USER MOD reduce.3.24.130724 H: found=0, std=0, add=539, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 531 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 189 TYR OH : rot 53:sc= 1.22 USER MOD Set 1.2: A 193 GLN : amide:sc= 0.939 K(o=2.2,f=-0.24) USER MOD Set 2.1: A 171 CYS SG : rot 114:sc= 0.487 USER MOD Set 2.2: A 177 CYS SG : rot -44:sc= 0.255 USER MOD Set 2.3: A 187 CYS SG : rot 177:sc= 0.00474 USER MOD Set 2.4: A 190 CYS SG : rot -110:sc= -0.323 USER MOD Set 3.1: A 170 THR OG1 : rot 137:sc= 0.481 USER MOD Set 3.2: A 188 GLN : amide:sc= 3.18 K(o=3.7,f=-11!) USER MOD Set 4.1: A 169 TYR OH : rot 176:sc= 1.19 USER MOD Set 4.2: A 192 TYR OH : rot 180:sc= 0.966 USER MOD Set 5.1: A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 150 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 143 SER OG : rot 62:sc= 0.738 USER MOD Set 6.2: A 146 HIS : no HE2:sc= 0.737 K(o=1.5,f=-8.4!) USER MOD Set 7.1: A 135 CYS SG : rot 30:sc= 0.955 USER MOD Set 7.2: A 138 CYS SG : rot -31:sc= 0.348 USER MOD Set 7.3: A 151 SER OG : rot 24:sc= 1.47 USER MOD Set 7.4: A 152 CYS SG : rot -67:sc= 0.398 USER MOD Set 7.5: A 155 CYS SG : rot 155:sc= 0.203 USER MOD Set 7.6: A 200 MET CE :methyl 177:sc= -0.122 (180deg=-0.0255) USER MOD Single : A 133 HIS : no HD1:sc= -0.614 X(o=-0.61,f=-0.16) USER MOD Single : A 142 SER OG : rot 85:sc= 1.01 USER MOD Single : A 147 TYR OH : rot -169:sc= 1.11 USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 LYS NZ :NH3+ -143:sc= -0.0471 (180deg=-0.751) USER MOD Single : A 162 THR OG1 : rot -180:sc= 1.58 USER MOD Single : A 165 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0373) USER MOD Single : A 168 THR OG1 : rot 180:sc= 0.0122 USER MOD Single : A 174 ASN : amide:sc= 0.856 K(o=0.86,f=-0.00022) USER MOD Single : A 175 LYS NZ :NH3+ 172:sc= 0.452 (180deg=0.312) USER MOD Single : A 194 LYS NZ :NH3+ -162:sc= 0.776 (180deg=0.31) USER MOD Single : A 198 MET CE :methyl -168:sc= -0.996 (180deg=-1.3) USER MOD Single : A 201 LYS NZ :NH3+ -151:sc= 1.03 (180deg=0.314) USER MOD Single : A 206 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD ----------------------------------------------------------------- ATOM 57 N HIS A 133 -2.547 -4.979 15.425 1.00 0.00 N ATOM 58 CA HIS A 133 -3.120 -3.936 14.592 1.00 0.00 C ATOM 59 C HIS A 133 -3.565 -4.473 13.235 1.00 0.00 C ATOM 60 O HIS A 133 -2.825 -5.200 12.571 1.00 0.00 O ATOM 61 CB HIS A 133 -2.108 -2.802 14.402 1.00 0.00 C ATOM 62 CG HIS A 133 -1.825 -2.023 15.659 1.00 0.00 C ATOM 63 ND1 HIS A 133 -0.961 -2.384 16.668 1.00 0.00 N ATOM 64 CD2 HIS A 133 -2.362 -0.808 15.987 1.00 0.00 C ATOM 65 CE1 HIS A 133 -0.985 -1.404 17.588 1.00 0.00 C ATOM 66 NE2 HIS A 133 -1.831 -0.427 17.223 1.00 0.00 N ATOM 0 HA HIS A 133 -4.005 -3.554 15.102 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -1.174 -3.220 14.027 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -2.481 -2.119 13.639 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -3.069 -0.244 15.397 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.403 -1.403 18.498 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -2.044 0.424 17.744 1.00 0.00 H new ATOM 74 N ILE A 134 -4.756 -4.064 12.799 1.00 0.00 N ATOM 75 CA ILE A 134 -5.240 -4.402 11.475 1.00 0.00 C ATOM 76 C ILE A 134 -4.538 -3.492 10.464 1.00 0.00 C ATOM 77 O ILE A 134 -4.220 -2.341 10.753 1.00 0.00 O ATOM 78 CB ILE A 134 -6.778 -4.370 11.383 1.00 0.00 C ATOM 79 CG1 ILE A 134 -7.498 -3.309 12.237 1.00 0.00 C ATOM 80 CG2 ILE A 134 -7.307 -5.756 11.766 1.00 0.00 C ATOM 81 CD1 ILE A 134 -7.091 -1.872 11.904 1.00 0.00 C ATOM 0 H ILE A 134 -5.400 -3.497 13.350 1.00 0.00 H new ATOM 0 HA ILE A 134 -4.989 -5.436 11.240 1.00 0.00 H new ATOM 0 HB ILE A 134 -6.999 -4.088 10.354 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -8.574 -3.414 12.099 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -7.291 -3.501 13.290 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -8.395 -5.759 11.708 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -6.905 -6.501 11.079 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -6.997 -5.995 12.783 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -7.639 -1.181 12.545 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -6.021 -1.749 12.069 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -7.324 -1.661 10.860 1.00 0.00 H new ATOM 93 N CYS A 135 -4.239 -4.044 9.293 1.00 0.00 N ATOM 94 CA CYS A 135 -3.515 -3.369 8.243 1.00 0.00 C ATOM 95 C CYS A 135 -4.350 -2.219 7.712 1.00 0.00 C ATOM 96 O CYS A 135 -5.448 -2.446 7.211 1.00 0.00 O ATOM 97 CB CYS A 135 -3.186 -4.356 7.122 1.00 0.00 C ATOM 98 SG CYS A 135 -2.468 -3.589 5.652 1.00 0.00 S ATOM 0 H CYS A 135 -4.504 -4.998 9.050 1.00 0.00 H new ATOM 0 HA CYS A 135 -2.580 -2.972 8.640 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -2.492 -5.105 7.504 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -4.097 -4.882 6.836 1.00 0.00 H new ATOM 0 HG CYS A 135 -1.791 -2.535 5.999 1.00 0.00 H new ATOM 103 N ALA A 136 -3.810 -1.005 7.794 1.00 0.00 N ATOM 104 CA ALA A 136 -4.457 0.206 7.319 1.00 0.00 C ATOM 105 C ALA A 136 -5.130 0.016 5.957 1.00 0.00 C ATOM 106 O ALA A 136 -6.273 0.412 5.753 1.00 0.00 O ATOM 107 CB ALA A 136 -3.392 1.304 7.248 1.00 0.00 C ATOM 0 H ALA A 136 -2.890 -0.837 8.202 1.00 0.00 H new ATOM 0 HA ALA A 136 -5.254 0.479 8.011 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -3.846 2.229 6.894 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -2.968 1.464 8.239 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.602 1.001 6.560 1.00 0.00 H new ATOM 113 N ILE A 137 -4.388 -0.561 5.012 1.00 0.00 N ATOM 114 CA ILE A 137 -4.823 -0.692 3.629 1.00 0.00 C ATOM 115 C ILE A 137 -5.884 -1.774 3.384 1.00 0.00 C ATOM 116 O ILE A 137 -6.781 -1.529 2.583 1.00 0.00 O ATOM 117 CB ILE A 137 -3.594 -0.834 2.708 1.00 0.00 C ATOM 118 CG1 ILE A 137 -2.669 0.388 2.859 1.00 0.00 C ATOM 119 CG2 ILE A 137 -3.986 -0.965 1.224 1.00 0.00 C ATOM 120 CD1 ILE A 137 -1.260 0.093 2.352 1.00 0.00 C ATOM 0 H ILE A 137 -3.463 -0.952 5.190 1.00 0.00 H new ATOM 0 HA ILE A 137 -5.350 0.229 3.377 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.081 -1.746 3.013 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.086 1.231 2.307 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.625 0.684 3.907 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -3.086 -1.062 0.617 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.611 -1.847 1.089 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.538 -0.078 0.914 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -0.636 0.978 2.475 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -0.834 -0.733 2.922 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -1.302 -0.178 1.297 1.00 0.00 H new ATOM 132 N CYS A 138 -5.769 -2.968 3.990 1.00 0.00 N ATOM 133 CA CYS A 138 -6.665 -4.092 3.676 1.00 0.00 C ATOM 134 C CYS A 138 -7.270 -4.850 4.866 1.00 0.00 C ATOM 135 O CYS A 138 -8.073 -5.759 4.661 1.00 0.00 O ATOM 136 CB CYS A 138 -5.942 -5.048 2.720 1.00 0.00 C ATOM 137 SG CYS A 138 -4.393 -5.768 3.317 1.00 0.00 S ATOM 0 H CYS A 138 -5.066 -3.179 4.698 1.00 0.00 H new ATOM 0 HA CYS A 138 -7.541 -3.641 3.210 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -6.623 -5.862 2.472 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -5.735 -4.512 1.794 1.00 0.00 H new ATOM 0 HG CYS A 138 -3.805 -4.930 4.118 1.00 0.00 H new ATOM 142 N GLY A 139 -6.937 -4.492 6.105 1.00 0.00 N ATOM 143 CA GLY A 139 -7.519 -5.114 7.291 1.00 0.00 C ATOM 144 C GLY A 139 -6.882 -6.447 7.708 1.00 0.00 C ATOM 145 O GLY A 139 -7.346 -7.075 8.654 1.00 0.00 O ATOM 0 H GLY A 139 -6.256 -3.762 6.314 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -7.440 -4.415 8.124 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -8.582 -5.278 7.112 1.00 0.00 H new ATOM 149 N ASP A 140 -5.811 -6.881 7.039 1.00 0.00 N ATOM 150 CA ASP A 140 -5.079 -8.099 7.382 1.00 0.00 C ATOM 151 C ASP A 140 -4.332 -7.869 8.700 1.00 0.00 C ATOM 152 O ASP A 140 -4.102 -6.725 9.071 1.00 0.00 O ATOM 153 CB ASP A 140 -4.060 -8.410 6.278 1.00 0.00 C ATOM 154 CG ASP A 140 -4.690 -8.935 4.992 1.00 0.00 C ATOM 155 OD1 ASP A 140 -5.670 -8.308 4.533 1.00 0.00 O ATOM 156 OD2 ASP A 140 -4.176 -9.953 4.483 1.00 0.00 O ATOM 0 H ASP A 140 -5.424 -6.389 6.234 1.00 0.00 H new ATOM 0 HA ASP A 140 -5.774 -8.933 7.482 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -3.495 -7.506 6.052 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -3.348 -9.146 6.650 1.00 0.00 H new ATOM 161 N ARG A 141 -3.902 -8.916 9.406 1.00 0.00 N ATOM 162 CA ARG A 141 -3.125 -8.715 10.627 1.00 0.00 C ATOM 163 C ARG A 141 -1.788 -8.077 10.231 1.00 0.00 C ATOM 164 O ARG A 141 -1.059 -8.639 9.414 1.00 0.00 O ATOM 165 CB ARG A 141 -2.951 -10.050 11.363 1.00 0.00 C ATOM 166 CG ARG A 141 -2.621 -9.898 12.857 1.00 0.00 C ATOM 167 CD ARG A 141 -1.211 -9.370 13.150 1.00 0.00 C ATOM 168 NE ARG A 141 -0.788 -9.744 14.509 1.00 0.00 N ATOM 169 CZ ARG A 141 0.399 -9.434 15.053 1.00 0.00 C ATOM 170 NH1 ARG A 141 1.253 -8.628 14.414 1.00 0.00 N ATOM 171 NH2 ARG A 141 0.734 -9.943 16.242 1.00 0.00 N ATOM 0 H ARG A 141 -4.074 -9.891 9.160 1.00 0.00 H new ATOM 0 HA ARG A 141 -3.637 -8.047 11.320 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -3.867 -10.632 11.260 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -2.156 -10.619 10.881 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -3.348 -9.224 13.309 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -2.740 -10.867 13.342 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -0.508 -9.773 12.421 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -1.194 -8.285 13.044 1.00 0.00 H new ATOM 0 HE ARG A 141 -1.445 -10.278 15.079 1.00 0.00 H new ATOM 0 HH11 ARG A 141 1.005 -8.242 13.503 1.00 0.00 H new ATOM 0 HH12 ARG A 141 2.152 -8.399 14.837 1.00 0.00 H new ATOM 0 HH21 ARG A 141 0.089 -10.564 16.731 1.00 0.00 H new ATOM 0 HH22 ARG A 141 1.635 -9.711 16.661 1.00 0.00 H new ATOM 185 N SER A 142 -1.476 -6.893 10.763 1.00 0.00 N ATOM 186 CA SER A 142 -0.253 -6.188 10.401 1.00 0.00 C ATOM 187 C SER A 142 0.991 -6.939 10.861 1.00 0.00 C ATOM 188 O SER A 142 1.014 -7.471 11.967 1.00 0.00 O ATOM 189 CB SER A 142 -0.226 -4.796 11.033 1.00 0.00 C ATOM 190 OG SER A 142 -1.338 -4.048 10.604 1.00 0.00 O ATOM 0 H SER A 142 -2.056 -6.406 11.446 1.00 0.00 H new ATOM 0 HA SER A 142 -0.247 -6.113 9.314 1.00 0.00 H new ATOM 0 HB2 SER A 142 -0.233 -4.881 12.120 1.00 0.00 H new ATOM 0 HB3 SER A 142 0.695 -4.282 10.759 1.00 0.00 H new ATOM 0 HG SER A 142 -2.107 -4.248 11.177 1.00 0.00 H new ATOM 196 N SER A 143 2.052 -6.905 10.055 1.00 0.00 N ATOM 197 CA SER A 143 3.347 -7.443 10.424 1.00 0.00 C ATOM 198 C SER A 143 4.117 -6.355 11.173 1.00 0.00 C ATOM 199 O SER A 143 4.868 -6.665 12.092 1.00 0.00 O ATOM 200 CB SER A 143 4.087 -7.947 9.182 1.00 0.00 C ATOM 201 OG SER A 143 3.781 -7.162 8.046 1.00 0.00 O ATOM 0 H SER A 143 2.029 -6.498 9.120 1.00 0.00 H new ATOM 0 HA SER A 143 3.240 -8.305 11.083 1.00 0.00 H new ATOM 0 HB2 SER A 143 5.162 -7.925 9.363 1.00 0.00 H new ATOM 0 HB3 SER A 143 3.817 -8.986 8.992 1.00 0.00 H new ATOM 0 HG SER A 143 4.068 -6.238 8.200 1.00 0.00 H new ATOM 207 N GLY A 144 3.929 -5.079 10.805 1.00 0.00 N ATOM 208 CA GLY A 144 4.602 -3.997 11.501 1.00 0.00 C ATOM 209 C GLY A 144 4.104 -2.624 11.061 1.00 0.00 C ATOM 210 O GLY A 144 3.307 -2.496 10.129 1.00 0.00 O ATOM 0 H GLY A 144 3.323 -4.784 10.039 1.00 0.00 H new ATOM 0 HA2 GLY A 144 4.450 -4.109 12.574 1.00 0.00 H new ATOM 0 HA3 GLY A 144 5.675 -4.066 11.322 1.00 0.00 H new ATOM 214 N LYS A 145 4.599 -1.591 11.748 1.00 0.00 N ATOM 215 CA LYS A 145 4.288 -0.194 11.487 1.00 0.00 C ATOM 216 C LYS A 145 5.145 0.263 10.304 1.00 0.00 C ATOM 217 O LYS A 145 6.070 1.066 10.437 1.00 0.00 O ATOM 218 CB LYS A 145 4.495 0.602 12.783 1.00 0.00 C ATOM 219 CG LYS A 145 3.821 1.975 12.721 1.00 0.00 C ATOM 220 CD LYS A 145 3.862 2.649 14.097 1.00 0.00 C ATOM 221 CE LYS A 145 3.096 3.976 14.063 1.00 0.00 C ATOM 222 NZ LYS A 145 3.039 4.593 15.398 1.00 0.00 N ATOM 0 H LYS A 145 5.248 -1.714 12.525 1.00 0.00 H new ATOM 0 HA LYS A 145 3.249 -0.030 11.200 1.00 0.00 H new ATOM 0 HB2 LYS A 145 4.093 0.037 13.624 1.00 0.00 H new ATOM 0 HB3 LYS A 145 5.562 0.729 12.965 1.00 0.00 H new ATOM 0 HG2 LYS A 145 4.325 2.602 11.986 1.00 0.00 H new ATOM 0 HG3 LYS A 145 2.787 1.866 12.392 1.00 0.00 H new ATOM 0 HD2 LYS A 145 3.425 1.988 14.846 1.00 0.00 H new ATOM 0 HD3 LYS A 145 4.896 2.826 14.392 1.00 0.00 H new ATOM 0 HE2 LYS A 145 3.578 4.659 13.364 1.00 0.00 H new ATOM 0 HE3 LYS A 145 2.084 3.805 13.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 2.515 5.490 15.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 2.557 3.949 16.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 4.005 4.777 15.737 1.00 0.00 H new ATOM 236 N HIS A 146 4.839 -0.281 9.129 1.00 0.00 N ATOM 237 CA HIS A 146 5.610 -0.060 7.920 1.00 0.00 C ATOM 238 C HIS A 146 5.370 1.351 7.394 1.00 0.00 C ATOM 239 O HIS A 146 4.233 1.789 7.227 1.00 0.00 O ATOM 240 CB HIS A 146 5.229 -1.117 6.881 1.00 0.00 C ATOM 241 CG HIS A 146 5.393 -2.532 7.383 1.00 0.00 C ATOM 242 ND1 HIS A 146 6.409 -2.997 8.189 1.00 0.00 N ATOM 243 CD2 HIS A 146 4.533 -3.572 7.162 1.00 0.00 C ATOM 244 CE1 HIS A 146 6.168 -4.297 8.433 1.00 0.00 C ATOM 245 NE2 HIS A 146 5.039 -4.693 7.826 1.00 0.00 N ATOM 0 H HIS A 146 4.036 -0.896 8.994 1.00 0.00 H new ATOM 0 HA HIS A 146 6.674 -0.153 8.136 1.00 0.00 H new ATOM 0 HB2 HIS A 146 4.193 -0.963 6.579 1.00 0.00 H new ATOM 0 HB3 HIS A 146 5.844 -0.981 5.991 1.00 0.00 H new ATOM 0 HD1 HIS A 146 7.199 -2.454 8.537 1.00 0.00 H new ATOM 0 HD2 HIS A 146 3.625 -3.534 6.579 1.00 0.00 H new ATOM 0 HE1 HIS A 146 6.797 -4.935 9.035 1.00 0.00 H new ATOM 253 N TYR A 147 6.466 2.081 7.178 1.00 0.00 N ATOM 254 CA TYR A 147 6.452 3.465 6.722 1.00 0.00 C ATOM 255 C TYR A 147 5.596 4.334 7.652 1.00 0.00 C ATOM 256 O TYR A 147 4.985 5.305 7.210 1.00 0.00 O ATOM 257 CB TYR A 147 6.000 3.544 5.255 1.00 0.00 C ATOM 258 CG TYR A 147 6.500 2.413 4.375 1.00 0.00 C ATOM 259 CD1 TYR A 147 7.878 2.229 4.153 1.00 0.00 C ATOM 260 CD2 TYR A 147 5.588 1.463 3.884 1.00 0.00 C ATOM 261 CE1 TYR A 147 8.337 1.117 3.430 1.00 0.00 C ATOM 262 CE2 TYR A 147 6.046 0.364 3.142 1.00 0.00 C ATOM 263 CZ TYR A 147 7.420 0.194 2.909 1.00 0.00 C ATOM 264 OH TYR A 147 7.868 -0.867 2.186 1.00 0.00 O ATOM 0 H TYR A 147 7.407 1.715 7.320 1.00 0.00 H new ATOM 0 HA TYR A 147 7.465 3.864 6.764 1.00 0.00 H new ATOM 0 HB2 TYR A 147 4.910 3.555 5.225 1.00 0.00 H new ATOM 0 HB3 TYR A 147 6.340 4.491 4.835 1.00 0.00 H new ATOM 0 HD1 TYR A 147 8.585 2.947 4.541 1.00 0.00 H new ATOM 0 HD2 TYR A 147 4.532 1.579 4.078 1.00 0.00 H new ATOM 0 HE1 TYR A 147 9.396 0.973 3.275 1.00 0.00 H new ATOM 0 HE2 TYR A 147 5.340 -0.353 2.749 1.00 0.00 H new ATOM 0 HH TYR A 147 7.110 -1.311 1.752 1.00 0.00 H new ATOM 274 N GLY A 148 5.552 3.978 8.942 1.00 0.00 N ATOM 275 CA GLY A 148 4.796 4.700 9.952 1.00 0.00 C ATOM 276 C GLY A 148 3.328 4.270 10.055 1.00 0.00 C ATOM 277 O GLY A 148 2.603 4.850 10.859 1.00 0.00 O ATOM 0 H GLY A 148 6.050 3.168 9.310 1.00 0.00 H new ATOM 0 HA2 GLY A 148 5.275 4.558 10.921 1.00 0.00 H new ATOM 0 HA3 GLY A 148 4.837 5.766 9.729 1.00 0.00 H new ATOM 281 N VAL A 149 2.877 3.272 9.283 1.00 0.00 N ATOM 282 CA VAL A 149 1.489 2.819 9.291 1.00 0.00 C ATOM 283 C VAL A 149 1.426 1.303 9.505 1.00 0.00 C ATOM 284 O VAL A 149 2.145 0.547 8.857 1.00 0.00 O ATOM 285 CB VAL A 149 0.825 3.226 7.966 1.00 0.00 C ATOM 286 CG1 VAL A 149 -0.621 2.736 7.885 1.00 0.00 C ATOM 287 CG2 VAL A 149 0.848 4.749 7.766 1.00 0.00 C ATOM 0 H VAL A 149 3.472 2.757 8.634 1.00 0.00 H new ATOM 0 HA VAL A 149 0.949 3.287 10.114 1.00 0.00 H new ATOM 0 HB VAL A 149 1.406 2.753 7.175 1.00 0.00 H new ATOM 0 HG11 VAL A 149 -1.057 3.043 6.934 1.00 0.00 H new ATOM 0 HG12 VAL A 149 -0.641 1.649 7.959 1.00 0.00 H new ATOM 0 HG13 VAL A 149 -1.197 3.166 8.704 1.00 0.00 H new ATOM 0 HG21 VAL A 149 0.370 4.999 6.819 1.00 0.00 H new ATOM 0 HG22 VAL A 149 0.310 5.231 8.582 1.00 0.00 H new ATOM 0 HG23 VAL A 149 1.880 5.099 7.755 1.00 0.00 H new ATOM 297 N TYR A 150 0.551 0.846 10.406 1.00 0.00 N ATOM 298 CA TYR A 150 0.356 -0.575 10.668 1.00 0.00 C ATOM 299 C TYR A 150 -0.082 -1.269 9.380 1.00 0.00 C ATOM 300 O TYR A 150 -1.113 -0.910 8.804 1.00 0.00 O ATOM 301 CB TYR A 150 -0.668 -0.766 11.790 1.00 0.00 C ATOM 302 CG TYR A 150 -0.234 -0.166 13.113 1.00 0.00 C ATOM 303 CD1 TYR A 150 0.850 -0.727 13.814 1.00 0.00 C ATOM 304 CD2 TYR A 150 -0.884 0.972 13.626 1.00 0.00 C ATOM 305 CE1 TYR A 150 1.299 -0.135 15.006 1.00 0.00 C ATOM 306 CE2 TYR A 150 -0.429 1.567 14.815 1.00 0.00 C ATOM 307 CZ TYR A 150 0.655 1.006 15.510 1.00 0.00 C ATOM 308 OH TYR A 150 1.091 1.567 16.673 1.00 0.00 O ATOM 0 H TYR A 150 -0.040 1.455 10.972 1.00 0.00 H new ATOM 0 HA TYR A 150 1.292 -1.025 10.998 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -1.614 -0.316 11.489 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -0.852 -1.832 11.926 1.00 0.00 H new ATOM 0 HD1 TYR A 150 1.337 -1.613 13.435 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -1.734 1.389 13.105 1.00 0.00 H new ATOM 0 HE1 TYR A 150 2.140 -0.558 15.535 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -0.913 2.455 15.194 1.00 0.00 H new ATOM 0 HH TYR A 150 0.541 2.350 16.885 1.00 0.00 H new ATOM 318 N SER A 151 0.718 -2.223 8.891 1.00 0.00 N ATOM 319 CA SER A 151 0.428 -2.930 7.659 1.00 0.00 C ATOM 320 C SER A 151 1.094 -4.304 7.612 1.00 0.00 C ATOM 321 O SER A 151 1.909 -4.648 8.469 1.00 0.00 O ATOM 322 CB SER A 151 0.774 -2.035 6.460 1.00 0.00 C ATOM 323 OG SER A 151 -0.322 -1.179 6.200 1.00 0.00 O ATOM 0 H SER A 151 1.582 -2.520 9.345 1.00 0.00 H new ATOM 0 HA SER A 151 -0.640 -3.142 7.612 1.00 0.00 H new ATOM 0 HB2 SER A 151 1.669 -1.449 6.672 1.00 0.00 H new ATOM 0 HB3 SER A 151 0.993 -2.645 5.584 1.00 0.00 H new ATOM 0 HG SER A 151 -0.851 -1.067 7.017 1.00 0.00 H new ATOM 329 N CYS A 152 0.695 -5.095 6.609 1.00 0.00 N ATOM 330 CA CYS A 152 1.152 -6.455 6.362 1.00 0.00 C ATOM 331 C CYS A 152 2.217 -6.472 5.261 1.00 0.00 C ATOM 332 O CYS A 152 2.200 -5.618 4.373 1.00 0.00 O ATOM 333 CB CYS A 152 -0.044 -7.341 5.987 1.00 0.00 C ATOM 334 SG CYS A 152 -0.975 -6.851 4.510 1.00 0.00 S ATOM 0 H CYS A 152 0.012 -4.783 5.918 1.00 0.00 H new ATOM 0 HA CYS A 152 1.607 -6.851 7.270 1.00 0.00 H new ATOM 0 HB2 CYS A 152 0.317 -8.359 5.842 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -0.731 -7.364 6.833 1.00 0.00 H new ATOM 0 HG CYS A 152 -1.572 -5.717 4.730 1.00 0.00 H new ATOM 339 N GLU A 153 3.135 -7.443 5.305 1.00 0.00 N ATOM 340 CA GLU A 153 4.219 -7.609 4.338 1.00 0.00 C ATOM 341 C GLU A 153 3.750 -7.453 2.885 1.00 0.00 C ATOM 342 O GLU A 153 4.422 -6.810 2.082 1.00 0.00 O ATOM 343 CB GLU A 153 4.917 -8.964 4.535 1.00 0.00 C ATOM 344 CG GLU A 153 5.625 -9.098 5.893 1.00 0.00 C ATOM 345 CD GLU A 153 6.694 -8.028 6.120 1.00 0.00 C ATOM 346 OE1 GLU A 153 7.463 -7.782 5.166 1.00 0.00 O ATOM 347 OE2 GLU A 153 6.728 -7.475 7.241 1.00 0.00 O ATOM 0 H GLU A 153 3.142 -8.154 6.036 1.00 0.00 H new ATOM 0 HA GLU A 153 4.932 -6.807 4.527 1.00 0.00 H new ATOM 0 HB2 GLU A 153 4.180 -9.761 4.439 1.00 0.00 H new ATOM 0 HB3 GLU A 153 5.647 -9.107 3.738 1.00 0.00 H new ATOM 0 HG2 GLU A 153 4.884 -9.038 6.690 1.00 0.00 H new ATOM 0 HG3 GLU A 153 6.086 -10.084 5.960 1.00 0.00 H new ATOM 354 N GLY A 154 2.593 -8.026 2.542 1.00 0.00 N ATOM 355 CA GLY A 154 2.028 -7.920 1.200 1.00 0.00 C ATOM 356 C GLY A 154 1.880 -6.457 0.768 1.00 0.00 C ATOM 357 O GLY A 154 2.154 -6.107 -0.384 1.00 0.00 O ATOM 0 H GLY A 154 2.025 -8.575 3.188 1.00 0.00 H new ATOM 0 HA2 GLY A 154 2.668 -8.447 0.492 1.00 0.00 H new ATOM 0 HA3 GLY A 154 1.054 -8.409 1.174 1.00 0.00 H new ATOM 361 N CYS A 155 1.472 -5.595 1.701 1.00 0.00 N ATOM 362 CA CYS A 155 1.334 -4.169 1.476 1.00 0.00 C ATOM 363 C CYS A 155 2.704 -3.503 1.543 1.00 0.00 C ATOM 364 O CYS A 155 2.994 -2.627 0.733 1.00 0.00 O ATOM 365 CB CYS A 155 0.373 -3.567 2.493 1.00 0.00 C ATOM 366 SG CYS A 155 -1.351 -3.964 2.134 1.00 0.00 S ATOM 0 H CYS A 155 1.226 -5.881 2.649 1.00 0.00 H new ATOM 0 HA CYS A 155 0.919 -3.996 0.483 1.00 0.00 H new ATOM 0 HB2 CYS A 155 0.627 -3.932 3.488 1.00 0.00 H new ATOM 0 HB3 CYS A 155 0.497 -2.484 2.509 1.00 0.00 H new ATOM 0 HG CYS A 155 -2.045 -3.917 3.232 1.00 0.00 H new ATOM 371 N LYS A 156 3.542 -3.924 2.496 1.00 0.00 N ATOM 372 CA LYS A 156 4.895 -3.407 2.649 1.00 0.00 C ATOM 373 C LYS A 156 5.622 -3.461 1.304 1.00 0.00 C ATOM 374 O LYS A 156 6.065 -2.433 0.783 1.00 0.00 O ATOM 375 CB LYS A 156 5.660 -4.205 3.709 1.00 0.00 C ATOM 376 CG LYS A 156 6.975 -3.517 4.096 1.00 0.00 C ATOM 377 CD LYS A 156 7.750 -4.435 5.040 1.00 0.00 C ATOM 378 CE LYS A 156 8.996 -3.735 5.589 1.00 0.00 C ATOM 379 NZ LYS A 156 9.747 -4.626 6.491 1.00 0.00 N ATOM 0 H LYS A 156 3.294 -4.636 3.183 1.00 0.00 H new ATOM 0 HA LYS A 156 4.843 -2.370 2.981 1.00 0.00 H new ATOM 0 HB2 LYS A 156 5.037 -4.324 4.595 1.00 0.00 H new ATOM 0 HB3 LYS A 156 5.870 -5.205 3.330 1.00 0.00 H new ATOM 0 HG2 LYS A 156 7.567 -3.305 3.205 1.00 0.00 H new ATOM 0 HG3 LYS A 156 6.773 -2.561 4.580 1.00 0.00 H new ATOM 0 HD2 LYS A 156 7.107 -4.740 5.866 1.00 0.00 H new ATOM 0 HD3 LYS A 156 8.042 -5.343 4.512 1.00 0.00 H new ATOM 0 HE2 LYS A 156 9.636 -3.424 4.764 1.00 0.00 H new ATOM 0 HE3 LYS A 156 8.704 -2.832 6.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 10.587 -4.129 6.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 9.141 -4.903 7.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 10.044 -5.476 5.971 1.00 0.00 H new ATOM 393 N GLY A 157 5.727 -4.675 0.758 1.00 0.00 N ATOM 394 CA GLY A 157 6.374 -4.958 -0.508 1.00 0.00 C ATOM 395 C GLY A 157 5.717 -4.165 -1.628 1.00 0.00 C ATOM 396 O GLY A 157 6.409 -3.522 -2.415 1.00 0.00 O ATOM 0 H GLY A 157 5.349 -5.510 1.206 1.00 0.00 H new ATOM 0 HA2 GLY A 157 7.433 -4.705 -0.447 1.00 0.00 H new ATOM 0 HA3 GLY A 157 6.313 -6.025 -0.725 1.00 0.00 H new ATOM 400 N PHE A 158 4.380 -4.207 -1.696 1.00 0.00 N ATOM 401 CA PHE A 158 3.629 -3.463 -2.700 1.00 0.00 C ATOM 402 C PHE A 158 4.069 -2.001 -2.707 1.00 0.00 C ATOM 403 O PHE A 158 4.484 -1.495 -3.744 1.00 0.00 O ATOM 404 CB PHE A 158 2.118 -3.579 -2.446 1.00 0.00 C ATOM 405 CG PHE A 158 1.288 -2.496 -3.104 1.00 0.00 C ATOM 406 CD1 PHE A 158 1.138 -2.490 -4.503 1.00 0.00 C ATOM 407 CD2 PHE A 158 0.890 -1.369 -2.355 1.00 0.00 C ATOM 408 CE1 PHE A 158 0.617 -1.358 -5.150 1.00 0.00 C ATOM 409 CE2 PHE A 158 0.420 -0.218 -3.010 1.00 0.00 C ATOM 410 CZ PHE A 158 0.276 -0.216 -4.406 1.00 0.00 C ATOM 0 H PHE A 158 3.799 -4.754 -1.061 1.00 0.00 H new ATOM 0 HA PHE A 158 3.837 -3.892 -3.680 1.00 0.00 H new ATOM 0 HB2 PHE A 158 1.775 -4.550 -2.803 1.00 0.00 H new ATOM 0 HB3 PHE A 158 1.940 -3.554 -1.371 1.00 0.00 H new ATOM 0 HD1 PHE A 158 1.424 -3.357 -5.080 1.00 0.00 H new ATOM 0 HD2 PHE A 158 0.947 -1.391 -1.277 1.00 0.00 H new ATOM 0 HE1 PHE A 158 0.478 -1.365 -6.221 1.00 0.00 H new ATOM 0 HE2 PHE A 158 0.170 0.664 -2.440 1.00 0.00 H new ATOM 0 HZ PHE A 158 -0.097 0.664 -4.909 1.00 0.00 H new ATOM 420 N PHE A 159 3.977 -1.322 -1.562 1.00 0.00 N ATOM 421 CA PHE A 159 4.323 0.085 -1.466 1.00 0.00 C ATOM 422 C PHE A 159 5.783 0.314 -1.852 1.00 0.00 C ATOM 423 O PHE A 159 6.063 1.194 -2.663 1.00 0.00 O ATOM 424 CB PHE A 159 4.009 0.613 -0.065 1.00 0.00 C ATOM 425 CG PHE A 159 4.124 2.120 0.073 1.00 0.00 C ATOM 426 CD1 PHE A 159 3.083 2.950 -0.388 1.00 0.00 C ATOM 427 CD2 PHE A 159 5.241 2.694 0.707 1.00 0.00 C ATOM 428 CE1 PHE A 159 3.131 4.336 -0.156 1.00 0.00 C ATOM 429 CE2 PHE A 159 5.247 4.064 1.013 1.00 0.00 C ATOM 430 CZ PHE A 159 4.202 4.891 0.568 1.00 0.00 C ATOM 0 H PHE A 159 3.662 -1.735 -0.684 1.00 0.00 H new ATOM 0 HA PHE A 159 3.715 0.647 -2.175 1.00 0.00 H new ATOM 0 HB2 PHE A 159 2.998 0.311 0.207 1.00 0.00 H new ATOM 0 HB3 PHE A 159 4.685 0.142 0.649 1.00 0.00 H new ATOM 0 HD1 PHE A 159 2.247 2.521 -0.920 1.00 0.00 H new ATOM 0 HD2 PHE A 159 6.094 2.081 0.958 1.00 0.00 H new ATOM 0 HE1 PHE A 159 2.346 4.974 -0.534 1.00 0.00 H new ATOM 0 HE2 PHE A 159 6.057 4.483 1.592 1.00 0.00 H new ATOM 0 HZ PHE A 159 4.221 5.950 0.781 1.00 0.00 H new ATOM 440 N LYS A 160 6.709 -0.479 -1.299 1.00 0.00 N ATOM 441 CA LYS A 160 8.132 -0.344 -1.604 1.00 0.00 C ATOM 442 C LYS A 160 8.355 -0.381 -3.121 1.00 0.00 C ATOM 443 O LYS A 160 8.911 0.548 -3.708 1.00 0.00 O ATOM 444 CB LYS A 160 8.945 -1.439 -0.878 1.00 0.00 C ATOM 445 CG LYS A 160 10.243 -0.896 -0.261 1.00 0.00 C ATOM 446 CD LYS A 160 10.927 -1.864 0.716 1.00 0.00 C ATOM 447 CE LYS A 160 11.324 -3.211 0.095 1.00 0.00 C ATOM 448 NZ LYS A 160 10.215 -4.182 0.114 1.00 0.00 N ATOM 0 H LYS A 160 6.493 -1.223 -0.635 1.00 0.00 H new ATOM 0 HA LYS A 160 8.485 0.621 -1.241 1.00 0.00 H new ATOM 0 HB2 LYS A 160 8.332 -1.883 -0.094 1.00 0.00 H new ATOM 0 HB3 LYS A 160 9.187 -2.235 -1.582 1.00 0.00 H new ATOM 0 HG2 LYS A 160 10.940 -0.654 -1.063 1.00 0.00 H new ATOM 0 HG3 LYS A 160 10.022 0.035 0.262 1.00 0.00 H new ATOM 0 HD2 LYS A 160 11.820 -1.385 1.119 1.00 0.00 H new ATOM 0 HD3 LYS A 160 10.257 -2.048 1.556 1.00 0.00 H new ATOM 0 HE2 LYS A 160 11.649 -3.053 -0.933 1.00 0.00 H new ATOM 0 HE3 LYS A 160 12.175 -3.623 0.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 10.590 -5.134 0.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 9.539 -3.923 0.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 9.732 -4.176 -0.807 1.00 0.00 H new ATOM 462 N ARG A 161 7.890 -1.459 -3.758 1.00 0.00 N ATOM 463 CA ARG A 161 8.009 -1.651 -5.193 1.00 0.00 C ATOM 464 C ARG A 161 7.337 -0.504 -5.946 1.00 0.00 C ATOM 465 O ARG A 161 7.933 0.070 -6.852 1.00 0.00 O ATOM 466 CB ARG A 161 7.397 -3.001 -5.573 1.00 0.00 C ATOM 467 CG ARG A 161 8.263 -4.163 -5.063 1.00 0.00 C ATOM 468 CD ARG A 161 7.587 -5.514 -5.309 1.00 0.00 C ATOM 469 NE ARG A 161 6.377 -5.659 -4.488 1.00 0.00 N ATOM 470 CZ ARG A 161 5.638 -6.776 -4.419 1.00 0.00 C ATOM 471 NH1 ARG A 161 5.968 -7.844 -5.152 1.00 0.00 N ATOM 472 NH2 ARG A 161 4.574 -6.829 -3.612 1.00 0.00 N ATOM 0 H ARG A 161 7.417 -2.226 -3.281 1.00 0.00 H new ATOM 0 HA ARG A 161 9.062 -1.652 -5.475 1.00 0.00 H new ATOM 0 HB2 ARG A 161 6.394 -3.080 -5.154 1.00 0.00 H new ATOM 0 HB3 ARG A 161 7.296 -3.066 -6.656 1.00 0.00 H new ATOM 0 HG2 ARG A 161 9.232 -4.143 -5.562 1.00 0.00 H new ATOM 0 HG3 ARG A 161 8.451 -4.038 -3.997 1.00 0.00 H new ATOM 0 HD2 ARG A 161 7.328 -5.607 -6.364 1.00 0.00 H new ATOM 0 HD3 ARG A 161 8.284 -6.320 -5.080 1.00 0.00 H new ATOM 0 HE ARG A 161 6.079 -4.856 -3.933 1.00 0.00 H new ATOM 0 HH11 ARG A 161 6.783 -7.810 -5.765 1.00 0.00 H new ATOM 0 HH12 ARG A 161 5.405 -8.693 -5.099 1.00 0.00 H new ATOM 0 HH21 ARG A 161 4.322 -6.018 -3.046 1.00 0.00 H new ATOM 0 HH22 ARG A 161 4.014 -7.680 -3.562 1.00 0.00 H new ATOM 486 N THR A 162 6.103 -0.170 -5.571 1.00 0.00 N ATOM 487 CA THR A 162 5.330 0.887 -6.202 1.00 0.00 C ATOM 488 C THR A 162 6.086 2.209 -6.195 1.00 0.00 C ATOM 489 O THR A 162 6.205 2.844 -7.238 1.00 0.00 O ATOM 490 CB THR A 162 3.956 1.008 -5.536 1.00 0.00 C ATOM 491 OG1 THR A 162 3.251 -0.189 -5.767 1.00 0.00 O ATOM 492 CG2 THR A 162 3.137 2.142 -6.142 1.00 0.00 C ATOM 0 H THR A 162 5.609 -0.635 -4.809 1.00 0.00 H new ATOM 0 HA THR A 162 5.173 0.624 -7.248 1.00 0.00 H new ATOM 0 HB THR A 162 4.106 1.205 -4.475 1.00 0.00 H new ATOM 0 HG1 THR A 162 2.366 -0.133 -5.350 1.00 0.00 H new ATOM 0 HG21 THR A 162 2.169 2.198 -5.645 1.00 0.00 H new ATOM 0 HG22 THR A 162 3.668 3.085 -6.010 1.00 0.00 H new ATOM 0 HG23 THR A 162 2.988 1.955 -7.206 1.00 0.00 H new ATOM 500 N VAL A 163 6.597 2.624 -5.037 1.00 0.00 N ATOM 501 CA VAL A 163 7.352 3.860 -4.903 1.00 0.00 C ATOM 502 C VAL A 163 8.589 3.803 -5.801 1.00 0.00 C ATOM 503 O VAL A 163 8.831 4.724 -6.577 1.00 0.00 O ATOM 504 CB VAL A 163 7.693 4.072 -3.419 1.00 0.00 C ATOM 505 CG1 VAL A 163 8.787 5.124 -3.194 1.00 0.00 C ATOM 506 CG2 VAL A 163 6.426 4.490 -2.658 1.00 0.00 C ATOM 0 H VAL A 163 6.496 2.107 -4.164 1.00 0.00 H new ATOM 0 HA VAL A 163 6.766 4.719 -5.231 1.00 0.00 H new ATOM 0 HB VAL A 163 8.079 3.124 -3.045 1.00 0.00 H new ATOM 0 HG11 VAL A 163 8.980 5.225 -2.126 1.00 0.00 H new ATOM 0 HG12 VAL A 163 9.701 4.813 -3.700 1.00 0.00 H new ATOM 0 HG13 VAL A 163 8.458 6.082 -3.596 1.00 0.00 H new ATOM 0 HG21 VAL A 163 6.667 4.641 -1.606 1.00 0.00 H new ATOM 0 HG22 VAL A 163 6.039 5.418 -3.078 1.00 0.00 H new ATOM 0 HG23 VAL A 163 5.672 3.708 -2.749 1.00 0.00 H new ATOM 516 N ARG A 164 9.370 2.723 -5.703 1.00 0.00 N ATOM 517 CA ARG A 164 10.580 2.562 -6.508 1.00 0.00 C ATOM 518 C ARG A 164 10.299 2.641 -8.015 1.00 0.00 C ATOM 519 O ARG A 164 11.039 3.280 -8.758 1.00 0.00 O ATOM 520 CB ARG A 164 11.247 1.220 -6.180 1.00 0.00 C ATOM 521 CG ARG A 164 11.870 1.219 -4.779 1.00 0.00 C ATOM 522 CD ARG A 164 12.234 -0.206 -4.346 1.00 0.00 C ATOM 523 NE ARG A 164 13.258 -0.795 -5.220 1.00 0.00 N ATOM 524 CZ ARG A 164 13.972 -1.897 -4.949 1.00 0.00 C ATOM 525 NH1 ARG A 164 13.888 -2.487 -3.752 1.00 0.00 N ATOM 526 NH2 ARG A 164 14.783 -2.398 -5.883 1.00 0.00 N ATOM 0 H ARG A 164 9.183 1.945 -5.070 1.00 0.00 H new ATOM 0 HA ARG A 164 11.246 3.387 -6.256 1.00 0.00 H new ATOM 0 HB2 ARG A 164 10.509 0.421 -6.250 1.00 0.00 H new ATOM 0 HB3 ARG A 164 12.018 1.007 -6.920 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.762 1.845 -4.772 1.00 0.00 H new ATOM 0 HG3 ARG A 164 11.171 1.653 -4.065 1.00 0.00 H new ATOM 0 HD2 ARG A 164 12.597 -0.193 -3.318 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.340 -0.830 -4.360 1.00 0.00 H new ATOM 0 HE ARG A 164 13.441 -0.326 -6.107 1.00 0.00 H new ATOM 0 HH11 ARG A 164 13.276 -2.099 -3.034 1.00 0.00 H new ATOM 0 HH12 ARG A 164 14.436 -3.325 -3.557 1.00 0.00 H new ATOM 0 HH21 ARG A 164 14.855 -1.943 -6.793 1.00 0.00 H new ATOM 0 HH22 ARG A 164 15.331 -3.236 -5.687 1.00 0.00 H new ATOM 540 N LYS A 165 9.260 1.941 -8.465 1.00 0.00 N ATOM 541 CA LYS A 165 8.892 1.817 -9.870 1.00 0.00 C ATOM 542 C LYS A 165 8.135 3.031 -10.411 1.00 0.00 C ATOM 543 O LYS A 165 8.218 3.322 -11.601 1.00 0.00 O ATOM 544 CB LYS A 165 7.990 0.587 -10.018 1.00 0.00 C ATOM 545 CG LYS A 165 8.713 -0.743 -9.776 1.00 0.00 C ATOM 546 CD LYS A 165 9.294 -1.272 -11.093 1.00 0.00 C ATOM 547 CE LYS A 165 10.136 -2.535 -10.879 1.00 0.00 C ATOM 548 NZ LYS A 165 9.339 -3.644 -10.327 1.00 0.00 N ATOM 0 H LYS A 165 8.634 1.430 -7.842 1.00 0.00 H new ATOM 0 HA LYS A 165 9.816 1.732 -10.441 1.00 0.00 H new ATOM 0 HB2 LYS A 165 7.159 0.671 -9.317 1.00 0.00 H new ATOM 0 HB3 LYS A 165 7.562 0.580 -11.021 1.00 0.00 H new ATOM 0 HG2 LYS A 165 9.511 -0.605 -9.047 1.00 0.00 H new ATOM 0 HG3 LYS A 165 8.020 -1.472 -9.356 1.00 0.00 H new ATOM 0 HD2 LYS A 165 8.482 -1.490 -11.787 1.00 0.00 H new ATOM 0 HD3 LYS A 165 9.909 -0.500 -11.555 1.00 0.00 H new ATOM 0 HE2 LYS A 165 10.576 -2.842 -11.828 1.00 0.00 H new ATOM 0 HE3 LYS A 165 10.961 -2.310 -10.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 9.920 -4.506 -10.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 9.024 -3.401 -9.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 8.509 -3.810 -10.932 1.00 0.00 H new ATOM 562 N ASP A 166 7.326 3.667 -9.562 1.00 0.00 N ATOM 563 CA ASP A 166 6.385 4.720 -9.922 1.00 0.00 C ATOM 564 C ASP A 166 5.417 4.158 -10.972 1.00 0.00 C ATOM 565 O ASP A 166 5.310 4.659 -12.088 1.00 0.00 O ATOM 566 CB ASP A 166 7.085 6.013 -10.355 1.00 0.00 C ATOM 567 CG ASP A 166 6.084 7.144 -10.587 1.00 0.00 C ATOM 568 OD1 ASP A 166 5.061 7.167 -9.863 1.00 0.00 O ATOM 569 OD2 ASP A 166 6.364 7.982 -11.471 1.00 0.00 O ATOM 0 H ASP A 166 7.311 3.451 -8.565 1.00 0.00 H new ATOM 0 HA ASP A 166 5.810 5.019 -9.045 1.00 0.00 H new ATOM 0 HB2 ASP A 166 7.802 6.312 -9.591 1.00 0.00 H new ATOM 0 HB3 ASP A 166 7.650 5.833 -11.270 1.00 0.00 H new ATOM 574 N LEU A 167 4.751 3.064 -10.597 1.00 0.00 N ATOM 575 CA LEU A 167 3.859 2.297 -11.459 1.00 0.00 C ATOM 576 C LEU A 167 2.732 3.115 -12.082 1.00 0.00 C ATOM 577 O LEU A 167 2.274 4.110 -11.527 1.00 0.00 O ATOM 578 CB LEU A 167 3.205 1.163 -10.657 1.00 0.00 C ATOM 579 CG LEU A 167 4.188 0.146 -10.066 1.00 0.00 C ATOM 580 CD1 LEU A 167 3.416 -0.748 -9.092 1.00 0.00 C ATOM 581 CD2 LEU A 167 4.850 -0.705 -11.159 1.00 0.00 C ATOM 0 H LEU A 167 4.822 2.678 -9.655 1.00 0.00 H new ATOM 0 HA LEU A 167 4.492 1.927 -12.266 1.00 0.00 H new ATOM 0 HB2 LEU A 167 2.623 1.599 -9.845 1.00 0.00 H new ATOM 0 HB3 LEU A 167 2.504 0.636 -11.304 1.00 0.00 H new ATOM 0 HG LEU A 167 4.987 0.677 -9.550 1.00 0.00 H new ATOM 0 HD11 LEU A 167 4.094 -1.482 -8.657 1.00 0.00 H new ATOM 0 HD12 LEU A 167 2.986 -0.136 -8.299 1.00 0.00 H new ATOM 0 HD13 LEU A 167 2.618 -1.263 -9.626 1.00 0.00 H new ATOM 0 HD21 LEU A 167 5.540 -1.414 -10.701 1.00 0.00 H new ATOM 0 HD22 LEU A 167 4.083 -1.250 -11.710 1.00 0.00 H new ATOM 0 HD23 LEU A 167 5.397 -0.057 -11.843 1.00 0.00 H new ATOM 593 N THR A 168 2.229 2.623 -13.215 1.00 0.00 N ATOM 594 CA THR A 168 1.069 3.182 -13.885 1.00 0.00 C ATOM 595 C THR A 168 -0.137 2.922 -12.976 1.00 0.00 C ATOM 596 O THR A 168 -0.597 1.783 -12.856 1.00 0.00 O ATOM 597 CB THR A 168 0.918 2.502 -15.253 1.00 0.00 C ATOM 598 OG1 THR A 168 2.190 2.395 -15.860 1.00 0.00 O ATOM 599 CG2 THR A 168 -0.022 3.290 -16.169 1.00 0.00 C ATOM 0 H THR A 168 2.626 1.815 -13.694 1.00 0.00 H new ATOM 0 HA THR A 168 1.162 4.254 -14.061 1.00 0.00 H new ATOM 0 HB THR A 168 0.487 1.513 -15.100 1.00 0.00 H new ATOM 0 HG1 THR A 168 2.100 1.960 -16.733 1.00 0.00 H new ATOM 0 HG21 THR A 168 -0.106 2.781 -17.129 1.00 0.00 H new ATOM 0 HG22 THR A 168 -1.007 3.359 -15.707 1.00 0.00 H new ATOM 0 HG23 THR A 168 0.377 4.292 -16.324 1.00 0.00 H new ATOM 607 N TYR A 169 -0.632 3.958 -12.298 1.00 0.00 N ATOM 608 CA TYR A 169 -1.697 3.779 -11.330 1.00 0.00 C ATOM 609 C TYR A 169 -3.026 3.543 -12.028 1.00 0.00 C ATOM 610 O TYR A 169 -3.614 4.447 -12.613 1.00 0.00 O ATOM 611 CB TYR A 169 -1.788 4.966 -10.375 1.00 0.00 C ATOM 612 CG TYR A 169 -0.486 5.267 -9.666 1.00 0.00 C ATOM 613 CD1 TYR A 169 0.015 4.351 -8.725 1.00 0.00 C ATOM 614 CD2 TYR A 169 0.326 6.330 -10.104 1.00 0.00 C ATOM 615 CE1 TYR A 169 1.362 4.408 -8.341 1.00 0.00 C ATOM 616 CE2 TYR A 169 1.646 6.445 -9.639 1.00 0.00 C ATOM 617 CZ TYR A 169 2.182 5.451 -8.802 1.00 0.00 C ATOM 618 OH TYR A 169 3.460 5.564 -8.346 1.00 0.00 O ATOM 0 H TYR A 169 -0.311 4.920 -12.405 1.00 0.00 H new ATOM 0 HA TYR A 169 -1.460 2.896 -10.737 1.00 0.00 H new ATOM 0 HB2 TYR A 169 -2.102 5.848 -10.933 1.00 0.00 H new ATOM 0 HB3 TYR A 169 -2.560 4.767 -9.632 1.00 0.00 H new ATOM 0 HD1 TYR A 169 -0.637 3.604 -8.298 1.00 0.00 H new ATOM 0 HD2 TYR A 169 -0.067 7.058 -10.798 1.00 0.00 H new ATOM 0 HE1 TYR A 169 1.770 3.649 -7.690 1.00 0.00 H new ATOM 0 HE2 TYR A 169 2.248 7.295 -9.924 1.00 0.00 H new ATOM 0 HH TYR A 169 3.910 6.299 -8.812 1.00 0.00 H new ATOM 628 N THR A 170 -3.491 2.301 -11.935 1.00 0.00 N ATOM 629 CA THR A 170 -4.740 1.818 -12.470 1.00 0.00 C ATOM 630 C THR A 170 -5.396 0.964 -11.380 1.00 0.00 C ATOM 631 O THR A 170 -4.778 0.690 -10.345 1.00 0.00 O ATOM 632 CB THR A 170 -4.462 1.053 -13.773 1.00 0.00 C ATOM 633 OG1 THR A 170 -3.236 0.352 -13.714 1.00 0.00 O ATOM 634 CG2 THR A 170 -4.406 2.019 -14.960 1.00 0.00 C ATOM 0 H THR A 170 -2.968 1.569 -11.454 1.00 0.00 H new ATOM 0 HA THR A 170 -5.430 2.621 -12.731 1.00 0.00 H new ATOM 0 HB THR A 170 -5.276 0.340 -13.902 1.00 0.00 H new ATOM 0 HG1 THR A 170 -3.353 -0.543 -14.095 1.00 0.00 H new ATOM 0 HG21 THR A 170 -4.208 1.460 -15.875 1.00 0.00 H new ATOM 0 HG22 THR A 170 -5.360 2.539 -15.051 1.00 0.00 H new ATOM 0 HG23 THR A 170 -3.610 2.746 -14.800 1.00 0.00 H new ATOM 642 N CYS A 171 -6.653 0.582 -11.606 1.00 0.00 N ATOM 643 CA CYS A 171 -7.487 -0.181 -10.697 1.00 0.00 C ATOM 644 C CYS A 171 -8.173 -1.279 -11.503 1.00 0.00 C ATOM 645 O CYS A 171 -8.349 -1.128 -12.710 1.00 0.00 O ATOM 646 CB CYS A 171 -8.522 0.785 -10.101 1.00 0.00 C ATOM 647 SG CYS A 171 -9.889 0.062 -9.156 1.00 0.00 S ATOM 0 H CYS A 171 -7.135 0.812 -12.475 1.00 0.00 H new ATOM 0 HA CYS A 171 -6.911 -0.637 -9.892 1.00 0.00 H new ATOM 0 HB2 CYS A 171 -7.996 1.484 -9.451 1.00 0.00 H new ATOM 0 HB3 CYS A 171 -8.948 1.368 -10.917 1.00 0.00 H new ATOM 0 HG CYS A 171 -9.790 0.417 -7.909 1.00 0.00 H new ATOM 652 N ARG A 172 -8.562 -2.372 -10.841 1.00 0.00 N ATOM 653 CA ARG A 172 -9.260 -3.472 -11.490 1.00 0.00 C ATOM 654 C ARG A 172 -10.698 -3.056 -11.810 1.00 0.00 C ATOM 655 O ARG A 172 -11.190 -3.302 -12.907 1.00 0.00 O ATOM 656 CB ARG A 172 -9.232 -4.721 -10.599 1.00 0.00 C ATOM 657 CG ARG A 172 -7.828 -5.188 -10.173 1.00 0.00 C ATOM 658 CD ARG A 172 -6.900 -5.496 -11.356 1.00 0.00 C ATOM 659 NE ARG A 172 -6.284 -4.279 -11.900 1.00 0.00 N ATOM 660 CZ ARG A 172 -5.180 -3.680 -11.428 1.00 0.00 C ATOM 661 NH1 ARG A 172 -4.492 -4.179 -10.396 1.00 0.00 N ATOM 662 NH2 ARG A 172 -4.753 -2.551 -11.997 1.00 0.00 N ATOM 0 H ARG A 172 -8.400 -2.514 -9.844 1.00 0.00 H new ATOM 0 HA ARG A 172 -8.755 -3.716 -12.425 1.00 0.00 H new ATOM 0 HB2 ARG A 172 -9.819 -4.522 -9.703 1.00 0.00 H new ATOM 0 HB3 ARG A 172 -9.724 -5.537 -11.128 1.00 0.00 H new ATOM 0 HG2 ARG A 172 -7.370 -4.417 -9.553 1.00 0.00 H new ATOM 0 HG3 ARG A 172 -7.923 -6.080 -9.554 1.00 0.00 H new ATOM 0 HD2 ARG A 172 -6.119 -6.186 -11.035 1.00 0.00 H new ATOM 0 HD3 ARG A 172 -7.466 -5.998 -12.140 1.00 0.00 H new ATOM 0 HE ARG A 172 -6.735 -3.851 -12.708 1.00 0.00 H new ATOM 0 HH11 ARG A 172 -4.803 -5.039 -9.944 1.00 0.00 H new ATOM 0 HH12 ARG A 172 -3.656 -3.700 -10.061 1.00 0.00 H new ATOM 0 HH21 ARG A 172 -5.265 -2.151 -12.783 1.00 0.00 H new ATOM 0 HH22 ARG A 172 -3.915 -2.088 -11.645 1.00 0.00 H new ATOM 676 N ASP A 173 -11.368 -2.443 -10.827 1.00 0.00 N ATOM 677 CA ASP A 173 -12.748 -1.985 -10.929 1.00 0.00 C ATOM 678 C ASP A 173 -12.781 -0.477 -11.207 1.00 0.00 C ATOM 679 O ASP A 173 -12.414 -0.046 -12.296 1.00 0.00 O ATOM 680 CB ASP A 173 -13.521 -2.396 -9.666 1.00 0.00 C ATOM 681 CG ASP A 173 -13.586 -3.912 -9.514 1.00 0.00 C ATOM 682 OD1 ASP A 173 -12.642 -4.460 -8.902 1.00 0.00 O ATOM 683 OD2 ASP A 173 -14.573 -4.493 -10.012 1.00 0.00 O ATOM 0 H ASP A 173 -10.949 -2.249 -9.917 1.00 0.00 H new ATOM 0 HA ASP A 173 -13.249 -2.461 -11.772 1.00 0.00 H new ATOM 0 HB2 ASP A 173 -13.042 -1.962 -8.788 1.00 0.00 H new ATOM 0 HB3 ASP A 173 -14.532 -1.991 -9.710 1.00 0.00 H new ATOM 688 N ASN A 174 -13.215 0.342 -10.241 1.00 0.00 N ATOM 689 CA ASN A 174 -13.320 1.800 -10.330 1.00 0.00 C ATOM 690 C ASN A 174 -12.893 2.395 -8.986 1.00 0.00 C ATOM 691 O ASN A 174 -12.644 1.656 -8.037 1.00 0.00 O ATOM 692 CB ASN A 174 -14.772 2.215 -10.655 1.00 0.00 C ATOM 693 CG ASN A 174 -15.104 2.408 -12.138 1.00 0.00 C ATOM 694 OD1 ASN A 174 -16.002 3.178 -12.458 1.00 0.00 O ATOM 695 ND2 ASN A 174 -14.407 1.759 -13.064 1.00 0.00 N ATOM 0 H ASN A 174 -13.516 -0.013 -9.334 1.00 0.00 H new ATOM 0 HA ASN A 174 -12.675 2.170 -11.127 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -15.444 1.458 -10.249 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -14.988 3.146 -10.132 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -14.617 1.899 -14.052 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -13.662 1.120 -12.787 1.00 0.00 H new ATOM 702 N LYS A 175 -12.827 3.728 -8.898 1.00 0.00 N ATOM 703 CA LYS A 175 -12.439 4.480 -7.704 1.00 0.00 C ATOM 704 C LYS A 175 -13.091 3.988 -6.402 1.00 0.00 C ATOM 705 O LYS A 175 -12.500 4.103 -5.333 1.00 0.00 O ATOM 706 CB LYS A 175 -12.718 5.974 -7.933 1.00 0.00 C ATOM 707 CG LYS A 175 -14.216 6.266 -8.123 1.00 0.00 C ATOM 708 CD LYS A 175 -14.466 7.758 -8.364 1.00 0.00 C ATOM 709 CE LYS A 175 -15.940 8.024 -8.702 1.00 0.00 C ATOM 710 NZ LYS A 175 -16.854 7.538 -7.650 1.00 0.00 N ATOM 0 H LYS A 175 -13.051 4.334 -9.687 1.00 0.00 H new ATOM 0 HA LYS A 175 -11.372 4.311 -7.560 1.00 0.00 H new ATOM 0 HB2 LYS A 175 -12.344 6.546 -7.084 1.00 0.00 H new ATOM 0 HB3 LYS A 175 -12.170 6.313 -8.812 1.00 0.00 H new ATOM 0 HG2 LYS A 175 -14.597 5.690 -8.967 1.00 0.00 H new ATOM 0 HG3 LYS A 175 -14.767 5.941 -7.241 1.00 0.00 H new ATOM 0 HD2 LYS A 175 -14.185 8.325 -7.476 1.00 0.00 H new ATOM 0 HD3 LYS A 175 -13.834 8.109 -9.180 1.00 0.00 H new ATOM 0 HE2 LYS A 175 -16.090 9.094 -8.844 1.00 0.00 H new ATOM 0 HE3 LYS A 175 -16.187 7.539 -9.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 -17.822 7.858 -7.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 -16.831 6.499 -7.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 -16.554 7.914 -6.728 1.00 0.00 H new ATOM 724 N ASP A 176 -14.306 3.432 -6.485 1.00 0.00 N ATOM 725 CA ASP A 176 -15.060 2.947 -5.330 1.00 0.00 C ATOM 726 C ASP A 176 -14.534 1.602 -4.807 1.00 0.00 C ATOM 727 O ASP A 176 -15.108 1.029 -3.882 1.00 0.00 O ATOM 728 CB ASP A 176 -16.546 2.848 -5.701 1.00 0.00 C ATOM 729 CG ASP A 176 -17.110 4.189 -6.163 1.00 0.00 C ATOM 730 OD1 ASP A 176 -16.940 4.491 -7.365 1.00 0.00 O ATOM 731 OD2 ASP A 176 -17.678 4.900 -5.306 1.00 0.00 O ATOM 0 H ASP A 176 -14.797 3.306 -7.370 1.00 0.00 H new ATOM 0 HA ASP A 176 -14.931 3.662 -4.518 1.00 0.00 H new ATOM 0 HB2 ASP A 176 -16.674 2.109 -6.492 1.00 0.00 H new ATOM 0 HB3 ASP A 176 -17.112 2.494 -4.839 1.00 0.00 H new ATOM 736 N CYS A 177 -13.441 1.092 -5.381 1.00 0.00 N ATOM 737 CA CYS A 177 -12.760 -0.132 -4.990 1.00 0.00 C ATOM 738 C CYS A 177 -12.075 0.056 -3.630 1.00 0.00 C ATOM 739 O CYS A 177 -10.853 0.157 -3.526 1.00 0.00 O ATOM 740 CB CYS A 177 -11.770 -0.449 -6.112 1.00 0.00 C ATOM 741 SG CYS A 177 -10.561 -1.776 -5.876 1.00 0.00 S ATOM 0 H CYS A 177 -12.989 1.551 -6.172 1.00 0.00 H new ATOM 0 HA CYS A 177 -13.449 -0.966 -4.862 1.00 0.00 H new ATOM 0 HB2 CYS A 177 -12.350 -0.689 -7.003 1.00 0.00 H new ATOM 0 HB3 CYS A 177 -11.216 0.465 -6.328 1.00 0.00 H new ATOM 0 HG CYS A 177 -10.044 -1.686 -4.687 1.00 0.00 H new ATOM 746 N LEU A 178 -12.884 0.115 -2.573 1.00 0.00 N ATOM 747 CA LEU A 178 -12.412 0.245 -1.202 1.00 0.00 C ATOM 748 C LEU A 178 -11.693 -1.052 -0.827 1.00 0.00 C ATOM 749 O LEU A 178 -12.341 -2.065 -0.574 1.00 0.00 O ATOM 750 CB LEU A 178 -13.590 0.516 -0.254 1.00 0.00 C ATOM 751 CG LEU A 178 -14.282 1.870 -0.487 1.00 0.00 C ATOM 752 CD1 LEU A 178 -15.549 1.939 0.373 1.00 0.00 C ATOM 753 CD2 LEU A 178 -13.372 3.054 -0.134 1.00 0.00 C ATOM 0 H LEU A 178 -13.900 0.073 -2.650 1.00 0.00 H new ATOM 0 HA LEU A 178 -11.725 1.087 -1.114 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -14.325 -0.281 -0.368 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -13.232 0.475 0.775 1.00 0.00 H new ATOM 0 HG LEU A 178 -14.525 1.941 -1.547 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -16.045 2.896 0.213 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.223 1.129 0.093 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -15.281 1.840 1.425 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -13.904 3.988 -0.315 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -13.089 2.995 0.917 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -12.476 3.021 -0.753 1.00 0.00 H new ATOM 765 N ILE A 179 -10.357 -1.032 -0.836 1.00 0.00 N ATOM 766 CA ILE A 179 -9.531 -2.198 -0.554 1.00 0.00 C ATOM 767 C ILE A 179 -9.886 -2.811 0.805 1.00 0.00 C ATOM 768 O ILE A 179 -10.085 -2.099 1.787 1.00 0.00 O ATOM 769 CB ILE A 179 -8.034 -1.836 -0.630 1.00 0.00 C ATOM 770 CG1 ILE A 179 -7.618 -1.226 -1.979 1.00 0.00 C ATOM 771 CG2 ILE A 179 -7.160 -3.062 -0.330 1.00 0.00 C ATOM 772 CD1 ILE A 179 -7.644 -2.220 -3.143 1.00 0.00 C ATOM 0 H ILE A 179 -9.817 -0.192 -1.043 1.00 0.00 H new ATOM 0 HA ILE A 179 -9.735 -2.950 -1.316 1.00 0.00 H new ATOM 0 HB ILE A 179 -7.877 -1.071 0.130 1.00 0.00 H new ATOM 0 HG12 ILE A 179 -8.282 -0.393 -2.210 1.00 0.00 H new ATOM 0 HG13 ILE A 179 -6.612 -0.816 -1.887 1.00 0.00 H new ATOM 0 HG21 ILE A 179 -6.108 -2.782 -0.389 1.00 0.00 H new ATOM 0 HG22 ILE A 179 -7.381 -3.430 0.672 1.00 0.00 H new ATOM 0 HG23 ILE A 179 -7.369 -3.845 -1.059 1.00 0.00 H new ATOM 0 HD11 ILE A 179 -7.339 -1.715 -4.059 1.00 0.00 H new ATOM 0 HD12 ILE A 179 -6.958 -3.041 -2.935 1.00 0.00 H new ATOM 0 HD13 ILE A 179 -8.654 -2.612 -3.264 1.00 0.00 H new ATOM 784 N ASP A 180 -9.929 -4.146 0.847 1.00 0.00 N ATOM 785 CA ASP A 180 -10.187 -4.980 2.010 1.00 0.00 C ATOM 786 C ASP A 180 -9.589 -6.350 1.689 1.00 0.00 C ATOM 787 O ASP A 180 -9.292 -6.616 0.525 1.00 0.00 O ATOM 788 CB ASP A 180 -11.695 -5.103 2.281 1.00 0.00 C ATOM 789 CG ASP A 180 -12.277 -3.858 2.944 1.00 0.00 C ATOM 790 OD1 ASP A 180 -11.880 -3.597 4.100 1.00 0.00 O ATOM 791 OD2 ASP A 180 -13.132 -3.215 2.298 1.00 0.00 O ATOM 0 H ASP A 180 -9.773 -4.705 0.008 1.00 0.00 H new ATOM 0 HA ASP A 180 -9.743 -4.547 2.906 1.00 0.00 H new ATOM 0 HB2 ASP A 180 -12.215 -5.286 1.341 1.00 0.00 H new ATOM 0 HB3 ASP A 180 -11.876 -5.968 2.919 1.00 0.00 H new ATOM 921 N CYS A 187 -3.788 -3.766 -6.614 1.00 0.00 N ATOM 922 CA CYS A 187 -4.582 -2.702 -7.204 1.00 0.00 C ATOM 923 C CYS A 187 -3.873 -1.371 -6.952 1.00 0.00 C ATOM 924 O CYS A 187 -4.203 -0.656 -6.004 1.00 0.00 O ATOM 925 CB CYS A 187 -5.984 -2.755 -6.602 1.00 0.00 C ATOM 926 SG CYS A 187 -7.084 -1.480 -7.239 1.00 0.00 S ATOM 0 HA CYS A 187 -4.685 -2.818 -8.283 1.00 0.00 H new ATOM 0 HB2 CYS A 187 -6.420 -3.734 -6.801 1.00 0.00 H new ATOM 0 HB3 CYS A 187 -5.911 -2.653 -5.519 1.00 0.00 H new ATOM 0 HG CYS A 187 -8.271 -1.638 -6.732 1.00 0.00 H new ATOM 931 N GLN A 188 -2.861 -1.084 -7.776 1.00 0.00 N ATOM 932 CA GLN A 188 -1.970 0.061 -7.623 1.00 0.00 C ATOM 933 C GLN A 188 -2.667 1.350 -7.196 1.00 0.00 C ATOM 934 O GLN A 188 -2.353 1.862 -6.128 1.00 0.00 O ATOM 935 CB GLN A 188 -1.063 0.318 -8.838 1.00 0.00 C ATOM 936 CG GLN A 188 -0.628 -0.932 -9.606 1.00 0.00 C ATOM 937 CD GLN A 188 -1.666 -1.263 -10.668 1.00 0.00 C ATOM 938 OE1 GLN A 188 -2.536 -2.102 -10.460 1.00 0.00 O ATOM 939 NE2 GLN A 188 -1.620 -0.561 -11.794 1.00 0.00 N ATOM 0 H GLN A 188 -2.636 -1.659 -8.588 1.00 0.00 H new ATOM 0 HA GLN A 188 -1.328 -0.244 -6.796 1.00 0.00 H new ATOM 0 HB2 GLN A 188 -1.585 0.983 -9.526 1.00 0.00 H new ATOM 0 HB3 GLN A 188 -0.171 0.845 -8.500 1.00 0.00 H new ATOM 0 HG2 GLN A 188 0.344 -0.766 -10.071 1.00 0.00 H new ATOM 0 HG3 GLN A 188 -0.514 -1.771 -8.920 1.00 0.00 H new ATOM 0 HE21 GLN A 188 -0.882 0.129 -11.935 1.00 0.00 H new ATOM 0 HE22 GLN A 188 -2.322 -0.712 -12.518 1.00 0.00 H new ATOM 948 N TYR A 189 -3.574 1.891 -8.020 1.00 0.00 N ATOM 949 CA TYR A 189 -4.224 3.159 -7.726 1.00 0.00 C ATOM 950 C TYR A 189 -4.796 3.197 -6.311 1.00 0.00 C ATOM 951 O TYR A 189 -4.403 4.031 -5.499 1.00 0.00 O ATOM 952 CB TYR A 189 -5.300 3.451 -8.784 1.00 0.00 C ATOM 953 CG TYR A 189 -5.899 4.842 -8.710 1.00 0.00 C ATOM 954 CD1 TYR A 189 -6.848 5.158 -7.719 1.00 0.00 C ATOM 955 CD2 TYR A 189 -5.480 5.837 -9.613 1.00 0.00 C ATOM 956 CE1 TYR A 189 -7.325 6.473 -7.593 1.00 0.00 C ATOM 957 CE2 TYR A 189 -5.928 7.161 -9.459 1.00 0.00 C ATOM 958 CZ TYR A 189 -6.810 7.487 -8.416 1.00 0.00 C ATOM 959 OH TYR A 189 -7.061 8.794 -8.127 1.00 0.00 O ATOM 0 H TYR A 189 -3.870 1.462 -8.897 1.00 0.00 H new ATOM 0 HA TYR A 189 -3.471 3.946 -7.770 1.00 0.00 H new ATOM 0 HB2 TYR A 189 -4.865 3.309 -9.774 1.00 0.00 H new ATOM 0 HB3 TYR A 189 -6.101 2.719 -8.680 1.00 0.00 H new ATOM 0 HD1 TYR A 189 -7.210 4.388 -7.054 1.00 0.00 H new ATOM 0 HD2 TYR A 189 -4.814 5.583 -10.425 1.00 0.00 H new ATOM 0 HE1 TYR A 189 -8.087 6.704 -6.864 1.00 0.00 H new ATOM 0 HE2 TYR A 189 -5.594 7.927 -10.143 1.00 0.00 H new ATOM 0 HH TYR A 189 -6.803 8.979 -7.200 1.00 0.00 H new ATOM 969 N CYS A 190 -5.743 2.309 -6.022 1.00 0.00 N ATOM 970 CA CYS A 190 -6.424 2.289 -4.743 1.00 0.00 C ATOM 971 C CYS A 190 -5.465 2.003 -3.596 1.00 0.00 C ATOM 972 O CYS A 190 -5.477 2.732 -2.612 1.00 0.00 O ATOM 973 CB CYS A 190 -7.547 1.264 -4.792 1.00 0.00 C ATOM 974 SG CYS A 190 -8.802 1.613 -6.040 1.00 0.00 S ATOM 0 H CYS A 190 -6.055 1.586 -6.671 1.00 0.00 H new ATOM 0 HA CYS A 190 -6.845 3.277 -4.555 1.00 0.00 H new ATOM 0 HB2 CYS A 190 -7.119 0.280 -4.986 1.00 0.00 H new ATOM 0 HB3 CYS A 190 -8.025 1.216 -3.814 1.00 0.00 H new ATOM 0 HG CYS A 190 -9.909 1.965 -5.456 1.00 0.00 H new ATOM 979 N ARG A 191 -4.635 0.963 -3.698 1.00 0.00 N ATOM 980 CA ARG A 191 -3.710 0.641 -2.620 1.00 0.00 C ATOM 981 C ARG A 191 -2.780 1.822 -2.334 1.00 0.00 C ATOM 982 O ARG A 191 -2.574 2.191 -1.179 1.00 0.00 O ATOM 983 CB ARG A 191 -2.908 -0.620 -2.946 1.00 0.00 C ATOM 984 CG ARG A 191 -3.785 -1.865 -2.842 1.00 0.00 C ATOM 985 CD ARG A 191 -2.949 -3.126 -3.079 1.00 0.00 C ATOM 986 NE ARG A 191 -3.697 -4.323 -2.674 1.00 0.00 N ATOM 987 CZ ARG A 191 -3.905 -4.693 -1.403 1.00 0.00 C ATOM 988 NH1 ARG A 191 -3.299 -4.046 -0.403 1.00 0.00 N ATOM 989 NH2 ARG A 191 -4.737 -5.698 -1.128 1.00 0.00 N ATOM 0 H ARG A 191 -4.587 0.340 -4.505 1.00 0.00 H new ATOM 0 HA ARG A 191 -4.293 0.443 -1.721 1.00 0.00 H new ATOM 0 HB2 ARG A 191 -2.496 -0.544 -3.952 1.00 0.00 H new ATOM 0 HB3 ARG A 191 -2.064 -0.706 -2.261 1.00 0.00 H new ATOM 0 HG2 ARG A 191 -4.250 -1.909 -1.857 1.00 0.00 H new ATOM 0 HG3 ARG A 191 -4.591 -1.812 -3.574 1.00 0.00 H new ATOM 0 HD2 ARG A 191 -2.679 -3.198 -4.133 1.00 0.00 H new ATOM 0 HD3 ARG A 191 -2.018 -3.064 -2.515 1.00 0.00 H new ATOM 0 HE ARG A 191 -4.085 -4.913 -3.410 1.00 0.00 H new ATOM 0 HH11 ARG A 191 -2.674 -3.266 -0.605 1.00 0.00 H new ATOM 0 HH12 ARG A 191 -3.461 -4.332 0.562 1.00 0.00 H new ATOM 0 HH21 ARG A 191 -5.216 -6.186 -1.885 1.00 0.00 H new ATOM 0 HH22 ARG A 191 -4.895 -5.979 -0.160 1.00 0.00 H new ATOM 1003 N TYR A 192 -2.223 2.421 -3.388 1.00 0.00 N ATOM 1004 CA TYR A 192 -1.332 3.562 -3.270 1.00 0.00 C ATOM 1005 C TYR A 192 -2.077 4.733 -2.627 1.00 0.00 C ATOM 1006 O TYR A 192 -1.589 5.322 -1.666 1.00 0.00 O ATOM 1007 CB TYR A 192 -0.765 3.901 -4.654 1.00 0.00 C ATOM 1008 CG TYR A 192 0.367 4.906 -4.693 1.00 0.00 C ATOM 1009 CD1 TYR A 192 1.533 4.682 -3.935 1.00 0.00 C ATOM 1010 CD2 TYR A 192 0.360 5.909 -5.680 1.00 0.00 C ATOM 1011 CE1 TYR A 192 2.683 5.455 -4.166 1.00 0.00 C ATOM 1012 CE2 TYR A 192 1.507 6.688 -5.900 1.00 0.00 C ATOM 1013 CZ TYR A 192 2.682 6.428 -5.176 1.00 0.00 C ATOM 1014 OH TYR A 192 3.808 7.155 -5.420 1.00 0.00 O ATOM 0 H TYR A 192 -2.382 2.122 -4.350 1.00 0.00 H new ATOM 0 HA TYR A 192 -0.489 3.330 -2.620 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -0.417 2.977 -5.116 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -1.579 4.280 -5.273 1.00 0.00 H new ATOM 0 HD1 TYR A 192 1.543 3.915 -3.175 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -0.529 6.080 -6.269 1.00 0.00 H new ATOM 0 HE1 TYR A 192 3.568 5.300 -3.566 1.00 0.00 H new ATOM 0 HE2 TYR A 192 1.486 7.487 -6.626 1.00 0.00 H new ATOM 0 HH TYR A 192 3.639 7.785 -6.152 1.00 0.00 H new ATOM 1024 N GLN A 193 -3.274 5.063 -3.123 1.00 0.00 N ATOM 1025 CA GLN A 193 -4.081 6.129 -2.553 1.00 0.00 C ATOM 1026 C GLN A 193 -4.363 5.874 -1.071 1.00 0.00 C ATOM 1027 O GLN A 193 -4.190 6.773 -0.254 1.00 0.00 O ATOM 1028 CB GLN A 193 -5.387 6.245 -3.348 1.00 0.00 C ATOM 1029 CG GLN A 193 -5.170 6.834 -4.748 1.00 0.00 C ATOM 1030 CD GLN A 193 -5.494 8.323 -4.826 1.00 0.00 C ATOM 1031 OE1 GLN A 193 -6.463 8.722 -5.468 1.00 0.00 O ATOM 1032 NE2 GLN A 193 -4.691 9.165 -4.182 1.00 0.00 N ATOM 0 H GLN A 193 -3.702 4.599 -3.924 1.00 0.00 H new ATOM 0 HA GLN A 193 -3.533 7.069 -2.619 1.00 0.00 H new ATOM 0 HB2 GLN A 193 -5.843 5.259 -3.438 1.00 0.00 H new ATOM 0 HB3 GLN A 193 -6.089 6.872 -2.798 1.00 0.00 H new ATOM 0 HG2 GLN A 193 -4.133 6.678 -5.045 1.00 0.00 H new ATOM 0 HG3 GLN A 193 -5.791 6.295 -5.463 1.00 0.00 H new ATOM 0 HE21 GLN A 193 -3.893 8.808 -3.656 1.00 0.00 H new ATOM 0 HE22 GLN A 193 -4.873 10.168 -4.214 1.00 0.00 H new ATOM 1041 N LYS A 194 -4.781 4.658 -0.719 1.00 0.00 N ATOM 1042 CA LYS A 194 -5.091 4.252 0.642 1.00 0.00 C ATOM 1043 C LYS A 194 -3.849 4.464 1.523 1.00 0.00 C ATOM 1044 O LYS A 194 -3.915 5.101 2.576 1.00 0.00 O ATOM 1045 CB LYS A 194 -5.562 2.789 0.560 1.00 0.00 C ATOM 1046 CG LYS A 194 -6.274 2.210 1.782 1.00 0.00 C ATOM 1047 CD LYS A 194 -7.688 2.777 1.981 1.00 0.00 C ATOM 1048 CE LYS A 194 -8.511 1.938 2.972 1.00 0.00 C ATOM 1049 NZ LYS A 194 -8.782 0.572 2.477 1.00 0.00 N ATOM 0 H LYS A 194 -4.916 3.909 -1.398 1.00 0.00 H new ATOM 0 HA LYS A 194 -5.883 4.843 1.103 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.232 2.698 -0.295 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -4.692 2.166 0.350 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -6.335 1.126 1.680 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.679 2.414 2.672 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -7.620 3.803 2.344 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -8.203 2.812 1.021 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -7.977 1.877 3.920 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -9.457 2.442 3.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -9.571 0.158 3.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -9.032 0.612 1.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -7.933 -0.017 2.600 1.00 0.00 H new ATOM 1063 N ALA A 195 -2.703 3.949 1.066 1.00 0.00 N ATOM 1064 CA ALA A 195 -1.419 4.077 1.741 1.00 0.00 C ATOM 1065 C ALA A 195 -1.056 5.544 1.988 1.00 0.00 C ATOM 1066 O ALA A 195 -0.726 5.938 3.108 1.00 0.00 O ATOM 1067 CB ALA A 195 -0.340 3.407 0.886 1.00 0.00 C ATOM 0 H ALA A 195 -2.647 3.420 0.196 1.00 0.00 H new ATOM 0 HA ALA A 195 -1.487 3.589 2.713 1.00 0.00 H new ATOM 0 HB1 ALA A 195 0.626 3.497 1.383 1.00 0.00 H new ATOM 0 HB2 ALA A 195 -0.583 2.353 0.754 1.00 0.00 H new ATOM 0 HB3 ALA A 195 -0.294 3.893 -0.088 1.00 0.00 H new ATOM 1073 N LEU A 196 -1.096 6.357 0.930 1.00 0.00 N ATOM 1074 CA LEU A 196 -0.738 7.761 1.013 1.00 0.00 C ATOM 1075 C LEU A 196 -1.702 8.514 1.924 1.00 0.00 C ATOM 1076 O LEU A 196 -1.266 9.286 2.774 1.00 0.00 O ATOM 1077 CB LEU A 196 -0.691 8.361 -0.396 1.00 0.00 C ATOM 1078 CG LEU A 196 0.462 7.802 -1.251 1.00 0.00 C ATOM 1079 CD1 LEU A 196 0.274 8.268 -2.697 1.00 0.00 C ATOM 1080 CD2 LEU A 196 1.843 8.243 -0.746 1.00 0.00 C ATOM 0 H LEU A 196 -1.378 6.055 -0.003 1.00 0.00 H new ATOM 0 HA LEU A 196 0.253 7.857 1.457 1.00 0.00 H new ATOM 0 HB2 LEU A 196 -1.637 8.165 -0.900 1.00 0.00 H new ATOM 0 HB3 LEU A 196 -0.588 9.444 -0.321 1.00 0.00 H new ATOM 0 HG LEU A 196 0.430 6.715 -1.182 1.00 0.00 H new ATOM 0 HD11 LEU A 196 1.085 7.879 -3.313 1.00 0.00 H new ATOM 0 HD12 LEU A 196 -0.679 7.900 -3.077 1.00 0.00 H new ATOM 0 HD13 LEU A 196 0.283 9.357 -2.732 1.00 0.00 H new ATOM 0 HD21 LEU A 196 2.617 7.820 -1.386 1.00 0.00 H new ATOM 0 HD22 LEU A 196 1.908 9.331 -0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 196 1.986 7.892 0.276 1.00 0.00 H new ATOM 1092 N ALA A 197 -3.004 8.276 1.766 1.00 0.00 N ATOM 1093 CA ALA A 197 -4.046 8.901 2.569 1.00 0.00 C ATOM 1094 C ALA A 197 -3.760 8.737 4.062 1.00 0.00 C ATOM 1095 O ALA A 197 -3.848 9.706 4.811 1.00 0.00 O ATOM 1096 CB ALA A 197 -5.418 8.325 2.203 1.00 0.00 C ATOM 0 H ALA A 197 -3.367 7.632 1.063 1.00 0.00 H new ATOM 0 HA ALA A 197 -4.054 9.969 2.351 1.00 0.00 H new ATOM 0 HB1 ALA A 197 -6.187 8.802 2.811 1.00 0.00 H new ATOM 0 HB2 ALA A 197 -5.622 8.512 1.149 1.00 0.00 H new ATOM 0 HB3 ALA A 197 -5.423 7.251 2.388 1.00 0.00 H new ATOM 1102 N MET A 198 -3.406 7.521 4.495 1.00 0.00 N ATOM 1103 CA MET A 198 -3.088 7.266 5.900 1.00 0.00 C ATOM 1104 C MET A 198 -1.654 7.663 6.279 1.00 0.00 C ATOM 1105 O MET A 198 -1.256 7.492 7.430 1.00 0.00 O ATOM 1106 CB MET A 198 -3.480 5.834 6.275 1.00 0.00 C ATOM 1107 CG MET A 198 -5.000 5.821 6.497 1.00 0.00 C ATOM 1108 SD MET A 198 -5.801 4.214 6.655 1.00 0.00 S ATOM 1109 CE MET A 198 -5.559 3.616 4.975 1.00 0.00 C ATOM 0 H MET A 198 -3.333 6.702 3.892 1.00 0.00 H new ATOM 0 HA MET A 198 -3.695 7.928 6.518 1.00 0.00 H new ATOM 0 HB2 MET A 198 -3.201 5.139 5.483 1.00 0.00 H new ATOM 0 HB3 MET A 198 -2.957 5.516 7.177 1.00 0.00 H new ATOM 0 HG2 MET A 198 -5.214 6.394 7.399 1.00 0.00 H new ATOM 0 HG3 MET A 198 -5.466 6.350 5.666 1.00 0.00 H new ATOM 0 HE1 MET A 198 -6.170 2.728 4.814 1.00 0.00 H new ATOM 0 HE2 MET A 198 -5.852 4.391 4.267 1.00 0.00 H new ATOM 0 HE3 MET A 198 -4.509 3.366 4.825 1.00 0.00 H new ATOM 1119 N GLY A 199 -0.898 8.258 5.354 1.00 0.00 N ATOM 1120 CA GLY A 199 0.401 8.833 5.637 1.00 0.00 C ATOM 1121 C GLY A 199 1.557 7.851 5.588 1.00 0.00 C ATOM 1122 O GLY A 199 2.509 8.021 6.350 1.00 0.00 O ATOM 0 H GLY A 199 -1.182 8.351 4.379 1.00 0.00 H new ATOM 0 HA2 GLY A 199 0.592 9.633 4.922 1.00 0.00 H new ATOM 0 HA3 GLY A 199 0.373 9.290 6.626 1.00 0.00 H new ATOM 1126 N MET A 200 1.528 6.862 4.685 1.00 0.00 N ATOM 1127 CA MET A 200 2.695 5.996 4.536 1.00 0.00 C ATOM 1128 C MET A 200 3.869 6.860 4.062 1.00 0.00 C ATOM 1129 O MET A 200 3.823 7.451 2.983 1.00 0.00 O ATOM 1130 CB MET A 200 2.446 4.823 3.581 1.00 0.00 C ATOM 1131 CG MET A 200 1.727 3.678 4.298 1.00 0.00 C ATOM 1132 SD MET A 200 1.800 2.084 3.451 1.00 0.00 S ATOM 1133 CE MET A 200 1.085 1.026 4.725 1.00 0.00 C ATOM 0 H MET A 200 0.742 6.650 4.071 1.00 0.00 H new ATOM 0 HA MET A 200 2.922 5.541 5.500 1.00 0.00 H new ATOM 0 HB2 MET A 200 1.848 5.159 2.734 1.00 0.00 H new ATOM 0 HB3 MET A 200 3.395 4.467 3.180 1.00 0.00 H new ATOM 0 HG2 MET A 200 2.158 3.564 5.293 1.00 0.00 H new ATOM 0 HG3 MET A 200 0.681 3.953 4.433 1.00 0.00 H new ATOM 0 HE1 MET A 200 1.004 0.006 4.348 1.00 0.00 H new ATOM 0 HE2 MET A 200 1.724 1.037 5.608 1.00 0.00 H new ATOM 0 HE3 MET A 200 0.094 1.394 4.990 1.00 0.00 H new ATOM 1143 N LYS A 201 4.908 6.965 4.891 1.00 0.00 N ATOM 1144 CA LYS A 201 6.054 7.807 4.628 1.00 0.00 C ATOM 1145 C LYS A 201 6.901 7.260 3.483 1.00 0.00 C ATOM 1146 O LYS A 201 7.862 6.531 3.720 1.00 0.00 O ATOM 1147 CB LYS A 201 6.876 7.982 5.911 1.00 0.00 C ATOM 1148 CG LYS A 201 6.058 8.551 7.077 1.00 0.00 C ATOM 1149 CD LYS A 201 5.400 9.904 6.770 1.00 0.00 C ATOM 1150 CE LYS A 201 4.683 10.469 8.001 1.00 0.00 C ATOM 1151 NZ LYS A 201 3.643 9.549 8.495 1.00 0.00 N ATOM 0 H LYS A 201 4.969 6.457 5.773 1.00 0.00 H new ATOM 0 HA LYS A 201 5.700 8.788 4.310 1.00 0.00 H new ATOM 0 HB2 LYS A 201 7.292 7.018 6.203 1.00 0.00 H new ATOM 0 HB3 LYS A 201 7.718 8.644 5.708 1.00 0.00 H new ATOM 0 HG2 LYS A 201 5.283 7.834 7.349 1.00 0.00 H new ATOM 0 HG3 LYS A 201 6.708 8.662 7.945 1.00 0.00 H new ATOM 0 HD2 LYS A 201 6.158 10.611 6.432 1.00 0.00 H new ATOM 0 HD3 LYS A 201 4.687 9.787 5.954 1.00 0.00 H new ATOM 0 HE2 LYS A 201 5.410 10.656 8.792 1.00 0.00 H new ATOM 0 HE3 LYS A 201 4.231 11.429 7.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 2.887 10.095 8.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 3.246 9.013 7.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 4.061 8.889 9.181 1.00 0.00 H new ATOM 1165 N ARG A 202 6.556 7.649 2.251 1.00 0.00 N ATOM 1166 CA ARG A 202 7.275 7.318 1.024 1.00 0.00 C ATOM 1167 C ARG A 202 8.787 7.366 1.257 1.00 0.00 C ATOM 1168 O ARG A 202 9.511 6.463 0.848 1.00 0.00 O ATOM 1169 CB ARG A 202 6.858 8.304 -0.081 1.00 0.00 C ATOM 1170 CG ARG A 202 7.610 8.033 -1.391 1.00 0.00 C ATOM 1171 CD ARG A 202 7.234 9.004 -2.515 1.00 0.00 C ATOM 1172 NE ARG A 202 5.893 8.735 -3.052 1.00 0.00 N ATOM 1173 CZ ARG A 202 4.774 9.420 -2.777 1.00 0.00 C ATOM 1174 NH1 ARG A 202 4.750 10.345 -1.811 1.00 0.00 N ATOM 1175 NH2 ARG A 202 3.676 9.164 -3.490 1.00 0.00 N ATOM 0 H ARG A 202 5.733 8.227 2.078 1.00 0.00 H new ATOM 0 HA ARG A 202 7.022 6.304 0.715 1.00 0.00 H new ATOM 0 HB2 ARG A 202 5.785 8.226 -0.254 1.00 0.00 H new ATOM 0 HB3 ARG A 202 7.054 9.325 0.248 1.00 0.00 H new ATOM 0 HG2 ARG A 202 8.682 8.098 -1.207 1.00 0.00 H new ATOM 0 HG3 ARG A 202 7.404 7.013 -1.716 1.00 0.00 H new ATOM 0 HD2 ARG A 202 7.275 10.026 -2.139 1.00 0.00 H new ATOM 0 HD3 ARG A 202 7.967 8.930 -3.318 1.00 0.00 H new ATOM 0 HE ARG A 202 5.805 7.950 -3.697 1.00 0.00 H new ATOM 0 HH11 ARG A 202 5.592 10.539 -1.270 1.00 0.00 H new ATOM 0 HH12 ARG A 202 3.889 10.856 -1.616 1.00 0.00 H new ATOM 0 HH21 ARG A 202 3.699 8.459 -4.227 1.00 0.00 H new ATOM 0 HH22 ARG A 202 2.813 9.673 -3.298 1.00 0.00 H new ATOM 1189 N GLU A 203 9.249 8.413 1.944 1.00 0.00 N ATOM 1190 CA GLU A 203 10.638 8.646 2.288 1.00 0.00 C ATOM 1191 C GLU A 203 11.316 7.373 2.810 1.00 0.00 C ATOM 1192 O GLU A 203 12.409 7.015 2.376 1.00 0.00 O ATOM 1193 CB GLU A 203 10.702 9.750 3.356 1.00 0.00 C ATOM 1194 CG GLU A 203 9.973 11.049 2.974 1.00 0.00 C ATOM 1195 CD GLU A 203 8.540 11.090 3.509 1.00 0.00 C ATOM 1196 OE1 GLU A 203 7.661 10.518 2.826 1.00 0.00 O ATOM 1197 OE2 GLU A 203 8.353 11.660 4.605 1.00 0.00 O ATOM 0 H GLU A 203 8.632 9.149 2.287 1.00 0.00 H new ATOM 0 HA GLU A 203 11.173 8.953 1.389 1.00 0.00 H new ATOM 0 HB2 GLU A 203 10.274 9.367 4.283 1.00 0.00 H new ATOM 0 HB3 GLU A 203 11.748 9.981 3.559 1.00 0.00 H new ATOM 0 HG2 GLU A 203 10.528 11.902 3.363 1.00 0.00 H new ATOM 0 HG3 GLU A 203 9.956 11.148 1.889 1.00 0.00 H new ATOM 1204 N ALA A 204 10.655 6.672 3.735 1.00 0.00 N ATOM 1205 CA ALA A 204 11.186 5.469 4.354 1.00 0.00 C ATOM 1206 C ALA A 204 11.490 4.360 3.341 1.00 0.00 C ATOM 1207 O ALA A 204 12.375 3.547 3.589 1.00 0.00 O ATOM 1208 CB ALA A 204 10.254 5.010 5.476 1.00 0.00 C ATOM 0 H ALA A 204 9.729 6.931 4.074 1.00 0.00 H new ATOM 0 HA ALA A 204 12.153 5.713 4.794 1.00 0.00 H new ATOM 0 HB1 ALA A 204 10.656 4.108 5.937 1.00 0.00 H new ATOM 0 HB2 ALA A 204 10.174 5.796 6.227 1.00 0.00 H new ATOM 0 HB3 ALA A 204 9.267 4.798 5.065 1.00 0.00 H new ATOM 1214 N VAL A 205 10.830 4.332 2.177 1.00 0.00 N ATOM 1215 CA VAL A 205 11.151 3.346 1.147 1.00 0.00 C ATOM 1216 C VAL A 205 12.615 3.479 0.729 1.00 0.00 C ATOM 1217 O VAL A 205 13.246 2.498 0.334 1.00 0.00 O ATOM 1218 CB VAL A 205 10.215 3.491 -0.063 1.00 0.00 C ATOM 1219 CG1 VAL A 205 10.690 2.647 -1.253 1.00 0.00 C ATOM 1220 CG2 VAL A 205 8.788 3.100 0.342 1.00 0.00 C ATOM 0 H VAL A 205 10.078 4.975 1.929 1.00 0.00 H new ATOM 0 HA VAL A 205 11.001 2.349 1.562 1.00 0.00 H new ATOM 0 HB VAL A 205 10.228 4.533 -0.383 1.00 0.00 H new ATOM 0 HG11 VAL A 205 10.002 2.776 -2.089 1.00 0.00 H new ATOM 0 HG12 VAL A 205 11.688 2.968 -1.551 1.00 0.00 H new ATOM 0 HG13 VAL A 205 10.718 1.596 -0.966 1.00 0.00 H new ATOM 0 HG21 VAL A 205 8.125 3.203 -0.517 1.00 0.00 H new ATOM 0 HG22 VAL A 205 8.778 2.066 0.686 1.00 0.00 H new ATOM 0 HG23 VAL A 205 8.446 3.753 1.145 1.00 0.00 H new ATOM 1230 N GLN A 206 13.187 4.679 0.836 1.00 0.00 N ATOM 1231 CA GLN A 206 14.575 4.912 0.481 1.00 0.00 C ATOM 1232 C GLN A 206 15.546 4.184 1.424 1.00 0.00 C ATOM 1233 O GLN A 206 16.746 4.194 1.161 1.00 0.00 O ATOM 1234 CB GLN A 206 14.844 6.420 0.406 1.00 0.00 C ATOM 1235 CG GLN A 206 13.924 7.102 -0.624 1.00 0.00 C ATOM 1236 CD GLN A 206 14.047 8.623 -0.585 1.00 0.00 C ATOM 1237 OE1 GLN A 206 13.065 9.324 -0.363 1.00 0.00 O ATOM 1238 NE2 GLN A 206 15.244 9.157 -0.803 1.00 0.00 N ATOM 0 H GLN A 206 12.698 5.509 1.170 1.00 0.00 H new ATOM 0 HA GLN A 206 14.757 4.486 -0.506 1.00 0.00 H new ATOM 0 HB2 GLN A 206 14.690 6.868 1.388 1.00 0.00 H new ATOM 0 HB3 GLN A 206 15.886 6.593 0.137 1.00 0.00 H new ATOM 0 HG2 GLN A 206 14.171 6.744 -1.623 1.00 0.00 H new ATOM 0 HG3 GLN A 206 12.890 6.817 -0.430 1.00 0.00 H new ATOM 0 HE21 GLN A 206 16.046 8.554 -0.985 1.00 0.00 H new ATOM 0 HE22 GLN A 206 15.361 10.170 -0.788 1.00 0.00 H new ATOM 1247 N GLU A 207 15.060 3.527 2.487 1.00 0.00 N ATOM 1248 CA GLU A 207 15.879 2.783 3.441 1.00 0.00 C ATOM 1249 C GLU A 207 16.895 1.856 2.762 1.00 0.00 C ATOM 1250 O GLU A 207 18.036 1.755 3.206 1.00 0.00 O ATOM 1251 CB GLU A 207 14.967 2.005 4.404 1.00 0.00 C ATOM 1252 CG GLU A 207 14.086 0.953 3.702 1.00 0.00 C ATOM 1253 CD GLU A 207 12.922 0.481 4.569 1.00 0.00 C ATOM 1254 OE1 GLU A 207 13.088 0.480 5.807 1.00 0.00 O ATOM 1255 OE2 GLU A 207 11.887 0.111 3.971 1.00 0.00 O ATOM 0 H GLU A 207 14.065 3.501 2.708 1.00 0.00 H new ATOM 0 HA GLU A 207 16.469 3.505 4.005 1.00 0.00 H new ATOM 0 HB2 GLU A 207 15.583 1.509 5.154 1.00 0.00 H new ATOM 0 HB3 GLU A 207 14.326 2.710 4.933 1.00 0.00 H new ATOM 0 HG2 GLU A 207 13.695 1.373 2.775 1.00 0.00 H new ATOM 0 HG3 GLU A 207 14.701 0.095 3.429 1.00 0.00 H new