -18.204 -16.862 1.00 0.00 N ATOM 1242 CA SER A 80 14.032 -18.584 -17.433 1.00 0.00 C ATOM 1243 C SER A 80 12.893 -17.833 -16.750 1.00 0.00 C ATOM 1244 O SER A 80 12.079 -17.188 -17.410 1.00 0.00 O ATOM 1245 CB SER A 80 13.816 -20.092 -17.299 1.00 0.00 C ATOM 1246 OG SER A 80 13.034 -20.592 -18.370 1.00 0.00 O ATOM 0 H SER A 80 15.426 -18.433 -15.874 1.00 0.00 H new ATOM 0 HA SER A 80 14.038 -18.318 -18.490 1.00 0.00 H new ATOM 0 HB2 SER A 80 14.780 -20.600 -17.280 1.00 0.00 H new ATOM 0 HB3 SER A 80 13.322 -20.309 -16.352 1.00 0.00 H new ATOM 0 HG SER A 80 13.044 -21.572 -18.353 1.00 0.00 H new ATOM 1252 N GLU A 81 12.842 -17.924 -15.425 1.00 0.00 N ATOM 1253 CA GLU A 81 11.802 -17.254 -14.653 1.00 0.00 C ATOM 1254 C GLU A 81 11.721 -15.774 -15.018 1.00 0.00 C ATOM 1255 O GLU A 81 10.648 -15.172 -14.983 1.00 0.00 O ATOM 1256 CB GLU A 81 12.070 -17.407 -13.154 1.00 0.00 C ATOM 1257 CG GLU A 81 11.582 -18.727 -12.581 1.00 0.00 C ATOM 1258 CD GLU A 81 12.130 -18.999 -11.194 1.00 0.00 C ATOM 1259 OE1 GLU A 81 11.667 -18.345 -10.235 1.00 0.00 O ATOM 1260 OE2 GLU A 81 13.022 -19.863 -11.066 1.00 0.00 O ATOM 0 H GLU A 81 13.508 -18.455 -14.864 1.00 0.00 H new ATOM 0 HA GLU A 81 10.848 -17.723 -14.894 1.00 0.00 H new ATOM 0 HB2 GLU A 81 13.141 -17.316 -12.974 1.00 0.00 H new ATOM 0 HB3 GLU A 81 11.586 -16.588 -12.621 1.00 0.00 H new ATOM 0 HG2 GLU A 81 10.493 -18.721 -12.543 1.00 0.00 H new ATOM 0 HG3 GLU A 81 11.873 -19.538 -13.248 1.00 0.00 H new ATOM 1267 N THR A 82 12.865 -15.194 -15.367 1.00 0.00 N ATOM 1268 CA THR A 82 12.926 -13.785 -15.736 1.00 0.00 C ATOM 1269 C THR A 82 12.628 -13.592 -17.218 1.00 0.00 C ATOM 1270 O THR A 82 11.809 -12.753 -17.594 1.00 0.00 O ATOM 1271 CB THR A 82 14.306 -13.180 -15.418 1.00 0.00 C ATOM 1272 OG1 THR A 82 15.334 -13.937 -16.066 1.00 0.00 O ATOM 1273 CG2 THR A 82 14.555 -13.157 -13.918 1.00 0.00 C ATOM 0 H THR A 82 13.762 -15.678 -15.402 1.00 0.00 H new ATOM 0 HA THR A 82 12.168 -13.270 -15.146 1.00 0.00 H new ATOM 0 HB THR A 82 14.322 -12.155 -15.788 1.00 0.00 H new ATOM 0 HG1 THR A 82 15.714 -14.582 -15.433 1.00 0.00 H new ATOM 0 HG21 THR A 82 15.536 -12.725 -13.719 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.788 -12.555 -13.431 1.00 0.00 H new ATOM 0 HG23 THR A 82 14.520 -14.174 -13.528 1.00 0.00 H new ATOM 1281 N LYS A 83 13.297 -14.374 -18.058 1.00 0.00 N ATOM 1282 CA LYS A 83 13.103 -14.291 -19.501 1.00 0.00 C ATOM 1283 C LYS A 83 11.638 -14.504 -19.866 1.00 0.00 C ATOM 1284 O LYS A 83 11.190 -14.105 -20.942 1.00 0.00 O ATOM 1285 CB LYS A 83 13.973 -15.329 -20.214 1.00 0.00 C ATOM 1286 CG LYS A 83 13.727 -15.405 -21.711 1.00 0.00 C ATOM 1287 CD LYS A 83 14.834 -16.167 -22.420 1.00 0.00 C ATOM 1288 CE LYS A 83 15.995 -15.255 -22.782 1.00 0.00 C ATOM 1289 NZ LYS A 83 15.630 -14.292 -23.858 1.00 0.00 N ATOM 0 H LYS A 83 13.979 -15.073 -17.764 1.00 0.00 H new ATOM 0 HA LYS A 83 13.399 -13.293 -19.825 1.00 0.00 H new ATOM 0 HB2 LYS A 83 15.023 -15.093 -20.038 1.00 0.00 H new ATOM 0 HB3 LYS A 83 13.789 -16.309 -19.774 1.00 0.00 H new ATOM 0 HG2 LYS A 83 12.770 -15.892 -21.899 1.00 0.00 H new ATOM 0 HG3 LYS A 83 13.657 -14.397 -22.121 1.00 0.00 H new ATOM 0 HD2 LYS A 83 15.190 -16.974 -21.779 1.00 0.00 H new ATOM 0 HD3 LYS A 83 14.438 -16.629 -23.324 1.00 0.00 H new ATOM 0 HE2 LYS A 83 16.315 -14.706 -21.897 1.00 0.00 H new ATOM 0 HE3 LYS A 83 16.843 -15.858 -23.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 16.494 -13.945 -24.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 15.028 -14.768 -24.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 15.112 -13.490 -23.445 1.00 0.00 H new ATOM 1303 N THR A 84 10.893 -15.135 -18.963 1.00 0.00 N ATOM 1304 CA THR A 84 9.478 -15.400 -19.190 1.00 0.00 C ATOM 1305 C THR A 84 8.605 -14.376 -18.474 1.00 0.00 C ATOM 1306 O THR A 84 7.426 -14.621 -18.217 1.00 0.00 O ATOM 1307 CB THR A 84 9.088 -16.812 -18.715 1.00 0.00 C ATOM 1308 OG1 THR A 84 7.760 -17.125 -19.148 1.00 0.00 O ATOM 1309 CG2 THR A 84 9.169 -16.915 -17.199 1.00 0.00 C ATOM 0 H THR A 84 11.247 -15.472 -18.068 1.00 0.00 H new ATOM 0 HA THR A 84 9.311 -15.327 -20.265 1.00 0.00 H new ATOM 0 HB THR A 84 9.789 -17.524 -19.150 1.00 0.00 H new ATOM 0 HG1 THR A 84 7.171 -16.361 -18.975 1.00 0.00 H new ATOM 0 HG21 THR A 84 8.889 -17.921 -16.887 1.00 0.00 H new ATOM 0 HG22 THR A 84 10.188 -16.705 -16.874 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.488 -16.193 -16.748 1.00 0.00 H new ATOM 1317 N PHE A 85 9.190 -13.226 -18.155 1.00 0.00 N ATOM 1318 CA PHE A 85 8.465 -12.164 -17.468 1.00 0.00 C ATOM 1319 C PHE A 85 8.092 -11.045 -18.437 1.00 0.00 C ATOM 1320 O PHE A 85 6.987 -10.503 -18.381 1.00 0.00 O ATOM 1321 CB PHE A 85 9.307 -11.601 -16.321 1.00 0.00 C ATOM 1322 CG PHE A 85 8.535 -11.411 -15.047 1.00 0.00 C ATOM 1323 CD1 PHE A 85 8.287 -12.483 -14.205 1.00 0.00 C ATOM 1324 CD2 PHE A 85 8.057 -10.160 -14.691 1.00 0.00 C ATOM 1325 CE1 PHE A 85 7.576 -12.310 -13.033 1.00 0.00 C ATOM 1326 CE2 PHE A 85 7.346 -9.981 -13.520 1.00 0.00 C ATOM 1327 CZ PHE A 85 7.106 -11.058 -12.689 1.00 0.00 C ATOM 0 H PHE A 85 10.164 -13.006 -18.361 1.00 0.00 H new ATOM 0 HA PHE A 85 7.548 -12.589 -17.061 1.00 0.00 H new ATOM 0 HB2 PHE A 85 10.144 -12.273 -16.132 1.00 0.00 H new ATOM 0 HB3 PHE A 85 9.729 -10.644 -16.627 1.00 0.00 H new ATOM 0 HD1 PHE A 85 8.653 -13.464 -14.468 1.00 0.00 H new ATOM 0 HD2 PHE A 85 8.243 -9.315 -15.337 1.00 0.00 H new ATOM 0 HE1 PHE A 85 7.388 -13.154 -12.386 1.00 0.00 H new ATOM 0 HE2 PHE A 85 6.978 -9.001 -13.255 1.00 0.00 H new ATOM 0 HZ PHE A 85 6.552 -10.921 -11.772 1.00 0.00 H new ATOM 1337 N LEU A 86 9.020 -10.705 -19.323 1.00 0.00 N ATOM 1338 CA LEU A 86 8.791 -9.651 -20.305 1.00 0.00 C ATOM 1339 C LEU A 86 8.916 -10.193 -21.726 1.00 0.00 C ATOM 1340 O LEU A 86 8.377 -9.617 -22.670 1.00 0.00 O ATOM 1341 CB LEU A 86 9.783 -8.506 -20.095 1.00 0.00 C ATOM 1342 CG LEU A 86 11.264 -8.877 -20.180 1.00 0.00 C ATOM 1343 CD1 LEU A 86 11.680 -9.081 -21.628 1.00 0.00 C ATOM 1344 CD2 LEU A 86 12.121 -7.804 -19.523 1.00 0.00 C ATOM 0 H LEU A 86 9.939 -11.144 -19.382 1.00 0.00 H new ATOM 0 HA LEU A 86 7.777 -9.275 -20.167 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.579 -7.735 -20.838 1.00 0.00 H new ATOM 0 HB3 LEU A 86 9.595 -8.064 -19.116 1.00 0.00 H new ATOM 0 HG LEU A 86 11.416 -9.814 -19.644 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.737 -9.344 -21.669 1.00 0.00 H new ATOM 0 HD12 LEU A 86 11.088 -9.884 -22.067 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.513 -8.161 -22.188 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.172 -8.085 -19.593 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.965 -6.852 -20.031 1.00 0.00 H new ATOM 0 HD23 LEU A 86 11.841 -7.706 -18.474 1.00 0.00 H new ATOM 1356 N ALA A 87 9.630 -11.304 -21.868 1.00 0.00 N ATOM 1357 CA ALA A 87 9.822 -11.926 -23.172 1.00 0.00 C ATOM 1358 C ALA A 87 8.831 -13.064 -23.390 1.00 0.00 C ATOM 1359 O ALA A 87 8.996 -13.880 -24.296 1.00 0.00 O ATOM 1360 CB ALA A 87 11.250 -12.435 -23.309 1.00 0.00 C ATOM 0 H ALA A 87 10.085 -11.792 -21.096 1.00 0.00 H new ATOM 0 HA ALA A 87 9.641 -11.170 -23.937 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.379 -12.897 -24.288 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.945 -11.601 -23.207 1.00 0.00 H new ATOM 0 HB3 ALA A 87 11.450 -13.171 -22.531 1.00 0.00 H new ATOM 1366 N ALA A 88 7.800 -13.113 -22.552 1.00 0.00 N ATOM 1367 CA ALA A 88 6.781 -14.150 -22.654 1.00 0.00 C ATOM 1368 C ALA A 88 5.440 -13.562 -23.079 1.00 0.00 C ATOM 1369 O ALA A 88 4.693 -14.180 -23.837 1.00 0.00 O ATOM 1370 CB ALA A 88 6.641 -14.884 -21.328 1.00 0.00 C ATOM 0 H ALA A 88 7.649 -12.446 -21.795 1.00 0.00 H new ATOM 0 HA ALA A 88 7.095 -14.860 -23.419 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.877 -15.656 -21.418 1.00 0.00 H new ATOM 0 HB2 ALA A 88 7.593 -15.345 -21.065 1.00 0.00 H new ATOM 0 HB3 ALA A 88 6.353 -14.177 -20.550 1.00 0.00 H new ATOM 1376 N ALA A 89 5.141 -12.365 -22.585 1.00 0.00 N ATOM 1377 CA ALA A 89 3.890 -11.694 -22.915 1.00 0.00 C ATOM 1378 C ALA A 89 3.652 -11.686 -24.422 1.00 0.00 C ATOM 1379 O ALA A 89 2.731 -12.335 -24.918 1.00 0.00 O ATOM 1380 CB ALA A 89 3.895 -10.272 -22.372 1.00 0.00 C ATOM 0 H ALA A 89 5.748 -11.840 -21.955 1.00 0.00 H new ATOM 0 HA ALA A 89 3.075 -12.247 -22.448 1.00 0.00 H new ATOM 0 HB1 ALA A 89 2.955 -9.782 -22.626 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.011 -10.297 -21.288 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.723 -9.717 -22.813 1.00 0.00 H new ATOM 1386 N ASP A 90 4.487 -10.947 -25.144 1.00 0.00 N ATOM 1387 CA ASP A 90 4.367 -10.855 -26.594 1.00 0.00 C ATOM 1388 C ASP A 90 5.585 -10.160 -27.197 1.00 0.00 C ATOM 1389 O ASP A 90 6.505 -9.764 -26.480 1.00 0.00 O ATOM 1390 CB ASP A 90 3.093 -10.100 -26.976 1.00 0.00 C ATOM 1391 CG ASP A 90 1.944 -11.032 -27.303 1.00 0.00 C ATOM 1392 OD1 ASP A 90 2.049 -11.775 -28.301 1.00 0.00 O ATOM 1393 OD2 ASP A 90 0.938 -11.018 -26.562 1.00 0.00 O ATOM 0 H ASP A 90 5.254 -10.403 -24.749 1.00 0.00 H new ATOM 0 HA ASP A 90 4.313 -11.868 -26.994 1.00 0.00 H new ATOM 0 HB2 ASP A 90 2.803 -9.444 -26.155 1.00 0.00 H new ATOM 0 HB3 ASP A 90 3.296 -9.463 -27.837 1.00 0.00 H new ATOM 1453 N LYS A 96 9.617 -6.551 -25.463 1.00 0.00 N ATOM 1454 CA LYS A 96 9.593 -5.745 -24.248 1.00 0.00 C ATOM 1455 C LYS A 96 8.167 -5.327 -23.901 1.00 0.00 C ATOM 1456 O LYS A 96 7.350 -5.078 -24.789 1.00 0.00 O ATOM 1457 CB LYS A 96 10.472 -4.504 -24.417 1.00 0.00 C ATOM 1458 CG LYS A 96 10.057 -3.618 -25.579 1.00 0.00 C ATOM 1459 CD LYS A 96 11.094 -2.543 -25.859 1.00 0.00 C ATOM 1460 CE LYS A 96 12.160 -3.034 -26.825 1.00 0.00 C ATOM 1461 NZ LYS A 96 13.283 -2.064 -26.952 1.00 0.00 N ATOM 0 HA LYS A 96 9.985 -6.352 -23.432 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.442 -3.920 -23.497 1.00 0.00 H new ATOM 0 HB3 LYS A 96 11.506 -4.818 -24.562 1.00 0.00 H new ATOM 0 HG2 LYS A 96 9.915 -4.229 -26.471 1.00 0.00 H new ATOM 0 HG3 LYS A 96 9.098 -3.150 -25.357 1.00 0.00 H new ATOM 0 HD2 LYS A 96 10.604 -1.662 -26.274 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.563 -2.236 -24.924 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.546 -3.994 -26.482 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.713 -3.202 -27.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.989 -2.436 -27.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.919 -1.155 -27.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.727 -1.923 -26.022 1.00 0.00 H new ATOM 1475 N ILE A 97 7.876 -5.252 -22.607 1.00 0.00 N ATOM 1476 CA ILE A 97 6.550 -4.862 -22.145 1.00 0.00 C ATOM 1477 C ILE A 97 6.394 -3.345 -22.139 1.00 0.00 C ATOM 1478 O ILE A 97 7.351 -2.613 -21.892 1.00 0.00 O ATOM 1479 CB ILE A 97 6.266 -5.401 -20.730 1.00 0.00 C ATOM 1480 CG1 ILE A 97 6.679 -6.871 -20.628 1.00 0.00 C ATOM 1481 CG2 ILE A 97 4.794 -5.235 -20.385 1.00 0.00 C ATOM 1482 CD1 ILE A 97 5.898 -7.784 -21.548 1.00 0.00 C ATOM 0 H ILE A 97 8.540 -5.456 -21.860 1.00 0.00 H new ATOM 0 HA ILE A 97 5.833 -5.296 -22.842 1.00 0.00 H new ATOM 0 HB ILE A 97 6.854 -4.827 -20.014 1.00 0.00 H new ATOM 0 HG12 ILE A 97 7.741 -6.958 -20.858 1.00 0.00 H new ATOM 0 HG13 ILE A 97 6.547 -7.206 -19.599 1.00 0.00 H new ATOM 0 HG21 ILE A 97 4.610 -5.621 -19.382 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.529 -4.178 -20.422 1.00 0.00 H new ATOM 0 HG23 ILE A 97 4.188 -5.787 -21.103 1.00 0.00 H new ATOM 0 HD11 ILE A 97 6.244 -8.810 -21.422 1.00 0.00 H new ATOM 0 HD12 ILE A 97 4.837 -7.726 -21.303 1.00 0.00 H new ATOM 0 HD13 ILE A 97 6.049 -7.474 -22.582 1.00 0.00 H new ATOM 1494 N GLY A 98 5.178 -2.880 -22.412 1.00 0.00 N ATOM 1495 CA GLY A 98 4.918 -1.452 -22.431 1.00 0.00 C ATOM 1496 C GLY A 98 3.502 -1.115 -22.009 1.00 0.00 C ATOM 1497 O GLY A 98 2.749 -0.505 -22.767 1.00 0.00 O ATOM 0 H GLY A 98 4.369 -3.466 -22.620 1.00 0.00 H new ATOM 0 HA2 GLY A 98 5.621 -0.949 -21.767 1.00 0.00 H new ATOM 0 HA3 GLY A 98 5.096 -1.067 -23.435 1.00 0.00 H new ATOM 1501 N ALA A 99 3.138 -1.515 -20.795 1.00 0.00 N ATOM 1502 CA ALA A 99 1.802 -1.252 -20.272 1.00 0.00 C ATOM 1503 C ALA A 99 0.729 -1.691 -21.262 1.00 0.00 C ATOM 1504 O ALA A 99 -0.324 -1.062 -21.369 1.00 0.00 O ATOM 1505 CB ALA A 99 1.647 0.225 -19.942 1.00 0.00 C ATOM 0 H ALA A 99 3.749 -2.022 -20.155 1.00 0.00 H new ATOM 0 HA ALA A 99 1.675 -1.833 -19.358 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.645 0.408 -19.553 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.385 0.510 -19.192 1.00 0.00 H new ATOM 0 HB3 ALA A 99 1.799 0.817 -20.844 1.00 0.00 H new ATOM 1511 N GLU A 100 1.004 -2.772 -21.985 1.00 0.00 N ATOM 1512 CA GLU A 100 0.060 -3.293 -22.968 1.00 0.00 C ATOM 1513 C GLU A 100 0.114 -4.817 -23.019 1.00 0.00 C ATOM 1514 O GLU A 100 -0.910 -5.479 -23.181 1.00 0.00 O ATOM 1515 CB GLU A 100 0.361 -2.715 -24.352 1.00 0.00 C ATOM 1516 CG GLU A 100 0.009 -1.242 -24.486 1.00 0.00 C ATOM 1517 CD GLU A 100 0.714 -0.578 -25.653 1.00 0.00 C ATOM 1518 OE1 GLU A 100 0.588 -1.082 -26.788 1.00 0.00 O ATOM 1519 OE2 GLU A 100 1.392 0.447 -25.430 1.00 0.00 O ATOM 0 H GLU A 100 1.871 -3.304 -21.909 1.00 0.00 H new ATOM 0 HA GLU A 100 -0.943 -2.992 -22.666 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.421 -2.848 -24.569 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -0.192 -3.282 -25.101 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -1.069 -1.140 -24.612 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.273 -0.724 -23.564 1.00 0.00 H new ATOM 1526 N GLU A 101 1.317 -5.366 -22.880 1.00 0.00 N ATOM 1527 CA GLU A 101 1.504 -6.812 -22.912 1.00 0.00 C ATOM 1528 C GLU A 101 1.176 -7.433 -21.557 1.00 0.00 C ATOM 1529 O GLU A 101 0.394 -8.380 -21.468 1.00 0.00 O ATOM 1530 CB GLU A 101 2.942 -7.154 -23.307 1.00 0.00 C ATOM 1531 CG GLU A 101 3.483 -6.296 -24.439 1.00 0.00 C ATOM 1532 CD GLU A 101 2.502 -6.162 -25.588 1.00 0.00 C ATOM 1533 OE1 GLU A 101 1.770 -7.136 -25.860 1.00 0.00 O ATOM 1534 OE2 GLU A 101 2.467 -5.082 -26.214 1.00 0.00 O ATOM 0 H GLU A 101 2.175 -4.832 -22.744 1.00 0.00 H new ATOM 0 HA GLU A 101 0.823 -7.224 -23.656 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.586 -7.039 -22.435 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.989 -8.202 -23.602 1.00 0.00 H new ATOM 0 HG2 GLU A 101 3.725 -5.305 -24.055 1.00 0.00 H new ATOM 0 HG3 GLU A 101 4.412 -6.731 -24.808 1.00 0.00 H new ATOM 1541 N PHE A 102 1.780 -6.893 -20.503 1.00 0.00 N ATOM 1542 CA PHE A 102 1.554 -7.394 -19.153 1.00 0.00 C ATOM 1543 C PHE A 102 0.062 -7.467 -18.842 1.00 0.00 C ATOM 1544 O PHE A 102 -0.398 -8.390 -18.170 1.00 0.00 O ATOM 1545 CB PHE A 102 2.256 -6.499 -18.130 1.00 0.00 C ATOM 1546 CG PHE A 102 2.963 -7.265 -17.048 1.00 0.00 C ATOM 1547 CD1 PHE A 102 2.244 -8.001 -16.119 1.00 0.00 C ATOM 1548 CD2 PHE A 102 4.345 -7.248 -16.959 1.00 0.00 C ATOM 1549 CE1 PHE A 102 2.891 -8.707 -15.123 1.00 0.00 C ATOM 1550 CE2 PHE A 102 4.997 -7.953 -15.964 1.00 0.00 C ATOM 1551 CZ PHE A 102 4.269 -8.682 -15.045 1.00 0.00 C ATOM 0 H PHE A 102 2.430 -6.109 -20.558 1.00 0.00 H new ATOM 0 HA PHE A 102 1.970 -8.400 -19.092 1.00 0.00 H new ATOM 0 HB2 PHE A 102 2.978 -5.867 -18.647 1.00 0.00 H new ATOM 0 HB3 PHE A 102 1.521 -5.836 -17.674 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.166 -8.023 -16.174 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.920 -6.678 -17.674 1.00 0.00 H new ATOM 0 HE1 PHE A 102 2.319 -9.278 -14.406 1.00 0.00 H new ATOM 0 HE2 PHE A 102 6.075 -7.933 -15.906 1.00 0.00 H new ATOM 0 HZ PHE A 102 4.777 -9.232 -14.266 1.00 0.00 H new ATOM 1561 N GLN A 103 -0.688 -6.487 -19.336 1.00 0.00 N ATOM 1562 CA GLN A 103 -2.127 -6.439 -19.110 1.00 0.00 C ATOM 1563 C GLN A 103 -2.827 -7.599 -19.811 1.00 0.00 C ATOM 1564 O GLN A 103 -3.433 -8.452 -19.163 1.00 0.00 O ATOM 1565 CB GLN A 103 -2.699 -5.109 -19.606 1.00 0.00 C ATOM 1566 CG GLN A 103 -2.491 -3.958 -18.635 1.00 0.00 C ATOM 1567 CD GLN A 103 -1.035 -3.769 -18.257 1.00 0.00 C ATOM 1568 OE1 GLN A 103 -0.687 -3.738 -17.076 1.00 0.00 O ATOM 1569 NE2 GLN A 103 -0.174 -3.643 -19.260 1.00 0.00 N ATOM 0 H GLN A 103 -0.323 -5.716 -19.895 1.00 0.00 H new ATOM 0 HA GLN A 103 -2.304 -6.525 -18.038 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -2.236 -4.857 -20.560 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -3.766 -5.229 -19.792 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -2.869 -3.038 -19.082 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -3.076 -4.138 -17.733 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.506 -3.675 -20.224 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.819 -3.515 -19.066 1.00 0.00 H new ATOM 1578 N GLU A 104 -2.739 -7.623 -21.137 1.00 0.00 N ATOM 1579 CA GLU A 104 -3.365 -8.679 -21.924 1.00 0.00 C ATOM 1580 C GLU A 104 -2.928 -10.056 -21.433 1.00 0.00 C ATOM 1581 O GLU A 104 -3.651 -11.040 -21.588 1.00 0.00 O ATOM 1582 CB GLU A 104 -3.014 -8.518 -23.405 1.00 0.00 C ATOM 1583 CG GLU A 104 -1.523 -8.590 -23.688 1.00 0.00 C ATOM 1584 CD GLU A 104 -1.203 -8.474 -25.166 1.00 0.00 C ATOM 1585 OE1 GLU A 104 -1.074 -7.334 -25.658 1.00 0.00 O ATOM 1586 OE2 GLU A 104 -1.082 -9.525 -25.830 1.00 0.00 O ATOM 0 H GLU A 104 -2.241 -6.924 -21.688 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.445 -8.595 -21.803 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.522 -9.295 -23.977 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -3.397 -7.561 -23.758 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -1.015 -7.792 -23.147 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.130 -9.533 -23.308 1.00 0.00 H new ATOM 1593 N MET A 105 -1.740 -10.117 -20.841 1.00 0.00 N ATOM 1594 CA MET A 105 -1.206 -11.373 -20.327 1.00 0.00 C ATOM 1595 C MET A 105 -2.061 -11.896 -19.176 1.00 0.00 C ATOM 1596 O MET A 105 -2.457 -13.062 -19.164 1.00 0.00 O ATOM 1597 CB MET A 105 0.238 -11.185 -19.860 1.00 0.00 C ATOM 1598 CG MET A 105 0.846 -12.436 -19.246 1.00 0.00 C ATOM 1599 SD MET A 105 2.230 -12.069 -18.149 1.00 0.00 S ATOM 1600 CE MET A 105 3.344 -11.235 -19.277 1.00 0.00 C ATOM 0 H MET A 105 -1.129 -9.312 -20.705 1.00 0.00 H new ATOM 0 HA MET A 105 -1.226 -12.105 -21.134 1.00 0.00 H new ATOM 0 HB2 MET A 105 0.848 -10.873 -20.708 1.00 0.00 H new ATOM 0 HB3 MET A 105 0.272 -10.378 -19.129 1.00 0.00 H new ATOM 0 HG2 MET A 105 0.078 -12.973 -18.689 1.00 0.00 H new ATOM 0 HG3 MET A 105 1.184 -13.099 -20.042 1.00 0.00 H new ATOM 0 HE1 MET A 105 4.227 -10.898 -18.734 1.00 0.00 H new ATOM 0 HE2 MET A 105 3.645 -11.923 -20.067 1.00 0.00 H new ATOM 0 HE3 MET A 105 2.839 -10.376 -19.718 1.00 0.00 H new ATOM 1610 N VAL A 106 -2.340 -11.027 -18.210 1.00 0.00 N ATOM 1611 CA VAL A 106 -3.148 -11.401 -17.055 1.00 0.00 C ATOM 1612 C VAL A 106 -4.634 -11.388 -17.397 1.00 0.00 C ATOM 1613 O VAL A 106 -5.355 -12.342 -17.107 1.00 0.00 O ATOM 1614 CB VAL A 106 -2.898 -10.456 -15.865 1.00 0.00 C ATOM 1615 CG1 VAL A 106 -3.661 -10.930 -14.638 1.00 0.00 C ATOM 1616 CG2 VAL A 106 -1.409 -10.354 -15.571 1.00 0.00 C ATOM 0 H VAL A 106 -2.019 -10.059 -18.204 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.851 -12.412 -16.775 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.262 -9.463 -16.128 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -3.472 -10.250 -13.807 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -4.729 -10.947 -14.858 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -3.330 -11.933 -14.369 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -1.250 -9.682 -14.727 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -1.018 -11.342 -15.327 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -0.891 -9.965 -16.447 1.00 0.00 H new ATOM 1626 N GLN A 107 -5.084 -10.301 -18.015 1.00 0.00 N ATOM 1627 CA GLN A 107 -6.485 -10.164 -18.395 1.00 0.00 C ATOM 1628 C GLN A 107 -6.911 -11.298 -19.321 1.00 0.00 C ATOM 1629 O GLN A 107 -8.027 -11.809 -19.221 1.00 0.00 O ATOM 1630 CB GLN A 107 -6.720 -8.816 -19.080 1.00 0.00 C ATOM 1631 CG GLN A 107 -6.289 -7.624 -18.241 1.00 0.00 C ATOM 1632 CD GLN A 107 -6.235 -7.942 -16.759 1.00 0.00 C ATOM 1633 OE1 GLN A 107 -5.162 -7.959 -16.155 1.00 0.00 O ATOM 1634 NE2 GLN A 107 -7.395 -8.197 -16.165 1.00 0.00 N ATOM 0 H GLN A 107 -4.499 -9.503 -18.263 1.00 0.00 H new ATOM 0 HA GLN A 107 -7.088 -10.213 -17.488 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -6.178 -8.799 -20.026 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -7.779 -8.718 -19.318 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -5.307 -7.287 -18.572 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -6.981 -6.799 -18.407 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -8.260 -8.172 -16.704 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -7.421 -8.418 -15.170 1.00 0.00 H new ATOM 1643 N SER A 108 -6.015 -11.688 -20.222 1.00 0.00 N ATOM 1644 CA SER A 108 -6.300 -12.761 -21.169 1.00 0.00 C ATOM 1645 C SER A 108 -7.608 -12.499 -21.908 1.00 0.00 C ATOM 1646 O SER A 108 -8.309 -13.431 -22.299 1.00 0.00 O ATOM 1647 CB SER A 108 -6.372 -14.105 -20.442 1.00 0.00 C ATOM 1648 OG SER A 108 -5.077 -14.642 -20.235 1.00 0.00 O ATOM 0 H SER A 108 -5.086 -11.278 -20.317 1.00 0.00 H new ATOM 0 HA SER A 108 -5.491 -12.794 -21.899 1.00 0.00 H new ATOM 0 HB2 SER A 108 -6.874 -13.977 -19.483 1.00 0.00 H new ATOM 0 HB3 SER A 108 -6.971 -14.805 -21.024 1.00 0.00 H new ATOM 0 HG SER A 108 -4.471 -13.931 -19.939 1.00 0.00 H new