USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 911 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 19 TYR OH : rot 180:sc= 1.06 USER MOD Set 1.2: A 102 THR OG1 : rot 119:sc= 1.39 USER MOD Single : A 13 THR OG1 : rot -145:sc= 0.257 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 165:sc= -0.0326 (180deg=-0.318) USER MOD Single : A 30 SER OG : rot 180:sc= -0.336 USER MOD Single : A 31 HIS : no HE2:sc= -0.129 X(o=-0.13,f=-0.13) USER MOD Single : A 32 GLN : amide:sc= -0.755! C(o=-0.76!,f=-3.6!) USER MOD Single : A 34 SER OG : rot -113:sc= -1! USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 167:sc=-0.00889 (180deg=-0.146) USER MOD Single : A 52 GLN : amide:sc= -0.317 K(o=-0.32,f=-5.6!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot -100:sc= -0.518 USER MOD Single : A 59 GLN : amide:sc=-0.00844 K(o=-0.0084,f=-1.2) USER MOD Single : A 64 ASN : amide:sc= 0.928 K(o=0.93,f=-0.013) USER MOD Single : A 66 ASN : amide:sc= -0.188 X(o=-0.19,f=-0.031) USER MOD Single : A 70 THR OG1 : rot 10:sc= 1.78 USER MOD Single : A 75 THR OG1 : rot 92:sc= 1.4 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= -0.327 X(o=-0.33,f=-0.16) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0231 USER MOD Single : A 100 MET CE :methyl 160:sc= -0.0985 (180deg=-0.55) USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 108 THR OG1 : rot 80:sc= 1.11 USER MOD Single : A 109 TYR OH : rot -163:sc= 1.17 USER MOD Single : A 110 ASN : amide:sc= 0.0332 X(o=0.033,f=-0.0079) USER MOD Single : A 112 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 148 N PHE A 10 -15.368 11.171 -15.542 1.00 0.00 N ATOM 149 CA PHE A 10 -15.361 10.702 -14.164 1.00 0.00 C ATOM 150 C PHE A 10 -14.071 11.132 -13.466 1.00 0.00 C ATOM 151 O PHE A 10 -13.120 10.359 -13.368 1.00 0.00 O ATOM 152 CB PHE A 10 -15.532 9.179 -14.123 1.00 0.00 C ATOM 153 CG PHE A 10 -16.164 8.670 -12.856 1.00 0.00 C ATOM 154 CD1 PHE A 10 -17.105 9.432 -12.180 1.00 0.00 C ATOM 155 CD2 PHE A 10 -15.825 7.429 -12.347 1.00 0.00 C ATOM 156 CE1 PHE A 10 -17.692 8.964 -11.019 1.00 0.00 C ATOM 157 CE2 PHE A 10 -16.408 6.955 -11.188 1.00 0.00 C ATOM 158 CZ PHE A 10 -17.344 7.723 -10.524 1.00 0.00 C ATOM 0 HA PHE A 10 -16.199 11.151 -13.631 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -16.142 8.869 -14.972 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -14.555 8.710 -14.244 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -17.383 10.402 -12.565 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -15.095 6.823 -12.863 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -18.422 9.568 -10.500 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -16.132 5.985 -10.802 1.00 0.00 H new ATOM 0 HZ PHE A 10 -17.803 7.354 -9.619 1.00 0.00 H new ATOM 168 N PRO A 11 -13.999 12.408 -13.048 1.00 0.00 N ATOM 169 CA PRO A 11 -12.845 12.971 -12.371 1.00 0.00 C ATOM 170 C PRO A 11 -13.047 13.144 -10.863 1.00 0.00 C ATOM 171 O PRO A 11 -14.177 13.142 -10.369 1.00 0.00 O ATOM 172 CB PRO A 11 -12.757 14.341 -13.040 1.00 0.00 C ATOM 173 CG PRO A 11 -14.179 14.710 -13.371 1.00 0.00 C ATOM 174 CD PRO A 11 -15.012 13.448 -13.253 1.00 0.00 C ATOM 0 HA PRO A 11 -11.961 12.338 -12.453 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -12.304 15.076 -12.375 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -12.141 14.302 -13.938 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -14.545 15.477 -12.689 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -14.245 15.121 -14.378 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -15.711 13.502 -12.419 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -15.601 13.267 -14.152 1.00 0.00 H new ATOM 182 N ARG A 12 -11.931 13.280 -10.144 1.00 0.00 N ATOM 183 CA ARG A 12 -11.939 13.671 -8.729 1.00 0.00 C ATOM 184 C ARG A 12 -12.785 12.737 -7.865 1.00 0.00 C ATOM 185 O ARG A 12 -13.370 13.164 -6.866 1.00 0.00 O ATOM 186 CB ARG A 12 -12.454 15.106 -8.586 1.00 0.00 C ATOM 187 CG ARG A 12 -11.591 16.147 -9.285 1.00 0.00 C ATOM 188 CD ARG A 12 -10.197 16.222 -8.681 1.00 0.00 C ATOM 189 NE ARG A 12 -10.238 16.474 -7.241 1.00 0.00 N ATOM 190 CZ ARG A 12 -9.814 17.597 -6.661 1.00 0.00 C ATOM 191 NH1 ARG A 12 -9.345 18.599 -7.394 1.00 0.00 N ATOM 192 NH2 ARG A 12 -9.874 17.717 -5.341 1.00 0.00 N ATOM 0 H ARG A 12 -10.997 13.123 -10.523 1.00 0.00 H new ATOM 0 HA ARG A 12 -10.911 13.602 -8.374 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -13.466 15.159 -8.987 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -12.518 15.354 -7.527 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -11.515 15.904 -10.345 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -12.071 17.123 -9.215 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -9.669 15.288 -8.871 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -9.631 17.014 -9.172 1.00 0.00 H new ATOM 0 HE ARG A 12 -10.616 15.742 -6.640 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -9.307 18.514 -8.410 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -9.023 19.455 -6.942 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -10.243 16.952 -4.776 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -9.551 18.574 -4.892 1.00 0.00 H new ATOM 206 N THR A 13 -12.837 11.471 -8.226 1.00 0.00 N ATOM 207 CA THR A 13 -13.615 10.507 -7.474 1.00 0.00 C ATOM 208 C THR A 13 -12.765 9.870 -6.381 1.00 0.00 C ATOM 209 O THR A 13 -11.878 9.063 -6.660 1.00 0.00 O ATOM 210 CB THR A 13 -14.190 9.422 -8.391 1.00 0.00 C ATOM 211 OG1 THR A 13 -14.767 10.033 -9.556 1.00 0.00 O ATOM 212 CG2 THR A 13 -15.246 8.598 -7.667 1.00 0.00 C ATOM 0 H THR A 13 -12.350 11.086 -9.035 1.00 0.00 H new ATOM 0 HA THR A 13 -14.446 11.039 -7.012 1.00 0.00 H new ATOM 0 HB THR A 13 -13.380 8.756 -8.687 1.00 0.00 H new ATOM 0 HG1 THR A 13 -15.559 9.526 -9.833 1.00 0.00 H new ATOM 0 HG21 THR A 13 -15.637 7.836 -8.340 1.00 0.00 H new ATOM 0 HG22 THR A 13 -14.799 8.118 -6.796 1.00 0.00 H new ATOM 0 HG23 THR A 13 -16.058 9.250 -7.345 1.00 0.00 H new ATOM 220 N ALA A 14 -13.017 10.264 -5.146 1.00 0.00 N ATOM 221 CA ALA A 14 -12.300 9.728 -4.003 1.00 0.00 C ATOM 222 C ALA A 14 -13.278 9.257 -2.939 1.00 0.00 C ATOM 223 O ALA A 14 -12.885 8.876 -1.836 1.00 0.00 O ATOM 224 CB ALA A 14 -11.366 10.781 -3.435 1.00 0.00 C ATOM 0 H ALA A 14 -13.722 10.962 -4.907 1.00 0.00 H new ATOM 0 HA ALA A 14 -11.707 8.873 -4.329 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -10.832 10.370 -2.578 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -10.649 11.081 -4.199 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -11.945 11.649 -3.120 1.00 0.00 H new ATOM 230 N ALA A 15 -14.559 9.286 -3.278 1.00 0.00 N ATOM 231 CA ALA A 15 -15.596 8.870 -2.354 1.00 0.00 C ATOM 232 C ALA A 15 -15.901 7.390 -2.528 1.00 0.00 C ATOM 233 O ALA A 15 -16.577 6.986 -3.477 1.00 0.00 O ATOM 234 CB ALA A 15 -16.853 9.701 -2.554 1.00 0.00 C ATOM 0 H ALA A 15 -14.902 9.594 -4.188 1.00 0.00 H new ATOM 0 HA ALA A 15 -15.237 9.030 -1.338 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.620 9.375 -1.852 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.625 10.753 -2.380 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.216 9.572 -3.574 1.00 0.00 H new ATOM 240 N ILE A 16 -15.378 6.587 -1.618 1.00 0.00 N ATOM 241 CA ILE A 16 -15.659 5.164 -1.592 1.00 0.00 C ATOM 242 C ILE A 16 -16.663 4.886 -0.485 1.00 0.00 C ATOM 243 O ILE A 16 -16.422 5.210 0.676 1.00 0.00 O ATOM 244 CB ILE A 16 -14.372 4.335 -1.373 1.00 0.00 C ATOM 245 CG1 ILE A 16 -13.352 4.651 -2.475 1.00 0.00 C ATOM 246 CG2 ILE A 16 -14.693 2.844 -1.349 1.00 0.00 C ATOM 247 CD1 ILE A 16 -12.023 3.944 -2.313 1.00 0.00 C ATOM 0 H ILE A 16 -14.749 6.902 -0.879 1.00 0.00 H new ATOM 0 HA ILE A 16 -16.073 4.868 -2.556 1.00 0.00 H new ATOM 0 HB ILE A 16 -13.940 4.604 -0.409 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -13.780 4.379 -3.440 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -13.178 5.727 -2.496 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -13.775 2.277 -1.194 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -15.390 2.635 -0.538 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -15.143 2.553 -2.298 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -11.361 4.222 -3.133 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -11.569 4.235 -1.365 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -12.181 2.866 -2.324 1.00 0.00 H new ATOM 259 N ASP A 17 -17.800 4.315 -0.851 1.00 0.00 N ATOM 260 CA ASP A 17 -18.904 4.162 0.087 1.00 0.00 C ATOM 261 C ASP A 17 -18.693 2.956 0.993 1.00 0.00 C ATOM 262 O ASP A 17 -18.607 3.093 2.213 1.00 0.00 O ATOM 263 CB ASP A 17 -20.230 4.030 -0.663 1.00 0.00 C ATOM 264 CG ASP A 17 -21.425 4.185 0.253 1.00 0.00 C ATOM 265 OD1 ASP A 17 -21.894 3.174 0.813 1.00 0.00 O ATOM 266 OD2 ASP A 17 -21.901 5.327 0.424 1.00 0.00 O ATOM 0 H ASP A 17 -17.983 3.951 -1.786 1.00 0.00 H new ATOM 0 HA ASP A 17 -18.938 5.055 0.711 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -20.277 4.784 -1.449 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -20.273 3.057 -1.152 1.00 0.00 H new ATOM 271 N ALA A 18 -18.587 1.782 0.390 1.00 0.00 N ATOM 272 CA ALA A 18 -18.426 0.550 1.143 1.00 0.00 C ATOM 273 C ALA A 18 -17.217 -0.226 0.651 1.00 0.00 C ATOM 274 O ALA A 18 -16.813 -0.105 -0.507 1.00 0.00 O ATOM 275 CB ALA A 18 -19.681 -0.302 1.042 1.00 0.00 C ATOM 0 H ALA A 18 -18.610 1.657 -0.622 1.00 0.00 H new ATOM 0 HA ALA A 18 -18.265 0.807 2.190 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -19.544 -1.221 1.612 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -20.530 0.251 1.445 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -19.871 -0.548 -0.003 1.00 0.00 H new ATOM 281 N TYR A 19 -16.647 -1.026 1.537 1.00 0.00 N ATOM 282 CA TYR A 19 -15.467 -1.809 1.220 1.00 0.00 C ATOM 283 C TYR A 19 -15.648 -3.252 1.676 1.00 0.00 C ATOM 284 O TYR A 19 -15.754 -3.528 2.875 1.00 0.00 O ATOM 285 CB TYR A 19 -14.233 -1.180 1.880 1.00 0.00 C ATOM 286 CG TYR A 19 -12.989 -2.035 1.805 1.00 0.00 C ATOM 287 CD1 TYR A 19 -12.339 -2.251 0.597 1.00 0.00 C ATOM 288 CD2 TYR A 19 -12.465 -2.623 2.948 1.00 0.00 C ATOM 289 CE1 TYR A 19 -11.203 -3.035 0.531 1.00 0.00 C ATOM 290 CE2 TYR A 19 -11.331 -3.404 2.892 1.00 0.00 C ATOM 291 CZ TYR A 19 -10.704 -3.608 1.682 1.00 0.00 C ATOM 292 OH TYR A 19 -9.575 -4.390 1.625 1.00 0.00 O ATOM 0 H TYR A 19 -16.988 -1.150 2.490 1.00 0.00 H new ATOM 0 HA TYR A 19 -15.322 -1.812 0.140 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -14.030 -0.220 1.405 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -14.458 -0.977 2.927 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -12.727 -1.800 -0.304 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -12.955 -2.466 3.898 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -10.709 -3.198 -0.416 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -10.936 -3.854 3.791 1.00 0.00 H new ATOM 0 HH TYR A 19 -9.357 -4.716 2.523 1.00 0.00 H new ATOM 302 N GLY A 20 -15.702 -4.165 0.718 1.00 0.00 N ATOM 303 CA GLY A 20 -15.845 -5.569 1.040 1.00 0.00 C ATOM 304 C GLY A 20 -16.763 -6.288 0.080 1.00 0.00 C ATOM 305 O GLY A 20 -16.305 -6.999 -0.817 1.00 0.00 O ATOM 0 H GLY A 20 -15.649 -3.958 -0.279 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -14.864 -6.044 1.026 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -16.233 -5.669 2.054 1.00 0.00 H new ATOM 309 N LYS A 21 -18.059 -6.096 0.260 1.00 0.00 N ATOM 310 CA LYS A 21 -19.048 -6.746 -0.585 1.00 0.00 C ATOM 311 C LYS A 21 -19.094 -6.085 -1.949 1.00 0.00 C ATOM 312 O LYS A 21 -19.037 -4.859 -2.061 1.00 0.00 O ATOM 313 CB LYS A 21 -20.434 -6.692 0.045 1.00 0.00 C ATOM 314 CG LYS A 21 -20.528 -7.354 1.407 1.00 0.00 C ATOM 315 CD LYS A 21 -21.942 -7.254 1.950 1.00 0.00 C ATOM 316 CE LYS A 21 -22.434 -5.820 1.907 1.00 0.00 C ATOM 317 NZ LYS A 21 -23.819 -5.679 2.427 1.00 0.00 N ATOM 0 H LYS A 21 -18.452 -5.495 0.984 1.00 0.00 H new ATOM 0 HA LYS A 21 -18.753 -7.790 -0.693 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -20.737 -5.649 0.139 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -21.145 -7.171 -0.628 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -20.235 -8.401 1.330 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -19.832 -6.878 2.098 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -22.607 -7.889 1.365 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -21.970 -7.622 2.975 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -21.763 -5.191 2.493 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -22.396 -5.457 0.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -24.109 -4.681 2.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -24.466 -6.257 1.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -23.853 -6.000 3.416 1.00 0.00 H new ATOM 331 N GLY A 22 -19.224 -6.907 -2.975 1.00 0.00 N ATOM 332 CA GLY A 22 -19.205 -6.417 -4.342 1.00 0.00 C ATOM 333 C GLY A 22 -17.885 -5.761 -4.712 1.00 0.00 C ATOM 334 O GLY A 22 -17.815 -5.006 -5.678 1.00 0.00 O ATOM 0 H GLY A 22 -19.344 -7.916 -2.888 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -19.398 -7.246 -5.023 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -20.013 -5.699 -4.477 1.00 0.00 H new ATOM 338 N GLY A 23 -16.841 -6.052 -3.942 1.00 0.00 N ATOM 339 CA GLY A 23 -15.545 -5.451 -4.185 1.00 0.00 C ATOM 340 C GLY A 23 -15.498 -4.005 -3.735 1.00 0.00 C ATOM 341 O GLY A 23 -15.425 -3.723 -2.536 1.00 0.00 O ATOM 0 H GLY A 23 -16.871 -6.696 -3.152 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.777 -6.019 -3.660 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.312 -5.508 -5.248 1.00 0.00 H new ATOM 345 N PHE A 24 -15.544 -3.091 -4.693 1.00 0.00 N ATOM 346 CA PHE A 24 -15.573 -1.672 -4.390 1.00 0.00 C ATOM 347 C PHE A 24 -16.955 -1.105 -4.665 1.00 0.00 C ATOM 348 O PHE A 24 -17.371 -0.977 -5.819 1.00 0.00 O ATOM 349 CB PHE A 24 -14.529 -0.908 -5.209 1.00 0.00 C ATOM 350 CG PHE A 24 -13.113 -1.219 -4.825 1.00 0.00 C ATOM 351 CD1 PHE A 24 -12.629 -0.860 -3.577 1.00 0.00 C ATOM 352 CD2 PHE A 24 -12.267 -1.867 -5.708 1.00 0.00 C ATOM 353 CE1 PHE A 24 -11.327 -1.141 -3.217 1.00 0.00 C ATOM 354 CE2 PHE A 24 -10.963 -2.149 -5.355 1.00 0.00 C ATOM 355 CZ PHE A 24 -10.491 -1.786 -4.108 1.00 0.00 C ATOM 0 H PHE A 24 -15.562 -3.310 -5.689 1.00 0.00 H new ATOM 0 HA PHE A 24 -15.335 -1.551 -3.333 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -14.669 -1.140 -6.265 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -14.701 0.162 -5.092 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -13.279 -0.354 -2.878 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -12.631 -2.155 -6.683 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -10.962 -0.857 -2.241 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.311 -2.653 -6.053 1.00 0.00 H new ATOM 0 HZ PHE A 24 -9.471 -2.006 -3.830 1.00 0.00 H new ATOM 365 N TYR A 25 -17.669 -0.785 -3.602 1.00 0.00 N ATOM 366 CA TYR A 25 -18.993 -0.212 -3.727 1.00 0.00 C ATOM 367 C TYR A 25 -18.947 1.282 -3.455 1.00 0.00 C ATOM 368 O TYR A 25 -18.536 1.724 -2.382 1.00 0.00 O ATOM 369 CB TYR A 25 -19.974 -0.896 -2.772 1.00 0.00 C ATOM 370 CG TYR A 25 -21.367 -0.305 -2.804 1.00 0.00 C ATOM 371 CD1 TYR A 25 -22.204 -0.510 -3.893 1.00 0.00 C ATOM 372 CD2 TYR A 25 -21.843 0.463 -1.749 1.00 0.00 C ATOM 373 CE1 TYR A 25 -23.474 0.030 -3.930 1.00 0.00 C ATOM 374 CE2 TYR A 25 -23.113 1.006 -1.777 1.00 0.00 C ATOM 375 CZ TYR A 25 -23.924 0.788 -2.870 1.00 0.00 C ATOM 376 OH TYR A 25 -25.190 1.326 -2.901 1.00 0.00 O ATOM 0 H TYR A 25 -17.352 -0.913 -2.641 1.00 0.00 H new ATOM 0 HA TYR A 25 -19.341 -0.373 -4.747 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -20.033 -1.955 -3.023 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -19.584 -0.830 -1.756 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -21.855 -1.102 -4.726 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -21.209 0.639 -0.892 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -24.112 -0.140 -4.785 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -23.469 1.598 -0.947 1.00 0.00 H new ATOM 0 HH TYR A 25 -25.351 1.831 -2.077 1.00 0.00 H new ATOM 386 N PHE A 26 -19.360 2.052 -4.438 1.00 0.00 N ATOM 387 CA PHE A 26 -19.450 3.492 -4.295 1.00 0.00 C ATOM 388 C PHE A 26 -20.761 3.967 -4.894 1.00 0.00 C ATOM 389 O PHE A 26 -21.523 3.158 -5.424 1.00 0.00 O ATOM 390 CB PHE A 26 -18.255 4.192 -4.962 1.00 0.00 C ATOM 391 CG PHE A 26 -18.091 3.894 -6.428 1.00 0.00 C ATOM 392 CD1 PHE A 26 -17.347 2.804 -6.849 1.00 0.00 C ATOM 393 CD2 PHE A 26 -18.673 4.712 -7.386 1.00 0.00 C ATOM 394 CE1 PHE A 26 -17.188 2.533 -8.194 1.00 0.00 C ATOM 395 CE2 PHE A 26 -18.516 4.447 -8.732 1.00 0.00 C ATOM 396 CZ PHE A 26 -17.773 3.357 -9.137 1.00 0.00 C ATOM 0 H PHE A 26 -19.642 1.702 -5.354 1.00 0.00 H new ATOM 0 HA PHE A 26 -19.422 3.749 -3.236 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -18.364 5.269 -4.834 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -17.343 3.900 -4.441 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -16.886 2.158 -6.117 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -19.256 5.566 -7.075 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -16.607 1.678 -8.508 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -18.974 5.092 -9.467 1.00 0.00 H new ATOM 0 HZ PHE A 26 -17.649 3.148 -10.189 1.00 0.00 H new ATOM 406 N ALA A 27 -21.029 5.260 -4.795 1.00 0.00 N ATOM 407 CA ALA A 27 -22.246 5.828 -5.356 1.00 0.00 C ATOM 408 C ALA A 27 -22.279 5.633 -6.869 1.00 0.00 C ATOM 409 O ALA A 27 -21.665 6.392 -7.619 1.00 0.00 O ATOM 410 CB ALA A 27 -22.356 7.302 -5.003 1.00 0.00 C ATOM 0 H ALA A 27 -20.421 5.936 -4.332 1.00 0.00 H new ATOM 0 HA ALA A 27 -23.101 5.307 -4.925 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -23.272 7.711 -5.430 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -22.379 7.416 -3.919 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -21.497 7.838 -5.406 1.00 0.00 H new ATOM 416 N GLY A 28 -22.966 4.589 -7.305 1.00 0.00 N ATOM 417 CA GLY A 28 -23.052 4.300 -8.717 1.00 0.00 C ATOM 418 C GLY A 28 -23.115 2.814 -9.005 1.00 0.00 C ATOM 419 O GLY A 28 -24.095 2.330 -9.568 1.00 0.00 O ATOM 0 H GLY A 28 -23.467 3.936 -6.702 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -23.937 4.784 -9.130 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -22.188 4.728 -9.225 1.00 0.00 H new ATOM 423 N MET A 29 -22.082 2.080 -8.612 1.00 0.00 N ATOM 424 CA MET A 29 -22.007 0.659 -8.936 1.00 0.00 C ATOM 425 C MET A 29 -21.288 -0.134 -7.850 1.00 0.00 C ATOM 426 O MET A 29 -20.565 0.430 -7.025 1.00 0.00 O ATOM 427 CB MET A 29 -21.271 0.458 -10.267 1.00 0.00 C ATOM 428 CG MET A 29 -19.777 0.730 -10.180 1.00 0.00 C ATOM 429 SD MET A 29 -18.903 0.390 -11.723 1.00 0.00 S ATOM 430 CE MET A 29 -19.616 1.633 -12.797 1.00 0.00 C ATOM 0 H MET A 29 -21.293 2.438 -8.075 1.00 0.00 H new ATOM 0 HA MET A 29 -23.031 0.292 -9.012 1.00 0.00 H new ATOM 0 HB2 MET A 29 -21.427 -0.565 -10.609 1.00 0.00 H new ATOM 0 HB3 MET A 29 -21.709 1.115 -11.018 1.00 0.00 H new ATOM 0 HG2 MET A 29 -19.619 1.772 -9.902 1.00 0.00 H new ATOM 0 HG3 MET A 29 -19.349 0.120 -9.385 1.00 0.00 H new ATOM 0 HE1 MET A 29 -19.004 1.733 -13.694 1.00 0.00 H new ATOM 0 HE2 MET A 29 -20.626 1.335 -13.078 1.00 0.00 H new ATOM 0 HE3 MET A 29 -19.652 2.589 -12.274 1.00 0.00 H new ATOM 440 N SER A 30 -21.500 -1.445 -7.864 1.00 0.00 N ATOM 441 CA SER A 30 -20.715 -2.370 -7.062 1.00 0.00 C ATOM 442 C SER A 30 -19.682 -3.035 -7.966 1.00 0.00 C ATOM 443 O SER A 30 -19.995 -3.989 -8.680 1.00 0.00 O ATOM 444 CB SER A 30 -21.616 -3.440 -6.430 1.00 0.00 C ATOM 445 OG SER A 30 -22.730 -2.856 -5.768 1.00 0.00 O ATOM 0 H SER A 30 -22.220 -1.894 -8.431 1.00 0.00 H new ATOM 0 HA SER A 30 -20.221 -1.824 -6.258 1.00 0.00 H new ATOM 0 HB2 SER A 30 -21.968 -4.124 -7.202 1.00 0.00 H new ATOM 0 HB3 SER A 30 -21.038 -4.031 -5.720 1.00 0.00 H new ATOM 0 HG SER A 30 -23.285 -3.562 -5.377 1.00 0.00 H new ATOM 451 N HIS A 31 -18.465 -2.513 -7.969 1.00 0.00 N ATOM 452 CA HIS A 31 -17.463 -2.958 -8.926 1.00 0.00 C ATOM 453 C HIS A 31 -16.414 -3.845 -8.267 1.00 0.00 C ATOM 454 O HIS A 31 -15.545 -3.368 -7.535 1.00 0.00 O ATOM 455 CB HIS A 31 -16.793 -1.750 -9.595 1.00 0.00 C ATOM 456 CG HIS A 31 -15.881 -2.113 -10.730 1.00 0.00 C ATOM 457 ND1 HIS A 31 -16.215 -1.936 -12.055 1.00 0.00 N ATOM 458 CD2 HIS A 31 -14.637 -2.651 -10.729 1.00 0.00 C ATOM 459 CE1 HIS A 31 -15.221 -2.354 -12.817 1.00 0.00 C ATOM 460 NE2 HIS A 31 -14.249 -2.793 -12.038 1.00 0.00 N ATOM 0 H HIS A 31 -18.149 -1.787 -7.326 1.00 0.00 H new ATOM 0 HA HIS A 31 -17.970 -3.552 -9.686 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -17.566 -1.076 -9.964 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -16.223 -1.201 -8.845 1.00 0.00 H new ATOM 0 HD1 HIS A 31 -17.093 -1.543 -12.394 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -14.057 -2.919 -9.858 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -15.205 -2.339 -13.897 1.00 0.00 H new ATOM 469 N GLN A 32 -16.502 -5.139 -8.530 1.00 0.00 N ATOM 470 CA GLN A 32 -15.480 -6.071 -8.091 1.00 0.00 C ATOM 471 C GLN A 32 -14.344 -6.093 -9.108 1.00 0.00 C ATOM 472 O GLN A 32 -14.530 -5.705 -10.263 1.00 0.00 O ATOM 473 CB GLN A 32 -16.053 -7.485 -7.903 1.00 0.00 C ATOM 474 CG GLN A 32 -16.390 -8.212 -9.202 1.00 0.00 C ATOM 475 CD GLN A 32 -17.568 -7.608 -9.941 1.00 0.00 C ATOM 476 OE1 GLN A 32 -18.487 -7.062 -9.332 1.00 0.00 O ATOM 477 NE2 GLN A 32 -17.536 -7.682 -11.258 1.00 0.00 N ATOM 0 H GLN A 32 -17.271 -5.566 -9.046 1.00 0.00 H new ATOM 0 HA GLN A 32 -15.101 -5.738 -7.125 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -15.334 -8.083 -7.344 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -16.955 -7.419 -7.294 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -15.516 -8.200 -9.854 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -16.607 -9.257 -8.979 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -16.755 -8.144 -11.724 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -18.292 -7.277 -11.810 1.00 0.00 H new ATOM 486 N GLY A 33 -13.175 -6.534 -8.683 1.00 0.00 N ATOM 487 CA GLY A 33 -12.032 -6.553 -9.569 1.00 0.00 C ATOM 488 C GLY A 33 -11.013 -5.509 -9.181 1.00 0.00 C ATOM 489 O GLY A 33 -10.397 -5.608 -8.125 1.00 0.00 O ATOM 0 H GLY A 33 -12.995 -6.880 -7.740 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.570 -7.540 -9.547 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.361 -6.378 -10.593 1.00 0.00 H new ATOM 493 N SER A 34 -10.845 -4.495 -10.016 1.00 0.00 N ATOM 494 CA SER A 34 -9.903 -3.429 -9.719 1.00 0.00 C ATOM 495 C SER A 34 -10.331 -2.115 -10.363 1.00 0.00 C ATOM 496 O SER A 34 -11.081 -2.098 -11.344 1.00 0.00 O ATOM 497 CB SER A 34 -8.499 -3.817 -10.188 1.00 0.00 C ATOM 498 OG SER A 34 -8.515 -4.267 -11.532 1.00 0.00 O ATOM 0 H SER A 34 -11.345 -4.389 -10.899 1.00 0.00 H new ATOM 0 HA SER A 34 -9.890 -3.284 -8.639 1.00 0.00 H new ATOM 0 HB2 SER A 34 -7.832 -2.960 -10.096 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.101 -4.601 -9.544 1.00 0.00 H new ATOM 0 HG SER A 34 -8.286 -5.219 -11.561 1.00 0.00 H new ATOM 504 N LEU A 35 -9.863 -1.020 -9.788 1.00 0.00 N ATOM 505 CA LEU A 35 -10.134 0.309 -10.311 1.00 0.00 C ATOM 506 C LEU A 35 -8.833 1.083 -10.462 1.00 0.00 C ATOM 507 O LEU A 35 -7.976 1.052 -9.576 1.00 0.00 O ATOM 508 CB LEU A 35 -11.094 1.067 -9.391 1.00 0.00 C ATOM 509 CG LEU A 35 -12.528 0.536 -9.358 1.00 0.00 C ATOM 510 CD1 LEU A 35 -13.344 1.269 -8.307 1.00 0.00 C ATOM 511 CD2 LEU A 35 -13.179 0.680 -10.728 1.00 0.00 C ATOM 0 H LEU A 35 -9.286 -1.027 -8.947 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.604 0.207 -11.289 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.693 1.045 -8.378 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.119 2.112 -9.701 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.497 -0.522 -9.096 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.361 0.878 -8.298 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -12.890 1.123 -7.327 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -13.367 2.333 -8.541 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.199 0.298 -10.688 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.197 1.732 -11.014 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.608 0.114 -11.464 1.00 0.00 H new ATOM 523 N LEU A 36 -8.689 1.763 -11.585 1.00 0.00 N ATOM 524 CA LEU A 36 -7.492 2.533 -11.868 1.00 0.00 C ATOM 525 C LEU A 36 -7.820 4.019 -11.783 1.00 0.00 C ATOM 526 O LEU A 36 -8.482 4.572 -12.662 1.00 0.00 O ATOM 527 CB LEU A 36 -6.951 2.165 -13.259 1.00 0.00 C ATOM 528 CG LEU A 36 -5.468 2.477 -13.513 1.00 0.00 C ATOM 529 CD1 LEU A 36 -4.992 1.775 -14.773 1.00 0.00 C ATOM 530 CD2 LEU A 36 -5.232 3.976 -13.635 1.00 0.00 C ATOM 0 H LEU A 36 -9.393 1.797 -12.322 1.00 0.00 H new ATOM 0 HA LEU A 36 -6.720 2.303 -11.134 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.109 1.098 -13.417 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -7.545 2.689 -14.008 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.898 2.111 -12.659 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.940 2.004 -14.942 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -5.115 0.698 -14.658 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.579 2.118 -15.625 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.173 4.164 -13.814 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.817 4.370 -14.466 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.537 4.469 -12.712 1.00 0.00 H new ATOM 542 N PHE A 37 -7.376 4.647 -10.710 1.00 0.00 N ATOM 543 CA PHE A 37 -7.647 6.056 -10.481 1.00 0.00 C ATOM 544 C PHE A 37 -6.499 6.916 -10.989 1.00 0.00 C ATOM 545 O PHE A 37 -5.331 6.647 -10.706 1.00 0.00 O ATOM 546 CB PHE A 37 -7.868 6.328 -8.992 1.00 0.00 C ATOM 547 CG PHE A 37 -9.052 5.613 -8.403 1.00 0.00 C ATOM 548 CD1 PHE A 37 -10.309 6.194 -8.426 1.00 0.00 C ATOM 549 CD2 PHE A 37 -8.906 4.365 -7.821 1.00 0.00 C ATOM 550 CE1 PHE A 37 -11.398 5.546 -7.876 1.00 0.00 C ATOM 551 CE2 PHE A 37 -9.991 3.710 -7.272 1.00 0.00 C ATOM 552 CZ PHE A 37 -11.239 4.301 -7.300 1.00 0.00 C ATOM 0 H PHE A 37 -6.823 4.201 -9.978 1.00 0.00 H new ATOM 0 HA PHE A 37 -8.553 6.314 -11.029 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -6.972 6.036 -8.444 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -7.996 7.400 -8.845 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -10.439 7.165 -8.879 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -7.932 3.898 -7.796 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -12.372 6.012 -7.896 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -9.864 2.737 -6.821 1.00 0.00 H new ATOM 0 HZ PHE A 37 -12.089 3.790 -6.872 1.00 0.00 H new ATOM 562 N LEU A 38 -6.847 7.940 -11.743 1.00 0.00 N ATOM 563 CA LEU A 38 -5.892 8.920 -12.229 1.00 0.00 C ATOM 564 C LEU A 38 -6.257 10.288 -11.661 1.00 0.00 C ATOM 565 O LEU A 38 -7.393 10.489 -11.229 1.00 0.00 O ATOM 566 CB LEU A 38 -5.896 8.954 -13.765 1.00 0.00 C ATOM 567 CG LEU A 38 -5.369 7.690 -14.449 1.00 0.00 C ATOM 568 CD1 LEU A 38 -5.506 7.802 -15.960 1.00 0.00 C ATOM 569 CD2 LEU A 38 -3.917 7.445 -14.066 1.00 0.00 C ATOM 0 H LEU A 38 -7.807 8.118 -12.039 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.888 8.648 -11.902 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -6.916 9.133 -14.105 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.296 9.802 -14.095 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.966 6.843 -14.111 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.126 6.894 -16.428 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.556 7.933 -16.221 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.934 8.660 -16.315 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.558 6.543 -14.561 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.310 8.295 -14.377 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.842 7.321 -12.986 1.00 0.00 H new ATOM 581 N PRO A 39 -5.310 11.247 -11.660 1.00 0.00 N ATOM 582 CA PRO A 39 -5.518 12.584 -11.079 1.00 0.00 C ATOM 583 C PRO A 39 -6.831 13.252 -11.504 1.00 0.00 C ATOM 584 O PRO A 39 -7.406 14.035 -10.747 1.00 0.00 O ATOM 585 CB PRO A 39 -4.326 13.380 -11.608 1.00 0.00 C ATOM 586 CG PRO A 39 -3.252 12.366 -11.787 1.00 0.00 C ATOM 587 CD PRO A 39 -3.943 11.095 -12.200 1.00 0.00 C ATOM 0 HA PRO A 39 -5.587 12.532 -9.992 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -4.565 13.875 -12.549 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -4.025 14.158 -10.906 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -2.537 12.685 -12.545 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -2.693 12.223 -10.862 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -3.951 10.978 -13.284 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -3.445 10.217 -11.788 1.00 0.00 H new ATOM 595 N ASP A 40 -7.305 12.949 -12.709 1.00 0.00 N ATOM 596 CA ASP A 40 -8.536 13.554 -13.210 1.00 0.00 C ATOM 597 C ASP A 40 -9.426 12.532 -13.908 1.00 0.00 C ATOM 598 O ASP A 40 -10.324 12.901 -14.662 1.00 0.00 O ATOM 599 CB ASP A 40 -8.224 14.708 -14.173 1.00 0.00 C ATOM 600 CG ASP A 40 -7.434 14.276 -15.396 1.00 0.00 C ATOM 601 OD1 ASP A 40 -8.014 13.642 -16.301 1.00 0.00 O ATOM 602 OD2 ASP A 40 -6.228 14.596 -15.469 1.00 0.00 O ATOM 0 H ASP A 40 -6.860 12.294 -13.352 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.075 13.942 -12.345 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -9.159 15.164 -14.496 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -7.663 15.475 -13.639 1.00 0.00 H new ATOM 607 N ALA A 41 -9.214 11.253 -13.636 1.00 0.00 N ATOM 608 CA ALA A 41 -9.973 10.212 -14.318 1.00 0.00 C ATOM 609 C ALA A 41 -10.087 8.953 -13.475 1.00 0.00 C ATOM 610 O ALA A 41 -9.248 8.690 -12.626 1.00 0.00 O ATOM 611 CB ALA A 41 -9.332 9.880 -15.656 1.00 0.00 C ATOM 0 H ALA A 41 -8.533 10.913 -12.958 1.00 0.00 H new ATOM 0 HA ALA A 41 -10.979 10.598 -14.483 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -9.910 9.101 -16.153 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -9.312 10.772 -16.281 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -8.313 9.528 -15.494 1.00 0.00 H new ATOM 617 N VAL A 42 -11.141 8.190 -13.708 1.00 0.00 N ATOM 618 CA VAL A 42 -11.311 6.899 -13.066 1.00 0.00 C ATOM 619 C VAL A 42 -11.620 5.847 -14.123 1.00 0.00 C ATOM 620 O VAL A 42 -12.587 5.978 -14.877 1.00 0.00 O ATOM 621 CB VAL A 42 -12.445 6.921 -12.021 1.00 0.00 C ATOM 622 CG1 VAL A 42 -12.598 5.558 -11.358 1.00 0.00 C ATOM 623 CG2 VAL A 42 -12.198 8.000 -10.977 1.00 0.00 C ATOM 0 H VAL A 42 -11.897 8.446 -14.343 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.383 6.659 -12.548 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.375 7.154 -12.539 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -13.404 5.598 -10.625 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.833 4.810 -12.115 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.667 5.289 -10.859 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -13.011 7.996 -10.251 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.255 7.804 -10.467 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -12.151 8.974 -11.464 1.00 0.00 H new ATOM 633 N TRP A 43 -10.786 4.824 -14.196 1.00 0.00 N ATOM 634 CA TRP A 43 -10.947 3.782 -15.195 1.00 0.00 C ATOM 635 C TRP A 43 -11.145 2.424 -14.539 1.00 0.00 C ATOM 636 O TRP A 43 -10.556 2.132 -13.500 1.00 0.00 O ATOM 637 CB TRP A 43 -9.726 3.729 -16.117 1.00 0.00 C ATOM 638 CG TRP A 43 -9.504 4.991 -16.892 1.00 0.00 C ATOM 639 CD1 TRP A 43 -8.674 6.024 -16.561 1.00 0.00 C ATOM 640 CD2 TRP A 43 -10.122 5.354 -18.131 1.00 0.00 C ATOM 641 NE1 TRP A 43 -8.738 7.004 -17.521 1.00 0.00 N ATOM 642 CE2 TRP A 43 -9.619 6.617 -18.494 1.00 0.00 C ATOM 643 CE3 TRP A 43 -11.050 4.731 -18.970 1.00 0.00 C ATOM 644 CZ2 TRP A 43 -10.015 7.268 -19.659 1.00 0.00 C ATOM 645 CZ3 TRP A 43 -11.442 5.379 -20.126 1.00 0.00 C ATOM 646 CH2 TRP A 43 -10.925 6.636 -20.461 1.00 0.00 C ATOM 0 H TRP A 43 -9.989 4.693 -13.574 1.00 0.00 H new ATOM 0 HA TRP A 43 -11.833 4.021 -15.783 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.839 3.519 -15.519 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -9.844 2.900 -16.815 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.058 6.064 -15.675 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -8.214 7.879 -17.510 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -11.453 3.761 -18.720 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -9.618 8.238 -19.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -12.159 4.908 -20.782 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -11.251 7.117 -21.371 1.00 0.00 H new ATOM 657 N GLY A 44 -11.981 1.602 -15.146 1.00 0.00 N ATOM 658 CA GLY A 44 -12.133 0.238 -14.693 1.00 0.00 C ATOM 659 C GLY A 44 -10.962 -0.606 -15.140 1.00 0.00 C ATOM 660 O GLY A 44 -10.715 -0.743 -16.339 1.00 0.00 O ATOM 0 H GLY A 44 -12.559 1.855 -15.947 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -12.209 0.217 -13.606 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.060 -0.180 -15.086 1.00 0.00 H new ATOM 664 N TRP A 45 -10.222 -1.148 -14.190 1.00 0.00 N ATOM 665 CA TRP A 45 -9.031 -1.911 -14.513 1.00 0.00 C ATOM 666 C TRP A 45 -9.410 -3.367 -14.767 1.00 0.00 C ATOM 667 O TRP A 45 -10.273 -3.922 -14.086 1.00 0.00 O ATOM 668 CB TRP A 45 -8.009 -1.789 -13.380 1.00 0.00 C ATOM 669 CG TRP A 45 -6.582 -1.945 -13.825 1.00 0.00 C ATOM 670 CD1 TRP A 45 -6.100 -1.866 -15.102 1.00 0.00 C ATOM 671 CD2 TRP A 45 -5.449 -2.183 -12.983 1.00 0.00 C ATOM 672 NE1 TRP A 45 -4.739 -2.051 -15.104 1.00 0.00 N ATOM 673 CE2 TRP A 45 -4.316 -2.245 -13.816 1.00 0.00 C ATOM 674 CE3 TRP A 45 -5.281 -2.352 -11.607 1.00 0.00 C ATOM 675 CZ2 TRP A 45 -3.037 -2.470 -13.317 1.00 0.00 C ATOM 676 CZ3 TRP A 45 -4.012 -2.575 -11.113 1.00 0.00 C ATOM 677 CH2 TRP A 45 -2.903 -2.632 -11.967 1.00 0.00 C ATOM 0 H TRP A 45 -10.424 -1.074 -13.193 1.00 0.00 H new ATOM 0 HA TRP A 45 -8.574 -1.514 -15.419 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -8.126 -0.816 -12.902 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -8.228 -2.543 -12.624 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -6.701 -1.685 -15.981 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -4.141 -2.045 -15.930 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -6.130 -2.309 -10.941 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -2.181 -2.515 -13.973 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -3.871 -2.708 -10.050 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -1.922 -2.808 -11.550 1.00 0.00 H new ATOM 688 N ASP A 46 -8.767 -3.977 -15.752 1.00 0.00 N ATOM 689 CA ASP A 46 -9.149 -5.312 -16.210 1.00 0.00 C ATOM 690 C ASP A 46 -8.367 -6.393 -15.468 1.00 0.00 C ATOM 691 O ASP A 46 -8.420 -7.577 -15.801 1.00 0.00 O ATOM 692 CB ASP A 46 -8.913 -5.413 -17.721 1.00 0.00 C ATOM 693 CG ASP A 46 -9.475 -6.681 -18.328 1.00 0.00 C ATOM 694 OD1 ASP A 46 -10.709 -6.770 -18.479 1.00 0.00 O ATOM 695 OD2 ASP A 46 -8.684 -7.579 -18.687 1.00 0.00 O ATOM 0 H ASP A 46 -7.976 -3.571 -16.252 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.206 -5.470 -15.997 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.366 -4.551 -18.211 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -7.842 -5.366 -17.919 1.00 0.00 H new ATOM 700 N VAL A 47 -7.678 -5.976 -14.432 1.00 0.00 N ATOM 701 CA VAL A 47 -6.815 -6.868 -13.676 1.00 0.00 C ATOM 702 C VAL A 47 -7.569 -7.496 -12.513 1.00 0.00 C ATOM 703 O VAL A 47 -8.040 -6.803 -11.615 1.00 0.00 O ATOM 704 CB VAL A 47 -5.571 -6.120 -13.162 1.00 0.00 C ATOM 705 CG1 VAL A 47 -4.715 -7.012 -12.277 1.00 0.00 C ATOM 706 CG2 VAL A 47 -4.761 -5.608 -14.337 1.00 0.00 C ATOM 0 H VAL A 47 -7.696 -5.016 -14.087 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.489 -7.664 -14.346 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.903 -5.276 -12.557 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.845 -6.454 -11.931 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -5.300 -7.342 -11.418 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.385 -7.881 -12.847 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.881 -5.079 -13.970 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.447 -6.448 -14.956 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.372 -4.928 -14.931 1.00 0.00 H new ATOM 716 N THR A 48 -7.702 -8.809 -12.545 1.00 0.00 N ATOM 717 CA THR A 48 -8.413 -9.523 -11.499 1.00 0.00 C ATOM 718 C THR A 48 -7.427 -10.306 -10.631 1.00 0.00 C ATOM 719 O THR A 48 -7.800 -10.930 -9.640 1.00 0.00 O ATOM 720 CB THR A 48 -9.452 -10.485 -12.113 1.00 0.00 C ATOM 721 OG1 THR A 48 -10.050 -9.873 -13.268 1.00 0.00 O ATOM 722 CG2 THR A 48 -10.541 -10.830 -11.106 1.00 0.00 C ATOM 0 H THR A 48 -7.327 -9.404 -13.284 1.00 0.00 H new ATOM 0 HA THR A 48 -8.934 -8.795 -10.877 1.00 0.00 H new ATOM 0 HB THR A 48 -8.940 -11.404 -12.399 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.708 -10.485 -13.658 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.259 -11.509 -11.565 1.00 0.00 H new ATOM 0 HG22 THR A 48 -10.093 -11.310 -10.236 1.00 0.00 H new ATOM 0 HG23 THR A 48 -11.051 -9.918 -10.795 1.00 0.00 H new ATOM 730 N LYS A 49 -6.158 -10.258 -11.015 1.00 0.00 N ATOM 731 CA LYS A 49 -5.115 -10.981 -10.305 1.00 0.00 C ATOM 732 C LYS A 49 -3.973 -10.037 -9.952 1.00 0.00 C ATOM 733 O LYS A 49 -3.422 -9.380 -10.826 1.00 0.00 O ATOM 734 CB LYS A 49 -4.585 -12.126 -11.174 1.00 0.00 C ATOM 735 CG LYS A 49 -5.677 -12.988 -11.786 1.00 0.00 C ATOM 736 CD LYS A 49 -5.100 -14.065 -12.687 1.00 0.00 C ATOM 737 CE LYS A 49 -6.197 -14.850 -13.386 1.00 0.00 C ATOM 738 NZ LYS A 49 -6.929 -14.027 -14.388 1.00 0.00 N ATOM 0 H LYS A 49 -5.827 -9.723 -11.818 1.00 0.00 H new ATOM 0 HA LYS A 49 -5.536 -11.393 -9.388 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.973 -11.709 -11.974 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.933 -12.757 -10.570 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.263 -13.452 -10.992 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.359 -12.360 -12.359 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.447 -13.608 -13.431 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -4.484 -14.744 -12.097 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.761 -15.718 -13.881 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -6.901 -15.226 -12.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -7.509 -14.647 -14.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -7.544 -13.347 -13.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -6.246 -13.512 -14.979 1.00 0.00 H new ATOM 752 N PRO A 50 -3.607 -9.944 -8.668 1.00 0.00 N ATOM 753 CA PRO A 50 -2.503 -9.085 -8.221 1.00 0.00 C ATOM 754 C PRO A 50 -1.195 -9.367 -8.966 1.00 0.00 C ATOM 755 O PRO A 50 -0.468 -8.444 -9.327 1.00 0.00 O ATOM 756 CB PRO A 50 -2.365 -9.427 -6.738 1.00 0.00 C ATOM 757 CG PRO A 50 -3.709 -9.933 -6.338 1.00 0.00 C ATOM 758 CD PRO A 50 -4.254 -10.644 -7.543 1.00 0.00 C ATOM 0 HA PRO A 50 -2.707 -8.031 -8.412 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.594 -10.180 -6.576 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.082 -8.551 -6.154 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.635 -10.609 -5.486 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -4.362 -9.113 -6.039 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -4.004 -11.705 -7.532 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -5.340 -10.573 -7.596 1.00 0.00 H new ATOM 766 N GLU A 51 -0.919 -10.643 -9.223 1.00 0.00 N ATOM 767 CA GLU A 51 0.319 -11.046 -9.893 1.00 0.00 C ATOM 768 C GLU A 51 0.172 -10.942 -11.421 1.00 0.00 C ATOM 769 O GLU A 51 1.029 -11.397 -12.180 1.00 0.00 O ATOM 770 CB GLU A 51 0.677 -12.483 -9.487 1.00 0.00 C ATOM 771 CG GLU A 51 2.124 -12.875 -9.749 1.00 0.00 C ATOM 772 CD GLU A 51 3.109 -12.136 -8.865 1.00 0.00 C ATOM 773 OE1 GLU A 51 3.410 -12.628 -7.757 1.00 0.00 O ATOM 774 OE2 GLU A 51 3.594 -11.062 -9.271 1.00 0.00 O ATOM 0 H GLU A 51 -1.535 -11.418 -8.978 1.00 0.00 H new ATOM 0 HA GLU A 51 1.121 -10.374 -9.586 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.467 -12.609 -8.425 1.00 0.00 H new ATOM 0 HB3 GLU A 51 0.025 -13.171 -10.025 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.238 -13.948 -9.592 1.00 0.00 H new ATOM 0 HG3 GLU A 51 2.364 -12.678 -10.794 1.00 0.00 H new ATOM 781 N GLN A 52 -0.925 -10.339 -11.866 1.00 0.00 N ATOM 782 CA GLN A 52 -1.183 -10.155 -13.293 1.00 0.00 C ATOM 783 C GLN A 52 -0.622 -8.814 -13.768 1.00 0.00 C ATOM 784 O GLN A 52 -0.560 -8.534 -14.965 1.00 0.00 O ATOM 785 CB GLN A 52 -2.694 -10.243 -13.559 1.00 0.00 C ATOM 786 CG GLN A 52 -3.114 -9.892 -14.977 1.00 0.00 C ATOM 787 CD GLN A 52 -4.618 -9.932 -15.168 1.00 0.00 C ATOM 788 OE1 GLN A 52 -5.387 -9.730 -14.226 1.00 0.00 O ATOM 789 NE2 GLN A 52 -5.045 -10.170 -16.397 1.00 0.00 N ATOM 0 H GLN A 52 -1.654 -9.967 -11.257 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.682 -10.945 -13.853 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -3.029 -11.256 -13.336 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.210 -9.577 -12.867 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -2.747 -8.896 -15.224 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -2.645 -10.587 -15.673 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.374 -10.332 -17.148 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -6.046 -10.191 -16.594 1.00 0.00 H new ATOM 798 N ILE A 53 -0.194 -7.993 -12.821 1.00 0.00 N ATOM 799 CA ILE A 53 0.344 -6.680 -13.140 1.00 0.00 C ATOM 800 C ILE A 53 1.676 -6.802 -13.884 1.00 0.00 C ATOM 801 O ILE A 53 2.708 -7.144 -13.301 1.00 0.00 O ATOM 802 CB ILE A 53 0.517 -5.823 -11.869 1.00 0.00 C ATOM 803 CG1 ILE A 53 -0.842 -5.641 -11.180 1.00 0.00 C ATOM 804 CG2 ILE A 53 1.131 -4.473 -12.210 1.00 0.00 C ATOM 805 CD1 ILE A 53 -0.781 -4.831 -9.902 1.00 0.00 C ATOM 0 H ILE A 53 -0.209 -8.213 -11.825 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.373 -6.180 -13.792 1.00 0.00 H new ATOM 0 HB ILE A 53 1.194 -6.336 -11.186 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.527 -5.155 -11.874 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.259 -6.623 -10.956 1.00 0.00 H new ATOM 0 HG21 ILE A 53 1.244 -3.884 -11.300 1.00 0.00 H new ATOM 0 HG22 ILE A 53 2.108 -4.623 -12.669 1.00 0.00 H new ATOM 0 HG23 ILE A 53 0.481 -3.943 -12.906 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.781 -4.748 -9.476 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.123 -5.326 -9.188 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.396 -3.835 -10.120 1.00 0.00 H new ATOM 817 N ASP A 54 1.629 -6.539 -15.184 1.00 0.00 N ATOM 818 CA ASP A 54 2.799 -6.638 -16.045 1.00 0.00 C ATOM 819 C ASP A 54 2.942 -5.368 -16.880 1.00 0.00 C ATOM 820 O ASP A 54 2.247 -4.380 -16.635 1.00 0.00 O ATOM 821 CB ASP A 54 2.684 -7.860 -16.968 1.00 0.00 C ATOM 822 CG ASP A 54 1.766 -7.627 -18.158 1.00 0.00 C ATOM 823 OD1 ASP A 54 0.535 -7.570 -17.969 1.00 0.00 O ATOM 824 OD2 ASP A 54 2.278 -7.506 -19.295 1.00 0.00 O ATOM 0 H ASP A 54 0.780 -6.251 -15.670 1.00 0.00 H new ATOM 0 HA ASP A 54 3.683 -6.755 -15.418 1.00 0.00 H new ATOM 0 HB2 ASP A 54 3.676 -8.129 -17.330 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.314 -8.709 -16.392 1.00 0.00 H new ATOM 829 N ARG A 55 3.827 -5.412 -17.871 1.00 0.00 N ATOM 830 CA ARG A 55 4.097 -4.268 -18.736 1.00 0.00 C ATOM 831 C ARG A 55 2.828 -3.808 -19.453 1.00 0.00 C ATOM 832 O ARG A 55 2.545 -2.612 -19.533 1.00 0.00 O ATOM 833 CB ARG A 55 5.158 -4.646 -19.770 1.00 0.00 C ATOM 834 CG ARG A 55 5.908 -3.461 -20.358 1.00 0.00 C ATOM 835 CD ARG A 55 6.860 -2.851 -19.341 1.00 0.00 C ATOM 836 NE ARG A 55 7.758 -3.857 -18.767 1.00 0.00 N ATOM 837 CZ ARG A 55 9.060 -3.676 -18.566 1.00 0.00 C ATOM 838 NH1 ARG A 55 9.632 -2.519 -18.883 1.00 0.00 N ATOM 839 NH2 ARG A 55 9.793 -4.659 -18.048 1.00 0.00 N ATOM 0 H ARG A 55 4.377 -6.241 -18.097 1.00 0.00 H new ATOM 0 HA ARG A 55 4.458 -3.448 -18.115 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.876 -5.322 -19.306 1.00 0.00 H new ATOM 0 HB3 ARG A 55 4.680 -5.197 -20.580 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.468 -3.782 -21.237 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.196 -2.706 -20.691 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.449 -2.068 -19.818 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.287 -2.378 -18.544 1.00 0.00 H new ATOM 0 HE ARG A 55 7.357 -4.757 -18.504 1.00 0.00 H new ATOM 0 HH11 ARG A 55 9.072 -1.766 -19.282 1.00 0.00 H new ATOM 0 HH12 ARG A 55 10.631 -2.384 -18.727 1.00 0.00 H new ATOM 0 HH21 ARG A 55 9.356 -5.548 -17.806 1.00 0.00 H new ATOM 0 HH22 ARG A 55 10.792 -4.523 -17.893 1.00 0.00 H new ATOM 853 N TYR A 56 2.058 -4.768 -19.955 1.00 0.00 N ATOM 854 CA TYR A 56 0.854 -4.464 -20.720 1.00 0.00 C ATOM 855 C TYR A 56 -0.303 -4.136 -19.784 1.00 0.00 C ATOM 856 O TYR A 56 -1.184 -3.348 -20.117 1.00 0.00 O ATOM 857 CB TYR A 56 0.489 -5.643 -21.630 1.00 0.00 C ATOM 858 CG TYR A 56 -0.684 -5.372 -22.548 1.00 0.00 C ATOM 859 CD1 TYR A 56 -0.542 -4.561 -23.667 1.00 0.00 C ATOM 860 CD2 TYR A 56 -1.930 -5.933 -22.299 1.00 0.00 C ATOM 861 CE1 TYR A 56 -1.609 -4.315 -24.511 1.00 0.00 C ATOM 862 CE2 TYR A 56 -3.002 -5.691 -23.137 1.00 0.00 C ATOM 863 CZ TYR A 56 -2.837 -4.883 -24.241 1.00 0.00 C ATOM 864 OH TYR A 56 -3.901 -4.647 -25.084 1.00 0.00 O ATOM 0 H TYR A 56 2.247 -5.764 -19.846 1.00 0.00 H new ATOM 0 HA TYR A 56 1.051 -3.592 -21.344 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.357 -5.905 -22.235 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.259 -6.510 -21.010 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.418 -4.115 -23.881 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -2.063 -6.569 -21.436 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -1.482 -3.682 -25.377 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -3.965 -6.133 -22.928 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.692 -5.121 -24.753 1.00 0.00 H new ATOM 874 N SER A 57 -0.293 -4.748 -18.611 1.00 0.00 N ATOM 875 CA SER A 57 -1.287 -4.460 -17.587 1.00 0.00 C ATOM 876 C SER A 57 -1.208 -2.992 -17.174 1.00 0.00 C ATOM 877 O SER A 57 -2.228 -2.338 -16.934 1.00 0.00 O ATOM 878 CB SER A 57 -1.056 -5.373 -16.382 1.00 0.00 C ATOM 879 OG SER A 57 -1.940 -5.077 -15.323 1.00 0.00 O ATOM 0 H SER A 57 0.396 -5.451 -18.342 1.00 0.00 H new ATOM 0 HA SER A 57 -2.284 -4.647 -17.987 1.00 0.00 H new ATOM 0 HB2 SER A 57 -1.185 -6.412 -16.684 1.00 0.00 H new ATOM 0 HB3 SER A 57 -0.027 -5.267 -16.037 1.00 0.00 H new ATOM 0 HG SER A 57 -1.477 -4.531 -14.653 1.00 0.00 H new ATOM 885 N LEU A 58 0.011 -2.468 -17.131 1.00 0.00 N ATOM 886 CA LEU A 58 0.239 -1.081 -16.762 1.00 0.00 C ATOM 887 C LEU A 58 0.295 -0.188 -17.999 1.00 0.00 C ATOM 888 O LEU A 58 0.890 0.889 -17.965 1.00 0.00 O ATOM 889 CB LEU A 58 1.539 -0.954 -15.968 1.00 0.00 C ATOM 890 CG LEU A 58 1.564 -1.704 -14.636 1.00 0.00 C ATOM 891 CD1 LEU A 58 2.904 -1.517 -13.949 1.00 0.00 C ATOM 892 CD2 LEU A 58 0.434 -1.229 -13.736 1.00 0.00 C ATOM 0 H LEU A 58 0.860 -2.989 -17.349 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.594 -0.754 -16.140 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.360 -1.316 -16.586 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.727 0.102 -15.776 1.00 0.00 H new ATOM 0 HG LEU A 58 1.422 -2.766 -14.835 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.906 -2.057 -13.002 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.698 -1.903 -14.589 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.072 -0.456 -13.762 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.467 -1.774 -12.792 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.546 -0.162 -13.543 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.522 -1.411 -14.226 1.00 0.00 H new ATOM 904 N GLN A 59 -0.345 -0.634 -19.078 1.00 0.00 N ATOM 905 CA GLN A 59 -0.413 0.134 -20.321 1.00 0.00 C ATOM 906 C GLN A 59 -0.910 1.551 -20.054 1.00 0.00 C ATOM 907 O GLN A 59 -0.352 2.523 -20.556 1.00 0.00 O ATOM 908 CB GLN A 59 -1.358 -0.560 -21.307 1.00 0.00 C ATOM 909 CG GLN A 59 -1.513 0.157 -22.638 1.00 0.00 C ATOM 910 CD GLN A 59 -2.614 -0.447 -23.488 1.00 0.00 C ATOM 911 OE1 GLN A 59 -3.598 -0.973 -22.968 1.00 0.00 O ATOM 912 NE2 GLN A 59 -2.464 -0.369 -24.800 1.00 0.00 N ATOM 0 H GLN A 59 -0.828 -1.531 -19.117 1.00 0.00 H new ATOM 0 HA GLN A 59 0.589 0.189 -20.747 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -0.992 -1.570 -21.493 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -2.340 -0.657 -20.844 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.731 1.210 -22.459 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.570 0.115 -23.184 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.634 0.075 -25.193 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -3.178 -0.753 -25.419 1.00 0.00 H new ATOM 921 N ARG A 60 -1.947 1.654 -19.234 1.00 0.00 N ATOM 922 CA ARG A 60 -2.562 2.938 -18.921 1.00 0.00 C ATOM 923 C ARG A 60 -1.669 3.758 -17.994 1.00 0.00 C ATOM 924 O ARG A 60 -1.778 4.981 -17.932 1.00 0.00 O ATOM 925 CB ARG A 60 -3.932 2.708 -18.283 1.00 0.00 C ATOM 926 CG ARG A 60 -4.855 1.873 -19.155 1.00 0.00 C ATOM 927 CD ARG A 60 -6.135 1.488 -18.433 1.00 0.00 C ATOM 928 NE ARG A 60 -6.908 0.512 -19.200 1.00 0.00 N ATOM 929 CZ ARG A 60 -8.066 -0.012 -18.806 1.00 0.00 C ATOM 930 NH1 ARG A 60 -8.613 0.358 -17.654 1.00 0.00 N ATOM 931 NH2 ARG A 60 -8.675 -0.908 -19.571 1.00 0.00 N ATOM 0 H ARG A 60 -2.383 0.857 -18.770 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.688 3.502 -19.845 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.801 2.212 -17.321 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -4.401 3.671 -18.084 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -5.103 2.432 -20.057 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -4.333 0.970 -19.472 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.892 1.074 -17.455 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -6.739 2.379 -18.261 1.00 0.00 H new ATOM 0 HE ARG A 60 -6.533 0.212 -20.100 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -8.145 1.048 -17.066 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.501 -0.047 -17.358 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.256 -1.192 -20.456 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -9.563 -1.313 -19.274 1.00 0.00 H new ATOM 945 N VAL A 61 -0.772 3.076 -17.292 1.00 0.00 N ATOM 946 CA VAL A 61 0.151 3.738 -16.382 1.00 0.00 C ATOM 947 C VAL A 61 1.326 4.325 -17.156 1.00 0.00 C ATOM 948 O VAL A 61 1.689 5.480 -16.959 1.00 0.00 O ATOM 949 CB VAL A 61 0.669 2.770 -15.296 1.00 0.00 C ATOM 950 CG1 VAL A 61 1.653 3.465 -14.367 1.00 0.00 C ATOM 951 CG2 VAL A 61 -0.495 2.191 -14.507 1.00 0.00 C ATOM 0 H VAL A 61 -0.665 2.063 -17.337 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.393 4.542 -15.886 1.00 0.00 H new ATOM 0 HB VAL A 61 1.196 1.954 -15.791 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.001 2.760 -13.612 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.503 3.829 -14.944 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.160 4.305 -13.878 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.115 1.510 -13.745 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.048 2.999 -14.029 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.157 1.648 -15.181 1.00 0.00 H new ATOM 961 N PHE A 62 1.905 3.528 -18.051 1.00 0.00 N ATOM 962 CA PHE A 62 2.994 4.002 -18.903 1.00 0.00 C ATOM 963 C PHE A 62 2.486 5.069 -19.865 1.00 0.00 C ATOM 964 O PHE A 62 3.209 6.005 -20.209 1.00 0.00 O ATOM 965 CB PHE A 62 3.618 2.847 -19.695 1.00 0.00 C ATOM 966 CG PHE A 62 4.402 1.878 -18.855 1.00 0.00 C ATOM 967 CD1 PHE A 62 5.641 2.230 -18.345 1.00 0.00 C ATOM 968 CD2 PHE A 62 3.904 0.615 -18.581 1.00 0.00 C ATOM 969 CE1 PHE A 62 6.368 1.342 -17.576 1.00 0.00 C ATOM 970 CE2 PHE A 62 4.626 -0.278 -17.813 1.00 0.00 C ATOM 971 CZ PHE A 62 5.860 0.086 -17.310 1.00 0.00 C ATOM 0 H PHE A 62 1.640 2.555 -18.205 1.00 0.00 H new ATOM 0 HA PHE A 62 3.760 4.433 -18.258 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.826 2.305 -20.211 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.274 3.259 -20.462 1.00 0.00 H new ATOM 0 HD1 PHE A 62 6.044 3.211 -18.551 1.00 0.00 H new ATOM 0 HD2 PHE A 62 2.940 0.325 -18.972 1.00 0.00 H new ATOM 0 HE1 PHE A 62 7.332 1.630 -17.184 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.226 -1.260 -17.606 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.426 -0.611 -16.710 1.00 0.00 H new ATOM 981 N ASP A 63 1.238 4.911 -20.291 1.00 0.00 N ATOM 982 CA ASP A 63 0.589 5.858 -21.196 1.00 0.00 C ATOM 983 C ASP A 63 0.588 7.265 -20.615 1.00 0.00 C ATOM 984 O ASP A 63 1.070 8.208 -21.240 1.00 0.00 O ATOM 985 CB ASP A 63 -0.854 5.419 -21.466 1.00 0.00 C ATOM 986 CG ASP A 63 -1.596 6.359 -22.396 1.00 0.00 C ATOM 987 OD1 ASP A 63 -2.215 7.328 -21.907 1.00 0.00 O ATOM 988 OD2 ASP A 63 -1.579 6.121 -23.620 1.00 0.00 O ATOM 0 H ASP A 63 0.647 4.125 -20.021 1.00 0.00 H new ATOM 0 HA ASP A 63 1.153 5.869 -22.129 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.848 4.419 -21.899 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.391 5.354 -20.520 1.00 0.00 H new ATOM 993 N ASN A 64 0.058 7.395 -19.411 1.00 0.00 N ATOM 994 CA ASN A 64 -0.106 8.697 -18.780 1.00 0.00 C ATOM 995 C ASN A 64 0.887 8.888 -17.641 1.00 0.00 C ATOM 996 O ASN A 64 0.620 9.617 -16.687 1.00 0.00 O ATOM 997 CB ASN A 64 -1.541 8.838 -18.270 1.00 0.00 C ATOM 998 CG ASN A 64 -2.346 9.842 -19.071 1.00 0.00 C ATOM 999 OD1 ASN A 64 -2.486 10.998 -18.678 1.00 0.00 O ATOM 1000 ND2 ASN A 64 -2.862 9.418 -20.216 1.00 0.00 N ATOM 0 H ASN A 64 -0.268 6.611 -18.846 1.00 0.00 H new ATOM 0 HA ASN A 64 0.093 9.471 -19.521 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -2.034 7.867 -18.310 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -1.523 9.143 -17.224 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.396 10.059 -20.803 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.725 8.451 -20.510 1.00 0.00 H new ATOM 1007 N ALA A 65 2.052 8.256 -17.770 1.00 0.00 N ATOM 1008 CA ALA A 65 3.096 8.327 -16.745 1.00 0.00 C ATOM 1009 C ALA A 65 3.540 9.764 -16.494 1.00 0.00 C ATOM 1010 O ALA A 65 3.923 10.122 -15.381 1.00 0.00 O ATOM 1011 CB ALA A 65 4.287 7.470 -17.150 1.00 0.00 C ATOM 0 H ALA A 65 2.299 7.685 -18.579 1.00 0.00 H new ATOM 0 HA ALA A 65 2.677 7.943 -15.815 1.00 0.00 H new ATOM 0 HB1 ALA A 65 5.057 7.530 -16.381 1.00 0.00 H new ATOM 0 HB2 ALA A 65 3.968 6.434 -17.264 1.00 0.00 H new ATOM 0 HB3 ALA A 65 4.690 7.831 -18.096 1.00 0.00 H new ATOM 1017 N ASN A 66 3.467 10.588 -17.532 1.00 0.00 N ATOM 1018 CA ASN A 66 3.848 11.993 -17.432 1.00 0.00 C ATOM 1019 C ASN A 66 2.957 12.746 -16.443 1.00 0.00 C ATOM 1020 O ASN A 66 3.359 13.766 -15.881 1.00 0.00 O ATOM 1021 CB ASN A 66 3.787 12.665 -18.810 1.00 0.00 C ATOM 1022 CG ASN A 66 2.400 12.626 -19.428 1.00 0.00 C ATOM 1023 OD1 ASN A 66 1.583 13.519 -19.207 1.00 0.00 O ATOM 1024 ND2 ASN A 66 2.131 11.597 -20.219 1.00 0.00 N ATOM 0 H ASN A 66 3.146 10.306 -18.458 1.00 0.00 H new ATOM 0 HA ASN A 66 4.872 12.031 -17.061 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.108 13.702 -18.717 1.00 0.00 H new ATOM 0 HB3 ASN A 66 4.491 12.172 -19.480 1.00 0.00 H new ATOM 0 HD21 ASN A 66 1.219 11.525 -20.670 1.00 0.00 H new ATOM 0 HD22 ASN A 66 2.836 10.877 -20.377 1.00 0.00 H new ATOM 1031 N ALA A 67 1.758 12.229 -16.212 1.00 0.00 N ATOM 1032 CA ALA A 67 0.811 12.866 -15.308 1.00 0.00 C ATOM 1033 C ALA A 67 0.844 12.212 -13.930 1.00 0.00 C ATOM 1034 O ALA A 67 0.123 12.617 -13.018 1.00 0.00 O ATOM 1035 CB ALA A 67 -0.592 12.802 -15.889 1.00 0.00 C ATOM 0 H ALA A 67 1.418 11.368 -16.640 1.00 0.00 H new ATOM 0 HA ALA A 67 1.100 13.911 -15.193 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -1.292 13.281 -15.204 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.612 13.318 -16.849 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.880 11.760 -16.031 1.00 0.00 H new ATOM 1041 N ILE A 68 1.692 11.207 -13.782 1.00 0.00 N ATOM 1042 CA ILE A 68 1.762 10.449 -12.545 1.00 0.00 C ATOM 1043 C ILE A 68 3.052 10.756 -11.788 1.00 0.00 C ATOM 1044 O ILE A 68 4.126 10.868 -12.381 1.00 0.00 O ATOM 1045 CB ILE A 68 1.673 8.929 -12.816 1.00 0.00 C ATOM 1046 CG1 ILE A 68 0.380 8.599 -13.572 1.00 0.00 C ATOM 1047 CG2 ILE A 68 1.736 8.146 -11.511 1.00 0.00 C ATOM 1048 CD1 ILE A 68 0.249 7.139 -13.952 1.00 0.00 C ATOM 0 H ILE A 68 2.342 10.898 -14.505 1.00 0.00 H new ATOM 0 HA ILE A 68 0.911 10.748 -11.933 1.00 0.00 H new ATOM 0 HB ILE A 68 2.524 8.639 -13.432 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.473 8.882 -12.955 1.00 0.00 H new ATOM 0 HG13 ILE A 68 0.334 9.206 -14.476 1.00 0.00 H new ATOM 0 HG21 ILE A 68 1.672 7.079 -11.724 1.00 0.00 H new ATOM 0 HG22 ILE A 68 2.677 8.359 -11.004 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.904 8.439 -10.870 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.690 6.984 -14.483 1.00 0.00 H new ATOM 0 HD12 ILE A 68 1.081 6.855 -14.596 1.00 0.00 H new ATOM 0 HD13 ILE A 68 0.262 6.526 -13.051 1.00 0.00 H new ATOM 1060 N ASP A 69 2.923 10.933 -10.482 1.00 0.00 N ATOM 1061 CA ASP A 69 4.075 11.069 -9.600 1.00 0.00 C ATOM 1062 C ASP A 69 4.086 9.908 -8.619 1.00 0.00 C ATOM 1063 O ASP A 69 5.001 9.088 -8.613 1.00 0.00 O ATOM 1064 CB ASP A 69 4.024 12.401 -8.842 1.00 0.00 C ATOM 1065 CG ASP A 69 5.091 12.517 -7.765 1.00 0.00 C ATOM 1066 OD1 ASP A 69 4.884 11.978 -6.655 1.00 0.00 O ATOM 1067 OD2 ASP A 69 6.128 13.169 -8.014 1.00 0.00 O ATOM 0 H ASP A 69 2.023 10.986 -10.005 1.00 0.00 H new ATOM 0 HA ASP A 69 4.987 11.056 -10.197 1.00 0.00 H new ATOM 0 HB2 ASP A 69 4.142 13.220 -9.551 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.041 12.514 -8.385 1.00 0.00 H new ATOM 1072 N THR A 70 3.037 9.829 -7.816 1.00 0.00 N ATOM 1073 CA THR A 70 2.907 8.777 -6.825 1.00 0.00 C ATOM 1074 C THR A 70 1.884 7.739 -7.283 1.00 0.00 C ATOM 1075 O THR A 70 0.754 8.086 -7.635 1.00 0.00 O ATOM 1076 CB THR A 70 2.468 9.365 -5.470 1.00 0.00 C ATOM 1077 OG1 THR A 70 3.328 10.459 -5.108 1.00 0.00 O ATOM 1078 CG2 THR A 70 2.502 8.307 -4.377 1.00 0.00 C ATOM 0 H THR A 70 2.258 10.487 -7.833 1.00 0.00 H new ATOM 0 HA THR A 70 3.879 8.297 -6.709 1.00 0.00 H new ATOM 0 HB THR A 70 1.443 9.723 -5.573 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.897 10.694 -5.871 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.188 8.750 -3.432 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.827 7.492 -4.638 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.516 7.920 -4.277 1.00 0.00 H new ATOM 1086 N LEU A 71 2.285 6.475 -7.295 1.00 0.00 N ATOM 1087 CA LEU A 71 1.389 5.395 -7.678 1.00 0.00 C ATOM 1088 C LEU A 71 1.085 4.513 -6.475 1.00 0.00 C ATOM 1089 O LEU A 71 1.941 3.752 -6.011 1.00 0.00 O ATOM 1090 CB LEU A 71 1.997 4.559 -8.809 1.00 0.00 C ATOM 1091 CG LEU A 71 1.118 3.412 -9.319 1.00 0.00 C ATOM 1092 CD1 LEU A 71 -0.188 3.945 -9.887 1.00 0.00 C ATOM 1093 CD2 LEU A 71 1.858 2.598 -10.370 1.00 0.00 C ATOM 0 H LEU A 71 3.226 6.173 -7.043 1.00 0.00 H new ATOM 0 HA LEU A 71 0.458 5.833 -8.039 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.225 5.220 -9.645 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.944 4.144 -8.463 1.00 0.00 H new ATOM 0 HG LEU A 71 0.886 2.762 -8.476 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -0.796 3.113 -10.243 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.730 4.484 -9.110 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.024 4.620 -10.716 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.218 1.788 -10.720 1.00 0.00 H new ATOM 0 HD22 LEU A 71 2.121 3.241 -11.210 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.766 2.180 -9.934 1.00 0.00 H new ATOM 1105 N ILE A 72 -0.130 4.630 -5.969 1.00 0.00 N ATOM 1106 CA ILE A 72 -0.559 3.855 -4.817 1.00 0.00 C ATOM 1107 C ILE A 72 -1.267 2.590 -5.278 1.00 0.00 C ATOM 1108 O ILE A 72 -2.337 2.656 -5.883 1.00 0.00 O ATOM 1109 CB ILE A 72 -1.515 4.669 -3.918 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -0.870 5.999 -3.520 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -1.894 3.868 -2.679 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -1.799 6.918 -2.759 1.00 0.00 C ATOM 0 H ILE A 72 -0.842 5.259 -6.341 1.00 0.00 H new ATOM 0 HA ILE A 72 0.329 3.598 -4.239 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.424 4.880 -4.482 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.010 5.798 -2.909 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.524 6.509 -4.419 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.568 4.457 -2.057 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.391 2.946 -2.980 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.995 3.627 -2.112 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.275 7.841 -2.510 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.668 7.149 -3.376 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.125 6.427 -1.842 1.00 0.00 H new ATOM 1124 N VAL A 73 -0.664 1.444 -5.017 1.00 0.00 N ATOM 1125 CA VAL A 73 -1.250 0.179 -5.421 1.00 0.00 C ATOM 1126 C VAL A 73 -1.786 -0.579 -4.216 1.00 0.00 C ATOM 1127 O VAL A 73 -1.030 -0.953 -3.317 1.00 0.00 O ATOM 1128 CB VAL A 73 -0.235 -0.704 -6.177 1.00 0.00 C ATOM 1129 CG1 VAL A 73 -0.861 -2.035 -6.573 1.00 0.00 C ATOM 1130 CG2 VAL A 73 0.289 0.023 -7.406 1.00 0.00 C ATOM 0 H VAL A 73 0.228 1.363 -4.529 1.00 0.00 H new ATOM 0 HA VAL A 73 -2.074 0.410 -6.096 1.00 0.00 H new ATOM 0 HB VAL A 73 0.602 -0.908 -5.509 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.126 -2.639 -7.104 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.187 -2.564 -5.678 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.719 -1.855 -7.221 1.00 0.00 H new ATOM 0 HG21 VAL A 73 1.004 -0.613 -7.928 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.542 0.258 -8.072 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.781 0.946 -7.100 1.00 0.00 H new ATOM 1140 N GLY A 74 -3.096 -0.785 -4.200 1.00 0.00 N ATOM 1141 CA GLY A 74 -3.719 -1.570 -3.159 1.00 0.00 C ATOM 1142 C GLY A 74 -3.886 -3.003 -3.604 1.00 0.00 C ATOM 1143 O GLY A 74 -4.702 -3.291 -4.479 1.00 0.00 O ATOM 0 H GLY A 74 -3.742 -0.417 -4.898 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.112 -1.533 -2.255 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.691 -1.146 -2.908 1.00 0.00 H new ATOM 1147 N THR A 75 -3.114 -3.897 -3.011 1.00 0.00 N ATOM 1148 CA THR A 75 -3.051 -5.279 -3.462 1.00 0.00 C ATOM 1149 C THR A 75 -4.106 -6.153 -2.787 1.00 0.00 C ATOM 1150 O THR A 75 -4.051 -7.383 -2.869 1.00 0.00 O ATOM 1151 CB THR A 75 -1.651 -5.858 -3.206 1.00 0.00 C ATOM 1152 OG1 THR A 75 -1.342 -5.815 -1.806 1.00 0.00 O ATOM 1153 CG2 THR A 75 -0.604 -5.071 -3.977 1.00 0.00 C ATOM 0 H THR A 75 -2.517 -3.690 -2.210 1.00 0.00 H new ATOM 0 HA THR A 75 -3.257 -5.280 -4.532 1.00 0.00 H new ATOM 0 HB THR A 75 -1.643 -6.894 -3.545 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.617 -6.656 -1.384 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.383 -5.493 -3.785 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.821 -5.125 -5.044 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.622 -4.030 -3.655 1.00 0.00 H new ATOM 1161 N GLY A 76 -5.063 -5.517 -2.132 1.00 0.00 N ATOM 1162 CA GLY A 76 -6.134 -6.248 -1.492 1.00 0.00 C ATOM 1163 C GLY A 76 -5.855 -6.524 -0.031 1.00 0.00 C ATOM 1164 O GLY A 76 -5.328 -5.667 0.683 1.00 0.00 O ATOM 0 H GLY A 76 -5.117 -4.503 -2.032 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -7.060 -5.681 -1.581 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.287 -7.193 -2.014 1.00 0.00 H new ATOM 1168 N ALA A 77 -6.200 -7.728 0.406 1.00 0.00 N ATOM 1169 CA ALA A 77 -6.055 -8.112 1.803 1.00 0.00 C ATOM 1170 C ALA A 77 -4.594 -8.365 2.155 1.00 0.00 C ATOM 1171 O ALA A 77 -4.095 -7.880 3.171 1.00 0.00 O ATOM 1172 CB ALA A 77 -6.892 -9.349 2.094 1.00 0.00 C ATOM 0 H ALA A 77 -6.585 -8.459 -0.192 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.411 -7.288 2.422 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.777 -9.628 3.141 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.941 -9.135 1.889 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.559 -10.171 1.461 1.00 0.00 H new ATOM 1178 N ASP A 78 -3.915 -9.131 1.316 1.00 0.00 N ATOM 1179 CA ASP A 78 -2.509 -9.437 1.532 1.00 0.00 C ATOM 1180 C ASP A 78 -1.640 -8.503 0.704 1.00 0.00 C ATOM 1181 O ASP A 78 -2.087 -7.951 -0.304 1.00 0.00 O ATOM 1182 CB ASP A 78 -2.208 -10.898 1.180 1.00 0.00 C ATOM 1183 CG ASP A 78 -2.402 -11.201 -0.292 1.00 0.00 C ATOM 1184 OD1 ASP A 78 -3.564 -11.288 -0.737 1.00 0.00 O ATOM 1185 OD2 ASP A 78 -1.392 -11.354 -1.012 1.00 0.00 O ATOM 0 H ASP A 78 -4.315 -9.553 0.478 1.00 0.00 H new ATOM 0 HA ASP A 78 -2.282 -9.290 2.588 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -1.181 -11.130 1.461 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.855 -11.549 1.768 1.00 0.00 H new ATOM 1190 N VAL A 79 -0.403 -8.320 1.136 1.00 0.00 N ATOM 1191 CA VAL A 79 0.503 -7.398 0.473 1.00 0.00 C ATOM 1192 C VAL A 79 1.248 -8.090 -0.659 1.00 0.00 C ATOM 1193 O VAL A 79 2.077 -8.973 -0.428 1.00 0.00 O ATOM 1194 CB VAL A 79 1.527 -6.794 1.460 1.00 0.00 C ATOM 1195 CG1 VAL A 79 2.422 -5.782 0.760 1.00 0.00 C ATOM 1196 CG2 VAL A 79 0.817 -6.156 2.642 1.00 0.00 C ATOM 0 H VAL A 79 -0.004 -8.798 1.943 1.00 0.00 H new ATOM 0 HA VAL A 79 -0.108 -6.591 0.067 1.00 0.00 H new ATOM 0 HB VAL A 79 2.157 -7.601 1.833 1.00 0.00 H new ATOM 0 HG11 VAL A 79 3.134 -5.370 1.475 1.00 0.00 H new ATOM 0 HG12 VAL A 79 2.963 -6.273 -0.049 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.811 -4.977 0.352 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.554 -5.736 3.326 1.00 0.00 H new ATOM 0 HG22 VAL A 79 0.159 -5.363 2.286 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.227 -6.910 3.163 1.00 0.00 H new ATOM 1206 N TRP A 80 0.929 -7.703 -1.881 1.00 0.00 N ATOM 1207 CA TRP A 80 1.641 -8.189 -3.050 1.00 0.00 C ATOM 1208 C TRP A 80 2.826 -7.279 -3.330 1.00 0.00 C ATOM 1209 O TRP A 80 2.666 -6.067 -3.486 1.00 0.00 O ATOM 1210 CB TRP A 80 0.701 -8.255 -4.264 1.00 0.00 C ATOM 1211 CG TRP A 80 1.401 -8.469 -5.578 1.00 0.00 C ATOM 1212 CD1 TRP A 80 1.866 -9.649 -6.082 1.00 0.00 C ATOM 1213 CD2 TRP A 80 1.698 -7.468 -6.561 1.00 0.00 C ATOM 1214 NE1 TRP A 80 2.440 -9.440 -7.314 1.00 0.00 N ATOM 1215 CE2 TRP A 80 2.349 -8.112 -7.628 1.00 0.00 C ATOM 1216 CE3 TRP A 80 1.481 -6.090 -6.638 1.00 0.00 C ATOM 1217 CZ2 TRP A 80 2.780 -7.426 -8.760 1.00 0.00 C ATOM 1218 CZ3 TRP A 80 1.910 -5.411 -7.761 1.00 0.00 C ATOM 1219 CH2 TRP A 80 2.553 -6.079 -8.809 1.00 0.00 C ATOM 0 H TRP A 80 0.175 -7.048 -2.091 1.00 0.00 H new ATOM 0 HA TRP A 80 2.006 -9.198 -2.858 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -0.015 -9.063 -4.111 1.00 0.00 H new ATOM 0 HB3 TRP A 80 0.129 -7.328 -4.317 1.00 0.00 H new ATOM 0 HD1 TRP A 80 1.794 -10.606 -5.586 1.00 0.00 H new ATOM 0 HE1 TRP A 80 2.865 -10.159 -7.899 1.00 0.00 H new ATOM 0 HE3 TRP A 80 0.987 -5.565 -5.834 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 3.276 -7.940 -9.570 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 1.746 -4.346 -7.832 1.00 0.00 H new ATOM 0 HH2 TRP A 80 2.876 -5.519 -9.674 1.00 0.00 H new ATOM 1230 N ILE A 81 4.012 -7.855 -3.368 1.00 0.00 N ATOM 1231 CA ILE A 81 5.207 -7.082 -3.633 1.00 0.00 C ATOM 1232 C ILE A 81 5.527 -7.104 -5.124 1.00 0.00 C ATOM 1233 O ILE A 81 5.780 -8.162 -5.711 1.00 0.00 O ATOM 1234 CB ILE A 81 6.416 -7.578 -2.800 1.00 0.00 C ATOM 1235 CG1 ILE A 81 7.678 -6.785 -3.156 1.00 0.00 C ATOM 1236 CG2 ILE A 81 6.644 -9.071 -2.992 1.00 0.00 C ATOM 1237 CD1 ILE A 81 8.886 -7.159 -2.325 1.00 0.00 C ATOM 0 H ILE A 81 4.172 -8.851 -3.219 1.00 0.00 H new ATOM 0 HA ILE A 81 5.012 -6.054 -3.329 1.00 0.00 H new ATOM 0 HB ILE A 81 6.189 -7.410 -1.747 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.910 -6.942 -4.209 1.00 0.00 H new ATOM 0 HG13 ILE A 81 7.476 -5.721 -3.029 1.00 0.00 H new ATOM 0 HG21 ILE A 81 7.499 -9.388 -2.395 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.756 -9.618 -2.675 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.840 -9.277 -4.044 1.00 0.00 H new ATOM 0 HD11 ILE A 81 9.741 -6.557 -2.634 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.674 -6.975 -1.272 1.00 0.00 H new ATOM 0 HD13 ILE A 81 9.115 -8.215 -2.470 1.00 0.00 H new ATOM 1249 N ALA A 82 5.467 -5.931 -5.736 1.00 0.00 N ATOM 1250 CA ALA A 82 5.737 -5.789 -7.157 1.00 0.00 C ATOM 1251 C ALA A 82 7.148 -6.254 -7.487 1.00 0.00 C ATOM 1252 O ALA A 82 8.098 -5.907 -6.779 1.00 0.00 O ATOM 1253 CB ALA A 82 5.542 -4.343 -7.586 1.00 0.00 C ATOM 0 H ALA A 82 5.232 -5.057 -5.265 1.00 0.00 H new ATOM 0 HA ALA A 82 5.034 -6.416 -7.706 1.00 0.00 H new ATOM 0 HB1 ALA A 82 5.747 -4.249 -8.652 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.514 -4.040 -7.386 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.225 -3.703 -7.027 1.00 0.00 H new ATOM 1259 N PRO A 83 7.293 -7.060 -8.551 1.00 0.00 N ATOM 1260 CA PRO A 83 8.598 -7.536 -9.010 1.00 0.00 C ATOM 1261 C PRO A 83 9.575 -6.383 -9.181 1.00 0.00 C ATOM 1262 O PRO A 83 9.211 -5.333 -9.714 1.00 0.00 O ATOM 1263 CB PRO A 83 8.285 -8.183 -10.359 1.00 0.00 C ATOM 1264 CG PRO A 83 6.861 -8.600 -10.256 1.00 0.00 C ATOM 1265 CD PRO A 83 6.192 -7.572 -9.388 1.00 0.00 C ATOM 0 HA PRO A 83 9.069 -8.220 -8.304 1.00 0.00 H new ATOM 0 HB2 PRO A 83 8.434 -7.481 -11.179 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.935 -9.037 -10.549 1.00 0.00 H new ATOM 0 HG2 PRO A 83 6.395 -8.643 -11.240 1.00 0.00 H new ATOM 0 HG3 PRO A 83 6.776 -9.595 -9.819 1.00 0.00 H new ATOM 0 HD2 PRO A 83 5.737 -6.779 -9.982 1.00 0.00 H new ATOM 0 HD3 PRO A 83 5.399 -8.012 -8.783 1.00 0.00 H new ATOM 1273 N ARG A 84 10.807 -6.571 -8.726 1.00 0.00 N ATOM 1274 CA ARG A 84 11.785 -5.491 -8.726 1.00 0.00 C ATOM 1275 C ARG A 84 12.024 -4.960 -10.138 1.00 0.00 C ATOM 1276 O ARG A 84 12.206 -3.762 -10.329 1.00 0.00 O ATOM 1277 CB ARG A 84 13.104 -5.938 -8.098 1.00 0.00 C ATOM 1278 CG ARG A 84 14.055 -4.781 -7.847 1.00 0.00 C ATOM 1279 CD ARG A 84 15.315 -5.226 -7.131 1.00 0.00 C ATOM 1280 NE ARG A 84 16.138 -4.085 -6.733 1.00 0.00 N ATOM 1281 CZ ARG A 84 17.271 -4.189 -6.039 1.00 0.00 C ATOM 1282 NH1 ARG A 84 17.704 -5.381 -5.647 1.00 0.00 N ATOM 1283 NH2 ARG A 84 17.957 -3.098 -5.725 1.00 0.00 N ATOM 0 H ARG A 84 11.152 -7.456 -8.354 1.00 0.00 H new ATOM 0 HA ARG A 84 11.374 -4.683 -8.121 1.00 0.00 H new ATOM 0 HB2 ARG A 84 12.899 -6.446 -7.155 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.586 -6.664 -8.753 1.00 0.00 H new ATOM 0 HG2 ARG A 84 14.322 -4.319 -8.797 1.00 0.00 H new ATOM 0 HG3 ARG A 84 13.550 -4.019 -7.253 1.00 0.00 H new ATOM 0 HD2 ARG A 84 15.047 -5.808 -6.249 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.892 -5.882 -7.782 1.00 0.00 H new ATOM 0 HE ARG A 84 15.826 -3.152 -7.003 1.00 0.00 H new ATOM 0 HH11 ARG A 84 17.169 -6.219 -5.877 1.00 0.00 H new ATOM 0 HH12 ARG A 84 18.571 -5.459 -5.116 1.00 0.00 H new ATOM 0 HH21 ARG A 84 17.617 -2.181 -6.015 1.00 0.00 H new ATOM 0 HH22 ARG A 84 18.824 -3.176 -5.194 1.00 0.00 H new ATOM 1297 N GLN A 85 11.995 -5.848 -11.127 1.00 0.00 N ATOM 1298 CA GLN A 85 12.167 -5.442 -12.519 1.00 0.00 C ATOM 1299 C GLN A 85 11.061 -4.475 -12.936 1.00 0.00 C ATOM 1300 O GLN A 85 11.307 -3.499 -13.648 1.00 0.00 O ATOM 1301 CB GLN A 85 12.173 -6.665 -13.437 1.00 0.00 C ATOM 1302 CG GLN A 85 13.340 -7.605 -13.185 1.00 0.00 C ATOM 1303 CD GLN A 85 13.296 -8.835 -14.067 1.00 0.00 C ATOM 1304 OE1 GLN A 85 13.844 -8.844 -15.169 1.00 0.00 O ATOM 1305 NE2 GLN A 85 12.643 -9.880 -13.593 1.00 0.00 N ATOM 0 H GLN A 85 11.855 -6.849 -10.992 1.00 0.00 H new ATOM 0 HA GLN A 85 13.126 -4.933 -12.611 1.00 0.00 H new ATOM 0 HB2 GLN A 85 11.240 -7.213 -13.305 1.00 0.00 H new ATOM 0 HB3 GLN A 85 12.203 -6.331 -14.474 1.00 0.00 H new ATOM 0 HG2 GLN A 85 14.275 -7.072 -13.357 1.00 0.00 H new ATOM 0 HG3 GLN A 85 13.336 -7.912 -12.139 1.00 0.00 H new ATOM 0 HE21 GLN A 85 12.202 -9.832 -12.674 1.00 0.00 H new ATOM 0 HE22 GLN A 85 12.579 -10.735 -14.145 1.00 0.00 H new ATOM 1314 N LEU A 86 9.848 -4.748 -12.472 1.00 0.00 N ATOM 1315 CA LEU A 86 8.707 -3.885 -12.740 1.00 0.00 C ATOM 1316 C LEU A 86 8.824 -2.593 -11.935 1.00 0.00 C ATOM 1317 O LEU A 86 8.564 -1.503 -12.445 1.00 0.00 O ATOM 1318 CB LEU A 86 7.407 -4.610 -12.380 1.00 0.00 C ATOM 1319 CG LEU A 86 6.122 -3.836 -12.678 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.981 -3.594 -14.171 1.00 0.00 C ATOM 1321 CD2 LEU A 86 4.916 -4.588 -12.139 1.00 0.00 C ATOM 0 H LEU A 86 9.629 -5.567 -11.904 1.00 0.00 H new ATOM 0 HA LEU A 86 8.694 -3.638 -13.802 1.00 0.00 H new ATOM 0 HB2 LEU A 86 7.376 -5.555 -12.922 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.428 -4.852 -11.317 1.00 0.00 H new ATOM 0 HG LEU A 86 6.175 -2.868 -12.179 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.061 -3.042 -14.365 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.833 -3.016 -14.528 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.947 -4.550 -14.693 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.009 -4.025 -12.358 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.858 -5.569 -12.611 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.016 -4.710 -11.060 1.00 0.00 H new ATOM 1333 N ARG A 87 9.232 -2.734 -10.677 1.00 0.00 N ATOM 1334 CA ARG A 87 9.418 -1.593 -9.787 1.00 0.00 C ATOM 1335 C ARG A 87 10.412 -0.600 -10.383 1.00 0.00 C ATOM 1336 O ARG A 87 10.126 0.591 -10.489 1.00 0.00 O ATOM 1337 CB ARG A 87 9.923 -2.061 -8.419 1.00 0.00 C ATOM 1338 CG ARG A 87 10.107 -0.930 -7.419 1.00 0.00 C ATOM 1339 CD ARG A 87 10.930 -1.369 -6.220 1.00 0.00 C ATOM 1340 NE ARG A 87 10.297 -2.448 -5.465 1.00 0.00 N ATOM 1341 CZ ARG A 87 10.972 -3.385 -4.796 1.00 0.00 C ATOM 1342 NH1 ARG A 87 12.301 -3.412 -4.837 1.00 0.00 N ATOM 1343 NH2 ARG A 87 10.317 -4.301 -4.093 1.00 0.00 N ATOM 0 H ARG A 87 9.442 -3.636 -10.249 1.00 0.00 H new ATOM 0 HA ARG A 87 8.454 -1.099 -9.666 1.00 0.00 H new ATOM 0 HB2 ARG A 87 9.219 -2.786 -8.010 1.00 0.00 H new ATOM 0 HB3 ARG A 87 10.874 -2.578 -8.549 1.00 0.00 H new ATOM 0 HG2 ARG A 87 10.597 -0.088 -7.908 1.00 0.00 H new ATOM 0 HG3 ARG A 87 9.131 -0.580 -7.082 1.00 0.00 H new ATOM 0 HD2 ARG A 87 11.913 -1.697 -6.560 1.00 0.00 H new ATOM 0 HD3 ARG A 87 11.089 -0.515 -5.561 1.00 0.00 H new ATOM 0 HE ARG A 87 9.278 -2.487 -5.448 1.00 0.00 H new ATOM 0 HH11 ARG A 87 12.809 -2.715 -5.381 1.00 0.00 H new ATOM 0 HH12 ARG A 87 12.813 -4.130 -4.324 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.297 -4.289 -4.064 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.833 -5.017 -3.582 1.00 0.00 H new ATOM 1357 N GLU A 88 11.570 -1.107 -10.786 1.00 0.00 N ATOM 1358 CA GLU A 88 12.630 -0.269 -11.332 1.00 0.00 C ATOM 1359 C GLU A 88 12.218 0.341 -12.669 1.00 0.00 C ATOM 1360 O GLU A 88 12.654 1.440 -13.020 1.00 0.00 O ATOM 1361 CB GLU A 88 13.915 -1.083 -11.494 1.00 0.00 C ATOM 1362 CG GLU A 88 14.435 -1.662 -10.188 1.00 0.00 C ATOM 1363 CD GLU A 88 14.782 -0.598 -9.168 1.00 0.00 C ATOM 1364 OE1 GLU A 88 13.888 -0.175 -8.407 1.00 0.00 O ATOM 1365 OE2 GLU A 88 15.958 -0.184 -9.117 1.00 0.00 O ATOM 0 H GLU A 88 11.800 -2.100 -10.745 1.00 0.00 H new ATOM 0 HA GLU A 88 12.811 0.547 -10.632 1.00 0.00 H new ATOM 0 HB2 GLU A 88 13.734 -1.897 -12.196 1.00 0.00 H new ATOM 0 HB3 GLU A 88 14.685 -0.448 -11.933 1.00 0.00 H new ATOM 0 HG2 GLU A 88 13.683 -2.330 -9.768 1.00 0.00 H new ATOM 0 HG3 GLU A 88 15.320 -2.266 -10.391 1.00 0.00 H new ATOM 1372 N ALA A 89 11.377 -0.373 -13.410 1.00 0.00 N ATOM 1373 CA ALA A 89 10.856 0.132 -14.672 1.00 0.00 C ATOM 1374 C ALA A 89 9.981 1.359 -14.438 1.00 0.00 C ATOM 1375 O ALA A 89 10.125 2.377 -15.117 1.00 0.00 O ATOM 1376 CB ALA A 89 10.070 -0.953 -15.397 1.00 0.00 C ATOM 0 H ALA A 89 11.043 -1.303 -13.157 1.00 0.00 H new ATOM 0 HA ALA A 89 11.698 0.425 -15.299 1.00 0.00 H new ATOM 0 HB1 ALA A 89 9.688 -0.558 -16.338 1.00 0.00 H new ATOM 0 HB2 ALA A 89 10.723 -1.802 -15.598 1.00 0.00 H new ATOM 0 HB3 ALA A 89 9.236 -1.276 -14.774 1.00 0.00 H new ATOM 1382 N LEU A 90 9.087 1.262 -13.462 1.00 0.00 N ATOM 1383 CA LEU A 90 8.208 2.372 -13.114 1.00 0.00 C ATOM 1384 C LEU A 90 8.994 3.493 -12.447 1.00 0.00 C ATOM 1385 O LEU A 90 8.793 4.670 -12.745 1.00 0.00 O ATOM 1386 CB LEU A 90 7.085 1.900 -12.187 1.00 0.00 C ATOM 1387 CG LEU A 90 6.090 0.922 -12.814 1.00 0.00 C ATOM 1388 CD1 LEU A 90 5.057 0.487 -11.790 1.00 0.00 C ATOM 1389 CD2 LEU A 90 5.409 1.552 -14.019 1.00 0.00 C ATOM 0 H LEU A 90 8.951 0.424 -12.896 1.00 0.00 H new ATOM 0 HA LEU A 90 7.767 2.754 -14.035 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.532 1.427 -11.312 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.537 2.773 -11.832 1.00 0.00 H new ATOM 0 HG LEU A 90 6.638 0.042 -13.149 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.357 -0.209 -12.252 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.557 -0.003 -10.954 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.515 1.360 -11.427 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.705 0.841 -14.452 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.874 2.449 -13.707 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.160 1.818 -14.763 1.00 0.00 H new ATOM 1401 N ARG A 91 9.906 3.121 -11.560 1.00 0.00 N ATOM 1402 CA ARG A 91 10.704 4.092 -10.820 1.00 0.00 C ATOM 1403 C ARG A 91 11.584 4.905 -11.771 1.00 0.00 C ATOM 1404 O ARG A 91 11.915 6.061 -11.497 1.00 0.00 O ATOM 1405 CB ARG A 91 11.558 3.369 -9.769 1.00 0.00 C ATOM 1406 CG ARG A 91 12.206 4.295 -8.755 1.00 0.00 C ATOM 1407 CD ARG A 91 12.856 3.522 -7.615 1.00 0.00 C ATOM 1408 NE ARG A 91 13.999 2.718 -8.054 1.00 0.00 N ATOM 1409 CZ ARG A 91 15.267 3.121 -7.960 1.00 0.00 C ATOM 1410 NH1 ARG A 91 15.549 4.313 -7.445 1.00 0.00 N ATOM 1411 NH2 ARG A 91 16.251 2.327 -8.368 1.00 0.00 N ATOM 0 H ARG A 91 10.113 2.148 -11.334 1.00 0.00 H new ATOM 0 HA ARG A 91 10.034 4.785 -10.311 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.933 2.649 -9.241 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.337 2.801 -10.277 1.00 0.00 H new ATOM 0 HG2 ARG A 91 12.957 4.909 -9.252 1.00 0.00 H new ATOM 0 HG3 ARG A 91 11.455 4.974 -8.351 1.00 0.00 H new ATOM 0 HD2 ARG A 91 13.184 4.223 -6.847 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.114 2.870 -7.155 1.00 0.00 H new ATOM 0 HE ARG A 91 13.815 1.798 -8.454 1.00 0.00 H new ATOM 0 HH11 ARG A 91 14.796 4.920 -7.121 1.00 0.00 H new ATOM 0 HH12 ARG A 91 16.519 4.621 -7.373 1.00 0.00 H new ATOM 0 HH21 ARG A 91 16.037 1.407 -8.754 1.00 0.00 H new ATOM 0 HH22 ARG A 91 17.220 2.637 -8.295 1.00 0.00 H new ATOM 1425 N GLY A 92 11.943 4.300 -12.898 1.00 0.00 N ATOM 1426 CA GLY A 92 12.744 4.990 -13.891 1.00 0.00 C ATOM 1427 C GLY A 92 11.940 6.010 -14.678 1.00 0.00 C ATOM 1428 O GLY A 92 12.472 7.035 -15.107 1.00 0.00 O ATOM 0 H GLY A 92 11.693 3.342 -13.142 1.00 0.00 H new ATOM 0 HA2 GLY A 92 13.577 5.491 -13.398 1.00 0.00 H new ATOM 0 HA3 GLY A 92 13.173 4.261 -14.578 1.00 0.00 H new ATOM 1432 N VAL A 93 10.651 5.741 -14.857 1.00 0.00 N ATOM 1433 CA VAL A 93 9.784 6.635 -15.618 1.00 0.00 C ATOM 1434 C VAL A 93 9.025 7.590 -14.696 1.00 0.00 C ATOM 1435 O VAL A 93 7.915 8.017 -15.011 1.00 0.00 O ATOM 1436 CB VAL A 93 8.790 5.856 -16.515 1.00 0.00 C ATOM 1437 CG1 VAL A 93 9.538 5.084 -17.589 1.00 0.00 C ATOM 1438 CG2 VAL A 93 7.918 4.915 -15.696 1.00 0.00 C ATOM 0 H VAL A 93 10.184 4.913 -14.487 1.00 0.00 H new ATOM 0 HA VAL A 93 10.433 7.221 -16.269 1.00 0.00 H new ATOM 0 HB VAL A 93 8.135 6.584 -16.994 1.00 0.00 H new ATOM 0 HG11 VAL A 93 8.825 4.542 -18.211 1.00 0.00 H new ATOM 0 HG12 VAL A 93 10.105 5.779 -18.208 1.00 0.00 H new ATOM 0 HG13 VAL A 93 10.221 4.376 -17.119 1.00 0.00 H new ATOM 0 HG21 VAL A 93 7.233 4.385 -16.358 1.00 0.00 H new ATOM 0 HG22 VAL A 93 8.549 4.195 -15.175 1.00 0.00 H new ATOM 0 HG23 VAL A 93 7.347 5.490 -14.967 1.00 0.00 H new ATOM 1448 N ASN A 94 9.650 7.912 -13.556 1.00 0.00 N ATOM 1449 CA ASN A 94 9.156 8.945 -12.631 1.00 0.00 C ATOM 1450 C ASN A 94 7.986 8.441 -11.781 1.00 0.00 C ATOM 1451 O ASN A 94 7.465 9.162 -10.933 1.00 0.00 O ATOM 1452 CB ASN A 94 8.762 10.217 -13.409 1.00 0.00 C ATOM 1453 CG ASN A 94 8.479 11.412 -12.516 1.00 0.00 C ATOM 1454 OD1 ASN A 94 9.394 12.141 -12.129 1.00 0.00 O ATOM 1455 ND2 ASN A 94 7.210 11.646 -12.208 1.00 0.00 N ATOM 0 H ASN A 94 10.513 7.464 -13.247 1.00 0.00 H new ATOM 0 HA ASN A 94 9.967 9.190 -11.945 1.00 0.00 H new ATOM 0 HB2 ASN A 94 9.564 10.473 -14.101 1.00 0.00 H new ATOM 0 HB3 ASN A 94 7.878 10.006 -14.010 1.00 0.00 H new ATOM 0 HD21 ASN A 94 6.965 12.452 -11.633 1.00 0.00 H new ATOM 0 HD22 ASN A 94 6.479 11.020 -12.547 1.00 0.00 H new ATOM 1462 N VAL A 95 7.599 7.192 -11.972 1.00 0.00 N ATOM 1463 CA VAL A 95 6.463 6.643 -11.251 1.00 0.00 C ATOM 1464 C VAL A 95 6.899 6.066 -9.908 1.00 0.00 C ATOM 1465 O VAL A 95 7.556 5.024 -9.848 1.00 0.00 O ATOM 1466 CB VAL A 95 5.742 5.552 -12.074 1.00 0.00 C ATOM 1467 CG1 VAL A 95 4.561 4.984 -11.305 1.00 0.00 C ATOM 1468 CG2 VAL A 95 5.285 6.111 -13.413 1.00 0.00 C ATOM 0 H VAL A 95 8.051 6.542 -12.616 1.00 0.00 H new ATOM 0 HA VAL A 95 5.766 7.463 -11.079 1.00 0.00 H new ATOM 0 HB VAL A 95 6.449 4.743 -12.257 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.070 4.218 -11.906 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.912 4.544 -10.372 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.852 5.782 -11.085 1.00 0.00 H new ATOM 0 HG21 VAL A 95 4.779 5.329 -13.980 1.00 0.00 H new ATOM 0 HG22 VAL A 95 4.598 6.940 -13.246 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.150 6.464 -13.974 1.00 0.00 H new ATOM 1478 N VAL A 96 6.553 6.760 -8.831 1.00 0.00 N ATOM 1479 CA VAL A 96 6.851 6.278 -7.492 1.00 0.00 C ATOM 1480 C VAL A 96 5.874 5.174 -7.110 1.00 0.00 C ATOM 1481 O VAL A 96 4.763 5.438 -6.647 1.00 0.00 O ATOM 1482 CB VAL A 96 6.796 7.412 -6.443 1.00 0.00 C ATOM 1483 CG1 VAL A 96 7.179 6.895 -5.063 1.00 0.00 C ATOM 1484 CG2 VAL A 96 7.702 8.564 -6.851 1.00 0.00 C ATOM 0 H VAL A 96 6.067 7.656 -8.860 1.00 0.00 H new ATOM 0 HA VAL A 96 7.868 5.886 -7.502 1.00 0.00 H new ATOM 0 HB VAL A 96 5.771 7.779 -6.396 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.133 7.712 -4.343 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.487 6.108 -4.764 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.192 6.495 -5.093 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.649 9.352 -6.100 1.00 0.00 H new ATOM 0 HG22 VAL A 96 8.729 8.208 -6.932 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.378 8.958 -7.814 1.00 0.00 H new ATOM 1494 N LEU A 97 6.285 3.939 -7.351 1.00 0.00 N ATOM 1495 CA LEU A 97 5.453 2.776 -7.085 1.00 0.00 C ATOM 1496 C LEU A 97 5.540 2.358 -5.622 1.00 0.00 C ATOM 1497 O LEU A 97 6.621 2.037 -5.126 1.00 0.00 O ATOM 1498 CB LEU A 97 5.892 1.613 -7.980 1.00 0.00 C ATOM 1499 CG LEU A 97 5.196 0.278 -7.714 1.00 0.00 C ATOM 1500 CD1 LEU A 97 3.717 0.368 -8.049 1.00 0.00 C ATOM 1501 CD2 LEU A 97 5.861 -0.836 -8.507 1.00 0.00 C ATOM 0 H LEU A 97 7.203 3.715 -7.736 1.00 0.00 H new ATOM 0 HA LEU A 97 4.418 3.040 -7.303 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.719 1.892 -9.019 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.966 1.472 -7.862 1.00 0.00 H new ATOM 0 HG LEU A 97 5.290 0.047 -6.653 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.240 -0.592 -7.853 1.00 0.00 H new ATOM 0 HD12 LEU A 97 3.251 1.137 -7.433 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.597 0.624 -9.102 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.353 -1.779 -8.306 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.800 -0.611 -9.572 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.907 -0.918 -8.213 1.00 0.00 H new ATOM 1513 N ASP A 98 4.405 2.361 -4.938 1.00 0.00 N ATOM 1514 CA ASP A 98 4.345 1.879 -3.565 1.00 0.00 C ATOM 1515 C ASP A 98 3.201 0.882 -3.421 1.00 0.00 C ATOM 1516 O ASP A 98 2.056 1.181 -3.770 1.00 0.00 O ATOM 1517 CB ASP A 98 4.164 3.043 -2.587 1.00 0.00 C ATOM 1518 CG ASP A 98 4.561 2.670 -1.171 1.00 0.00 C ATOM 1519 OD1 ASP A 98 3.760 2.023 -0.470 1.00 0.00 O ATOM 1520 OD2 ASP A 98 5.691 3.015 -0.757 1.00 0.00 O ATOM 0 H ASP A 98 3.515 2.691 -5.310 1.00 0.00 H new ATOM 0 HA ASP A 98 5.286 1.382 -3.327 1.00 0.00 H new ATOM 0 HB2 ASP A 98 4.763 3.891 -2.919 1.00 0.00 H new ATOM 0 HB3 ASP A 98 3.123 3.365 -2.597 1.00 0.00 H new ATOM 1525 N THR A 99 3.517 -0.308 -2.932 1.00 0.00 N ATOM 1526 CA THR A 99 2.533 -1.374 -2.813 1.00 0.00 C ATOM 1527 C THR A 99 2.073 -1.553 -1.368 1.00 0.00 C ATOM 1528 O THR A 99 2.890 -1.734 -0.461 1.00 0.00 O ATOM 1529 CB THR A 99 3.105 -2.701 -3.348 1.00 0.00 C ATOM 1530 OG1 THR A 99 4.500 -2.802 -3.019 1.00 0.00 O ATOM 1531 CG2 THR A 99 2.926 -2.798 -4.855 1.00 0.00 C ATOM 0 H THR A 99 4.451 -0.560 -2.610 1.00 0.00 H new ATOM 0 HA THR A 99 1.669 -1.089 -3.413 1.00 0.00 H new ATOM 0 HB THR A 99 2.561 -3.521 -2.880 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.856 -3.649 -3.361 1.00 0.00 H new ATOM 0 HG21 THR A 99 3.337 -3.743 -5.210 1.00 0.00 H new ATOM 0 HG22 THR A 99 1.865 -2.749 -5.099 1.00 0.00 H new ATOM 0 HG23 THR A 99 3.448 -1.971 -5.337 1.00 0.00 H new ATOM 1539 N MET A 100 0.765 -1.504 -1.162 1.00 0.00 N ATOM 1540 CA MET A 100 0.195 -1.611 0.173 1.00 0.00 C ATOM 1541 C MET A 100 -1.168 -2.295 0.118 1.00 0.00 C ATOM 1542 O MET A 100 -1.670 -2.612 -0.962 1.00 0.00 O ATOM 1543 CB MET A 100 0.058 -0.219 0.800 1.00 0.00 C ATOM 1544 CG MET A 100 -0.884 0.706 0.041 1.00 0.00 C ATOM 1545 SD MET A 100 -0.951 2.368 0.740 1.00 0.00 S ATOM 1546 CE MET A 100 0.718 2.936 0.424 1.00 0.00 C ATOM 0 H MET A 100 0.076 -1.390 -1.906 1.00 0.00 H new ATOM 0 HA MET A 100 0.863 -2.214 0.788 1.00 0.00 H new ATOM 0 HB2 MET A 100 -0.299 -0.325 1.824 1.00 0.00 H new ATOM 0 HB3 MET A 100 1.043 0.244 0.853 1.00 0.00 H new ATOM 0 HG2 MET A 100 -0.564 0.768 -0.999 1.00 0.00 H new ATOM 0 HG3 MET A 100 -1.886 0.276 0.042 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.745 4.025 0.462 1.00 0.00 H new ATOM 0 HE2 MET A 100 1.390 2.530 1.180 1.00 0.00 H new ATOM 0 HE3 MET A 100 1.036 2.600 -0.563 1.00 0.00 H new ATOM 1556 N GLN A 101 -1.758 -2.529 1.281 1.00 0.00 N ATOM 1557 CA GLN A 101 -3.096 -3.099 1.359 1.00 0.00 C ATOM 1558 C GLN A 101 -4.128 -2.060 0.938 1.00 0.00 C ATOM 1559 O GLN A 101 -3.854 -0.858 0.966 1.00 0.00 O ATOM 1560 CB GLN A 101 -3.390 -3.576 2.781 1.00 0.00 C ATOM 1561 CG GLN A 101 -2.467 -4.683 3.258 1.00 0.00 C ATOM 1562 CD GLN A 101 -2.672 -5.019 4.721 1.00 0.00 C ATOM 1563 OE1 GLN A 101 -3.039 -4.159 5.522 1.00 0.00 O ATOM 1564 NE2 GLN A 101 -2.436 -6.268 5.080 1.00 0.00 N ATOM 0 H GLN A 101 -1.330 -2.333 2.186 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.151 -3.954 0.685 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.309 -2.729 3.463 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.420 -3.928 2.831 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.635 -5.576 2.656 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -1.431 -4.382 3.099 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -2.133 -6.950 4.385 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -2.557 -6.551 6.053 1.00 0.00 H new ATOM 1573 N THR A 102 -5.315 -2.516 0.562 1.00 0.00 N ATOM 1574 CA THR A 102 -6.368 -1.620 0.107 1.00 0.00 C ATOM 1575 C THR A 102 -6.810 -0.658 1.207 1.00 0.00 C ATOM 1576 O THR A 102 -7.193 0.476 0.925 1.00 0.00 O ATOM 1577 CB THR A 102 -7.574 -2.418 -0.407 1.00 0.00 C ATOM 1578 OG1 THR A 102 -7.512 -3.753 0.103 1.00 0.00 O ATOM 1579 CG2 THR A 102 -7.593 -2.444 -1.928 1.00 0.00 C ATOM 0 H THR A 102 -5.573 -3.503 0.563 1.00 0.00 H new ATOM 0 HA THR A 102 -5.956 -1.028 -0.710 1.00 0.00 H new ATOM 0 HB THR A 102 -8.489 -1.936 -0.062 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.301 -3.928 0.658 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.456 -3.015 -2.271 1.00 0.00 H new ATOM 0 HG22 THR A 102 -7.657 -1.425 -2.309 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.679 -2.911 -2.295 1.00 0.00 H new ATOM 1587 N GLY A 103 -6.738 -1.112 2.456 1.00 0.00 N ATOM 1588 CA GLY A 103 -7.095 -0.265 3.587 1.00 0.00 C ATOM 1589 C GLY A 103 -6.290 1.026 3.622 1.00 0.00 C ATOM 1590 O GLY A 103 -6.849 2.111 3.439 1.00 0.00 O ATOM 0 H GLY A 103 -6.438 -2.054 2.708 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.157 -0.026 3.538 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.935 -0.815 4.514 1.00 0.00 H new ATOM 1594 N PRO A 104 -4.968 0.942 3.862 1.00 0.00 N ATOM 1595 CA PRO A 104 -4.083 2.113 3.841 1.00 0.00 C ATOM 1596 C PRO A 104 -4.114 2.845 2.500 1.00 0.00 C ATOM 1597 O PRO A 104 -3.908 4.059 2.443 1.00 0.00 O ATOM 1598 CB PRO A 104 -2.692 1.522 4.092 1.00 0.00 C ATOM 1599 CG PRO A 104 -2.944 0.222 4.769 1.00 0.00 C ATOM 1600 CD PRO A 104 -4.237 -0.291 4.206 1.00 0.00 C ATOM 0 HA PRO A 104 -4.384 2.857 4.579 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -2.148 1.382 3.158 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -2.089 2.182 4.716 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.131 -0.480 4.582 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -3.012 0.351 5.849 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -4.074 -0.920 3.331 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -4.782 -0.893 4.933 1.00 0.00 H new ATOM 1608 N ALA A 105 -4.378 2.105 1.427 1.00 0.00 N ATOM 1609 CA ALA A 105 -4.450 2.688 0.094 1.00 0.00 C ATOM 1610 C ALA A 105 -5.587 3.700 -0.001 1.00 0.00 C ATOM 1611 O ALA A 105 -5.390 4.817 -0.479 1.00 0.00 O ATOM 1612 CB ALA A 105 -4.616 1.600 -0.953 1.00 0.00 C ATOM 0 H ALA A 105 -4.546 1.099 1.456 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.514 3.214 -0.096 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -4.668 2.053 -1.943 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.765 0.920 -0.909 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.534 1.045 -0.759 1.00 0.00 H new ATOM 1618 N ILE A 106 -6.771 3.308 0.466 1.00 0.00 N ATOM 1619 CA ILE A 106 -7.928 4.198 0.465 1.00 0.00 C ATOM 1620 C ILE A 106 -7.641 5.439 1.307 1.00 0.00 C ATOM 1621 O ILE A 106 -7.962 6.562 0.908 1.00 0.00 O ATOM 1622 CB ILE A 106 -9.192 3.486 1.002 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -9.546 2.288 0.115 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -10.365 4.456 1.077 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -10.726 1.481 0.619 1.00 0.00 C ATOM 0 H ILE A 106 -6.953 2.381 0.849 1.00 0.00 H new ATOM 0 HA ILE A 106 -8.116 4.493 -0.567 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.981 3.125 2.009 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -9.765 2.645 -0.891 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -8.677 1.635 0.039 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -11.244 3.935 1.457 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.114 5.280 1.745 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.577 4.848 0.082 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -10.916 0.651 -0.061 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -10.503 1.093 1.613 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.609 2.119 0.668 1.00 0.00 H new ATOM 1637 N ARG A 107 -7.016 5.223 2.461 1.00 0.00 N ATOM 1638 CA ARG A 107 -6.632 6.316 3.348 1.00 0.00 C ATOM 1639 C ARG A 107 -5.737 7.311 2.621 1.00 0.00 C ATOM 1640 O ARG A 107 -6.041 8.502 2.541 1.00 0.00 O ATOM 1641 CB ARG A 107 -5.885 5.773 4.570 1.00 0.00 C ATOM 1642 CG ARG A 107 -6.716 4.879 5.473 1.00 0.00 C ATOM 1643 CD ARG A 107 -7.834 5.650 6.154 1.00 0.00 C ATOM 1644 NE ARG A 107 -8.472 4.865 7.208 1.00 0.00 N ATOM 1645 CZ ARG A 107 -9.657 5.157 7.741 1.00 0.00 C ATOM 1646 NH1 ARG A 107 -10.345 6.207 7.307 1.00 0.00 N ATOM 1647 NH2 ARG A 107 -10.148 4.406 8.715 1.00 0.00 N ATOM 0 H ARG A 107 -6.764 4.296 2.805 1.00 0.00 H new ATOM 0 HA ARG A 107 -7.543 6.821 3.670 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -5.014 5.213 4.228 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.513 6.614 5.156 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -7.141 4.064 4.887 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -6.073 4.427 6.228 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -7.434 6.571 6.578 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -8.580 5.938 5.413 1.00 0.00 H new ATOM 0 HE ARG A 107 -7.980 4.043 7.557 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -9.966 6.793 6.563 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -11.252 6.427 7.718 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -9.619 3.604 9.057 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -11.056 4.630 9.123 1.00 0.00 H new ATOM 1661 N THR A 108 -4.639 6.801 2.077 1.00 0.00 N ATOM 1662 CA THR A 108 -3.639 7.634 1.431 1.00 0.00 C ATOM 1663 C THR A 108 -4.203 8.322 0.187 1.00 0.00 C ATOM 1664 O THR A 108 -3.946 9.502 -0.042 1.00 0.00 O ATOM 1665 CB THR A 108 -2.400 6.803 1.047 1.00 0.00 C ATOM 1666 OG1 THR A 108 -2.018 5.968 2.150 1.00 0.00 O ATOM 1667 CG2 THR A 108 -1.231 7.705 0.674 1.00 0.00 C ATOM 0 H THR A 108 -4.420 5.805 2.072 1.00 0.00 H new ATOM 0 HA THR A 108 -3.346 8.402 2.147 1.00 0.00 H new ATOM 0 HB THR A 108 -2.656 6.189 0.184 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.598 5.179 2.179 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.370 7.093 0.407 1.00 0.00 H new ATOM 0 HG22 THR A 108 -1.509 8.329 -0.175 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.976 8.340 1.523 1.00 0.00 H new ATOM 1675 N TYR A 109 -4.983 7.589 -0.602 1.00 0.00 N ATOM 1676 CA TYR A 109 -5.555 8.132 -1.831 1.00 0.00 C ATOM 1677 C TYR A 109 -6.465 9.323 -1.540 1.00 0.00 C ATOM 1678 O TYR A 109 -6.346 10.371 -2.179 1.00 0.00 O ATOM 1679 CB TYR A 109 -6.327 7.049 -2.591 1.00 0.00 C ATOM 1680 CG TYR A 109 -7.075 7.569 -3.801 1.00 0.00 C ATOM 1681 CD1 TYR A 109 -6.413 8.256 -4.813 1.00 0.00 C ATOM 1682 CD2 TYR A 109 -8.443 7.368 -3.933 1.00 0.00 C ATOM 1683 CE1 TYR A 109 -7.095 8.731 -5.917 1.00 0.00 C ATOM 1684 CE2 TYR A 109 -9.132 7.840 -5.034 1.00 0.00 C ATOM 1685 CZ TYR A 109 -8.453 8.520 -6.023 1.00 0.00 C ATOM 1686 OH TYR A 109 -9.135 8.986 -7.122 1.00 0.00 O ATOM 0 H TYR A 109 -5.234 6.618 -0.413 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.731 8.480 -2.454 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -5.629 6.275 -2.911 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -7.037 6.577 -1.912 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -5.349 8.421 -4.735 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -8.978 6.833 -3.162 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -6.567 9.265 -6.693 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -10.196 7.677 -5.119 1.00 0.00 H new ATOM 0 HH TYR A 109 -10.096 9.000 -6.929 1.00 0.00 H new ATOM 1696 N ASN A 110 -7.357 9.164 -0.567 1.00 0.00 N ATOM 1697 CA ASN A 110 -8.302 10.221 -0.211 1.00 0.00 C ATOM 1698 C ASN A 110 -7.558 11.478 0.239 1.00 0.00 C ATOM 1699 O ASN A 110 -7.959 12.598 -0.074 1.00 0.00 O ATOM 1700 CB ASN A 110 -9.248 9.739 0.894 1.00 0.00 C ATOM 1701 CG ASN A 110 -10.375 10.718 1.179 1.00 0.00 C ATOM 1702 OD1 ASN A 110 -10.242 11.617 2.009 1.00 0.00 O ATOM 1703 ND2 ASN A 110 -11.504 10.538 0.507 1.00 0.00 N ATOM 0 H ASN A 110 -7.446 8.314 -0.010 1.00 0.00 H new ATOM 0 HA ASN A 110 -8.892 10.467 -1.094 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -9.673 8.777 0.607 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -8.677 9.575 1.808 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -12.299 11.156 0.671 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -11.577 9.782 -0.174 1.00 0.00 H new ATOM 1710 N ILE A 111 -6.455 11.283 0.952 1.00 0.00 N ATOM 1711 CA ILE A 111 -5.640 12.397 1.419 1.00 0.00 C ATOM 1712 C ILE A 111 -4.838 13.015 0.270 1.00 0.00 C ATOM 1713 O ILE A 111 -4.770 14.237 0.139 1.00 0.00 O ATOM 1714 CB ILE A 111 -4.679 11.951 2.544 1.00 0.00 C ATOM 1715 CG1 ILE A 111 -5.476 11.427 3.743 1.00 0.00 C ATOM 1716 CG2 ILE A 111 -3.772 13.102 2.962 1.00 0.00 C ATOM 1717 CD1 ILE A 111 -4.613 10.895 4.868 1.00 0.00 C ATOM 0 H ILE A 111 -6.105 10.363 1.219 1.00 0.00 H new ATOM 0 HA ILE A 111 -6.320 13.150 1.817 1.00 0.00 H new ATOM 0 HB ILE A 111 -4.051 11.144 2.166 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -6.104 12.230 4.129 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -6.144 10.635 3.405 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -3.103 12.768 3.755 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -3.184 13.431 2.105 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -4.380 13.931 3.325 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -5.250 10.543 5.680 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -4.004 10.069 4.500 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -3.963 11.690 5.235 1.00 0.00 H new ATOM 1729 N MET A 112 -4.252 12.166 -0.569 1.00 0.00 N ATOM 1730 CA MET A 112 -3.412 12.622 -1.678 1.00 0.00 C ATOM 1731 C MET A 112 -4.188 13.482 -2.669 1.00 0.00 C ATOM 1732 O MET A 112 -3.693 14.516 -3.122 1.00 0.00 O ATOM 1733 CB MET A 112 -2.789 11.430 -2.408 1.00 0.00 C ATOM 1734 CG MET A 112 -1.587 10.839 -1.694 1.00 0.00 C ATOM 1735 SD MET A 112 -0.183 11.969 -1.651 1.00 0.00 S ATOM 1736 CE MET A 112 0.982 11.012 -0.685 1.00 0.00 C ATOM 0 H MET A 112 -4.343 11.152 -0.503 1.00 0.00 H new ATOM 0 HA MET A 112 -2.622 13.237 -1.246 1.00 0.00 H new ATOM 0 HB2 MET A 112 -3.545 10.655 -2.531 1.00 0.00 H new ATOM 0 HB3 MET A 112 -2.489 11.744 -3.408 1.00 0.00 H new ATOM 0 HG2 MET A 112 -1.868 10.575 -0.674 1.00 0.00 H new ATOM 0 HG3 MET A 112 -1.291 9.916 -2.192 1.00 0.00 H new ATOM 0 HE1 MET A 112 1.907 11.576 -0.568 1.00 0.00 H new ATOM 0 HE2 MET A 112 0.557 10.805 0.297 1.00 0.00 H new ATOM 0 HE3 MET A 112 1.192 10.072 -1.195 1.00 0.00 H new ATOM 1746 N ILE A 113 -5.401 13.061 -3.003 1.00 0.00 N ATOM 1747 CA ILE A 113 -6.217 13.802 -3.956 1.00 0.00 C ATOM 1748 C ILE A 113 -6.663 15.137 -3.353 1.00 0.00 C ATOM 1749 O ILE A 113 -6.902 16.107 -4.071 1.00 0.00 O ATOM 1750 CB ILE A 113 -7.452 12.980 -4.410 1.00 0.00 C ATOM 1751 CG1 ILE A 113 -8.169 13.669 -5.577 1.00 0.00 C ATOM 1752 CG2 ILE A 113 -8.415 12.762 -3.254 1.00 0.00 C ATOM 1753 CD1 ILE A 113 -7.327 13.777 -6.831 1.00 0.00 C ATOM 0 H ILE A 113 -5.839 12.218 -2.632 1.00 0.00 H new ATOM 0 HA ILE A 113 -5.603 13.996 -4.835 1.00 0.00 H new ATOM 0 HB ILE A 113 -7.097 12.007 -4.750 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -9.080 13.117 -5.808 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -8.472 14.669 -5.266 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -9.272 12.183 -3.599 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.908 12.220 -2.456 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -8.756 13.726 -2.878 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -7.901 14.275 -7.613 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -6.428 14.355 -6.617 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -7.046 12.779 -7.167 1.00 0.00 H new ATOM 1765 N GLY A 114 -6.740 15.185 -2.028 1.00 0.00 N ATOM 1766 CA GLY A 114 -7.120 16.407 -1.348 1.00 0.00 C ATOM 1767 C GLY A 114 -5.936 17.322 -1.113 1.00 0.00 C ATOM 1768 O GLY A 114 -6.099 18.532 -0.933 1.00 0.00 O ATOM 0 H GLY A 114 -6.545 14.396 -1.412 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.871 16.931 -1.939 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.582 16.160 -0.392 1.00 0.00 H new ATOM 1772 N GLU A 115 -4.738 16.744 -1.125 1.00 0.00 N ATOM 1773 CA GLU A 115 -3.513 17.504 -0.915 1.00 0.00 C ATOM 1774 C GLU A 115 -3.038 18.109 -2.237 1.00 0.00 C ATOM 1775 O GLU A 115 -2.061 18.860 -2.280 1.00 0.00 O ATOM 1776 CB GLU A 115 -2.429 16.599 -0.314 1.00 0.00 C ATOM 1777 CG GLU A 115 -1.246 17.358 0.265 1.00 0.00 C ATOM 1778 CD GLU A 115 -0.185 16.443 0.841 1.00 0.00 C ATOM 1779 OE1 GLU A 115 -0.323 16.019 2.007 1.00 0.00 O ATOM 1780 OE2 GLU A 115 0.804 16.157 0.137 1.00 0.00 O ATOM 0 H GLU A 115 -4.591 15.746 -1.279 1.00 0.00 H new ATOM 0 HA GLU A 115 -3.713 18.316 -0.215 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.874 15.986 0.470 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.069 15.918 -1.085 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.801 17.977 -0.514 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -1.600 18.032 1.045 1.00 0.00 H new ATOM 1787 N ARG A 116 -3.750 17.763 -3.309 1.00 0.00 N ATOM 1788 CA ARG A 116 -3.495 18.304 -4.642 1.00 0.00 C ATOM 1789 C ARG A 116 -2.104 17.899 -5.133 1.00 0.00 C ATOM 1790 O ARG A 116 -1.206 18.731 -5.279 1.00 0.00 O ATOM 1791 CB ARG A 116 -3.663 19.833 -4.635 1.00 0.00 C ATOM 1792 CG ARG A 116 -4.157 20.427 -5.950 1.00 0.00 C ATOM 1793 CD ARG A 116 -3.088 20.418 -7.031 1.00 0.00 C ATOM 1794 NE ARG A 116 -3.543 21.087 -8.249 1.00 0.00 N ATOM 1795 CZ ARG A 116 -2.794 21.925 -8.965 1.00 0.00 C ATOM 1796 NH1 ARG A 116 -1.545 22.190 -8.599 1.00 0.00 N ATOM 1797 NH2 ARG A 116 -3.300 22.494 -10.050 1.00 0.00 N ATOM 0 H ARG A 116 -4.522 17.097 -3.276 1.00 0.00 H new ATOM 0 HA ARG A 116 -4.224 17.886 -5.336 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -4.363 20.104 -3.844 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -2.705 20.289 -4.383 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -5.024 19.864 -6.296 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -4.489 21.451 -5.780 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -2.190 20.912 -6.659 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -2.813 19.389 -7.262 1.00 0.00 H new ATOM 0 HE ARG A 116 -4.493 20.901 -8.571 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -1.154 21.751 -7.765 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -0.977 22.832 -9.151 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -4.258 22.290 -10.333 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -2.731 23.136 -10.602 1.00 0.00 H new ATOM 1811 N ARG A 117 -1.930 16.604 -5.359 1.00 0.00 N ATOM 1812 CA ARG A 117 -0.683 16.076 -5.899 1.00 0.00 C ATOM 1813 C ARG A 117 -0.968 15.210 -7.118 1.00 0.00 C ATOM 1814 O ARG A 117 -2.123 14.902 -7.411 1.00 0.00 O ATOM 1815 CB ARG A 117 0.067 15.243 -4.856 1.00 0.00 C ATOM 1816 CG ARG A 117 0.491 16.012 -3.616 1.00 0.00 C ATOM 1817 CD ARG A 117 1.414 15.174 -2.744 1.00 0.00 C ATOM 1818 NE ARG A 117 2.688 14.891 -3.411 1.00 0.00 N ATOM 1819 CZ ARG A 117 3.067 13.683 -3.832 1.00 0.00 C ATOM 1820 NH1 ARG A 117 2.290 12.623 -3.634 1.00 0.00 N ATOM 1821 NH2 ARG A 117 4.233 13.540 -4.443 1.00 0.00 N ATOM 0 H ARG A 117 -2.641 15.896 -5.176 1.00 0.00 H new ATOM 0 HA ARG A 117 -0.059 16.924 -6.182 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -0.567 14.410 -4.552 1.00 0.00 H new ATOM 0 HB3 ARG A 117 0.954 14.814 -5.322 1.00 0.00 H new ATOM 0 HG2 ARG A 117 0.998 16.931 -3.909 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -0.391 16.302 -3.045 1.00 0.00 H new ATOM 0 HD2 ARG A 117 1.603 15.698 -1.807 1.00 0.00 H new ATOM 0 HD3 ARG A 117 0.921 14.236 -2.490 1.00 0.00 H new ATOM 0 HE ARG A 117 3.328 15.670 -3.564 1.00 0.00 H new ATOM 0 HH11 ARG A 117 1.395 12.729 -3.156 1.00 0.00 H new ATOM 0 HH12 ARG A 117 2.589 11.704 -3.960 1.00 0.00 H new ATOM 0 HH21 ARG A 117 4.835 14.350 -4.589 1.00 0.00 H new ATOM 0 HH22 ARG A 117 4.529 12.619 -4.767 1.00 0.00 H new ATOM 1835 N ARG A 118 0.085 14.816 -7.822 1.00 0.00 N ATOM 1836 CA ARG A 118 -0.057 13.922 -8.964 1.00 0.00 C ATOM 1837 C ARG A 118 -0.085 12.480 -8.478 1.00 0.00 C ATOM 1838 O ARG A 118 0.951 11.817 -8.406 1.00 0.00 O ATOM 1839 CB ARG A 118 1.097 14.100 -9.952 1.00 0.00 C ATOM 1840 CG ARG A 118 1.361 15.539 -10.360 1.00 0.00 C ATOM 1841 CD ARG A 118 2.534 15.618 -11.318 1.00 0.00 C ATOM 1842 NE ARG A 118 2.934 16.994 -11.599 1.00 0.00 N ATOM 1843 CZ ARG A 118 3.853 17.328 -12.503 1.00 0.00 C ATOM 1844 NH1 ARG A 118 4.465 16.389 -13.216 1.00 0.00 N ATOM 1845 NH2 ARG A 118 4.174 18.601 -12.691 1.00 0.00 N ATOM 0 H ARG A 118 1.044 15.100 -7.623 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.989 14.165 -9.475 1.00 0.00 H new ATOM 0 HB2 ARG A 118 2.004 13.689 -9.509 1.00 0.00 H new ATOM 0 HB3 ARG A 118 0.886 13.515 -10.847 1.00 0.00 H new ATOM 0 HG2 ARG A 118 0.472 15.958 -10.831 1.00 0.00 H new ATOM 0 HG3 ARG A 118 1.567 16.141 -9.475 1.00 0.00 H new ATOM 0 HD2 ARG A 118 3.380 15.076 -10.897 1.00 0.00 H new ATOM 0 HD3 ARG A 118 2.270 15.122 -12.252 1.00 0.00 H new ATOM 0 HE ARG A 118 2.484 17.742 -11.072 1.00 0.00 H new ATOM 0 HH11 ARG A 118 4.232 15.406 -13.072 1.00 0.00 H new ATOM 0 HH12 ARG A 118 5.168 16.651 -13.907 1.00 0.00 H new ATOM 0 HH21 ARG A 118 3.716 19.329 -12.142 1.00 0.00 H new ATOM 0 HH22 ARG A 118 4.879 18.852 -13.385 1.00 0.00 H new ATOM 1859 N VAL A 119 -1.260 12.003 -8.116 1.00 0.00 N ATOM 1860 CA VAL A 119 -1.382 10.672 -7.553 1.00 0.00 C ATOM 1861 C VAL A 119 -2.289 9.790 -8.401 1.00 0.00 C ATOM 1862 O VAL A 119 -3.327 10.230 -8.894 1.00 0.00 O ATOM 1863 CB VAL A 119 -1.899 10.728 -6.095 1.00 0.00 C ATOM 1864 CG1 VAL A 119 -3.258 11.410 -6.018 1.00 0.00 C ATOM 1865 CG2 VAL A 119 -1.958 9.334 -5.487 1.00 0.00 C ATOM 0 H VAL A 119 -2.139 12.513 -8.201 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.386 10.230 -7.549 1.00 0.00 H new ATOM 0 HB VAL A 119 -1.194 11.323 -5.515 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.595 11.434 -4.982 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.176 12.429 -6.397 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.978 10.856 -6.621 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -2.324 9.399 -4.462 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.631 8.709 -6.074 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.961 8.894 -5.489 1.00 0.00 H new ATOM 1875 N ALA A 120 -1.857 8.556 -8.595 1.00 0.00 N ATOM 1876 CA ALA A 120 -2.659 7.553 -9.265 1.00 0.00 C ATOM 1877 C ALA A 120 -2.844 6.367 -8.332 1.00 0.00 C ATOM 1878 O ALA A 120 -1.925 6.008 -7.594 1.00 0.00 O ATOM 1879 CB ALA A 120 -2.000 7.124 -10.567 1.00 0.00 C ATOM 0 H ALA A 120 -0.941 8.224 -8.292 1.00 0.00 H new ATOM 0 HA ALA A 120 -3.635 7.970 -9.513 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -2.617 6.370 -11.056 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -1.894 7.988 -11.223 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.016 6.706 -10.356 1.00 0.00 H new ATOM 1885 N ALA A 121 -4.021 5.767 -8.349 1.00 0.00 N ATOM 1886 CA ALA A 121 -4.324 4.684 -7.429 1.00 0.00 C ATOM 1887 C ALA A 121 -4.798 3.443 -8.166 1.00 0.00 C ATOM 1888 O ALA A 121 -5.814 3.466 -8.856 1.00 0.00 O ATOM 1889 CB ALA A 121 -5.365 5.126 -6.410 1.00 0.00 C ATOM 0 H ALA A 121 -4.780 6.009 -8.986 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.404 4.428 -6.904 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.580 4.303 -5.729 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -4.982 5.975 -5.844 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.279 5.417 -6.927 1.00 0.00 H new ATOM 1895 N ALA A 122 -4.049 2.366 -8.022 1.00 0.00 N ATOM 1896 CA ALA A 122 -4.433 1.089 -8.589 1.00 0.00 C ATOM 1897 C ALA A 122 -4.963 0.189 -7.485 1.00 0.00 C ATOM 1898 O ALA A 122 -4.195 -0.445 -6.763 1.00 0.00 O ATOM 1899 CB ALA A 122 -3.253 0.441 -9.301 1.00 0.00 C ATOM 0 H ALA A 122 -3.165 2.352 -7.513 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.219 1.244 -9.328 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.562 -0.517 -9.720 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.909 1.094 -10.103 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -2.442 0.282 -8.590 1.00 0.00 H new ATOM 1905 N LEU A 123 -6.275 0.163 -7.330 1.00 0.00 N ATOM 1906 CA LEU A 123 -6.889 -0.556 -6.228 1.00 0.00 C ATOM 1907 C LEU A 123 -7.493 -1.868 -6.697 1.00 0.00 C ATOM 1908 O LEU A 123 -8.413 -1.881 -7.514 1.00 0.00 O ATOM 1909 CB LEU A 123 -7.963 0.307 -5.559 1.00 0.00 C ATOM 1910 CG LEU A 123 -7.470 1.637 -4.982 1.00 0.00 C ATOM 1911 CD1 LEU A 123 -8.603 2.368 -4.283 1.00 0.00 C ATOM 1912 CD2 LEU A 123 -6.311 1.409 -4.023 1.00 0.00 C ATOM 0 H LEU A 123 -6.935 0.630 -7.952 1.00 0.00 H new ATOM 0 HA LEU A 123 -6.109 -0.781 -5.500 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.745 0.515 -6.289 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.421 -0.271 -4.756 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.117 2.257 -5.806 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -8.234 3.311 -3.879 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.402 2.567 -4.997 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -8.987 1.751 -3.471 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.975 2.366 -3.624 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.637 0.769 -3.204 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.489 0.929 -4.554 1.00 0.00 H new ATOM 1924 N ILE A 124 -6.959 -2.967 -6.186 1.00 0.00 N ATOM 1925 CA ILE A 124 -7.489 -4.288 -6.479 1.00 0.00 C ATOM 1926 C ILE A 124 -8.326 -4.773 -5.301 1.00 0.00 C ATOM 1927 O ILE A 124 -7.872 -4.747 -4.157 1.00 0.00 O ATOM 1928 CB ILE A 124 -6.357 -5.302 -6.760 1.00 0.00 C ATOM 1929 CG1 ILE A 124 -5.448 -4.785 -7.880 1.00 0.00 C ATOM 1930 CG2 ILE A 124 -6.936 -6.663 -7.131 1.00 0.00 C ATOM 1931 CD1 ILE A 124 -4.255 -5.675 -8.160 1.00 0.00 C ATOM 0 H ILE A 124 -6.153 -2.968 -5.562 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.107 -4.214 -7.374 1.00 0.00 H new ATOM 0 HB ILE A 124 -5.763 -5.418 -5.853 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.035 -4.682 -8.793 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.092 -3.789 -7.616 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.124 -7.363 -7.325 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.547 -7.035 -6.308 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.552 -6.565 -8.025 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -3.660 -5.243 -8.964 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.644 -5.758 -7.261 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.601 -6.665 -8.456 1.00 0.00 H new ATOM 1943 N ALA A 125 -9.549 -5.194 -5.579 1.00 0.00 N ATOM 1944 CA ALA A 125 -10.453 -5.654 -4.540 1.00 0.00 C ATOM 1945 C ALA A 125 -10.052 -7.036 -4.052 1.00 0.00 C ATOM 1946 O ALA A 125 -9.293 -7.742 -4.716 1.00 0.00 O ATOM 1947 CB ALA A 125 -11.886 -5.666 -5.049 1.00 0.00 C ATOM 0 H ALA A 125 -9.939 -5.226 -6.521 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.389 -4.962 -3.700 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -12.550 -6.013 -4.258 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -12.174 -4.658 -5.349 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -11.962 -6.335 -5.906 1.00 0.00 H new ATOM 1953 N VAL A 126 -10.564 -7.420 -2.892 1.00 0.00 N ATOM 1954 CA VAL A 126 -10.263 -8.721 -2.320 1.00 0.00 C ATOM 1955 C VAL A 126 -10.822 -9.837 -3.203 1.00 0.00 C ATOM 1956 O VAL A 126 -11.988 -9.802 -3.608 1.00 0.00 O ATOM 1957 CB VAL A 126 -10.808 -8.852 -0.883 1.00 0.00 C ATOM 1958 CG1 VAL A 126 -10.052 -7.923 0.058 1.00 0.00 C ATOM 1959 CG2 VAL A 126 -12.301 -8.552 -0.829 1.00 0.00 C ATOM 0 H VAL A 126 -11.191 -6.846 -2.328 1.00 0.00 H new ATOM 0 HA VAL A 126 -9.178 -8.816 -2.274 1.00 0.00 H new ATOM 0 HB VAL A 126 -10.658 -9.883 -0.561 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -10.448 -8.027 1.068 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -8.994 -8.184 0.055 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -10.172 -6.892 -0.274 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -12.655 -8.653 0.197 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -12.481 -7.535 -1.177 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -12.836 -9.254 -1.468 1.00 0.00 H new