USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 598 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 85 TYR OH : rot 180:sc=-0.00353 USER MOD Single : A 86 ASN : amide:sc= 0.196 X(o=0.2,f=-0.3) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 SER OG : rot 23:sc= 0.454 USER MOD Single : B 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 170 THR OG1 : rot 94:sc= 1.25 USER MOD Single : B 172 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : B 177 ASN : amide:sc= 0.0665 K(o=0.067,f=-0.53) USER MOD Single : B 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 183 THR OG1 : rot 75:sc= 0.761 USER MOD Single : B 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 186 MET CE :methyl 173:sc= -0.1 (180deg=-0.132) USER MOD Single : B 187 GLN : amide:sc= -0.382 X(o=-0.38,f=-0.38) USER MOD Single : B 188 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.292) USER MOD Single : B 190 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 192 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 193 TYR OH : rot 180:sc= 0 USER MOD Single : B 194 GLN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : B 201 GLN : amide:sc= 0 X(o=0,f=-0.0041) USER MOD Single : B 202 HIS : no HD1:sc= -0.243 K(o=-0.24,f=-1.5) USER MOD Single : B 203 SER OG : rot 180:sc= 0 USER MOD Single : B 206 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 207 TYR OH : rot 70:sc= 0 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 214 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 215 TYR OH : rot 180:sc= 0 USER MOD Single : B 216 THR OG1 : rot 33:sc= 0.092 USER MOD ----------------------------------------------------------------- ATOM 131 N GLU A 80 -11.473 -11.980 2.754 1.00 0.00 N ATOM 132 CA GLU A 80 -11.153 -10.770 2.000 1.00 0.00 C ATOM 133 C GLU A 80 -10.042 -9.978 2.697 1.00 0.00 C ATOM 134 O GLU A 80 -9.023 -9.640 2.096 1.00 0.00 O ATOM 135 CB GLU A 80 -12.405 -9.881 1.837 1.00 0.00 C ATOM 136 CG GLU A 80 -13.644 -10.572 1.244 1.00 0.00 C ATOM 137 CD GLU A 80 -14.593 -11.131 2.313 1.00 0.00 C ATOM 138 OE1 GLU A 80 -14.267 -12.161 2.944 1.00 0.00 O ATOM 139 OE2 GLU A 80 -15.664 -10.529 2.581 1.00 0.00 O ATOM 0 HA GLU A 80 -10.805 -11.072 1.012 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -12.670 -9.477 2.814 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -12.146 -9.034 1.202 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -14.187 -9.860 0.622 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -13.322 -11.384 0.592 1.00 0.00 H new ATOM 146 N PHE A 81 -10.239 -9.674 3.981 1.00 0.00 N ATOM 147 CA PHE A 81 -9.267 -8.925 4.768 1.00 0.00 C ATOM 148 C PHE A 81 -7.968 -9.701 4.951 1.00 0.00 C ATOM 149 O PHE A 81 -6.923 -9.069 5.074 1.00 0.00 O ATOM 150 CB PHE A 81 -9.834 -8.521 6.126 1.00 0.00 C ATOM 151 CG PHE A 81 -10.891 -7.445 6.091 1.00 0.00 C ATOM 152 CD1 PHE A 81 -10.523 -6.130 5.761 1.00 0.00 C ATOM 153 CD2 PHE A 81 -12.224 -7.739 6.440 1.00 0.00 C ATOM 154 CE1 PHE A 81 -11.496 -5.119 5.745 1.00 0.00 C ATOM 155 CE2 PHE A 81 -13.189 -6.718 6.447 1.00 0.00 C ATOM 156 CZ PHE A 81 -12.827 -5.409 6.082 1.00 0.00 C ATOM 0 H PHE A 81 -11.075 -9.941 4.500 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.044 -8.018 4.206 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.256 -9.406 6.603 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.013 -8.180 6.757 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.496 -5.898 5.521 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.504 -8.749 6.702 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.219 -4.112 5.472 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -14.207 -6.938 6.732 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.572 -4.628 6.061 1.00 0.00 H new ATOM 166 N ALA A 82 -7.995 -11.037 5.008 1.00 0.00 N ATOM 167 CA ALA A 82 -6.762 -11.808 5.158 1.00 0.00 C ATOM 168 C ALA A 82 -5.858 -11.487 3.973 1.00 0.00 C ATOM 169 O ALA A 82 -4.689 -11.140 4.136 1.00 0.00 O ATOM 170 CB ALA A 82 -7.052 -13.309 5.203 1.00 0.00 C ATOM 0 H ALA A 82 -8.845 -11.598 4.953 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.276 -11.539 6.096 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.117 -13.857 5.315 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.705 -13.528 6.048 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.542 -13.613 4.278 1.00 0.00 H new ATOM 176 N GLU A 83 -6.428 -11.574 2.774 1.00 0.00 N ATOM 177 CA GLU A 83 -5.722 -11.293 1.544 1.00 0.00 C ATOM 178 C GLU A 83 -5.316 -9.821 1.481 1.00 0.00 C ATOM 179 O GLU A 83 -4.216 -9.506 1.030 1.00 0.00 O ATOM 180 CB GLU A 83 -6.610 -11.752 0.390 1.00 0.00 C ATOM 181 CG GLU A 83 -5.934 -11.649 -0.981 1.00 0.00 C ATOM 182 CD GLU A 83 -4.561 -12.326 -1.099 1.00 0.00 C ATOM 183 OE1 GLU A 83 -4.232 -13.263 -0.326 1.00 0.00 O ATOM 184 OE2 GLU A 83 -3.817 -11.953 -2.032 1.00 0.00 O ATOM 0 H GLU A 83 -7.402 -11.845 2.636 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.782 -11.840 1.481 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.909 -12.786 0.562 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.521 -11.153 0.383 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -6.599 -12.085 -1.727 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -5.821 -10.594 -1.232 1.00 0.00 H new ATOM 191 N PHE A 84 -6.158 -8.920 1.985 1.00 0.00 N ATOM 192 CA PHE A 84 -5.877 -7.492 2.007 1.00 0.00 C ATOM 193 C PHE A 84 -4.596 -7.254 2.813 1.00 0.00 C ATOM 194 O PHE A 84 -3.673 -6.593 2.337 1.00 0.00 O ATOM 195 CB PHE A 84 -7.088 -6.763 2.599 1.00 0.00 C ATOM 196 CG PHE A 84 -7.045 -5.256 2.523 1.00 0.00 C ATOM 197 CD1 PHE A 84 -7.056 -4.618 1.269 1.00 0.00 C ATOM 198 CD2 PHE A 84 -7.052 -4.486 3.702 1.00 0.00 C ATOM 199 CE1 PHE A 84 -7.046 -3.217 1.202 1.00 0.00 C ATOM 200 CE2 PHE A 84 -7.047 -3.082 3.627 1.00 0.00 C ATOM 201 CZ PHE A 84 -7.038 -2.448 2.375 1.00 0.00 C ATOM 0 H PHE A 84 -7.060 -9.166 2.392 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.712 -7.100 1.003 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -7.985 -7.109 2.085 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.188 -7.053 3.645 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -7.072 -5.204 0.362 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -7.061 -4.975 4.665 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -7.044 -2.727 0.240 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -7.050 -2.492 4.532 1.00 0.00 H new ATOM 0 HZ PHE A 84 -7.025 -1.370 2.315 1.00 0.00 H new ATOM 211 N TYR A 85 -4.503 -7.834 4.014 1.00 0.00 N ATOM 212 CA TYR A 85 -3.340 -7.694 4.877 1.00 0.00 C ATOM 213 C TYR A 85 -2.115 -8.411 4.302 1.00 0.00 C ATOM 214 O TYR A 85 -0.994 -7.939 4.530 1.00 0.00 O ATOM 215 CB TYR A 85 -3.677 -8.151 6.299 1.00 0.00 C ATOM 216 CG TYR A 85 -4.871 -7.448 6.932 1.00 0.00 C ATOM 217 CD1 TYR A 85 -5.085 -6.064 6.763 1.00 0.00 C ATOM 218 CD2 TYR A 85 -5.792 -8.198 7.683 1.00 0.00 C ATOM 219 CE1 TYR A 85 -6.219 -5.437 7.308 1.00 0.00 C ATOM 220 CE2 TYR A 85 -6.916 -7.581 8.251 1.00 0.00 C ATOM 221 CZ TYR A 85 -7.154 -6.205 8.044 1.00 0.00 C ATOM 222 OH TYR A 85 -8.301 -5.652 8.525 1.00 0.00 O ATOM 0 H TYR A 85 -5.240 -8.416 4.411 1.00 0.00 H new ATOM 0 HA TYR A 85 -3.072 -6.639 4.926 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -3.871 -9.223 6.284 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -2.804 -7.994 6.932 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -4.368 -5.478 6.207 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -5.633 -9.257 7.824 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -6.376 -4.378 7.167 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -7.603 -8.161 8.850 1.00 0.00 H new ATOM 0 HH TYR A 85 -8.818 -6.334 9.003 1.00 0.00 H new ATOM 232 N ASN A 86 -2.283 -9.517 3.559 1.00 0.00 N ATOM 233 CA ASN A 86 -1.194 -10.253 2.938 1.00 0.00 C ATOM 234 C ASN A 86 -0.515 -9.290 1.954 1.00 0.00 C ATOM 235 O ASN A 86 0.705 -9.116 1.975 1.00 0.00 O ATOM 236 CB ASN A 86 -1.730 -11.472 2.159 1.00 0.00 C ATOM 237 CG ASN A 86 -2.262 -12.656 2.963 1.00 0.00 C ATOM 238 OD1 ASN A 86 -1.904 -12.888 4.116 1.00 0.00 O ATOM 239 ND2 ASN A 86 -3.111 -13.472 2.350 1.00 0.00 N ATOM 0 H ASN A 86 -3.200 -9.924 3.376 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.502 -10.616 3.698 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.530 -11.125 1.505 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.929 -11.837 1.517 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -3.469 -14.295 2.836 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -3.406 -13.276 1.393 1.00 0.00 H new ATOM 246 N ARG A 87 -1.321 -8.646 1.098 1.00 0.00 N ATOM 247 CA ARG A 87 -0.871 -7.689 0.091 1.00 0.00 C ATOM 248 C ARG A 87 -0.293 -6.438 0.750 1.00 0.00 C ATOM 249 O ARG A 87 0.799 -6.028 0.376 1.00 0.00 O ATOM 250 CB ARG A 87 -2.028 -7.351 -0.872 1.00 0.00 C ATOM 251 CG ARG A 87 -2.556 -8.551 -1.678 1.00 0.00 C ATOM 252 CD ARG A 87 -1.560 -9.040 -2.733 1.00 0.00 C ATOM 253 NE ARG A 87 -1.629 -10.496 -2.926 1.00 0.00 N ATOM 254 CZ ARG A 87 -0.765 -11.224 -3.637 1.00 0.00 C ATOM 255 NH1 ARG A 87 0.192 -10.630 -4.349 1.00 0.00 N ATOM 256 NH2 ARG A 87 -0.862 -12.545 -3.622 1.00 0.00 N ATOM 0 H ARG A 87 -2.332 -8.784 1.091 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.070 -8.140 -0.495 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.850 -6.925 -0.297 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.693 -6.581 -1.567 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.786 -9.369 -0.995 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.489 -8.272 -2.167 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.761 -8.539 -3.680 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -0.550 -8.762 -2.433 1.00 0.00 H new ATOM 0 HE ARG A 87 -2.401 -10.991 -2.480 1.00 0.00 H new ATOM 0 HH11 ARG A 87 0.268 -9.613 -4.353 1.00 0.00 H new ATOM 0 HH12 ARG A 87 0.849 -11.192 -4.890 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -1.592 -12.997 -3.071 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -0.207 -13.111 -4.162 1.00 0.00 H new ATOM 270 N LEU A 88 -0.973 -5.843 1.737 1.00 0.00 N ATOM 271 CA LEU A 88 -0.486 -4.644 2.432 1.00 0.00 C ATOM 272 C LEU A 88 0.933 -4.833 2.945 1.00 0.00 C ATOM 273 O LEU A 88 1.787 -3.991 2.670 1.00 0.00 O ATOM 274 CB LEU A 88 -1.398 -4.248 3.608 1.00 0.00 C ATOM 275 CG LEU A 88 -2.507 -3.258 3.223 1.00 0.00 C ATOM 276 CD1 LEU A 88 -3.731 -3.462 4.113 1.00 0.00 C ATOM 277 CD2 LEU A 88 -2.017 -1.816 3.426 1.00 0.00 C ATOM 0 H LEU A 88 -1.875 -6.178 2.076 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.497 -3.841 1.695 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.854 -5.148 4.022 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.788 -3.808 4.397 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.766 -3.431 2.179 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.509 -2.754 3.829 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.104 -4.479 3.991 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.455 -3.299 5.155 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.810 -1.120 3.151 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.750 -1.666 4.472 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.143 -1.637 2.799 1.00 0.00 H new ATOM 289 N LYS A 89 1.183 -5.923 3.684 1.00 0.00 N ATOM 290 CA LYS A 89 2.503 -6.211 4.239 1.00 0.00 C ATOM 291 C LYS A 89 3.557 -6.143 3.137 1.00 0.00 C ATOM 292 O LYS A 89 4.566 -5.468 3.327 1.00 0.00 O ATOM 293 CB LYS A 89 2.488 -7.569 4.966 1.00 0.00 C ATOM 294 CG LYS A 89 3.891 -7.988 5.433 1.00 0.00 C ATOM 295 CD LYS A 89 3.904 -9.350 6.133 1.00 0.00 C ATOM 296 CE LYS A 89 5.368 -9.714 6.402 1.00 0.00 C ATOM 297 NZ LYS A 89 5.538 -11.077 6.940 1.00 0.00 N ATOM 0 H LYS A 89 0.477 -6.623 3.910 1.00 0.00 H new ATOM 0 HA LYS A 89 2.766 -5.457 4.981 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.822 -7.512 5.827 1.00 0.00 H new ATOM 0 HB3 LYS A 89 2.085 -8.332 4.300 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.560 -8.021 4.573 1.00 0.00 H new ATOM 0 HG3 LYS A 89 4.283 -7.232 6.113 1.00 0.00 H new ATOM 0 HD2 LYS A 89 3.342 -9.307 7.066 1.00 0.00 H new ATOM 0 HD3 LYS A 89 3.429 -10.107 5.509 1.00 0.00 H new ATOM 0 HE2 LYS A 89 5.935 -9.623 5.475 1.00 0.00 H new ATOM 0 HE3 LYS A 89 5.791 -8.997 7.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 6.548 -11.263 7.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 5.023 -11.162 7.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 5.163 -11.768 6.260 1.00 0.00 H new ATOM 311 N GLN A 90 3.312 -6.807 2.006 1.00 0.00 N ATOM 312 CA GLN A 90 4.182 -6.867 0.858 1.00 0.00 C ATOM 313 C GLN A 90 4.649 -5.473 0.423 1.00 0.00 C ATOM 314 O GLN A 90 5.851 -5.282 0.229 1.00 0.00 O ATOM 315 CB GLN A 90 3.405 -7.614 -0.240 1.00 0.00 C ATOM 316 CG GLN A 90 4.294 -8.454 -1.148 1.00 0.00 C ATOM 317 CD GLN A 90 4.324 -7.888 -2.566 1.00 0.00 C ATOM 318 OE1 GLN A 90 4.952 -6.867 -2.840 1.00 0.00 O ATOM 319 NE2 GLN A 90 3.636 -8.511 -3.503 1.00 0.00 N ATOM 0 H GLN A 90 2.453 -7.341 1.872 1.00 0.00 H new ATOM 0 HA GLN A 90 5.104 -7.401 1.089 1.00 0.00 H new ATOM 0 HB2 GLN A 90 2.662 -8.260 0.227 1.00 0.00 H new ATOM 0 HB3 GLN A 90 2.861 -6.890 -0.846 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.306 -8.485 -0.744 1.00 0.00 H new ATOM 0 HG3 GLN A 90 3.929 -9.481 -1.171 1.00 0.00 H new ATOM 0 HE21 GLN A 90 3.115 -9.358 -3.275 1.00 0.00 H new ATOM 0 HE22 GLN A 90 3.625 -8.146 -4.455 1.00 0.00 H new ATOM 328 N ILE A 91 3.730 -4.504 0.310 1.00 0.00 N ATOM 329 CA ILE A 91 4.065 -3.140 -0.091 1.00 0.00 C ATOM 330 C ILE A 91 4.919 -2.467 0.996 1.00 0.00 C ATOM 331 O ILE A 91 6.001 -1.966 0.687 1.00 0.00 O ATOM 332 CB ILE A 91 2.821 -2.269 -0.379 1.00 0.00 C ATOM 333 CG1 ILE A 91 1.673 -2.927 -1.170 1.00 0.00 C ATOM 334 CG2 ILE A 91 3.287 -1.018 -1.154 1.00 0.00 C ATOM 335 CD1 ILE A 91 0.380 -2.110 -1.028 1.00 0.00 C ATOM 0 H ILE A 91 2.737 -4.648 0.495 1.00 0.00 H new ATOM 0 HA ILE A 91 4.626 -3.219 -1.022 1.00 0.00 H new ATOM 0 HB ILE A 91 2.393 -2.056 0.601 1.00 0.00 H new ATOM 0 HG12 ILE A 91 1.947 -3.004 -2.222 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.510 -3.942 -0.808 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.428 -0.384 -1.371 1.00 0.00 H new ATOM 0 HG22 ILE A 91 4.005 -0.463 -0.550 1.00 0.00 H new ATOM 0 HG23 ILE A 91 3.758 -1.323 -2.088 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.418 -2.591 -1.593 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.098 -2.055 0.023 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.542 -1.103 -1.413 1.00 0.00 H new ATOM 347 N LYS A 92 4.478 -2.476 2.266 1.00 0.00 N ATOM 348 CA LYS A 92 5.229 -1.847 3.360 1.00 0.00 C ATOM 349 C LYS A 92 6.671 -2.335 3.353 1.00 0.00 C ATOM 350 O LYS A 92 7.606 -1.537 3.388 1.00 0.00 O ATOM 351 CB LYS A 92 4.566 -2.086 4.728 1.00 0.00 C ATOM 352 CG LYS A 92 3.091 -1.660 4.763 1.00 0.00 C ATOM 353 CD LYS A 92 2.650 -1.198 6.154 1.00 0.00 C ATOM 354 CE LYS A 92 1.281 -0.506 6.028 1.00 0.00 C ATOM 355 NZ LYS A 92 0.888 0.270 7.223 1.00 0.00 N ATOM 0 H LYS A 92 3.604 -2.913 2.558 1.00 0.00 H new ATOM 0 HA LYS A 92 5.223 -0.770 3.194 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.639 -3.144 4.981 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.115 -1.537 5.493 1.00 0.00 H new ATOM 0 HG2 LYS A 92 2.932 -0.853 4.048 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.467 -2.495 4.446 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.583 -2.049 6.832 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.384 -0.511 6.575 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.300 0.160 5.165 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.520 -1.261 5.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.043 0.706 7.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.837 -0.363 8.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 1.593 1.014 7.401 1.00 0.00 H new ATOM 1028 N SER B 160 2.853 9.740 -2.605 1.00 0.00 N ATOM 1029 CA SER B 160 4.029 8.961 -2.272 1.00 0.00 C ATOM 1030 C SER B 160 3.865 7.580 -2.918 1.00 0.00 C ATOM 1031 O SER B 160 2.738 7.100 -3.067 1.00 0.00 O ATOM 1032 CB SER B 160 4.105 8.870 -0.747 1.00 0.00 C ATOM 1033 OG SER B 160 3.834 10.135 -0.167 1.00 0.00 O ATOM 0 HA SER B 160 4.952 9.410 -2.640 1.00 0.00 H new ATOM 0 HB2 SER B 160 3.388 8.134 -0.383 1.00 0.00 H new ATOM 0 HB3 SER B 160 5.095 8.528 -0.445 1.00 0.00 H new ATOM 0 HG SER B 160 3.321 10.681 -0.799 1.00 0.00 H new ATOM 1039 N ALA B 161 4.960 6.903 -3.274 1.00 0.00 N ATOM 1040 CA ALA B 161 4.886 5.580 -3.900 1.00 0.00 C ATOM 1041 C ALA B 161 4.180 4.573 -2.986 1.00 0.00 C ATOM 1042 O ALA B 161 3.473 3.686 -3.468 1.00 0.00 O ATOM 1043 CB ALA B 161 6.309 5.115 -4.224 1.00 0.00 C ATOM 0 H ALA B 161 5.910 7.250 -3.139 1.00 0.00 H new ATOM 0 HA ALA B 161 4.300 5.645 -4.817 1.00 0.00 H new ATOM 0 HB1 ALA B 161 6.273 4.131 -4.691 1.00 0.00 H new ATOM 0 HB2 ALA B 161 6.777 5.824 -4.907 1.00 0.00 H new ATOM 0 HB3 ALA B 161 6.892 5.059 -3.305 1.00 0.00 H new ATOM 1049 N PHE B 162 4.360 4.717 -1.674 1.00 0.00 N ATOM 1050 CA PHE B 162 3.743 3.860 -0.679 1.00 0.00 C ATOM 1051 C PHE B 162 2.234 4.069 -0.733 1.00 0.00 C ATOM 1052 O PHE B 162 1.475 3.114 -0.894 1.00 0.00 O ATOM 1053 CB PHE B 162 4.347 4.225 0.683 1.00 0.00 C ATOM 1054 CG PHE B 162 3.975 3.363 1.880 1.00 0.00 C ATOM 1055 CD1 PHE B 162 2.631 3.127 2.248 1.00 0.00 C ATOM 1056 CD2 PHE B 162 5.009 2.816 2.667 1.00 0.00 C ATOM 1057 CE1 PHE B 162 2.334 2.333 3.369 1.00 0.00 C ATOM 1058 CE2 PHE B 162 4.706 2.042 3.799 1.00 0.00 C ATOM 1059 CZ PHE B 162 3.368 1.815 4.157 1.00 0.00 C ATOM 0 H PHE B 162 4.949 5.446 -1.272 1.00 0.00 H new ATOM 0 HA PHE B 162 3.930 2.802 -0.862 1.00 0.00 H new ATOM 0 HB2 PHE B 162 5.432 4.208 0.583 1.00 0.00 H new ATOM 0 HB3 PHE B 162 4.064 5.253 0.910 1.00 0.00 H new ATOM 0 HD1 PHE B 162 1.830 3.558 1.666 1.00 0.00 H new ATOM 0 HD2 PHE B 162 6.040 2.993 2.398 1.00 0.00 H new ATOM 0 HE1 PHE B 162 1.306 2.122 3.623 1.00 0.00 H new ATOM 0 HE2 PHE B 162 5.503 1.621 4.394 1.00 0.00 H new ATOM 0 HZ PHE B 162 3.136 1.240 5.041 1.00 0.00 H new ATOM 1069 N ASP B 163 1.801 5.326 -0.588 1.00 0.00 N ATOM 1070 CA ASP B 163 0.398 5.716 -0.592 1.00 0.00 C ATOM 1071 C ASP B 163 -0.296 5.257 -1.864 1.00 0.00 C ATOM 1072 O ASP B 163 -1.399 4.719 -1.802 1.00 0.00 O ATOM 1073 CB ASP B 163 0.252 7.236 -0.409 1.00 0.00 C ATOM 1074 CG ASP B 163 0.375 7.613 1.062 1.00 0.00 C ATOM 1075 OD1 ASP B 163 -0.562 7.273 1.818 1.00 0.00 O ATOM 1076 OD2 ASP B 163 1.404 8.171 1.499 1.00 0.00 O ATOM 0 H ASP B 163 2.436 6.114 -0.462 1.00 0.00 H new ATOM 0 HA ASP B 163 -0.087 5.223 0.250 1.00 0.00 H new ATOM 0 HB2 ASP B 163 1.018 7.753 -0.988 1.00 0.00 H new ATOM 0 HB3 ASP B 163 -0.714 7.563 -0.794 1.00 0.00 H new ATOM 1081 N LEU B 164 0.370 5.435 -3.003 1.00 0.00 N ATOM 1082 CA LEU B 164 -0.106 5.075 -4.325 1.00 0.00 C ATOM 1083 C LEU B 164 -0.534 3.618 -4.412 1.00 0.00 C ATOM 1084 O LEU B 164 -1.644 3.330 -4.861 1.00 0.00 O ATOM 1085 CB LEU B 164 1.027 5.355 -5.324 1.00 0.00 C ATOM 1086 CG LEU B 164 0.707 4.938 -6.763 1.00 0.00 C ATOM 1087 CD1 LEU B 164 -0.500 5.701 -7.307 1.00 0.00 C ATOM 1088 CD2 LEU B 164 1.921 5.189 -7.645 1.00 0.00 C ATOM 0 H LEU B 164 1.300 5.854 -3.024 1.00 0.00 H new ATOM 0 HA LEU B 164 -0.990 5.670 -4.555 1.00 0.00 H new ATOM 0 HB2 LEU B 164 1.256 6.420 -5.308 1.00 0.00 H new ATOM 0 HB3 LEU B 164 1.925 4.831 -4.996 1.00 0.00 H new ATOM 0 HG LEU B 164 0.461 3.876 -6.767 1.00 0.00 H new ATOM 0 HD11 LEU B 164 -0.701 5.382 -8.330 1.00 0.00 H new ATOM 0 HD12 LEU B 164 -1.371 5.495 -6.685 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.290 6.771 -7.295 1.00 0.00 H new ATOM 0 HD21 LEU B 164 1.694 4.893 -8.669 1.00 0.00 H new ATOM 0 HD22 LEU B 164 2.175 6.249 -7.622 1.00 0.00 H new ATOM 0 HD23 LEU B 164 2.765 4.606 -7.277 1.00 0.00 H new ATOM 1100 N ASP B 165 0.356 2.706 -4.030 1.00 0.00 N ATOM 1101 CA ASP B 165 0.084 1.277 -4.086 1.00 0.00 C ATOM 1102 C ASP B 165 -1.043 0.905 -3.120 1.00 0.00 C ATOM 1103 O ASP B 165 -1.906 0.109 -3.488 1.00 0.00 O ATOM 1104 CB ASP B 165 1.382 0.509 -3.849 1.00 0.00 C ATOM 1105 CG ASP B 165 1.328 -0.963 -4.289 1.00 0.00 C ATOM 1106 OD1 ASP B 165 0.307 -1.661 -4.109 1.00 0.00 O ATOM 1107 OD2 ASP B 165 2.320 -1.437 -4.892 1.00 0.00 O ATOM 0 H ASP B 165 1.283 2.938 -3.674 1.00 0.00 H new ATOM 0 HA ASP B 165 -0.276 0.995 -5.075 1.00 0.00 H new ATOM 0 HB2 ASP B 165 2.190 1.008 -4.384 1.00 0.00 H new ATOM 0 HB3 ASP B 165 1.628 0.551 -2.788 1.00 0.00 H new ATOM 1112 N VAL B 166 -1.101 1.501 -1.919 1.00 0.00 N ATOM 1113 CA VAL B 166 -2.160 1.218 -0.942 1.00 0.00 C ATOM 1114 C VAL B 166 -3.512 1.582 -1.574 1.00 0.00 C ATOM 1115 O VAL B 166 -4.456 0.786 -1.528 1.00 0.00 O ATOM 1116 CB VAL B 166 -1.892 1.969 0.385 1.00 0.00 C ATOM 1117 CG1 VAL B 166 -3.079 1.907 1.360 1.00 0.00 C ATOM 1118 CG2 VAL B 166 -0.667 1.397 1.114 1.00 0.00 C ATOM 0 H VAL B 166 -0.418 2.189 -1.600 1.00 0.00 H new ATOM 0 HA VAL B 166 -2.176 0.158 -0.688 1.00 0.00 H new ATOM 0 HB VAL B 166 -1.721 3.006 0.094 1.00 0.00 H new ATOM 0 HG11 VAL B 166 -2.830 2.451 2.271 1.00 0.00 H new ATOM 0 HG12 VAL B 166 -3.956 2.359 0.895 1.00 0.00 H new ATOM 0 HG13 VAL B 166 -3.294 0.867 1.606 1.00 0.00 H new ATOM 0 HG21 VAL B 166 -0.506 1.946 2.042 1.00 0.00 H new ATOM 0 HG22 VAL B 166 -0.837 0.344 1.340 1.00 0.00 H new ATOM 0 HG23 VAL B 166 0.213 1.494 0.478 1.00 0.00 H new ATOM 1128 N VAL B 167 -3.604 2.768 -2.182 1.00 0.00 N ATOM 1129 CA VAL B 167 -4.803 3.263 -2.848 1.00 0.00 C ATOM 1130 C VAL B 167 -5.175 2.287 -3.970 1.00 0.00 C ATOM 1131 O VAL B 167 -6.309 1.809 -4.011 1.00 0.00 O ATOM 1132 CB VAL B 167 -4.534 4.705 -3.336 1.00 0.00 C ATOM 1133 CG1 VAL B 167 -5.600 5.240 -4.297 1.00 0.00 C ATOM 1134 CG2 VAL B 167 -4.454 5.669 -2.141 1.00 0.00 C ATOM 0 H VAL B 167 -2.824 3.424 -2.223 1.00 0.00 H new ATOM 0 HA VAL B 167 -5.660 3.312 -2.176 1.00 0.00 H new ATOM 0 HB VAL B 167 -3.588 4.655 -3.875 1.00 0.00 H new ATOM 0 HG11 VAL B 167 -5.343 6.256 -4.596 1.00 0.00 H new ATOM 0 HG12 VAL B 167 -5.646 4.603 -5.180 1.00 0.00 H new ATOM 0 HG13 VAL B 167 -6.570 5.242 -3.800 1.00 0.00 H new ATOM 0 HG21 VAL B 167 -4.264 6.680 -2.501 1.00 0.00 H new ATOM 0 HG22 VAL B 167 -5.397 5.650 -1.594 1.00 0.00 H new ATOM 0 HG23 VAL B 167 -3.644 5.362 -1.479 1.00 0.00 H new ATOM 1144 N LYS B 168 -4.230 1.963 -4.857 1.00 0.00 N ATOM 1145 CA LYS B 168 -4.432 1.053 -5.982 1.00 0.00 C ATOM 1146 C LYS B 168 -4.904 -0.334 -5.537 1.00 0.00 C ATOM 1147 O LYS B 168 -5.801 -0.894 -6.172 1.00 0.00 O ATOM 1148 CB LYS B 168 -3.121 0.960 -6.781 1.00 0.00 C ATOM 1149 CG LYS B 168 -2.963 2.078 -7.826 1.00 0.00 C ATOM 1150 CD LYS B 168 -1.655 1.839 -8.595 1.00 0.00 C ATOM 1151 CE LYS B 168 -1.448 2.859 -9.715 1.00 0.00 C ATOM 1152 NZ LYS B 168 -0.282 2.535 -10.571 1.00 0.00 N ATOM 0 H LYS B 168 -3.282 2.336 -4.809 1.00 0.00 H new ATOM 0 HA LYS B 168 -5.226 1.453 -6.612 1.00 0.00 H new ATOM 0 HB2 LYS B 168 -2.279 0.997 -6.090 1.00 0.00 H new ATOM 0 HB3 LYS B 168 -3.078 -0.006 -7.284 1.00 0.00 H new ATOM 0 HG2 LYS B 168 -3.811 2.080 -8.511 1.00 0.00 H new ATOM 0 HG3 LYS B 168 -2.944 3.053 -7.339 1.00 0.00 H new ATOM 0 HD2 LYS B 168 -0.815 1.887 -7.903 1.00 0.00 H new ATOM 0 HD3 LYS B 168 -1.663 0.834 -9.018 1.00 0.00 H new ATOM 0 HE2 LYS B 168 -2.346 2.904 -10.332 1.00 0.00 H new ATOM 0 HE3 LYS B 168 -1.311 3.849 -9.280 1.00 0.00 H new ATOM 0 HZ1 LYS B 168 -0.186 3.256 -11.314 1.00 0.00 H new ATOM 0 HZ2 LYS B 168 0.581 2.518 -9.991 1.00 0.00 H new ATOM 0 HZ3 LYS B 168 -0.422 1.603 -11.010 1.00 0.00 H new ATOM 1166 N LEU B 169 -4.295 -0.903 -4.492 1.00 0.00 N ATOM 1167 CA LEU B 169 -4.611 -2.215 -3.931 1.00 0.00 C ATOM 1168 C LEU B 169 -6.064 -2.187 -3.477 1.00 0.00 C ATOM 1169 O LEU B 169 -6.880 -2.977 -3.957 1.00 0.00 O ATOM 1170 CB LEU B 169 -3.643 -2.495 -2.752 1.00 0.00 C ATOM 1171 CG LEU B 169 -3.650 -3.899 -2.103 1.00 0.00 C ATOM 1172 CD1 LEU B 169 -2.715 -3.911 -0.881 1.00 0.00 C ATOM 1173 CD2 LEU B 169 -5.011 -4.406 -1.629 1.00 0.00 C ATOM 0 H LEU B 169 -3.535 -0.439 -3.994 1.00 0.00 H new ATOM 0 HA LEU B 169 -4.487 -3.013 -4.663 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.630 -2.298 -3.102 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.857 -1.768 -1.969 1.00 0.00 H new ATOM 0 HG LEU B 169 -3.324 -4.563 -2.904 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -2.723 -4.902 -0.427 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -1.701 -3.664 -1.196 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.058 -3.175 -0.153 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -4.898 -5.398 -1.191 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -5.413 -3.723 -0.881 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.695 -4.459 -2.476 1.00 0.00 H new ATOM 1185 N THR B 170 -6.378 -1.253 -2.581 1.00 0.00 N ATOM 1186 CA THR B 170 -7.704 -1.077 -2.021 1.00 0.00 C ATOM 1187 C THR B 170 -8.742 -0.913 -3.128 1.00 0.00 C ATOM 1188 O THR B 170 -9.729 -1.647 -3.115 1.00 0.00 O ATOM 1189 CB THR B 170 -7.690 0.080 -1.005 1.00 0.00 C ATOM 1190 OG1 THR B 170 -6.594 -0.043 -0.118 1.00 0.00 O ATOM 1191 CG2 THR B 170 -8.958 0.077 -0.147 1.00 0.00 C ATOM 0 H THR B 170 -5.697 -0.585 -2.220 1.00 0.00 H new ATOM 0 HA THR B 170 -7.999 -1.972 -1.473 1.00 0.00 H new ATOM 0 HB THR B 170 -7.621 1.001 -1.583 1.00 0.00 H new ATOM 0 HG1 THR B 170 -5.839 0.483 -0.456 1.00 0.00 H new ATOM 0 HG21 THR B 170 -8.920 0.905 0.561 1.00 0.00 H new ATOM 0 HG22 THR B 170 -9.832 0.188 -0.789 1.00 0.00 H new ATOM 0 HG23 THR B 170 -9.026 -0.864 0.399 1.00 0.00 H new ATOM 1199 N ALA B 171 -8.505 -0.022 -4.099 1.00 0.00 N ATOM 1200 CA ALA B 171 -9.413 0.244 -5.212 1.00 0.00 C ATOM 1201 C ALA B 171 -9.741 -1.031 -6.004 1.00 0.00 C ATOM 1202 O ALA B 171 -10.863 -1.197 -6.478 1.00 0.00 O ATOM 1203 CB ALA B 171 -8.817 1.324 -6.121 1.00 0.00 C ATOM 0 H ALA B 171 -7.657 0.544 -4.130 1.00 0.00 H new ATOM 0 HA ALA B 171 -10.355 0.607 -4.802 1.00 0.00 H new ATOM 0 HB1 ALA B 171 -9.498 1.519 -6.950 1.00 0.00 H new ATOM 0 HB2 ALA B 171 -8.670 2.240 -5.549 1.00 0.00 H new ATOM 0 HB3 ALA B 171 -7.859 0.982 -6.512 1.00 0.00 H new ATOM 1209 N GLN B 172 -8.782 -1.948 -6.152 1.00 0.00 N ATOM 1210 CA GLN B 172 -9.006 -3.198 -6.870 1.00 0.00 C ATOM 1211 C GLN B 172 -9.950 -4.119 -6.088 1.00 0.00 C ATOM 1212 O GLN B 172 -10.855 -4.708 -6.687 1.00 0.00 O ATOM 1213 CB GLN B 172 -7.661 -3.891 -7.130 1.00 0.00 C ATOM 1214 CG GLN B 172 -7.140 -3.551 -8.528 1.00 0.00 C ATOM 1215 CD GLN B 172 -5.827 -4.269 -8.821 1.00 0.00 C ATOM 1216 OE1 GLN B 172 -4.976 -4.440 -7.948 1.00 0.00 O ATOM 1217 NE2 GLN B 172 -5.634 -4.721 -10.046 1.00 0.00 N ATOM 0 H GLN B 172 -7.838 -1.844 -5.780 1.00 0.00 H new ATOM 0 HA GLN B 172 -9.481 -2.974 -7.825 1.00 0.00 H new ATOM 0 HB2 GLN B 172 -6.934 -3.579 -6.380 1.00 0.00 H new ATOM 0 HB3 GLN B 172 -7.777 -4.970 -7.032 1.00 0.00 H new ATOM 0 HG2 GLN B 172 -7.884 -3.831 -9.274 1.00 0.00 H new ATOM 0 HG3 GLN B 172 -6.994 -2.474 -8.612 1.00 0.00 H new ATOM 0 HE21 GLN B 172 -6.346 -4.574 -10.762 1.00 0.00 H new ATOM 0 HE22 GLN B 172 -4.773 -5.217 -10.277 1.00 0.00 H new ATOM 1226 N PHE B 173 -9.738 -4.249 -4.775 1.00 0.00 N ATOM 1227 CA PHE B 173 -10.550 -5.098 -3.906 1.00 0.00 C ATOM 1228 C PHE B 173 -11.973 -4.559 -3.809 1.00 0.00 C ATOM 1229 O PHE B 173 -12.922 -5.323 -3.968 1.00 0.00 O ATOM 1230 CB PHE B 173 -9.936 -5.191 -2.498 1.00 0.00 C ATOM 1231 CG PHE B 173 -8.797 -6.181 -2.302 1.00 0.00 C ATOM 1232 CD1 PHE B 173 -7.702 -6.237 -3.188 1.00 0.00 C ATOM 1233 CD2 PHE B 173 -8.812 -7.032 -1.178 1.00 0.00 C ATOM 1234 CE1 PHE B 173 -6.620 -7.097 -2.928 1.00 0.00 C ATOM 1235 CE2 PHE B 173 -7.736 -7.898 -0.926 1.00 0.00 C ATOM 1236 CZ PHE B 173 -6.622 -7.904 -1.781 1.00 0.00 C ATOM 0 H PHE B 173 -8.989 -3.762 -4.283 1.00 0.00 H new ATOM 0 HA PHE B 173 -10.574 -6.096 -4.344 1.00 0.00 H new ATOM 0 HB2 PHE B 173 -9.575 -4.201 -2.220 1.00 0.00 H new ATOM 0 HB3 PHE B 173 -10.731 -5.448 -1.798 1.00 0.00 H new ATOM 0 HD1 PHE B 173 -7.694 -5.616 -4.072 1.00 0.00 H new ATOM 0 HD2 PHE B 173 -9.657 -7.018 -0.506 1.00 0.00 H new ATOM 0 HE1 PHE B 173 -5.786 -7.136 -3.613 1.00 0.00 H new ATOM 0 HE2 PHE B 173 -7.765 -8.560 -0.073 1.00 0.00 H new ATOM 0 HZ PHE B 173 -5.770 -8.528 -1.556 1.00 0.00 H new ATOM 1246 N VAL B 174 -12.152 -3.259 -3.560 1.00 0.00 N ATOM 1247 CA VAL B 174 -13.485 -2.661 -3.447 1.00 0.00 C ATOM 1248 C VAL B 174 -14.274 -2.812 -4.751 1.00 0.00 C ATOM 1249 O VAL B 174 -15.498 -2.860 -4.711 1.00 0.00 O ATOM 1250 CB VAL B 174 -13.410 -1.196 -2.990 1.00 0.00 C ATOM 1251 CG1 VAL B 174 -12.785 -1.077 -1.590 1.00 0.00 C ATOM 1252 CG2 VAL B 174 -12.658 -0.313 -3.962 1.00 0.00 C ATOM 0 H VAL B 174 -11.386 -2.598 -3.432 1.00 0.00 H new ATOM 0 HA VAL B 174 -14.027 -3.207 -2.675 1.00 0.00 H new ATOM 0 HB VAL B 174 -14.441 -0.843 -2.955 1.00 0.00 H new ATOM 0 HG11 VAL B 174 -12.747 -0.028 -1.297 1.00 0.00 H new ATOM 0 HG12 VAL B 174 -13.390 -1.632 -0.873 1.00 0.00 H new ATOM 0 HG13 VAL B 174 -11.775 -1.486 -1.607 1.00 0.00 H new ATOM 0 HG21 VAL B 174 -12.639 0.709 -3.585 1.00 0.00 H new ATOM 0 HG22 VAL B 174 -11.637 -0.679 -4.071 1.00 0.00 H new ATOM 0 HG23 VAL B 174 -13.156 -0.333 -4.931 1.00 0.00 H new ATOM 1262 N ALA B 175 -13.604 -2.902 -5.903 1.00 0.00 N ATOM 1263 CA ALA B 175 -14.297 -3.078 -7.167 1.00 0.00 C ATOM 1264 C ALA B 175 -14.823 -4.515 -7.288 1.00 0.00 C ATOM 1265 O ALA B 175 -15.943 -4.720 -7.742 1.00 0.00 O ATOM 1266 CB ALA B 175 -13.359 -2.720 -8.318 1.00 0.00 C ATOM 0 H ALA B 175 -12.588 -2.855 -5.979 1.00 0.00 H new ATOM 0 HA ALA B 175 -15.158 -2.411 -7.211 1.00 0.00 H new ATOM 0 HB1 ALA B 175 -13.880 -2.852 -9.266 1.00 0.00 H new ATOM 0 HB2 ALA B 175 -13.042 -1.682 -8.220 1.00 0.00 H new ATOM 0 HB3 ALA B 175 -12.485 -3.370 -8.290 1.00 0.00 H new ATOM 1272 N ARG B 176 -14.031 -5.515 -6.890 1.00 0.00 N ATOM 1273 CA ARG B 176 -14.407 -6.931 -6.945 1.00 0.00 C ATOM 1274 C ARG B 176 -15.414 -7.281 -5.856 1.00 0.00 C ATOM 1275 O ARG B 176 -16.535 -7.713 -6.136 1.00 0.00 O ATOM 1276 CB ARG B 176 -13.151 -7.781 -6.701 1.00 0.00 C ATOM 1277 CG ARG B 176 -12.214 -7.926 -7.901 1.00 0.00 C ATOM 1278 CD ARG B 176 -10.895 -8.439 -7.324 1.00 0.00 C ATOM 1279 NE ARG B 176 -9.856 -8.682 -8.328 1.00 0.00 N ATOM 1280 CZ ARG B 176 -8.578 -8.912 -8.003 1.00 0.00 C ATOM 1281 NH1 ARG B 176 -8.172 -8.846 -6.734 1.00 0.00 N ATOM 1282 NH2 ARG B 176 -7.695 -9.197 -8.946 1.00 0.00 N ATOM 0 H ARG B 176 -13.095 -5.361 -6.514 1.00 0.00 H new ATOM 0 HA ARG B 176 -14.850 -7.127 -7.921 1.00 0.00 H new ATOM 0 HB2 ARG B 176 -12.591 -7.342 -5.875 1.00 0.00 H new ATOM 0 HB3 ARG B 176 -13.462 -8.776 -6.382 1.00 0.00 H new ATOM 0 HG2 ARG B 176 -12.620 -8.623 -8.635 1.00 0.00 H new ATOM 0 HG3 ARG B 176 -12.076 -6.972 -8.410 1.00 0.00 H new ATOM 0 HD2 ARG B 176 -10.522 -7.715 -6.599 1.00 0.00 H new ATOM 0 HD3 ARG B 176 -11.084 -9.365 -6.781 1.00 0.00 H new ATOM 0 HE ARG B 176 -10.117 -8.676 -9.314 1.00 0.00 H new ATOM 0 HH11 ARG B 176 -8.839 -8.618 -5.996 1.00 0.00 H new ATOM 0 HH12 ARG B 176 -7.195 -9.024 -6.501 1.00 0.00 H new ATOM 0 HH21 ARG B 176 -7.988 -9.242 -9.922 1.00 0.00 H new ATOM 0 HH22 ARG B 176 -6.721 -9.372 -8.697 1.00 0.00 H new ATOM 1296 N ASN B 177 -14.990 -7.111 -4.603 1.00 0.00 N ATOM 1297 CA ASN B 177 -15.769 -7.408 -3.410 1.00 0.00 C ATOM 1298 C ASN B 177 -17.022 -6.551 -3.419 1.00 0.00 C ATOM 1299 O ASN B 177 -18.125 -7.065 -3.235 1.00 0.00 O ATOM 1300 CB ASN B 177 -14.937 -7.197 -2.129 1.00 0.00 C ATOM 1301 CG ASN B 177 -13.688 -8.071 -2.048 1.00 0.00 C ATOM 1302 OD1 ASN B 177 -13.549 -9.070 -2.751 1.00 0.00 O ATOM 1303 ND2 ASN B 177 -12.736 -7.724 -1.200 1.00 0.00 N ATOM 0 H ASN B 177 -14.061 -6.750 -4.388 1.00 0.00 H new ATOM 0 HA ASN B 177 -16.058 -8.459 -3.416 1.00 0.00 H new ATOM 0 HB2 ASN B 177 -14.640 -6.150 -2.070 1.00 0.00 H new ATOM 0 HB3 ASN B 177 -15.566 -7.399 -1.262 1.00 0.00 H new ATOM 0 HD21 ASN B 177 -11.887 -8.285 -1.129 1.00 0.00 H new ATOM 0 HD22 ASN B 177 -12.850 -6.895 -0.616 1.00 0.00 H new ATOM 1310 N GLY B 178 -16.859 -5.259 -3.695 1.00 0.00 N ATOM 1311 CA GLY B 178 -17.925 -4.283 -3.763 1.00 0.00 C ATOM 1312 C GLY B 178 -17.782 -3.225 -2.676 1.00 0.00 C ATOM 1313 O GLY B 178 -16.817 -3.177 -1.903 1.00 0.00 O ATOM 0 H GLY B 178 -15.941 -4.855 -3.884 1.00 0.00 H new ATOM 0 HA2 GLY B 178 -17.919 -3.804 -4.742 1.00 0.00 H new ATOM 0 HA3 GLY B 178 -18.887 -4.785 -3.660 1.00 0.00 H new ATOM 1317 N ARG B 179 -18.773 -2.342 -2.647 1.00 0.00 N ATOM 1318 CA ARG B 179 -18.883 -1.225 -1.727 1.00 0.00 C ATOM 1319 C ARG B 179 -18.918 -1.678 -0.277 1.00 0.00 C ATOM 1320 O ARG B 179 -18.438 -0.926 0.567 1.00 0.00 O ATOM 1321 CB ARG B 179 -20.149 -0.438 -2.100 1.00 0.00 C ATOM 1322 CG ARG B 179 -20.444 0.811 -1.258 1.00 0.00 C ATOM 1323 CD ARG B 179 -19.261 1.788 -1.210 1.00 0.00 C ATOM 1324 NE ARG B 179 -19.724 3.169 -1.044 1.00 0.00 N ATOM 1325 CZ ARG B 179 -20.190 3.746 0.068 1.00 0.00 C ATOM 1326 NH1 ARG B 179 -20.124 3.138 1.247 1.00 0.00 N ATOM 1327 NH2 ARG B 179 -20.746 4.946 -0.024 1.00 0.00 N ATOM 0 H ARG B 179 -19.557 -2.391 -3.297 1.00 0.00 H new ATOM 0 HA ARG B 179 -18.002 -0.590 -1.816 1.00 0.00 H new ATOM 0 HB2 ARG B 179 -20.069 -0.136 -3.144 1.00 0.00 H new ATOM 0 HB3 ARG B 179 -21.004 -1.110 -2.027 1.00 0.00 H new ATOM 0 HG2 ARG B 179 -21.315 1.322 -1.667 1.00 0.00 H new ATOM 0 HG3 ARG B 179 -20.700 0.507 -0.243 1.00 0.00 H new ATOM 0 HD2 ARG B 179 -18.599 1.522 -0.386 1.00 0.00 H new ATOM 0 HD3 ARG B 179 -18.679 1.704 -2.127 1.00 0.00 H new ATOM 0 HE ARG B 179 -19.686 3.759 -1.875 1.00 0.00 H new ATOM 0 HH11 ARG B 179 -19.710 2.208 1.319 1.00 0.00 H new ATOM 0 HH12 ARG B 179 -20.487 3.601 2.080 1.00 0.00 H new ATOM 0 HH21 ARG B 179 -20.811 5.410 -0.930 1.00 0.00 H new ATOM 0 HH22 ARG B 179 -21.109 5.406 0.811 1.00 0.00 H new ATOM 1341 N GLN B 180 -19.450 -2.865 0.035 1.00 0.00 N ATOM 1342 CA GLN B 180 -19.514 -3.325 1.417 1.00 0.00 C ATOM 1343 C GLN B 180 -18.118 -3.354 2.038 1.00 0.00 C ATOM 1344 O GLN B 180 -17.939 -2.774 3.105 1.00 0.00 O ATOM 1345 CB GLN B 180 -20.234 -4.675 1.506 1.00 0.00 C ATOM 1346 CG GLN B 180 -20.467 -5.114 2.956 1.00 0.00 C ATOM 1347 CD GLN B 180 -21.312 -6.382 3.007 1.00 0.00 C ATOM 1348 OE1 GLN B 180 -22.535 -6.344 2.869 1.00 0.00 O ATOM 1349 NE2 GLN B 180 -20.672 -7.526 3.160 1.00 0.00 N ATOM 0 H GLN B 180 -19.838 -3.516 -0.648 1.00 0.00 H new ATOM 0 HA GLN B 180 -20.103 -2.619 2.001 1.00 0.00 H new ATOM 0 HB2 GLN B 180 -21.192 -4.608 0.990 1.00 0.00 H new ATOM 0 HB3 GLN B 180 -19.646 -5.433 0.989 1.00 0.00 H new ATOM 0 HG2 GLN B 180 -19.509 -5.289 3.446 1.00 0.00 H new ATOM 0 HG3 GLN B 180 -20.966 -4.316 3.507 1.00 0.00 H new ATOM 0 HE21 GLN B 180 -19.658 -7.532 3.273 1.00 0.00 H new ATOM 0 HE22 GLN B 180 -21.191 -8.404 3.166 1.00 0.00 H new ATOM 1358 N PHE B 181 -17.135 -3.974 1.377 1.00 0.00 N ATOM 1359 CA PHE B 181 -15.755 -4.078 1.841 1.00 0.00 C ATOM 1360 C PHE B 181 -15.179 -2.687 2.110 1.00 0.00 C ATOM 1361 O PHE B 181 -14.462 -2.494 3.092 1.00 0.00 O ATOM 1362 CB PHE B 181 -14.932 -4.875 0.813 1.00 0.00 C ATOM 1363 CG PHE B 181 -13.470 -5.073 1.158 1.00 0.00 C ATOM 1364 CD1 PHE B 181 -13.077 -6.135 1.994 1.00 0.00 C ATOM 1365 CD2 PHE B 181 -12.497 -4.208 0.627 1.00 0.00 C ATOM 1366 CE1 PHE B 181 -11.723 -6.296 2.336 1.00 0.00 C ATOM 1367 CE2 PHE B 181 -11.144 -4.369 0.965 1.00 0.00 C ATOM 1368 CZ PHE B 181 -10.761 -5.407 1.831 1.00 0.00 C ATOM 0 H PHE B 181 -17.286 -4.430 0.477 1.00 0.00 H new ATOM 0 HA PHE B 181 -15.715 -4.619 2.787 1.00 0.00 H new ATOM 0 HB2 PHE B 181 -15.393 -5.855 0.686 1.00 0.00 H new ATOM 0 HB3 PHE B 181 -14.994 -4.366 -0.149 1.00 0.00 H new ATOM 0 HD1 PHE B 181 -13.816 -6.826 2.373 1.00 0.00 H new ATOM 0 HD2 PHE B 181 -12.792 -3.415 -0.045 1.00 0.00 H new ATOM 0 HE1 PHE B 181 -11.423 -7.104 2.987 1.00 0.00 H new ATOM 0 HE2 PHE B 181 -10.401 -3.698 0.561 1.00 0.00 H new ATOM 0 HZ PHE B 181 -9.724 -5.521 2.109 1.00 0.00 H new ATOM 1378 N LEU B 182 -15.504 -1.718 1.248 1.00 0.00 N ATOM 1379 CA LEU B 182 -15.052 -0.341 1.391 1.00 0.00 C ATOM 1380 C LEU B 182 -15.630 0.207 2.695 1.00 0.00 C ATOM 1381 O LEU B 182 -14.883 0.670 3.552 1.00 0.00 O ATOM 1382 CB LEU B 182 -15.512 0.493 0.183 1.00 0.00 C ATOM 1383 CG LEU B 182 -14.716 1.790 -0.051 1.00 0.00 C ATOM 1384 CD1 LEU B 182 -15.307 2.489 -1.272 1.00 0.00 C ATOM 1385 CD2 LEU B 182 -14.723 2.759 1.126 1.00 0.00 C ATOM 0 H LEU B 182 -16.092 -1.874 0.429 1.00 0.00 H new ATOM 0 HA LEU B 182 -13.964 -0.292 1.424 1.00 0.00 H new ATOM 0 HB2 LEU B 182 -15.444 -0.124 -0.713 1.00 0.00 H new ATOM 0 HB3 LEU B 182 -16.563 0.748 0.316 1.00 0.00 H new ATOM 0 HG LEU B 182 -13.674 1.502 -0.193 1.00 0.00 H new ATOM 0 HD11 LEU B 182 -14.761 3.413 -1.462 1.00 0.00 H new ATOM 0 HD12 LEU B 182 -15.226 1.835 -2.140 1.00 0.00 H new ATOM 0 HD13 LEU B 182 -16.356 2.719 -1.087 1.00 0.00 H new ATOM 0 HD21 LEU B 182 -14.138 3.643 0.873 1.00 0.00 H new ATOM 0 HD22 LEU B 182 -15.749 3.053 1.349 1.00 0.00 H new ATOM 0 HD23 LEU B 182 -14.287 2.274 1.999 1.00 0.00 H new ATOM 1397 N THR B 183 -16.951 0.125 2.866 1.00 0.00 N ATOM 1398 CA THR B 183 -17.621 0.617 4.057 1.00 0.00 C ATOM 1399 C THR B 183 -17.028 -0.041 5.306 1.00 0.00 C ATOM 1400 O THR B 183 -16.786 0.638 6.300 1.00 0.00 O ATOM 1401 CB THR B 183 -19.129 0.331 3.959 1.00 0.00 C ATOM 1402 OG1 THR B 183 -19.684 0.759 2.728 1.00 0.00 O ATOM 1403 CG2 THR B 183 -19.870 1.024 5.097 1.00 0.00 C ATOM 0 H THR B 183 -17.581 -0.286 2.178 1.00 0.00 H new ATOM 0 HA THR B 183 -17.472 1.694 4.134 1.00 0.00 H new ATOM 0 HB THR B 183 -19.247 -0.751 4.027 1.00 0.00 H new ATOM 0 HG1 THR B 183 -19.426 0.135 2.018 1.00 0.00 H new ATOM 0 HG21 THR B 183 -20.937 0.815 5.017 1.00 0.00 H new ATOM 0 HG22 THR B 183 -19.498 0.654 6.052 1.00 0.00 H new ATOM 0 HG23 THR B 183 -19.706 2.100 5.036 1.00 0.00 H new ATOM 1411 N GLN B 184 -16.781 -1.353 5.269 1.00 0.00 N ATOM 1412 CA GLN B 184 -16.222 -2.079 6.398 1.00 0.00 C ATOM 1413 C GLN B 184 -14.877 -1.479 6.780 1.00 0.00 C ATOM 1414 O GLN B 184 -14.654 -1.264 7.969 1.00 0.00 O ATOM 1415 CB GLN B 184 -16.144 -3.576 6.103 1.00 0.00 C ATOM 1416 CG GLN B 184 -17.542 -4.163 5.860 1.00 0.00 C ATOM 1417 CD GLN B 184 -17.845 -5.327 6.790 1.00 0.00 C ATOM 1418 OE1 GLN B 184 -18.314 -5.129 7.909 1.00 0.00 O ATOM 1419 NE2 GLN B 184 -17.567 -6.545 6.378 1.00 0.00 N ATOM 0 H GLN B 184 -16.965 -1.936 4.453 1.00 0.00 H new ATOM 0 HA GLN B 184 -16.882 -1.976 7.259 1.00 0.00 H new ATOM 0 HB2 GLN B 184 -15.517 -3.745 5.227 1.00 0.00 H new ATOM 0 HB3 GLN B 184 -15.670 -4.091 6.939 1.00 0.00 H new ATOM 0 HG2 GLN B 184 -18.291 -3.384 6.000 1.00 0.00 H new ATOM 0 HG3 GLN B 184 -17.619 -4.497 4.825 1.00 0.00 H new ATOM 0 HE21 GLN B 184 -17.178 -6.692 5.447 1.00 0.00 H new ATOM 0 HE22 GLN B 184 -17.740 -7.342 6.990 1.00 0.00 H new ATOM 1428 N LEU B 185 -14.003 -1.173 5.810 1.00 0.00 N ATOM 1429 CA LEU B 185 -12.711 -0.557 6.108 1.00 0.00 C ATOM 1430 C LEU B 185 -12.963 0.758 6.842 1.00 0.00 C ATOM 1431 O LEU B 185 -12.330 1.009 7.865 1.00 0.00 O ATOM 1432 CB LEU B 185 -11.883 -0.279 4.837 1.00 0.00 C ATOM 1433 CG LEU B 185 -11.063 -1.473 4.331 1.00 0.00 C ATOM 1434 CD1 LEU B 185 -10.490 -1.168 2.943 1.00 0.00 C ATOM 1435 CD2 LEU B 185 -9.894 -1.791 5.277 1.00 0.00 C ATOM 0 H LEU B 185 -14.170 -1.343 4.818 1.00 0.00 H new ATOM 0 HA LEU B 185 -12.137 -1.252 6.721 1.00 0.00 H new ATOM 0 HB2 LEU B 185 -12.558 0.043 4.044 1.00 0.00 H new ATOM 0 HB3 LEU B 185 -11.205 0.551 5.036 1.00 0.00 H new ATOM 0 HG LEU B 185 -11.732 -2.332 4.287 1.00 0.00 H new ATOM 0 HD11 LEU B 185 -9.910 -2.022 2.593 1.00 0.00 H new ATOM 0 HD12 LEU B 185 -11.306 -0.974 2.247 1.00 0.00 H new ATOM 0 HD13 LEU B 185 -9.846 -0.291 3.000 1.00 0.00 H new ATOM 0 HD21 LEU B 185 -9.333 -2.642 4.890 1.00 0.00 H new ATOM 0 HD22 LEU B 185 -9.236 -0.925 5.347 1.00 0.00 H new ATOM 0 HD23 LEU B 185 -10.282 -2.033 6.267 1.00 0.00 H new ATOM 1447 N MET B 186 -13.904 1.576 6.355 1.00 0.00 N ATOM 1448 CA MET B 186 -14.240 2.860 6.967 1.00 0.00 C ATOM 1449 C MET B 186 -14.786 2.694 8.388 1.00 0.00 C ATOM 1450 O MET B 186 -14.810 3.669 9.130 1.00 0.00 O ATOM 1451 CB MET B 186 -15.262 3.622 6.116 1.00 0.00 C ATOM 1452 CG MET B 186 -14.753 3.877 4.697 1.00 0.00 C ATOM 1453 SD MET B 186 -15.937 4.731 3.638 1.00 0.00 S ATOM 1454 CE MET B 186 -15.588 6.437 4.106 1.00 0.00 C ATOM 0 H MET B 186 -14.453 1.362 5.523 1.00 0.00 H new ATOM 0 HA MET B 186 -13.314 3.432 7.021 1.00 0.00 H new ATOM 0 HB2 MET B 186 -16.191 3.054 6.071 1.00 0.00 H new ATOM 0 HB3 MET B 186 -15.494 4.574 6.594 1.00 0.00 H new ATOM 0 HG2 MET B 186 -13.837 4.466 4.750 1.00 0.00 H new ATOM 0 HG3 MET B 186 -14.492 2.923 4.238 1.00 0.00 H new ATOM 0 HE1 MET B 186 -16.144 7.113 3.457 1.00 0.00 H new ATOM 0 HE2 MET B 186 -15.888 6.599 5.141 1.00 0.00 H new ATOM 0 HE3 MET B 186 -14.520 6.631 4.003 1.00 0.00 H new ATOM 1464 N GLN B 187 -15.253 1.506 8.776 1.00 0.00 N ATOM 1465 CA GLN B 187 -15.774 1.225 10.106 1.00 0.00 C ATOM 1466 C GLN B 187 -14.656 0.705 11.005 1.00 0.00 C ATOM 1467 O GLN B 187 -14.416 1.290 12.062 1.00 0.00 O ATOM 1468 CB GLN B 187 -16.944 0.225 10.036 1.00 0.00 C ATOM 1469 CG GLN B 187 -18.216 0.828 9.425 1.00 0.00 C ATOM 1470 CD GLN B 187 -18.615 2.122 10.122 1.00 0.00 C ATOM 1471 OE1 GLN B 187 -18.882 2.135 11.320 1.00 0.00 O ATOM 1472 NE2 GLN B 187 -18.627 3.242 9.420 1.00 0.00 N ATOM 0 H GLN B 187 -15.278 0.696 8.156 1.00 0.00 H new ATOM 0 HA GLN B 187 -16.158 2.150 10.535 1.00 0.00 H new ATOM 0 HB2 GLN B 187 -16.640 -0.640 9.447 1.00 0.00 H new ATOM 0 HB3 GLN B 187 -17.166 -0.136 11.040 1.00 0.00 H new ATOM 0 HG2 GLN B 187 -18.055 1.020 8.364 1.00 0.00 H new ATOM 0 HG3 GLN B 187 -19.032 0.109 9.498 1.00 0.00 H new ATOM 0 HE21 GLN B 187 -18.404 3.223 8.425 1.00 0.00 H new ATOM 0 HE22 GLN B 187 -18.859 4.126 9.873 1.00 0.00 H new ATOM 1481 N LYS B 188 -13.969 -0.379 10.620 1.00 0.00 N ATOM 1482 CA LYS B 188 -12.899 -0.929 11.453 1.00 0.00 C ATOM 1483 C LYS B 188 -11.750 0.055 11.664 1.00 0.00 C ATOM 1484 O LYS B 188 -11.192 0.095 12.765 1.00 0.00 O ATOM 1485 CB LYS B 188 -12.395 -2.303 10.968 1.00 0.00 C ATOM 1486 CG LYS B 188 -11.906 -2.380 9.512 1.00 0.00 C ATOM 1487 CD LYS B 188 -10.909 -3.520 9.246 1.00 0.00 C ATOM 1488 CE LYS B 188 -11.542 -4.916 9.127 1.00 0.00 C ATOM 1489 NZ LYS B 188 -11.894 -5.520 10.426 1.00 0.00 N ATOM 0 H LYS B 188 -14.134 -0.884 9.749 1.00 0.00 H new ATOM 0 HA LYS B 188 -13.354 -1.098 12.429 1.00 0.00 H new ATOM 0 HB2 LYS B 188 -11.579 -2.616 11.619 1.00 0.00 H new ATOM 0 HB3 LYS B 188 -13.200 -3.026 11.096 1.00 0.00 H new ATOM 0 HG2 LYS B 188 -12.768 -2.505 8.856 1.00 0.00 H new ATOM 0 HG3 LYS B 188 -11.438 -1.432 9.246 1.00 0.00 H new ATOM 0 HD2 LYS B 188 -10.367 -3.303 8.325 1.00 0.00 H new ATOM 0 HD3 LYS B 188 -10.175 -3.537 10.051 1.00 0.00 H new ATOM 0 HE2 LYS B 188 -12.440 -4.847 8.513 1.00 0.00 H new ATOM 0 HE3 LYS B 188 -10.849 -5.576 8.605 1.00 0.00 H new ATOM 0 HZ1 LYS B 188 -11.990 -6.550 10.315 1.00 0.00 H new ATOM 0 HZ2 LYS B 188 -11.146 -5.314 11.119 1.00 0.00 H new ATOM 0 HZ3 LYS B 188 -12.795 -5.122 10.761 1.00 0.00 H new ATOM 1503 N GLU B 189 -11.457 0.897 10.675 1.00 0.00 N ATOM 1504 CA GLU B 189 -10.374 1.870 10.699 1.00 0.00 C ATOM 1505 C GLU B 189 -10.868 3.320 10.742 1.00 0.00 C ATOM 1506 O GLU B 189 -10.098 4.210 10.394 1.00 0.00 O ATOM 1507 CB GLU B 189 -9.463 1.604 9.481 1.00 0.00 C ATOM 1508 CG GLU B 189 -8.752 0.244 9.504 1.00 0.00 C ATOM 1509 CD GLU B 189 -7.595 0.200 10.503 1.00 0.00 C ATOM 1510 OE1 GLU B 189 -7.826 0.288 11.729 1.00 0.00 O ATOM 1511 OE2 GLU B 189 -6.443 0.002 10.058 1.00 0.00 O ATOM 0 H GLU B 189 -11.988 0.919 9.805 1.00 0.00 H new ATOM 0 HA GLU B 189 -9.808 1.744 11.622 1.00 0.00 H new ATOM 0 HB2 GLU B 189 -10.062 1.671 8.573 1.00 0.00 H new ATOM 0 HB3 GLU B 189 -8.712 2.392 9.426 1.00 0.00 H new ATOM 0 HG2 GLU B 189 -9.473 -0.534 9.755 1.00 0.00 H new ATOM 0 HG3 GLU B 189 -8.374 0.019 8.507 1.00 0.00 H new ATOM 1518 N GLN B 190 -12.097 3.605 11.204 1.00 0.00 N ATOM 1519 CA GLN B 190 -12.628 4.976 11.254 1.00 0.00 C ATOM 1520 C GLN B 190 -11.761 5.995 12.012 1.00 0.00 C ATOM 1521 O GLN B 190 -11.999 7.194 11.891 1.00 0.00 O ATOM 1522 CB GLN B 190 -14.069 4.999 11.802 1.00 0.00 C ATOM 1523 CG GLN B 190 -14.192 5.100 13.322 1.00 0.00 C ATOM 1524 CD GLN B 190 -15.647 4.992 13.753 1.00 0.00 C ATOM 1525 OE1 GLN B 190 -16.421 5.932 13.607 1.00 0.00 O ATOM 1526 NE2 GLN B 190 -16.053 3.858 14.297 1.00 0.00 N ATOM 0 H GLN B 190 -12.745 2.898 11.550 1.00 0.00 H new ATOM 0 HA GLN B 190 -12.615 5.301 10.214 1.00 0.00 H new ATOM 0 HB2 GLN B 190 -14.596 5.842 11.355 1.00 0.00 H new ATOM 0 HB3 GLN B 190 -14.579 4.094 11.473 1.00 0.00 H new ATOM 0 HG2 GLN B 190 -13.609 4.308 13.792 1.00 0.00 H new ATOM 0 HG3 GLN B 190 -13.776 6.048 13.663 1.00 0.00 H new ATOM 0 HE21 GLN B 190 -15.398 3.084 14.412 1.00 0.00 H new ATOM 0 HE22 GLN B 190 -17.021 3.756 14.602 1.00 0.00 H new ATOM 1535 N ARG B 191 -10.793 5.555 12.822 1.00 0.00 N ATOM 1536 CA ARG B 191 -9.908 6.438 13.588 1.00 0.00 C ATOM 1537 C ARG B 191 -8.464 6.370 13.077 1.00 0.00 C ATOM 1538 O ARG B 191 -7.611 7.124 13.551 1.00 0.00 O ATOM 1539 CB ARG B 191 -9.986 6.060 15.080 1.00 0.00 C ATOM 1540 CG ARG B 191 -11.424 5.996 15.630 1.00 0.00 C ATOM 1541 CD ARG B 191 -11.490 5.626 17.113 1.00 0.00 C ATOM 1542 NE ARG B 191 -10.821 6.622 17.954 1.00 0.00 N ATOM 1543 CZ ARG B 191 -10.912 6.728 19.280 1.00 0.00 C ATOM 1544 NH1 ARG B 191 -11.685 5.913 19.997 1.00 0.00 N ATOM 1545 NH2 ARG B 191 -10.221 7.671 19.901 1.00 0.00 N ATOM 0 H ARG B 191 -10.600 4.564 12.966 1.00 0.00 H new ATOM 0 HA ARG B 191 -10.240 7.468 13.458 1.00 0.00 H new ATOM 0 HB2 ARG B 191 -9.508 5.091 15.225 1.00 0.00 H new ATOM 0 HB3 ARG B 191 -9.417 6.787 15.660 1.00 0.00 H new ATOM 0 HG2 ARG B 191 -11.905 6.963 15.482 1.00 0.00 H new ATOM 0 HG3 ARG B 191 -11.993 5.266 15.055 1.00 0.00 H new ATOM 0 HD2 ARG B 191 -12.532 5.534 17.418 1.00 0.00 H new ATOM 0 HD3 ARG B 191 -11.026 4.651 17.265 1.00 0.00 H new ATOM 0 HE ARG B 191 -10.227 7.301 17.478 1.00 0.00 H new ATOM 0 HH11 ARG B 191 -12.227 5.184 19.532 1.00 0.00 H new ATOM 0 HH12 ARG B 191 -11.735 6.018 21.010 1.00 0.00 H new ATOM 0 HH21 ARG B 191 -9.628 8.305 19.365 1.00 0.00 H new ATOM 0 HH22 ARG B 191 -10.281 7.763 20.915 1.00 0.00 H new ATOM 1559 N ASN B 192 -8.167 5.452 12.157 1.00 0.00 N ATOM 1560 CA ASN B 192 -6.852 5.229 11.577 1.00 0.00 C ATOM 1561 C ASN B 192 -6.616 6.225 10.446 1.00 0.00 C ATOM 1562 O ASN B 192 -7.194 6.066 9.370 1.00 0.00 O ATOM 1563 CB ASN B 192 -6.781 3.779 11.069 1.00 0.00 C ATOM 1564 CG ASN B 192 -5.371 3.231 11.129 1.00 0.00 C ATOM 1565 OD1 ASN B 192 -4.956 2.749 12.180 1.00 0.00 O ATOM 1566 ND2 ASN B 192 -4.633 3.253 10.035 1.00 0.00 N ATOM 0 H ASN B 192 -8.872 4.817 11.782 1.00 0.00 H new ATOM 0 HA ASN B 192 -6.072 5.380 12.323 1.00 0.00 H new ATOM 0 HB2 ASN B 192 -7.441 3.151 11.668 1.00 0.00 H new ATOM 0 HB3 ASN B 192 -7.145 3.735 10.042 1.00 0.00 H new ATOM 0 HD21 ASN B 192 -3.691 2.863 10.048 1.00 0.00 H new ATOM 0 HD22 ASN B 192 -5.005 3.660 9.177 1.00 0.00 H new ATOM 1573 N TYR B 193 -5.775 7.238 10.666 1.00 0.00 N ATOM 1574 CA TYR B 193 -5.480 8.258 9.660 1.00 0.00 C ATOM 1575 C TYR B 193 -5.004 7.656 8.334 1.00 0.00 C ATOM 1576 O TYR B 193 -5.308 8.201 7.277 1.00 0.00 O ATOM 1577 CB TYR B 193 -4.460 9.285 10.186 1.00 0.00 C ATOM 1578 CG TYR B 193 -3.050 8.775 10.438 1.00 0.00 C ATOM 1579 CD1 TYR B 193 -2.133 8.641 9.374 1.00 0.00 C ATOM 1580 CD2 TYR B 193 -2.642 8.448 11.745 1.00 0.00 C ATOM 1581 CE1 TYR B 193 -0.841 8.129 9.599 1.00 0.00 C ATOM 1582 CE2 TYR B 193 -1.360 7.919 11.971 1.00 0.00 C ATOM 1583 CZ TYR B 193 -0.454 7.746 10.902 1.00 0.00 C ATOM 1584 OH TYR B 193 0.782 7.246 11.173 1.00 0.00 O ATOM 0 H TYR B 193 -5.280 7.373 11.547 1.00 0.00 H new ATOM 0 HA TYR B 193 -6.419 8.774 9.460 1.00 0.00 H new ATOM 0 HB2 TYR B 193 -4.403 10.106 9.471 1.00 0.00 H new ATOM 0 HB3 TYR B 193 -4.844 9.700 11.118 1.00 0.00 H new ATOM 0 HD1 TYR B 193 -2.425 8.934 8.377 1.00 0.00 H new ATOM 0 HD2 TYR B 193 -3.315 8.604 12.575 1.00 0.00 H new ATOM 0 HE1 TYR B 193 -0.148 8.029 8.777 1.00 0.00 H new ATOM 0 HE2 TYR B 193 -1.065 7.642 12.972 1.00 0.00 H new ATOM 0 HH TYR B 193 0.851 7.044 12.130 1.00 0.00 H new ATOM 1594 N GLN B 194 -4.324 6.502 8.363 1.00 0.00 N ATOM 1595 CA GLN B 194 -3.820 5.872 7.147 1.00 0.00 C ATOM 1596 C GLN B 194 -4.924 5.434 6.180 1.00 0.00 C ATOM 1597 O GLN B 194 -4.654 5.225 5.005 1.00 0.00 O ATOM 1598 CB GLN B 194 -2.907 4.695 7.511 1.00 0.00 C ATOM 1599 CG GLN B 194 -1.586 4.731 6.743 1.00 0.00 C ATOM 1600 CD GLN B 194 -1.686 4.358 5.266 1.00 0.00 C ATOM 1601 OE1 GLN B 194 -1.631 3.183 4.917 1.00 0.00 O ATOM 1602 NE2 GLN B 194 -1.764 5.330 4.372 1.00 0.00 N ATOM 0 H GLN B 194 -4.113 5.989 9.219 1.00 0.00 H new ATOM 0 HA GLN B 194 -3.247 6.629 6.612 1.00 0.00 H new ATOM 0 HB2 GLN B 194 -2.704 4.713 8.582 1.00 0.00 H new ATOM 0 HB3 GLN B 194 -3.423 3.758 7.300 1.00 0.00 H new ATOM 0 HG2 GLN B 194 -1.165 5.734 6.821 1.00 0.00 H new ATOM 0 HG3 GLN B 194 -0.884 4.052 7.227 1.00 0.00 H new ATOM 0 HE21 GLN B 194 -1.809 6.302 4.678 1.00 0.00 H new ATOM 0 HE22 GLN B 194 -1.779 5.107 3.377 1.00 0.00 H new ATOM 1611 N PHE B 195 -6.152 5.265 6.662 1.00 0.00 N ATOM 1612 CA PHE B 195 -7.297 4.861 5.853 1.00 0.00 C ATOM 1613 C PHE B 195 -8.237 6.039 5.595 1.00 0.00 C ATOM 1614 O PHE B 195 -9.310 5.849 5.022 1.00 0.00 O ATOM 1615 CB PHE B 195 -7.982 3.647 6.495 1.00 0.00 C ATOM 1616 CG PHE B 195 -7.202 2.378 6.218 1.00 0.00 C ATOM 1617 CD1 PHE B 195 -7.285 1.786 4.944 1.00 0.00 C ATOM 1618 CD2 PHE B 195 -6.314 1.852 7.174 1.00 0.00 C ATOM 1619 CE1 PHE B 195 -6.488 0.674 4.630 1.00 0.00 C ATOM 1620 CE2 PHE B 195 -5.509 0.743 6.856 1.00 0.00 C ATOM 1621 CZ PHE B 195 -5.605 0.146 5.586 1.00 0.00 C ATOM 0 H PHE B 195 -6.383 5.408 7.645 1.00 0.00 H new ATOM 0 HA PHE B 195 -6.958 4.546 4.866 1.00 0.00 H new ATOM 0 HB2 PHE B 195 -8.067 3.799 7.571 1.00 0.00 H new ATOM 0 HB3 PHE B 195 -8.995 3.548 6.106 1.00 0.00 H new ATOM 0 HD1 PHE B 195 -7.963 2.188 4.206 1.00 0.00 H new ATOM 0 HD2 PHE B 195 -6.250 2.301 8.154 1.00 0.00 H new ATOM 0 HE1 PHE B 195 -6.554 0.223 3.651 1.00 0.00 H new ATOM 0 HE2 PHE B 195 -4.818 0.350 7.587 1.00 0.00 H new ATOM 0 HZ PHE B 195 -5.001 -0.717 5.347 1.00 0.00 H new ATOM 1631 N ASP B 196 -7.844 7.260 5.975 1.00 0.00 N ATOM 1632 CA ASP B 196 -8.677 8.441 5.776 1.00 0.00 C ATOM 1633 C ASP B 196 -8.909 8.742 4.296 1.00 0.00 C ATOM 1634 O ASP B 196 -9.902 9.382 3.965 1.00 0.00 O ATOM 1635 CB ASP B 196 -8.111 9.653 6.520 1.00 0.00 C ATOM 1636 CG ASP B 196 -9.217 10.672 6.774 1.00 0.00 C ATOM 1637 OD1 ASP B 196 -10.258 10.282 7.354 1.00 0.00 O ATOM 1638 OD2 ASP B 196 -9.051 11.876 6.486 1.00 0.00 O ATOM 0 H ASP B 196 -6.948 7.452 6.424 1.00 0.00 H new ATOM 0 HA ASP B 196 -9.654 8.219 6.205 1.00 0.00 H new ATOM 0 HB2 ASP B 196 -7.672 9.337 7.466 1.00 0.00 H new ATOM 0 HB3 ASP B 196 -7.312 10.109 5.935 1.00 0.00 H new ATOM 1643 N PHE B 197 -8.065 8.218 3.391 1.00 0.00 N ATOM 1644 CA PHE B 197 -8.203 8.414 1.945 1.00 0.00 C ATOM 1645 C PHE B 197 -9.550 7.896 1.420 1.00 0.00 C ATOM 1646 O PHE B 197 -9.978 8.269 0.328 1.00 0.00 O ATOM 1647 CB PHE B 197 -7.021 7.793 1.183 1.00 0.00 C ATOM 1648 CG PHE B 197 -6.957 6.277 1.208 1.00 0.00 C ATOM 1649 CD1 PHE B 197 -7.695 5.517 0.279 1.00 0.00 C ATOM 1650 CD2 PHE B 197 -6.150 5.621 2.155 1.00 0.00 C ATOM 1651 CE1 PHE B 197 -7.645 4.111 0.318 1.00 0.00 C ATOM 1652 CE2 PHE B 197 -6.103 4.218 2.195 1.00 0.00 C ATOM 1653 CZ PHE B 197 -6.860 3.462 1.284 1.00 0.00 C ATOM 0 H PHE B 197 -7.263 7.643 3.648 1.00 0.00 H new ATOM 0 HA PHE B 197 -8.186 9.488 1.762 1.00 0.00 H new ATOM 0 HB2 PHE B 197 -7.067 8.121 0.145 1.00 0.00 H new ATOM 0 HB3 PHE B 197 -6.094 8.186 1.601 1.00 0.00 H new ATOM 0 HD1 PHE B 197 -8.300 6.014 -0.464 1.00 0.00 H new ATOM 0 HD2 PHE B 197 -5.564 6.199 2.854 1.00 0.00 H new ATOM 0 HE1 PHE B 197 -8.211 3.531 -0.396 1.00 0.00 H new ATOM 0 HE2 PHE B 197 -5.484 3.720 2.927 1.00 0.00 H new ATOM 0 HZ PHE B 197 -6.838 2.383 1.327 1.00 0.00 H new ATOM 1663 N LEU B 198 -10.213 7.019 2.180 1.00 0.00 N ATOM 1664 CA LEU B 198 -11.508 6.453 1.839 1.00 0.00 C ATOM 1665 C LEU B 198 -12.635 7.475 2.034 1.00 0.00 C ATOM 1666 O LEU B 198 -13.738 7.231 1.544 1.00 0.00 O ATOM 1667 CB LEU B 198 -11.782 5.226 2.724 1.00 0.00 C ATOM 1668 CG LEU B 198 -10.789 4.065 2.535 1.00 0.00 C ATOM 1669 CD1 LEU B 198 -11.043 3.001 3.606 1.00 0.00 C ATOM 1670 CD2 LEU B 198 -10.917 3.430 1.145 1.00 0.00 C ATOM 0 H LEU B 198 -9.849 6.679 3.070 1.00 0.00 H new ATOM 0 HA LEU B 198 -11.483 6.164 0.788 1.00 0.00 H new ATOM 0 HB2 LEU B 198 -11.763 5.536 3.769 1.00 0.00 H new ATOM 0 HB3 LEU B 198 -12.789 4.863 2.517 1.00 0.00 H new ATOM 0 HG LEU B 198 -9.780 4.465 2.630 1.00 0.00 H new ATOM 0 HD11 LEU B 198 -10.341 2.178 3.474 1.00 0.00 H new ATOM 0 HD12 LEU B 198 -10.906 3.440 4.594 1.00 0.00 H new ATOM 0 HD13 LEU B 198 -12.063 2.627 3.513 1.00 0.00 H new ATOM 0 HD21 LEU B 198 -10.200 2.615 1.050 1.00 0.00 H new ATOM 0 HD22 LEU B 198 -11.927 3.042 1.014 1.00 0.00 H new ATOM 0 HD23 LEU B 198 -10.715 4.181 0.382 1.00 0.00 H new ATOM 1682 N ARG B 199 -12.411 8.583 2.747 1.00 0.00 N ATOM 1683 CA ARG B 199 -13.407 9.622 3.014 1.00 0.00 C ATOM 1684 C ARG B 199 -13.230 10.777 2.030 1.00 0.00 C ATOM 1685 O ARG B 199 -12.091 11.102 1.701 1.00 0.00 O ATOM 1686 CB ARG B 199 -13.242 10.091 4.467 1.00 0.00 C ATOM 1687 CG ARG B 199 -13.677 8.979 5.429 1.00 0.00 C ATOM 1688 CD ARG B 199 -13.341 9.300 6.885 1.00 0.00 C ATOM 1689 NE ARG B 199 -14.295 8.675 7.812 1.00 0.00 N ATOM 1690 CZ ARG B 199 -15.509 9.160 8.100 1.00 0.00 C ATOM 1691 NH1 ARG B 199 -15.929 10.319 7.605 1.00 0.00 N ATOM 1692 NH2 ARG B 199 -16.336 8.483 8.879 1.00 0.00 N ATOM 0 H ARG B 199 -11.504 8.787 3.166 1.00 0.00 H new ATOM 0 HA ARG B 199 -14.415 9.230 2.881 1.00 0.00 H new ATOM 0 HB2 ARG B 199 -12.203 10.360 4.655 1.00 0.00 H new ATOM 0 HB3 ARG B 199 -13.839 10.986 4.639 1.00 0.00 H new ATOM 0 HG2 ARG B 199 -14.751 8.820 5.334 1.00 0.00 H new ATOM 0 HG3 ARG B 199 -13.191 8.046 5.144 1.00 0.00 H new ATOM 0 HD2 ARG B 199 -12.333 8.953 7.111 1.00 0.00 H new ATOM 0 HD3 ARG B 199 -13.346 10.380 7.030 1.00 0.00 H new ATOM 0 HE ARG B 199 -14.011 7.808 8.269 1.00 0.00 H new ATOM 0 HH11 ARG B 199 -15.322 10.861 6.990 1.00 0.00 H new ATOM 0 HH12 ARG B 199 -16.859 10.667 7.840 1.00 0.00 H new ATOM 0 HH21 ARG B 199 -16.051 7.583 9.266 1.00 0.00 H new ATOM 0 HH22 ARG B 199 -17.259 8.861 9.093 1.00 0.00 H new ATOM 1706 N PRO B 200 -14.317 11.456 1.613 1.00 0.00 N ATOM 1707 CA PRO B 200 -14.259 12.557 0.652 1.00 0.00 C ATOM 1708 C PRO B 200 -13.375 13.728 1.069 1.00 0.00 C ATOM 1709 O PRO B 200 -12.895 14.454 0.196 1.00 0.00 O ATOM 1710 CB PRO B 200 -15.709 12.975 0.385 1.00 0.00 C ATOM 1711 CG PRO B 200 -16.488 12.414 1.569 1.00 0.00 C ATOM 1712 CD PRO B 200 -15.701 11.165 1.955 1.00 0.00 C ATOM 0 HA PRO B 200 -13.770 12.211 -0.258 1.00 0.00 H new ATOM 0 HB2 PRO B 200 -15.805 14.059 0.323 1.00 0.00 H new ATOM 0 HB3 PRO B 200 -16.073 12.568 -0.559 1.00 0.00 H new ATOM 0 HG2 PRO B 200 -16.537 13.128 2.392 1.00 0.00 H new ATOM 0 HG3 PRO B 200 -17.515 12.172 1.295 1.00 0.00 H new ATOM 0 HD2 PRO B 200 -15.805 10.949 3.018 1.00 0.00 H new ATOM 0 HD3 PRO B 200 -16.063 10.290 1.415 1.00 0.00 H new ATOM 1720 N GLN B 201 -13.142 13.904 2.370 1.00 0.00 N ATOM 1721 CA GLN B 201 -12.314 14.966 2.910 1.00 0.00 C ATOM 1722 C GLN B 201 -10.876 14.884 2.370 1.00 0.00 C ATOM 1723 O GLN B 201 -10.226 15.919 2.187 1.00 0.00 O ATOM 1724 CB GLN B 201 -12.327 14.831 4.443 1.00 0.00 C ATOM 1725 CG GLN B 201 -11.745 16.049 5.167 1.00 0.00 C ATOM 1726 CD GLN B 201 -11.481 15.796 6.652 1.00 0.00 C ATOM 1727 OE1 GLN B 201 -12.268 15.177 7.360 1.00 0.00 O ATOM 1728 NE2 GLN B 201 -10.380 16.320 7.172 1.00 0.00 N ATOM 0 H GLN B 201 -13.535 13.295 3.088 1.00 0.00 H new ATOM 0 HA GLN B 201 -12.709 15.936 2.607 1.00 0.00 H new ATOM 0 HB2 GLN B 201 -13.353 14.675 4.778 1.00 0.00 H new ATOM 0 HB3 GLN B 201 -11.760 13.944 4.727 1.00 0.00 H new ATOM 0 HG2 GLN B 201 -10.813 16.340 4.683 1.00 0.00 H new ATOM 0 HG3 GLN B 201 -12.433 16.888 5.064 1.00 0.00 H new ATOM 0 HE21 GLN B 201 -9.730 16.834 6.577 1.00 0.00 H new ATOM 0 HE22 GLN B 201 -10.183 16.209 8.167 1.00 0.00 H new ATOM 1737 N HIS B 202 -10.347 13.671 2.180 1.00 0.00 N ATOM 1738 CA HIS B 202 -8.993 13.471 1.690 1.00 0.00 C ATOM 1739 C HIS B 202 -8.996 13.760 0.191 1.00 0.00 C ATOM 1740 O HIS B 202 -9.856 13.259 -0.531 1.00 0.00 O ATOM 1741 CB HIS B 202 -8.565 12.026 1.997 1.00 0.00 C ATOM 1742 CG HIS B 202 -7.144 11.856 2.492 1.00 0.00 C ATOM 1743 ND1 HIS B 202 -6.083 11.346 1.774 1.00 0.00 N ATOM 1744 CD2 HIS B 202 -6.714 12.031 3.783 1.00 0.00 C ATOM 1745 CE1 HIS B 202 -5.035 11.226 2.608 1.00 0.00 C ATOM 1746 NE2 HIS B 202 -5.363 11.654 3.841 1.00 0.00 N ATOM 0 H HIS B 202 -10.852 12.804 2.364 1.00 0.00 H new ATOM 0 HA HIS B 202 -8.280 14.138 2.175 1.00 0.00 H new ATOM 0 HB2 HIS B 202 -9.243 11.616 2.746 1.00 0.00 H new ATOM 0 HB3 HIS B 202 -8.690 11.429 1.093 1.00 0.00 H new ATOM 0 HD2 HIS B 202 -7.309 12.394 4.608 1.00 0.00 H new ATOM 0 HE1 HIS B 202 -4.066 10.840 2.328 1.00 0.00 H new ATOM 0 HE2 HIS B 202 -4.751 11.696 4.656 1.00 0.00 H new ATOM 1754 N SER B 203 -8.056 14.565 -0.302 1.00 0.00 N ATOM 1755 CA SER B 203 -7.967 14.889 -1.722 1.00 0.00 C ATOM 1756 C SER B 203 -7.787 13.605 -2.543 1.00 0.00 C ATOM 1757 O SER B 203 -8.381 13.471 -3.616 1.00 0.00 O ATOM 1758 CB SER B 203 -6.831 15.895 -1.934 1.00 0.00 C ATOM 1759 OG SER B 203 -7.068 17.061 -1.156 1.00 0.00 O ATOM 0 H SER B 203 -7.338 15.009 0.271 1.00 0.00 H new ATOM 0 HA SER B 203 -8.890 15.354 -2.069 1.00 0.00 H new ATOM 0 HB2 SER B 203 -5.878 15.446 -1.652 1.00 0.00 H new ATOM 0 HB3 SER B 203 -6.759 16.159 -2.989 1.00 0.00 H new ATOM 0 HG SER B 203 -6.338 17.700 -1.294 1.00 0.00 H new ATOM 1765 N LEU B 204 -7.065 12.619 -1.994 1.00 0.00 N ATOM 1766 CA LEU B 204 -6.817 11.332 -2.647 1.00 0.00 C ATOM 1767 C LEU B 204 -8.101 10.578 -2.989 1.00 0.00 C ATOM 1768 O LEU B 204 -8.071 9.724 -3.875 1.00 0.00 O ATOM 1769 CB LEU B 204 -5.944 10.419 -1.771 1.00 0.00 C ATOM 1770 CG LEU B 204 -4.519 10.933 -1.518 1.00 0.00 C ATOM 1771 CD1 LEU B 204 -3.724 9.851 -0.781 1.00 0.00 C ATOM 1772 CD2 LEU B 204 -3.834 11.310 -2.835 1.00 0.00 C ATOM 0 H LEU B 204 -6.633 12.696 -1.073 1.00 0.00 H new ATOM 0 HA LEU B 204 -6.299 11.576 -3.575 1.00 0.00 H new ATOM 0 HB2 LEU B 204 -6.440 10.280 -0.810 1.00 0.00 H new ATOM 0 HB3 LEU B 204 -5.882 9.438 -2.243 1.00 0.00 H new ATOM 0 HG LEU B 204 -4.563 11.832 -0.903 1.00 0.00 H new ATOM 0 HD11 LEU B 204 -2.710 10.206 -0.597 1.00 0.00 H new ATOM 0 HD12 LEU B 204 -4.209 9.627 0.169 1.00 0.00 H new ATOM 0 HD13 LEU B 204 -3.687 8.948 -1.391 1.00 0.00 H new ATOM 0 HD21 LEU B 204 -2.826 11.671 -2.631 1.00 0.00 H new ATOM 0 HD22 LEU B 204 -3.781 10.434 -3.481 1.00 0.00 H new ATOM 0 HD23 LEU B 204 -4.406 12.093 -3.332 1.00 0.00 H new ATOM 1784 N PHE B 205 -9.215 10.870 -2.312 1.00 0.00 N ATOM 1785 CA PHE B 205 -10.501 10.233 -2.553 1.00 0.00 C ATOM 1786 C PHE B 205 -10.889 10.372 -4.022 1.00 0.00 C ATOM 1787 O PHE B 205 -11.398 9.428 -4.624 1.00 0.00 O ATOM 1788 CB PHE B 205 -11.550 10.924 -1.681 1.00 0.00 C ATOM 1789 CG PHE B 205 -12.966 10.419 -1.850 1.00 0.00 C ATOM 1790 CD1 PHE B 205 -13.807 10.959 -2.843 1.00 0.00 C ATOM 1791 CD2 PHE B 205 -13.473 9.473 -0.947 1.00 0.00 C ATOM 1792 CE1 PHE B 205 -15.140 10.527 -2.950 1.00 0.00 C ATOM 1793 CE2 PHE B 205 -14.812 9.053 -1.041 1.00 0.00 C ATOM 1794 CZ PHE B 205 -15.642 9.570 -2.052 1.00 0.00 C ATOM 0 H PHE B 205 -9.243 11.569 -1.569 1.00 0.00 H new ATOM 0 HA PHE B 205 -10.440 9.173 -2.308 1.00 0.00 H new ATOM 0 HB2 PHE B 205 -11.263 10.808 -0.636 1.00 0.00 H new ATOM 0 HB3 PHE B 205 -11.534 11.992 -1.900 1.00 0.00 H new ATOM 0 HD1 PHE B 205 -13.426 11.706 -3.523 1.00 0.00 H new ATOM 0 HD2 PHE B 205 -12.834 9.066 -0.178 1.00 0.00 H new ATOM 0 HE1 PHE B 205 -15.778 10.930 -3.722 1.00 0.00 H new ATOM 0 HE2 PHE B 205 -15.203 8.333 -0.337 1.00 0.00 H new ATOM 0 HZ PHE B 205 -16.664 9.232 -2.138 1.00 0.00 H new ATOM 1804 N ASN B 206 -10.632 11.548 -4.603 1.00 0.00 N ATOM 1805 CA ASN B 206 -10.959 11.842 -5.990 1.00 0.00 C ATOM 1806 C ASN B 206 -10.243 10.919 -6.976 1.00 0.00 C ATOM 1807 O ASN B 206 -10.804 10.635 -8.034 1.00 0.00 O ATOM 1808 CB ASN B 206 -10.708 13.328 -6.298 1.00 0.00 C ATOM 1809 CG ASN B 206 -12.032 14.015 -6.568 1.00 0.00 C ATOM 1810 OD1 ASN B 206 -12.363 14.285 -7.718 1.00 0.00 O ATOM 1811 ND2 ASN B 206 -12.843 14.259 -5.551 1.00 0.00 N ATOM 0 H ASN B 206 -10.187 12.325 -4.114 1.00 0.00 H new ATOM 0 HA ASN B 206 -12.022 11.643 -6.124 1.00 0.00 H new ATOM 0 HB2 ASN B 206 -10.203 13.805 -5.458 1.00 0.00 H new ATOM 0 HB3 ASN B 206 -10.051 13.426 -7.163 1.00 0.00 H new ATOM 0 HD21 ASN B 206 -13.758 14.677 -5.718 1.00 0.00 H new ATOM 0 HD22 ASN B 206 -12.553 14.029 -4.601 1.00 0.00 H new ATOM 1818 N TYR B 207 -9.025 10.475 -6.648 1.00 0.00 N ATOM 1819 CA TYR B 207 -8.234 9.566 -7.473 1.00 0.00 C ATOM 1820 C TYR B 207 -8.708 8.135 -7.200 1.00 0.00 C ATOM 1821 O TYR B 207 -8.992 7.383 -8.131 1.00 0.00 O ATOM 1822 CB TYR B 207 -6.739 9.744 -7.141 1.00 0.00 C ATOM 1823 CG TYR B 207 -5.813 8.640 -7.630 1.00 0.00 C ATOM 1824 CD1 TYR B 207 -5.823 8.239 -8.980 1.00 0.00 C ATOM 1825 CD2 TYR B 207 -4.949 7.995 -6.723 1.00 0.00 C ATOM 1826 CE1 TYR B 207 -4.986 7.200 -9.420 1.00 0.00 C ATOM 1827 CE2 TYR B 207 -4.111 6.952 -7.154 1.00 0.00 C ATOM 1828 CZ TYR B 207 -4.125 6.551 -8.508 1.00 0.00 C ATOM 1829 OH TYR B 207 -3.295 5.556 -8.919 1.00 0.00 O ATOM 0 H TYR B 207 -8.555 10.745 -5.784 1.00 0.00 H new ATOM 0 HA TYR B 207 -8.365 9.783 -8.533 1.00 0.00 H new ATOM 0 HB2 TYR B 207 -6.402 10.689 -7.567 1.00 0.00 H new ATOM 0 HB3 TYR B 207 -6.634 9.827 -6.059 1.00 0.00 H new ATOM 0 HD1 TYR B 207 -6.478 8.733 -9.682 1.00 0.00 H new ATOM 0 HD2 TYR B 207 -4.930 8.304 -5.688 1.00 0.00 H new ATOM 0 HE1 TYR B 207 -5.001 6.897 -10.457 1.00 0.00 H new ATOM 0 HE2 TYR B 207 -3.457 6.458 -6.451 1.00 0.00 H new ATOM 0 HH TYR B 207 -2.586 5.933 -9.481 1.00 0.00 H new ATOM 1839 N PHE B 208 -8.819 7.777 -5.917 1.00 0.00 N ATOM 1840 CA PHE B 208 -9.250 6.468 -5.454 1.00 0.00 C ATOM 1841 C PHE B 208 -10.582 6.066 -6.087 1.00 0.00 C ATOM 1842 O PHE B 208 -10.653 5.011 -6.712 1.00 0.00 O ATOM 1843 CB PHE B 208 -9.344 6.476 -3.918 1.00 0.00 C ATOM 1844 CG PHE B 208 -10.047 5.263 -3.333 1.00 0.00 C ATOM 1845 CD1 PHE B 208 -9.343 4.073 -3.062 1.00 0.00 C ATOM 1846 CD2 PHE B 208 -11.437 5.308 -3.117 1.00 0.00 C ATOM 1847 CE1 PHE B 208 -10.021 2.951 -2.556 1.00 0.00 C ATOM 1848 CE2 PHE B 208 -12.115 4.173 -2.650 1.00 0.00 C ATOM 1849 CZ PHE B 208 -11.408 3.002 -2.341 1.00 0.00 C ATOM 0 H PHE B 208 -8.603 8.416 -5.152 1.00 0.00 H new ATOM 0 HA PHE B 208 -8.514 5.725 -5.761 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -8.338 6.534 -3.503 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -9.872 7.376 -3.602 1.00 0.00 H new ATOM 0 HD1 PHE B 208 -8.280 4.023 -3.244 1.00 0.00 H new ATOM 0 HD2 PHE B 208 -11.983 6.219 -3.312 1.00 0.00 H new ATOM 0 HE1 PHE B 208 -9.474 2.047 -2.332 1.00 0.00 H new ATOM 0 HE2 PHE B 208 -13.188 4.201 -2.528 1.00 0.00 H new ATOM 0 HZ PHE B 208 -11.927 2.144 -1.940 1.00 0.00 H new ATOM 1859 N THR B 209 -11.622 6.895 -5.950 1.00 0.00 N ATOM 1860 CA THR B 209 -12.945 6.599 -6.484 1.00 0.00 C ATOM 1861 C THR B 209 -12.890 6.315 -7.989 1.00 0.00 C ATOM 1862 O THR B 209 -13.432 5.304 -8.426 1.00 0.00 O ATOM 1863 CB THR B 209 -13.939 7.690 -6.025 1.00 0.00 C ATOM 1864 OG1 THR B 209 -15.273 7.232 -6.065 1.00 0.00 O ATOM 1865 CG2 THR B 209 -13.871 9.007 -6.807 1.00 0.00 C ATOM 0 H THR B 209 -11.565 7.790 -5.464 1.00 0.00 H new ATOM 0 HA THR B 209 -13.333 5.667 -6.074 1.00 0.00 H new ATOM 0 HB THR B 209 -13.623 7.900 -5.003 1.00 0.00 H new ATOM 0 HG1 THR B 209 -15.873 7.947 -5.767 1.00 0.00 H new ATOM 0 HG21 THR B 209 -14.607 9.705 -6.408 1.00 0.00 H new ATOM 0 HG22 THR B 209 -12.874 9.436 -6.711 1.00 0.00 H new ATOM 0 HG23 THR B 209 -14.084 8.817 -7.859 1.00 0.00 H new ATOM 1873 N LYS B 210 -12.185 7.137 -8.777 1.00 0.00 N ATOM 1874 CA LYS B 210 -12.070 6.943 -10.222 1.00 0.00 C ATOM 1875 C LYS B 210 -11.529 5.557 -10.555 1.00 0.00 C ATOM 1876 O LYS B 210 -12.038 4.907 -11.468 1.00 0.00 O ATOM 1877 CB LYS B 210 -11.202 8.051 -10.831 1.00 0.00 C ATOM 1878 CG LYS B 210 -12.040 9.316 -11.041 1.00 0.00 C ATOM 1879 CD LYS B 210 -11.194 10.441 -11.640 1.00 0.00 C ATOM 1880 CE LYS B 210 -12.132 11.563 -12.095 1.00 0.00 C ATOM 1881 NZ LYS B 210 -11.413 12.662 -12.764 1.00 0.00 N ATOM 0 H LYS B 210 -11.681 7.952 -8.429 1.00 0.00 H new ATOM 0 HA LYS B 210 -13.065 7.007 -10.662 1.00 0.00 H new ATOM 0 HB2 LYS B 210 -10.360 8.267 -10.174 1.00 0.00 H new ATOM 0 HB3 LYS B 210 -10.787 7.718 -11.782 1.00 0.00 H new ATOM 0 HG2 LYS B 210 -12.878 9.096 -11.702 1.00 0.00 H new ATOM 0 HG3 LYS B 210 -12.461 9.640 -10.089 1.00 0.00 H new ATOM 0 HD2 LYS B 210 -10.485 10.816 -10.902 1.00 0.00 H new ATOM 0 HD3 LYS B 210 -10.611 10.069 -12.483 1.00 0.00 H new ATOM 0 HE2 LYS B 210 -12.879 11.154 -12.775 1.00 0.00 H new ATOM 0 HE3 LYS B 210 -12.669 11.956 -11.232 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 -12.091 13.396 -13.053 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 -10.718 13.072 -12.108 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 -10.922 12.295 -13.604 1.00 0.00 H new ATOM 1895 N LEU B 211 -10.506 5.098 -9.828 1.00 0.00 N ATOM 1896 CA LEU B 211 -9.937 3.775 -10.064 1.00 0.00 C ATOM 1897 C LEU B 211 -10.995 2.695 -9.849 1.00 0.00 C ATOM 1898 O LEU B 211 -11.015 1.739 -10.620 1.00 0.00 O ATOM 1899 CB LEU B 211 -8.757 3.474 -9.126 1.00 0.00 C ATOM 1900 CG LEU B 211 -7.425 4.167 -9.442 1.00 0.00 C ATOM 1901 CD1 LEU B 211 -6.444 3.780 -8.327 1.00 0.00 C ATOM 1902 CD2 LEU B 211 -6.843 3.732 -10.795 1.00 0.00 C ATOM 0 H LEU B 211 -10.059 5.622 -9.076 1.00 0.00 H new ATOM 0 HA LEU B 211 -9.581 3.771 -11.094 1.00 0.00 H new ATOM 0 HB2 LEU B 211 -9.050 3.749 -8.113 1.00 0.00 H new ATOM 0 HB3 LEU B 211 -8.588 2.397 -9.128 1.00 0.00 H new ATOM 0 HG LEU B 211 -7.589 5.243 -9.498 1.00 0.00 H new ATOM 0 HD11 LEU B 211 -5.479 4.252 -8.511 1.00 0.00 H new ATOM 0 HD12 LEU B 211 -6.835 4.115 -7.366 1.00 0.00 H new ATOM 0 HD13 LEU B 211 -6.321 2.697 -8.311 1.00 0.00 H new ATOM 0 HD21 LEU B 211 -5.901 4.252 -10.970 1.00 0.00 H new ATOM 0 HD22 LEU B 211 -6.668 2.656 -10.787 1.00 0.00 H new ATOM 0 HD23 LEU B 211 -7.547 3.979 -11.590 1.00 0.00 H new ATOM 1914 N VAL B 212 -11.832 2.801 -8.809 1.00 0.00 N ATOM 1915 CA VAL B 212 -12.862 1.799 -8.545 1.00 0.00 C ATOM 1916 C VAL B 212 -13.766 1.693 -9.766 1.00 0.00 C ATOM 1917 O VAL B 212 -13.937 0.596 -10.284 1.00 0.00 O ATOM 1918 CB VAL B 212 -13.683 2.113 -7.277 1.00 0.00 C ATOM 1919 CG1 VAL B 212 -14.647 0.957 -6.980 1.00 0.00 C ATOM 1920 CG2 VAL B 212 -12.781 2.331 -6.055 1.00 0.00 C ATOM 0 H VAL B 212 -11.813 3.571 -8.140 1.00 0.00 H new ATOM 0 HA VAL B 212 -12.372 0.844 -8.358 1.00 0.00 H new ATOM 0 HB VAL B 212 -14.237 3.032 -7.467 1.00 0.00 H new ATOM 0 HG11 VAL B 212 -15.224 1.185 -6.084 1.00 0.00 H new ATOM 0 HG12 VAL B 212 -15.325 0.823 -7.823 1.00 0.00 H new ATOM 0 HG13 VAL B 212 -14.078 0.041 -6.822 1.00 0.00 H new ATOM 0 HG21 VAL B 212 -13.397 2.550 -5.183 1.00 0.00 H new ATOM 0 HG22 VAL B 212 -12.196 1.430 -5.870 1.00 0.00 H new ATOM 0 HG23 VAL B 212 -12.109 3.168 -6.244 1.00 0.00 H new ATOM 1930 N GLU B 213 -14.269 2.827 -10.258 1.00 0.00 N ATOM 1931 CA GLU B 213 -15.157 2.909 -11.412 1.00 0.00 C ATOM 1932 C GLU B 213 -14.535 2.219 -12.634 1.00 0.00 C ATOM 1933 O GLU B 213 -15.230 1.497 -13.350 1.00 0.00 O ATOM 1934 CB GLU B 213 -15.483 4.384 -11.707 1.00 0.00 C ATOM 1935 CG GLU B 213 -16.079 5.147 -10.512 1.00 0.00 C ATOM 1936 CD GLU B 213 -17.530 4.779 -10.233 1.00 0.00 C ATOM 1937 OE1 GLU B 213 -18.415 5.426 -10.831 1.00 0.00 O ATOM 1938 OE2 GLU B 213 -17.782 3.877 -9.397 1.00 0.00 O ATOM 0 H GLU B 213 -14.062 3.739 -9.850 1.00 0.00 H new ATOM 0 HA GLU B 213 -16.085 2.385 -11.185 1.00 0.00 H new ATOM 0 HB2 GLU B 213 -14.572 4.889 -12.029 1.00 0.00 H new ATOM 0 HB3 GLU B 213 -16.184 4.430 -12.540 1.00 0.00 H new ATOM 0 HG2 GLU B 213 -15.481 4.943 -9.624 1.00 0.00 H new ATOM 0 HG3 GLU B 213 -16.012 6.218 -10.702 1.00 0.00 H new ATOM 1945 N GLN B 214 -13.228 2.412 -12.862 1.00 0.00 N ATOM 1946 CA GLN B 214 -12.502 1.814 -13.983 1.00 0.00 C ATOM 1947 C GLN B 214 -12.319 0.298 -13.799 1.00 0.00 C ATOM 1948 O GLN B 214 -12.215 -0.430 -14.794 1.00 0.00 O ATOM 1949 CB GLN B 214 -11.133 2.502 -14.154 1.00 0.00 C ATOM 1950 CG GLN B 214 -11.229 4.006 -14.485 1.00 0.00 C ATOM 1951 CD GLN B 214 -10.634 4.394 -15.840 1.00 0.00 C ATOM 1952 OE1 GLN B 214 -11.333 4.878 -16.727 1.00 0.00 O ATOM 1953 NE2 GLN B 214 -9.336 4.232 -16.042 1.00 0.00 N ATOM 0 H GLN B 214 -12.642 2.995 -12.264 1.00 0.00 H new ATOM 0 HA GLN B 214 -13.096 1.966 -14.884 1.00 0.00 H new ATOM 0 HB2 GLN B 214 -10.557 2.377 -13.237 1.00 0.00 H new ATOM 0 HB3 GLN B 214 -10.581 1.999 -14.948 1.00 0.00 H new ATOM 0 HG2 GLN B 214 -12.277 4.304 -14.463 1.00 0.00 H new ATOM 0 HG3 GLN B 214 -10.721 4.571 -13.703 1.00 0.00 H new ATOM 0 HE21 GLN B 214 -8.752 3.831 -15.308 1.00 0.00 H new ATOM 0 HE22 GLN B 214 -8.920 4.509 -16.931 1.00 0.00 H new ATOM 1962 N TYR B 215 -12.238 -0.191 -12.557 1.00 0.00 N ATOM 1963 CA TYR B 215 -12.076 -1.612 -12.256 1.00 0.00 C ATOM 1964 C TYR B 215 -13.431 -2.328 -12.171 1.00 0.00 C ATOM 1965 O TYR B 215 -13.474 -3.535 -12.422 1.00 0.00 O ATOM 1966 CB TYR B 215 -11.274 -1.817 -10.960 1.00 0.00 C ATOM 1967 CG TYR B 215 -9.785 -1.505 -11.036 1.00 0.00 C ATOM 1968 CD1 TYR B 215 -8.961 -2.126 -11.998 1.00 0.00 C ATOM 1969 CD2 TYR B 215 -9.216 -0.607 -10.113 1.00 0.00 C ATOM 1970 CE1 TYR B 215 -7.592 -1.799 -12.081 1.00 0.00 C ATOM 1971 CE2 TYR B 215 -7.854 -0.268 -10.195 1.00 0.00 C ATOM 1972 CZ TYR B 215 -7.043 -0.843 -11.197 1.00 0.00 C ATOM 1973 OH TYR B 215 -5.731 -0.482 -11.261 1.00 0.00 O ATOM 0 H TYR B 215 -12.284 0.398 -11.725 1.00 0.00 H new ATOM 0 HA TYR B 215 -11.515 -2.055 -13.079 1.00 0.00 H new ATOM 0 HB2 TYR B 215 -11.715 -1.195 -10.182 1.00 0.00 H new ATOM 0 HB3 TYR B 215 -11.391 -2.854 -10.644 1.00 0.00 H new ATOM 0 HD1 TYR B 215 -9.381 -2.856 -12.674 1.00 0.00 H new ATOM 0 HD2 TYR B 215 -9.830 -0.175 -9.336 1.00 0.00 H new ATOM 0 HE1 TYR B 215 -6.965 -2.278 -12.818 1.00 0.00 H new ATOM 0 HE2 TYR B 215 -7.428 0.432 -9.491 1.00 0.00 H new ATOM 0 HH TYR B 215 -5.542 0.189 -10.572 1.00 0.00 H new ATOM 1983 N THR B 216 -14.528 -1.651 -11.816 1.00 0.00 N ATOM 1984 CA THR B 216 -15.835 -2.292 -11.746 1.00 0.00 C ATOM 1985 C THR B 216 -16.353 -2.533 -13.156 1.00 0.00 C ATOM 1986 O THR B 216 -16.374 -1.611 -13.973 1.00 0.00 O ATOM 1987 CB THR B 216 -16.863 -1.458 -10.967 1.00 0.00 C ATOM 1988 OG1 THR B 216 -16.740 -0.061 -11.160 1.00 0.00 O ATOM 1989 CG2 THR B 216 -16.760 -1.752 -9.476 1.00 0.00 C ATOM 0 H THR B 216 -14.532 -0.660 -11.574 1.00 0.00 H new ATOM 0 HA THR B 216 -15.706 -3.233 -11.212 1.00 0.00 H new ATOM 0 HB THR B 216 -17.835 -1.754 -11.363 1.00 0.00 H new ATOM 0 HG1 THR B 216 -16.429 0.117 -12.072 1.00 0.00 H new ATOM 0 HG21 THR B 216 -17.494 -1.154 -8.936 1.00 0.00 H new ATOM 0 HG22 THR B 216 -16.953 -2.810 -9.300 1.00 0.00 H new ATOM 0 HG23 THR B 216 -15.759 -1.502 -9.124 1.00 0.00 H new