USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=16 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 Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 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 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -16:sc= -1.68! USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=-0.0069) USER MOD Single : A 32 GLN : amide:sc= -3.46! C(o=-3.5!,f=-6.7!) USER MOD Single : A 34 SER OG : rot 167:sc=-0.00245 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -0.302 X(o=-0.3,f=-0.43) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot -89:sc= 2.09 USER MOD Single : A 59 GLN : amide:sc= -0.0111 K(o=-0.011,f=-0.56) USER MOD Single : A 64 ASN : amide:sc= -1.07 K(o=-1.1,f=-0.084) USER MOD Single : A 66 ASN : amide:sc= -0.05 X(o=-0.05,f=-0.019) USER MOD Single : A 70 THR OG1 : rot 7:sc= 0.3 USER MOD Single : A 75 THR OG1 : rot 126:sc= -1.14! USER MOD Single : A 85 GLN : amide:sc= -0.985 K(o=-0.98,f=-0.092) USER MOD Single : A 94 ASN : amide:sc= -1.93! K(o=-1.9!,f=-0.17) USER MOD Single : A 99 THR OG1 : rot 44:sc= 0.231 USER MOD Single : A 100 MET CE :methyl 167:sc= 0 (180deg=-0.186) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 102 THR OG1 : rot 120:sc= 0.00943 USER MOD Single : A 108 THR OG1 : rot 93:sc= 1.34 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -0.654 K(o=-0.65,f=-3!) USER MOD Single : A 112 MET CE :methyl 168:sc= 0 (180deg=-0.125) USER MOD ----------------------------------------------------------------- ATOM 148 N PHE A 10 -16.443 8.519 -13.047 1.00 0.00 N ATOM 149 CA PHE A 10 -16.467 9.354 -11.864 1.00 0.00 C ATOM 150 C PHE A 10 -15.302 10.331 -11.923 1.00 0.00 C ATOM 151 O PHE A 10 -14.144 9.911 -11.993 1.00 0.00 O ATOM 152 CB PHE A 10 -16.386 8.483 -10.609 1.00 0.00 C ATOM 153 CG PHE A 10 -17.385 7.358 -10.606 1.00 0.00 C ATOM 154 CD1 PHE A 10 -18.667 7.549 -10.118 1.00 0.00 C ATOM 155 CD2 PHE A 10 -17.044 6.110 -11.110 1.00 0.00 C ATOM 156 CE1 PHE A 10 -19.588 6.519 -10.130 1.00 0.00 C ATOM 157 CE2 PHE A 10 -17.962 5.078 -11.126 1.00 0.00 C ATOM 158 CZ PHE A 10 -19.236 5.282 -10.635 1.00 0.00 C ATOM 0 HA PHE A 10 -17.400 9.917 -11.825 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -15.381 8.069 -10.526 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -16.548 9.107 -9.730 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -18.950 8.514 -9.724 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -16.048 5.944 -11.494 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -20.584 6.681 -9.744 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -17.683 4.113 -11.522 1.00 0.00 H new ATOM 0 HZ PHE A 10 -19.956 4.477 -10.646 1.00 0.00 H new ATOM 168 N PRO A 11 -15.592 11.639 -11.928 1.00 0.00 N ATOM 169 CA PRO A 11 -14.575 12.682 -12.065 1.00 0.00 C ATOM 170 C PRO A 11 -13.725 12.845 -10.807 1.00 0.00 C ATOM 171 O PRO A 11 -13.936 13.770 -10.024 1.00 0.00 O ATOM 172 CB PRO A 11 -15.385 13.962 -12.339 1.00 0.00 C ATOM 173 CG PRO A 11 -16.796 13.513 -12.549 1.00 0.00 C ATOM 174 CD PRO A 11 -16.936 12.217 -11.810 1.00 0.00 C ATOM 0 HA PRO A 11 -13.864 12.441 -12.856 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -15.316 14.656 -11.501 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -15.006 14.484 -13.217 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.501 14.254 -12.172 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -17.009 13.381 -13.610 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.222 12.372 -10.770 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -17.695 11.575 -12.257 1.00 0.00 H new ATOM 182 N ARG A 12 -12.781 11.921 -10.626 1.00 0.00 N ATOM 183 CA ARG A 12 -11.839 11.954 -9.507 1.00 0.00 C ATOM 184 C ARG A 12 -12.573 11.980 -8.164 1.00 0.00 C ATOM 185 O ARG A 12 -12.677 13.020 -7.515 1.00 0.00 O ATOM 186 CB ARG A 12 -10.893 13.155 -9.637 1.00 0.00 C ATOM 187 CG ARG A 12 -9.775 13.183 -8.607 1.00 0.00 C ATOM 188 CD ARG A 12 -8.849 14.368 -8.833 1.00 0.00 C ATOM 189 NE ARG A 12 -9.539 15.649 -8.676 1.00 0.00 N ATOM 190 CZ ARG A 12 -9.623 16.580 -9.629 1.00 0.00 C ATOM 191 NH1 ARG A 12 -9.089 16.370 -10.825 1.00 0.00 N ATOM 192 NH2 ARG A 12 -10.250 17.720 -9.378 1.00 0.00 N ATOM 0 H ARG A 12 -12.648 11.127 -11.252 1.00 0.00 H new ATOM 0 HA ARG A 12 -11.244 11.041 -9.540 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -10.453 13.150 -10.634 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -11.475 14.073 -9.550 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -10.201 13.237 -7.605 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -9.204 12.256 -8.661 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -8.018 14.317 -8.129 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -8.423 14.308 -9.834 1.00 0.00 H new ATOM 0 HE ARG A 12 -9.985 15.843 -7.779 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -8.610 15.492 -11.022 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -9.158 17.087 -11.547 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -10.665 17.882 -8.461 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -10.317 18.435 -10.102 1.00 0.00 H new ATOM 206 N THR A 13 -13.090 10.830 -7.762 1.00 0.00 N ATOM 207 CA THR A 13 -13.805 10.722 -6.505 1.00 0.00 C ATOM 208 C THR A 13 -12.881 10.206 -5.405 1.00 0.00 C ATOM 209 O THR A 13 -12.131 9.250 -5.607 1.00 0.00 O ATOM 210 CB THR A 13 -15.048 9.805 -6.630 1.00 0.00 C ATOM 211 OG1 THR A 13 -15.718 9.687 -5.366 1.00 0.00 O ATOM 212 CG2 THR A 13 -14.672 8.419 -7.139 1.00 0.00 C ATOM 0 H THR A 13 -13.027 9.959 -8.290 1.00 0.00 H new ATOM 0 HA THR A 13 -14.151 11.721 -6.240 1.00 0.00 H new ATOM 0 HB THR A 13 -15.720 10.267 -7.354 1.00 0.00 H new ATOM 0 HG1 THR A 13 -16.501 9.106 -5.464 1.00 0.00 H new ATOM 0 HG21 THR A 13 -15.568 7.803 -7.214 1.00 0.00 H new ATOM 0 HG22 THR A 13 -14.208 8.506 -8.121 1.00 0.00 H new ATOM 0 HG23 THR A 13 -13.970 7.955 -6.446 1.00 0.00 H new ATOM 220 N ALA A 14 -12.925 10.862 -4.257 1.00 0.00 N ATOM 221 CA ALA A 14 -12.134 10.449 -3.109 1.00 0.00 C ATOM 222 C ALA A 14 -13.032 9.834 -2.047 1.00 0.00 C ATOM 223 O ALA A 14 -12.569 9.173 -1.115 1.00 0.00 O ATOM 224 CB ALA A 14 -11.372 11.637 -2.540 1.00 0.00 C ATOM 0 H ALA A 14 -13.503 11.687 -4.095 1.00 0.00 H new ATOM 0 HA ALA A 14 -11.413 9.698 -3.431 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -10.784 11.314 -1.681 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -10.708 12.042 -3.303 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -12.078 12.406 -2.228 1.00 0.00 H new ATOM 230 N ALA A 15 -14.332 10.048 -2.200 1.00 0.00 N ATOM 231 CA ALA A 15 -15.301 9.539 -1.250 1.00 0.00 C ATOM 232 C ALA A 15 -15.805 8.162 -1.666 1.00 0.00 C ATOM 233 O ALA A 15 -16.623 8.030 -2.579 1.00 0.00 O ATOM 234 CB ALA A 15 -16.462 10.512 -1.110 1.00 0.00 C ATOM 0 H ALA A 15 -14.736 10.572 -2.976 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.809 9.438 -0.283 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.183 10.118 -0.394 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.090 11.474 -0.758 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.946 10.642 -2.078 1.00 0.00 H new ATOM 240 N ILE A 16 -15.291 7.139 -1.001 1.00 0.00 N ATOM 241 CA ILE A 16 -15.747 5.773 -1.210 1.00 0.00 C ATOM 242 C ILE A 16 -16.562 5.329 -0.002 1.00 0.00 C ATOM 243 O ILE A 16 -16.093 5.419 1.132 1.00 0.00 O ATOM 244 CB ILE A 16 -14.562 4.803 -1.431 1.00 0.00 C ATOM 245 CG1 ILE A 16 -13.714 5.272 -2.620 1.00 0.00 C ATOM 246 CG2 ILE A 16 -15.065 3.382 -1.658 1.00 0.00 C ATOM 247 CD1 ILE A 16 -12.486 4.421 -2.873 1.00 0.00 C ATOM 0 H ILE A 16 -14.551 7.231 -0.305 1.00 0.00 H new ATOM 0 HA ILE A 16 -16.363 5.750 -2.109 1.00 0.00 H new ATOM 0 HB ILE A 16 -13.940 4.802 -0.536 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -14.333 5.274 -3.517 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -13.401 6.302 -2.447 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -14.216 2.716 -1.811 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -15.632 3.053 -0.787 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -15.707 3.360 -2.538 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -11.939 4.817 -3.729 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -11.844 4.438 -1.993 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -12.791 3.395 -3.080 1.00 0.00 H new ATOM 259 N ASP A 17 -17.781 4.871 -0.245 1.00 0.00 N ATOM 260 CA ASP A 17 -18.704 4.556 0.839 1.00 0.00 C ATOM 261 C ASP A 17 -18.491 3.141 1.360 1.00 0.00 C ATOM 262 O ASP A 17 -18.216 2.941 2.546 1.00 0.00 O ATOM 263 CB ASP A 17 -20.154 4.737 0.374 1.00 0.00 C ATOM 264 CG ASP A 17 -20.438 6.151 -0.093 1.00 0.00 C ATOM 265 OD1 ASP A 17 -20.617 7.044 0.762 1.00 0.00 O ATOM 266 OD2 ASP A 17 -20.477 6.380 -1.322 1.00 0.00 O ATOM 0 H ASP A 17 -18.155 4.709 -1.180 1.00 0.00 H new ATOM 0 HA ASP A 17 -18.503 5.247 1.657 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -20.362 4.040 -0.438 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -20.829 4.485 1.192 1.00 0.00 H new ATOM 271 N ALA A 18 -18.618 2.156 0.481 1.00 0.00 N ATOM 272 CA ALA A 18 -18.458 0.766 0.876 1.00 0.00 C ATOM 273 C ALA A 18 -17.677 -0.012 -0.171 1.00 0.00 C ATOM 274 O ALA A 18 -17.792 0.248 -1.365 1.00 0.00 O ATOM 275 CB ALA A 18 -19.820 0.125 1.107 1.00 0.00 C ATOM 0 H ALA A 18 -18.831 2.294 -0.507 1.00 0.00 H new ATOM 0 HA ALA A 18 -17.893 0.739 1.808 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -19.687 -0.916 1.402 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -20.346 0.662 1.897 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -20.404 0.169 0.188 1.00 0.00 H new ATOM 281 N TYR A 19 -16.869 -0.961 0.282 1.00 0.00 N ATOM 282 CA TYR A 19 -16.105 -1.805 -0.623 1.00 0.00 C ATOM 283 C TYR A 19 -15.898 -3.187 -0.012 1.00 0.00 C ATOM 284 O TYR A 19 -15.971 -3.349 1.208 1.00 0.00 O ATOM 285 CB TYR A 19 -14.750 -1.159 -0.961 1.00 0.00 C ATOM 286 CG TYR A 19 -13.820 -0.978 0.225 1.00 0.00 C ATOM 287 CD1 TYR A 19 -13.921 0.137 1.049 1.00 0.00 C ATOM 288 CD2 TYR A 19 -12.836 -1.918 0.511 1.00 0.00 C ATOM 289 CE1 TYR A 19 -13.069 0.306 2.126 1.00 0.00 C ATOM 290 CE2 TYR A 19 -11.984 -1.755 1.587 1.00 0.00 C ATOM 291 CZ TYR A 19 -12.105 -0.642 2.390 1.00 0.00 C ATOM 292 OH TYR A 19 -11.259 -0.477 3.463 1.00 0.00 O ATOM 0 H TYR A 19 -16.726 -1.165 1.271 1.00 0.00 H new ATOM 0 HA TYR A 19 -16.671 -1.913 -1.548 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -14.247 -1.772 -1.709 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -14.931 -0.185 -1.416 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -14.676 0.882 0.846 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -12.736 -2.790 -0.118 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -13.159 1.178 2.757 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -11.227 -2.496 1.797 1.00 0.00 H new ATOM 0 HH TYR A 19 -10.639 -1.234 3.510 1.00 0.00 H new ATOM 302 N GLY A 20 -15.674 -4.181 -0.862 1.00 0.00 N ATOM 303 CA GLY A 20 -15.358 -5.516 -0.386 1.00 0.00 C ATOM 304 C GLY A 20 -16.586 -6.355 -0.101 1.00 0.00 C ATOM 305 O GLY A 20 -16.740 -7.442 -0.655 1.00 0.00 O ATOM 0 H GLY A 20 -15.706 -4.087 -1.877 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -14.744 -6.024 -1.130 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -14.760 -5.439 0.522 1.00 0.00 H new ATOM 309 N LYS A 21 -17.455 -5.839 0.759 1.00 0.00 N ATOM 310 CA LYS A 21 -18.661 -6.553 1.191 1.00 0.00 C ATOM 311 C LYS A 21 -19.472 -7.051 -0.003 1.00 0.00 C ATOM 312 O LYS A 21 -19.606 -8.256 -0.221 1.00 0.00 O ATOM 313 CB LYS A 21 -19.524 -5.638 2.065 1.00 0.00 C ATOM 314 CG LYS A 21 -18.805 -5.118 3.302 1.00 0.00 C ATOM 315 CD LYS A 21 -19.701 -4.225 4.147 1.00 0.00 C ATOM 316 CE LYS A 21 -20.912 -4.978 4.675 1.00 0.00 C ATOM 317 NZ LYS A 21 -21.745 -4.129 5.565 1.00 0.00 N ATOM 0 H LYS A 21 -17.349 -4.916 1.179 1.00 0.00 H new ATOM 0 HA LYS A 21 -18.349 -7.422 1.771 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -19.860 -4.790 1.468 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -20.416 -6.182 2.376 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -18.462 -5.960 3.903 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -17.919 -4.560 2.999 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -19.129 -3.824 4.984 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -20.033 -3.375 3.551 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -21.516 -5.328 3.838 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -20.581 -5.861 5.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -22.561 -4.678 5.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -21.176 -3.815 6.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -22.082 -3.299 5.037 1.00 0.00 H new ATOM 331 N GLY A 22 -20.001 -6.117 -0.777 1.00 0.00 N ATOM 332 CA GLY A 22 -20.747 -6.472 -1.967 1.00 0.00 C ATOM 333 C GLY A 22 -20.132 -5.854 -3.201 1.00 0.00 C ATOM 334 O GLY A 22 -20.837 -5.386 -4.097 1.00 0.00 O ATOM 0 H GLY A 22 -19.927 -5.115 -0.602 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -20.772 -7.556 -2.074 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -21.780 -6.138 -1.866 1.00 0.00 H new ATOM 338 N GLY A 23 -18.808 -5.852 -3.238 1.00 0.00 N ATOM 339 CA GLY A 23 -18.094 -5.199 -4.310 1.00 0.00 C ATOM 340 C GLY A 23 -17.779 -3.764 -3.961 1.00 0.00 C ATOM 341 O GLY A 23 -17.918 -3.362 -2.803 1.00 0.00 O ATOM 0 H GLY A 23 -18.213 -6.295 -2.538 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -17.169 -5.738 -4.515 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -18.691 -5.232 -5.221 1.00 0.00 H new ATOM 345 N PHE A 24 -17.340 -2.995 -4.940 1.00 0.00 N ATOM 346 CA PHE A 24 -17.116 -1.573 -4.736 1.00 0.00 C ATOM 347 C PHE A 24 -18.426 -0.815 -4.892 1.00 0.00 C ATOM 348 O PHE A 24 -18.975 -0.736 -5.991 1.00 0.00 O ATOM 349 CB PHE A 24 -16.075 -1.036 -5.723 1.00 0.00 C ATOM 350 CG PHE A 24 -14.685 -1.548 -5.472 1.00 0.00 C ATOM 351 CD1 PHE A 24 -13.840 -0.887 -4.595 1.00 0.00 C ATOM 352 CD2 PHE A 24 -14.224 -2.688 -6.110 1.00 0.00 C ATOM 353 CE1 PHE A 24 -12.559 -1.352 -4.360 1.00 0.00 C ATOM 354 CE2 PHE A 24 -12.945 -3.158 -5.878 1.00 0.00 C ATOM 355 CZ PHE A 24 -12.113 -2.490 -5.003 1.00 0.00 C ATOM 0 H PHE A 24 -17.132 -3.328 -5.881 1.00 0.00 H new ATOM 0 HA PHE A 24 -16.734 -1.426 -3.726 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -16.375 -1.305 -6.736 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -16.066 0.053 -5.672 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -14.186 0.002 -4.089 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -14.871 -3.215 -6.796 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -11.909 -0.827 -3.676 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -12.597 -4.048 -6.381 1.00 0.00 H new ATOM 0 HZ PHE A 24 -11.114 -2.857 -4.821 1.00 0.00 H new ATOM 365 N TYR A 25 -18.933 -0.284 -3.789 1.00 0.00 N ATOM 366 CA TYR A 25 -20.190 0.441 -3.806 1.00 0.00 C ATOM 367 C TYR A 25 -19.953 1.918 -3.530 1.00 0.00 C ATOM 368 O TYR A 25 -19.772 2.333 -2.381 1.00 0.00 O ATOM 369 CB TYR A 25 -21.176 -0.141 -2.783 1.00 0.00 C ATOM 370 CG TYR A 25 -22.558 0.490 -2.834 1.00 0.00 C ATOM 371 CD1 TYR A 25 -22.862 1.631 -2.099 1.00 0.00 C ATOM 372 CD2 TYR A 25 -23.555 -0.053 -3.630 1.00 0.00 C ATOM 373 CE1 TYR A 25 -24.119 2.206 -2.156 1.00 0.00 C ATOM 374 CE2 TYR A 25 -24.812 0.514 -3.695 1.00 0.00 C ATOM 375 CZ TYR A 25 -25.090 1.644 -2.959 1.00 0.00 C ATOM 376 OH TYR A 25 -26.344 2.215 -3.033 1.00 0.00 O ATOM 0 H TYR A 25 -18.491 -0.343 -2.872 1.00 0.00 H new ATOM 0 HA TYR A 25 -20.628 0.334 -4.798 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -21.270 -1.214 -2.953 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -20.765 -0.012 -1.782 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -22.103 2.076 -1.473 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -23.344 -0.938 -4.211 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -24.339 3.090 -1.575 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -25.574 0.073 -4.320 1.00 0.00 H new ATOM 0 HH TYR A 25 -26.905 1.694 -3.644 1.00 0.00 H new ATOM 386 N PHE A 26 -19.915 2.695 -4.594 1.00 0.00 N ATOM 387 CA PHE A 26 -19.834 4.136 -4.489 1.00 0.00 C ATOM 388 C PHE A 26 -20.680 4.765 -5.586 1.00 0.00 C ATOM 389 O PHE A 26 -20.697 4.274 -6.718 1.00 0.00 O ATOM 390 CB PHE A 26 -18.379 4.627 -4.550 1.00 0.00 C ATOM 391 CG PHE A 26 -17.608 4.176 -5.761 1.00 0.00 C ATOM 392 CD1 PHE A 26 -17.066 2.901 -5.822 1.00 0.00 C ATOM 393 CD2 PHE A 26 -17.410 5.033 -6.831 1.00 0.00 C ATOM 394 CE1 PHE A 26 -16.347 2.492 -6.927 1.00 0.00 C ATOM 395 CE2 PHE A 26 -16.693 4.628 -7.938 1.00 0.00 C ATOM 396 CZ PHE A 26 -16.160 3.356 -7.988 1.00 0.00 C ATOM 0 H PHE A 26 -19.939 2.346 -5.552 1.00 0.00 H new ATOM 0 HA PHE A 26 -20.224 4.442 -3.518 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -18.377 5.717 -4.521 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -17.857 4.284 -3.657 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -17.208 2.220 -4.996 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -17.822 6.031 -6.798 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -15.931 1.496 -6.962 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.549 5.307 -8.766 1.00 0.00 H new ATOM 0 HZ PHE A 26 -15.599 3.037 -8.854 1.00 0.00 H new ATOM 406 N ALA A 27 -21.424 5.806 -5.221 1.00 0.00 N ATOM 407 CA ALA A 27 -22.330 6.499 -6.135 1.00 0.00 C ATOM 408 C ALA A 27 -23.495 5.600 -6.546 1.00 0.00 C ATOM 409 O ALA A 27 -24.236 5.907 -7.482 1.00 0.00 O ATOM 410 CB ALA A 27 -21.588 7.017 -7.361 1.00 0.00 C ATOM 0 H ALA A 27 -21.416 6.195 -4.278 1.00 0.00 H new ATOM 0 HA ALA A 27 -22.739 7.358 -5.602 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -22.289 7.528 -8.022 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -20.811 7.714 -7.048 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -21.133 6.180 -7.891 1.00 0.00 H new ATOM 416 N GLY A 28 -23.663 4.495 -5.831 1.00 0.00 N ATOM 417 CA GLY A 28 -24.785 3.612 -6.077 1.00 0.00 C ATOM 418 C GLY A 28 -24.433 2.407 -6.924 1.00 0.00 C ATOM 419 O GLY A 28 -25.238 1.487 -7.063 1.00 0.00 O ATOM 0 H GLY A 28 -23.039 4.194 -5.082 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -25.184 3.270 -5.122 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -25.578 4.174 -6.571 1.00 0.00 H new ATOM 423 N MET A 29 -23.236 2.396 -7.492 1.00 0.00 N ATOM 424 CA MET A 29 -22.825 1.290 -8.350 1.00 0.00 C ATOM 425 C MET A 29 -22.185 0.180 -7.526 1.00 0.00 C ATOM 426 O MET A 29 -21.838 0.383 -6.363 1.00 0.00 O ATOM 427 CB MET A 29 -21.857 1.772 -9.431 1.00 0.00 C ATOM 428 CG MET A 29 -22.359 1.510 -10.844 1.00 0.00 C ATOM 429 SD MET A 29 -22.609 -0.245 -11.183 1.00 0.00 S ATOM 430 CE MET A 29 -23.320 -0.169 -12.828 1.00 0.00 C ATOM 0 H MET A 29 -22.538 3.131 -7.378 1.00 0.00 H new ATOM 0 HA MET A 29 -23.715 0.892 -8.837 1.00 0.00 H new ATOM 0 HB2 MET A 29 -21.685 2.841 -9.306 1.00 0.00 H new ATOM 0 HB3 MET A 29 -20.896 1.277 -9.296 1.00 0.00 H new ATOM 0 HG2 MET A 29 -23.298 2.042 -10.996 1.00 0.00 H new ATOM 0 HG3 MET A 29 -21.644 1.915 -11.560 1.00 0.00 H new ATOM 0 HE1 MET A 29 -23.532 -1.179 -13.180 1.00 0.00 H new ATOM 0 HE2 MET A 29 -24.245 0.407 -12.798 1.00 0.00 H new ATOM 0 HE3 MET A 29 -22.616 0.311 -13.507 1.00 0.00 H new ATOM 440 N SER A 30 -22.049 -0.996 -8.127 1.00 0.00 N ATOM 441 CA SER A 30 -21.447 -2.143 -7.458 1.00 0.00 C ATOM 442 C SER A 30 -20.788 -3.067 -8.473 1.00 0.00 C ATOM 443 O SER A 30 -21.339 -3.306 -9.551 1.00 0.00 O ATOM 444 CB SER A 30 -22.501 -2.924 -6.671 1.00 0.00 C ATOM 445 OG SER A 30 -23.078 -2.125 -5.657 1.00 0.00 O ATOM 0 H SER A 30 -22.350 -1.181 -9.084 1.00 0.00 H new ATOM 0 HA SER A 30 -20.691 -1.769 -6.767 1.00 0.00 H new ATOM 0 HB2 SER A 30 -23.279 -3.274 -7.349 1.00 0.00 H new ATOM 0 HB3 SER A 30 -22.045 -3.808 -6.226 1.00 0.00 H new ATOM 0 HG SER A 30 -22.519 -1.335 -5.505 1.00 0.00 H new ATOM 451 N HIS A 31 -19.613 -3.577 -8.128 1.00 0.00 N ATOM 452 CA HIS A 31 -18.907 -4.530 -8.980 1.00 0.00 C ATOM 453 C HIS A 31 -17.664 -5.059 -8.273 1.00 0.00 C ATOM 454 O HIS A 31 -16.943 -4.302 -7.620 1.00 0.00 O ATOM 455 CB HIS A 31 -18.507 -3.876 -10.313 1.00 0.00 C ATOM 456 CG HIS A 31 -17.958 -4.842 -11.323 1.00 0.00 C ATOM 457 ND1 HIS A 31 -16.611 -4.971 -11.589 1.00 0.00 N ATOM 458 CD2 HIS A 31 -18.585 -5.722 -12.139 1.00 0.00 C ATOM 459 CE1 HIS A 31 -16.434 -5.888 -12.524 1.00 0.00 C ATOM 460 NE2 HIS A 31 -17.614 -6.358 -12.872 1.00 0.00 N ATOM 0 H HIS A 31 -19.126 -3.347 -7.262 1.00 0.00 H new ATOM 0 HA HIS A 31 -19.581 -5.362 -9.185 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -19.378 -3.377 -10.738 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -17.761 -3.105 -10.119 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -19.650 -5.892 -12.202 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -15.484 -6.199 -12.933 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -17.780 -7.079 -13.574 1.00 0.00 H new ATOM 469 N GLN A 32 -17.431 -6.360 -8.390 1.00 0.00 N ATOM 470 CA GLN A 32 -16.205 -6.969 -7.890 1.00 0.00 C ATOM 471 C GLN A 32 -15.179 -7.055 -9.008 1.00 0.00 C ATOM 472 O GLN A 32 -15.317 -7.849 -9.935 1.00 0.00 O ATOM 473 CB GLN A 32 -16.480 -8.359 -7.309 1.00 0.00 C ATOM 474 CG GLN A 32 -16.996 -8.325 -5.880 1.00 0.00 C ATOM 475 CD GLN A 32 -15.903 -8.008 -4.873 1.00 0.00 C ATOM 476 OE1 GLN A 32 -15.609 -6.846 -4.597 1.00 0.00 O ATOM 477 NE2 GLN A 32 -15.306 -9.043 -4.304 1.00 0.00 N ATOM 0 H GLN A 32 -18.077 -7.016 -8.828 1.00 0.00 H new ATOM 0 HA GLN A 32 -15.809 -6.344 -7.090 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -17.209 -8.870 -7.938 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -15.562 -8.946 -7.342 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -17.786 -7.579 -5.800 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -17.442 -9.289 -5.635 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -15.578 -9.992 -4.559 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -14.574 -8.891 -3.610 1.00 0.00 H new ATOM 486 N GLY A 33 -14.172 -6.208 -8.927 1.00 0.00 N ATOM 487 CA GLY A 33 -13.140 -6.166 -9.939 1.00 0.00 C ATOM 488 C GLY A 33 -12.074 -5.163 -9.573 1.00 0.00 C ATOM 489 O GLY A 33 -12.015 -4.719 -8.430 1.00 0.00 O ATOM 0 H GLY A 33 -14.048 -5.538 -8.168 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.693 -7.154 -10.051 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -13.578 -5.903 -10.902 1.00 0.00 H new ATOM 493 N SER A 34 -11.245 -4.792 -10.526 1.00 0.00 N ATOM 494 CA SER A 34 -10.188 -3.834 -10.260 1.00 0.00 C ATOM 495 C SER A 34 -10.464 -2.516 -10.981 1.00 0.00 C ATOM 496 O SER A 34 -10.805 -2.497 -12.167 1.00 0.00 O ATOM 497 CB SER A 34 -8.843 -4.422 -10.682 1.00 0.00 C ATOM 498 OG SER A 34 -8.718 -5.759 -10.223 1.00 0.00 O ATOM 0 H SER A 34 -11.280 -5.135 -11.486 1.00 0.00 H new ATOM 0 HA SER A 34 -10.155 -3.625 -9.191 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.752 -4.394 -11.768 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.032 -3.816 -10.279 1.00 0.00 H new ATOM 0 HG SER A 34 -7.958 -6.188 -10.668 1.00 0.00 H new ATOM 504 N LEU A 35 -10.340 -1.418 -10.252 1.00 0.00 N ATOM 505 CA LEU A 35 -10.619 -0.098 -10.798 1.00 0.00 C ATOM 506 C LEU A 35 -9.397 0.799 -10.680 1.00 0.00 C ATOM 507 O LEU A 35 -8.626 0.691 -9.725 1.00 0.00 O ATOM 508 CB LEU A 35 -11.805 0.543 -10.072 1.00 0.00 C ATOM 509 CG LEU A 35 -13.144 -0.178 -10.242 1.00 0.00 C ATOM 510 CD1 LEU A 35 -14.210 0.471 -9.375 1.00 0.00 C ATOM 511 CD2 LEU A 35 -13.573 -0.173 -11.703 1.00 0.00 C ATOM 0 H LEU A 35 -10.046 -1.415 -9.275 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.870 -0.214 -11.852 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -11.573 0.597 -9.008 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.916 1.568 -10.426 1.00 0.00 H new ATOM 0 HG LEU A 35 -13.020 -1.213 -9.923 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -15.156 -0.054 -9.508 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -13.910 0.418 -8.329 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -14.330 1.515 -9.666 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.527 -0.690 -11.804 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.680 0.856 -12.047 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.820 -0.681 -12.305 1.00 0.00 H new ATOM 523 N LEU A 36 -9.228 1.681 -11.650 1.00 0.00 N ATOM 524 CA LEU A 36 -8.097 2.589 -11.661 1.00 0.00 C ATOM 525 C LEU A 36 -8.589 4.021 -11.480 1.00 0.00 C ATOM 526 O LEU A 36 -9.262 4.575 -12.353 1.00 0.00 O ATOM 527 CB LEU A 36 -7.317 2.453 -12.974 1.00 0.00 C ATOM 528 CG LEU A 36 -5.790 2.549 -12.849 1.00 0.00 C ATOM 529 CD1 LEU A 36 -5.132 2.354 -14.205 1.00 0.00 C ATOM 530 CD2 LEU A 36 -5.368 3.882 -12.244 1.00 0.00 C ATOM 0 H LEU A 36 -9.862 1.787 -12.442 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.428 2.336 -10.838 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.567 1.494 -13.427 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -7.657 3.228 -13.660 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.459 1.755 -12.180 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.050 2.425 -14.098 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -5.394 1.372 -14.599 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.480 3.125 -14.893 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.281 3.920 -12.168 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.716 4.696 -12.879 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.804 3.985 -11.251 1.00 0.00 H new ATOM 542 N PHE A 37 -8.264 4.602 -10.339 1.00 0.00 N ATOM 543 CA PHE A 37 -8.670 5.959 -10.022 1.00 0.00 C ATOM 544 C PHE A 37 -7.592 6.943 -10.455 1.00 0.00 C ATOM 545 O PHE A 37 -6.561 7.082 -9.795 1.00 0.00 O ATOM 546 CB PHE A 37 -8.937 6.100 -8.517 1.00 0.00 C ATOM 547 CG PHE A 37 -10.043 5.217 -8.005 1.00 0.00 C ATOM 548 CD1 PHE A 37 -9.813 3.877 -7.732 1.00 0.00 C ATOM 549 CD2 PHE A 37 -11.312 5.729 -7.794 1.00 0.00 C ATOM 550 CE1 PHE A 37 -10.827 3.067 -7.257 1.00 0.00 C ATOM 551 CE2 PHE A 37 -12.331 4.924 -7.320 1.00 0.00 C ATOM 552 CZ PHE A 37 -12.088 3.591 -7.053 1.00 0.00 C ATOM 0 H PHE A 37 -7.714 4.149 -9.609 1.00 0.00 H new ATOM 0 HA PHE A 37 -9.590 6.181 -10.562 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -8.021 5.870 -7.973 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -9.185 7.139 -8.298 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -8.829 3.461 -7.893 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -11.508 6.770 -8.002 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -10.633 2.026 -7.046 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -13.316 5.337 -7.159 1.00 0.00 H new ATOM 0 HZ PHE A 37 -12.883 2.959 -6.685 1.00 0.00 H new ATOM 562 N LEU A 38 -7.817 7.593 -11.586 1.00 0.00 N ATOM 563 CA LEU A 38 -6.886 8.588 -12.089 1.00 0.00 C ATOM 564 C LEU A 38 -7.251 9.963 -11.541 1.00 0.00 C ATOM 565 O LEU A 38 -8.390 10.182 -11.125 1.00 0.00 O ATOM 566 CB LEU A 38 -6.900 8.606 -13.623 1.00 0.00 C ATOM 567 CG LEU A 38 -6.373 7.337 -14.295 1.00 0.00 C ATOM 568 CD1 LEU A 38 -6.524 7.434 -15.806 1.00 0.00 C ATOM 569 CD2 LEU A 38 -4.916 7.103 -13.922 1.00 0.00 C ATOM 0 H LEU A 38 -8.638 7.448 -12.173 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.881 8.330 -11.757 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.923 8.778 -13.959 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.306 9.453 -13.966 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.961 6.490 -13.942 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.144 6.523 -16.269 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.577 7.558 -16.059 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.959 8.291 -16.174 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.557 6.196 -14.409 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.316 7.952 -14.249 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.830 6.993 -12.841 1.00 0.00 H new ATOM 581 N PRO A 39 -6.298 10.913 -11.540 1.00 0.00 N ATOM 582 CA PRO A 39 -6.525 12.280 -11.040 1.00 0.00 C ATOM 583 C PRO A 39 -7.481 13.090 -11.921 1.00 0.00 C ATOM 584 O PRO A 39 -7.549 14.317 -11.817 1.00 0.00 O ATOM 585 CB PRO A 39 -5.126 12.916 -11.058 1.00 0.00 C ATOM 586 CG PRO A 39 -4.171 11.781 -11.224 1.00 0.00 C ATOM 587 CD PRO A 39 -4.912 10.732 -11.996 1.00 0.00 C ATOM 0 HA PRO A 39 -6.993 12.264 -10.056 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -5.031 13.631 -11.875 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -4.931 13.460 -10.134 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -3.275 12.099 -11.757 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -3.847 11.398 -10.256 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -4.817 10.879 -13.072 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -4.541 9.731 -11.777 1.00 0.00 H new ATOM 595 N ASP A 40 -8.227 12.399 -12.770 1.00 0.00 N ATOM 596 CA ASP A 40 -9.186 13.039 -13.660 1.00 0.00 C ATOM 597 C ASP A 40 -10.502 12.275 -13.670 1.00 0.00 C ATOM 598 O ASP A 40 -11.565 12.848 -13.434 1.00 0.00 O ATOM 599 CB ASP A 40 -8.635 13.137 -15.086 1.00 0.00 C ATOM 600 CG ASP A 40 -7.554 14.188 -15.217 1.00 0.00 C ATOM 601 OD1 ASP A 40 -7.879 15.389 -15.119 1.00 0.00 O ATOM 602 OD2 ASP A 40 -6.376 13.822 -15.423 1.00 0.00 O ATOM 0 H ASP A 40 -8.186 11.384 -12.862 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.362 14.047 -13.285 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -8.234 12.168 -15.385 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -9.449 13.370 -15.772 1.00 0.00 H new ATOM 607 N ALA A 41 -10.426 10.977 -13.935 1.00 0.00 N ATOM 608 CA ALA A 41 -11.614 10.139 -13.985 1.00 0.00 C ATOM 609 C ALA A 41 -11.281 8.711 -13.578 1.00 0.00 C ATOM 610 O ALA A 41 -10.122 8.300 -13.616 1.00 0.00 O ATOM 611 CB ALA A 41 -12.225 10.165 -15.379 1.00 0.00 C ATOM 0 H ALA A 41 -9.553 10.483 -14.119 1.00 0.00 H new ATOM 0 HA ALA A 41 -12.343 10.536 -13.279 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -13.113 9.533 -15.399 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.502 11.188 -15.636 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.499 9.793 -16.102 1.00 0.00 H new ATOM 617 N VAL A 42 -12.299 7.966 -13.180 1.00 0.00 N ATOM 618 CA VAL A 42 -12.129 6.569 -12.818 1.00 0.00 C ATOM 619 C VAL A 42 -12.317 5.679 -14.043 1.00 0.00 C ATOM 620 O VAL A 42 -13.277 5.847 -14.805 1.00 0.00 O ATOM 621 CB VAL A 42 -13.125 6.145 -11.717 1.00 0.00 C ATOM 622 CG1 VAL A 42 -12.899 4.697 -11.300 1.00 0.00 C ATOM 623 CG2 VAL A 42 -13.016 7.072 -10.516 1.00 0.00 C ATOM 0 H VAL A 42 -13.257 8.308 -13.099 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.117 6.451 -12.431 1.00 0.00 H new ATOM 0 HB VAL A 42 -14.133 6.222 -12.125 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -13.614 4.426 -10.524 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -13.035 4.045 -12.162 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.886 4.583 -10.915 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -13.725 6.759 -9.749 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -12.004 7.029 -10.114 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -13.241 8.093 -10.823 1.00 0.00 H new ATOM 633 N TRP A 43 -11.389 4.754 -14.239 1.00 0.00 N ATOM 634 CA TRP A 43 -11.439 3.837 -15.369 1.00 0.00 C ATOM 635 C TRP A 43 -11.387 2.391 -14.889 1.00 0.00 C ATOM 636 O TRP A 43 -10.938 2.110 -13.777 1.00 0.00 O ATOM 637 CB TRP A 43 -10.277 4.106 -16.329 1.00 0.00 C ATOM 638 CG TRP A 43 -10.399 5.398 -17.080 1.00 0.00 C ATOM 639 CD1 TRP A 43 -10.048 6.642 -16.641 1.00 0.00 C ATOM 640 CD2 TRP A 43 -10.901 5.569 -18.410 1.00 0.00 C ATOM 641 NE1 TRP A 43 -10.309 7.577 -17.614 1.00 0.00 N ATOM 642 CE2 TRP A 43 -10.831 6.943 -18.709 1.00 0.00 C ATOM 643 CE3 TRP A 43 -11.402 4.694 -19.377 1.00 0.00 C ATOM 644 CZ2 TRP A 43 -11.242 7.461 -19.936 1.00 0.00 C ATOM 645 CZ3 TRP A 43 -11.813 5.208 -20.593 1.00 0.00 C ATOM 646 CH2 TRP A 43 -11.730 6.580 -20.863 1.00 0.00 C ATOM 0 H TRP A 43 -10.586 4.618 -13.625 1.00 0.00 H new ATOM 0 HA TRP A 43 -12.379 4.000 -15.896 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -9.345 4.112 -15.764 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -10.211 3.286 -17.044 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -9.627 6.860 -15.671 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -10.141 8.580 -17.533 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -11.467 3.634 -19.178 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -11.178 8.518 -20.147 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -12.204 4.541 -21.347 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.058 6.951 -21.823 1.00 0.00 H new ATOM 657 N GLY A 44 -11.844 1.478 -15.735 1.00 0.00 N ATOM 658 CA GLY A 44 -11.816 0.070 -15.395 1.00 0.00 C ATOM 659 C GLY A 44 -10.494 -0.570 -15.759 1.00 0.00 C ATOM 660 O GLY A 44 -10.001 -0.395 -16.875 1.00 0.00 O ATOM 0 H GLY A 44 -12.235 1.689 -16.653 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -11.996 -0.050 -14.327 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.624 -0.445 -15.914 1.00 0.00 H new ATOM 664 N TRP A 45 -9.912 -1.295 -14.822 1.00 0.00 N ATOM 665 CA TRP A 45 -8.621 -1.933 -15.032 1.00 0.00 C ATOM 666 C TRP A 45 -8.675 -3.352 -14.478 1.00 0.00 C ATOM 667 O TRP A 45 -8.178 -3.625 -13.390 1.00 0.00 O ATOM 668 CB TRP A 45 -7.524 -1.103 -14.348 1.00 0.00 C ATOM 669 CG TRP A 45 -6.123 -1.561 -14.625 1.00 0.00 C ATOM 670 CD1 TRP A 45 -5.471 -1.537 -15.825 1.00 0.00 C ATOM 671 CD2 TRP A 45 -5.190 -2.085 -13.672 1.00 0.00 C ATOM 672 NE1 TRP A 45 -4.197 -2.027 -15.678 1.00 0.00 N ATOM 673 CE2 TRP A 45 -4.000 -2.367 -14.366 1.00 0.00 C ATOM 674 CE3 TRP A 45 -5.249 -2.347 -12.299 1.00 0.00 C ATOM 675 CZ2 TRP A 45 -2.877 -2.899 -13.733 1.00 0.00 C ATOM 676 CZ3 TRP A 45 -4.135 -2.871 -11.673 1.00 0.00 C ATOM 677 CH2 TRP A 45 -2.962 -3.142 -12.390 1.00 0.00 C ATOM 0 H TRP A 45 -10.315 -1.459 -13.900 1.00 0.00 H new ATOM 0 HA TRP A 45 -8.388 -1.986 -16.096 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -7.622 -0.065 -14.667 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -7.691 -1.123 -13.271 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -5.895 -1.184 -16.753 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -3.509 -2.122 -16.425 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -6.149 -2.143 -11.739 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -1.973 -3.111 -14.284 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -4.169 -3.075 -10.613 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -2.108 -3.551 -11.871 1.00 0.00 H new ATOM 688 N ASP A 46 -9.313 -4.243 -15.226 1.00 0.00 N ATOM 689 CA ASP A 46 -9.629 -5.579 -14.727 1.00 0.00 C ATOM 690 C ASP A 46 -8.400 -6.478 -14.670 1.00 0.00 C ATOM 691 O ASP A 46 -7.978 -7.049 -15.678 1.00 0.00 O ATOM 692 CB ASP A 46 -10.717 -6.229 -15.584 1.00 0.00 C ATOM 693 CG ASP A 46 -11.116 -7.602 -15.072 1.00 0.00 C ATOM 694 OD1 ASP A 46 -11.705 -7.682 -13.975 1.00 0.00 O ATOM 695 OD2 ASP A 46 -10.870 -8.604 -15.782 1.00 0.00 O ATOM 0 H ASP A 46 -9.623 -4.066 -16.182 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.997 -5.461 -13.708 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -11.594 -5.583 -15.604 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.363 -6.316 -16.611 1.00 0.00 H new ATOM 700 N VAL A 47 -7.820 -6.567 -13.485 1.00 0.00 N ATOM 701 CA VAL A 47 -6.730 -7.491 -13.216 1.00 0.00 C ATOM 702 C VAL A 47 -7.075 -8.305 -11.975 1.00 0.00 C ATOM 703 O VAL A 47 -6.884 -7.848 -10.848 1.00 0.00 O ATOM 704 CB VAL A 47 -5.383 -6.760 -13.009 1.00 0.00 C ATOM 705 CG1 VAL A 47 -4.260 -7.751 -12.742 1.00 0.00 C ATOM 706 CG2 VAL A 47 -5.050 -5.897 -14.217 1.00 0.00 C ATOM 0 H VAL A 47 -8.091 -6.000 -12.681 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.611 -8.142 -14.082 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.483 -6.114 -12.137 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.324 -7.211 -12.600 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.487 -8.325 -11.844 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.163 -8.428 -13.591 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -4.099 -5.391 -14.052 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.977 -6.526 -15.104 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.835 -5.155 -14.362 1.00 0.00 H new ATOM 716 N THR A 48 -7.622 -9.493 -12.201 1.00 0.00 N ATOM 717 CA THR A 48 -8.126 -10.338 -11.125 1.00 0.00 C ATOM 718 C THR A 48 -7.034 -10.697 -10.116 1.00 0.00 C ATOM 719 O THR A 48 -7.240 -10.594 -8.907 1.00 0.00 O ATOM 720 CB THR A 48 -8.747 -11.623 -11.702 1.00 0.00 C ATOM 721 OG1 THR A 48 -9.668 -11.276 -12.747 1.00 0.00 O ATOM 722 CG2 THR A 48 -9.477 -12.416 -10.626 1.00 0.00 C ATOM 0 H THR A 48 -7.729 -9.897 -13.132 1.00 0.00 H new ATOM 0 HA THR A 48 -8.890 -9.767 -10.597 1.00 0.00 H new ATOM 0 HB THR A 48 -7.944 -12.245 -12.097 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.064 -12.092 -13.118 1.00 0.00 H new ATOM 0 HG21 THR A 48 -9.904 -13.317 -11.065 1.00 0.00 H new ATOM 0 HG22 THR A 48 -8.775 -12.693 -9.839 1.00 0.00 H new ATOM 0 HG23 THR A 48 -10.275 -11.806 -10.202 1.00 0.00 H new ATOM 730 N LYS A 49 -5.876 -11.114 -10.606 1.00 0.00 N ATOM 731 CA LYS A 49 -4.776 -11.454 -9.721 1.00 0.00 C ATOM 732 C LYS A 49 -3.593 -10.529 -9.961 1.00 0.00 C ATOM 733 O LYS A 49 -3.126 -10.383 -11.092 1.00 0.00 O ATOM 734 CB LYS A 49 -4.357 -12.915 -9.887 1.00 0.00 C ATOM 735 CG LYS A 49 -5.460 -13.904 -9.536 1.00 0.00 C ATOM 736 CD LYS A 49 -4.895 -15.169 -8.908 1.00 0.00 C ATOM 737 CE LYS A 49 -4.256 -14.874 -7.560 1.00 0.00 C ATOM 738 NZ LYS A 49 -3.631 -16.082 -6.962 1.00 0.00 N ATOM 0 H LYS A 49 -5.676 -11.224 -11.600 1.00 0.00 H new ATOM 0 HA LYS A 49 -5.121 -11.321 -8.695 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -4.045 -13.081 -10.918 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.490 -13.110 -9.256 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.163 -13.437 -8.846 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.019 -14.161 -10.436 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -5.691 -15.903 -8.784 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -4.155 -15.611 -9.576 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.501 -14.097 -7.679 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -5.012 -14.482 -6.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.208 -15.836 -6.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -4.355 -16.815 -6.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.892 -16.442 -7.599 1.00 0.00 H new ATOM 752 N PRO A 50 -3.091 -9.902 -8.886 1.00 0.00 N ATOM 753 CA PRO A 50 -2.030 -8.888 -8.963 1.00 0.00 C ATOM 754 C PRO A 50 -0.684 -9.445 -9.422 1.00 0.00 C ATOM 755 O PRO A 50 0.247 -8.689 -9.677 1.00 0.00 O ATOM 756 CB PRO A 50 -1.924 -8.366 -7.529 1.00 0.00 C ATOM 757 CG PRO A 50 -2.470 -9.459 -6.677 1.00 0.00 C ATOM 758 CD PRO A 50 -3.536 -10.128 -7.497 1.00 0.00 C ATOM 0 HA PRO A 50 -2.275 -8.124 -9.701 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -0.890 -8.141 -7.267 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.493 -7.445 -7.402 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.688 -10.167 -6.401 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -2.882 -9.062 -5.749 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -3.612 -11.191 -7.267 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -4.518 -9.691 -7.313 1.00 0.00 H new ATOM 766 N GLU A 51 -0.585 -10.762 -9.531 1.00 0.00 N ATOM 767 CA GLU A 51 0.644 -11.388 -9.993 1.00 0.00 C ATOM 768 C GLU A 51 0.893 -11.055 -11.464 1.00 0.00 C ATOM 769 O GLU A 51 2.027 -11.079 -11.937 1.00 0.00 O ATOM 770 CB GLU A 51 0.581 -12.906 -9.791 1.00 0.00 C ATOM 771 CG GLU A 51 1.848 -13.630 -10.219 1.00 0.00 C ATOM 772 CD GLU A 51 1.817 -15.108 -9.900 1.00 0.00 C ATOM 773 OE1 GLU A 51 1.292 -15.888 -10.718 1.00 0.00 O ATOM 774 OE2 GLU A 51 2.322 -15.495 -8.825 1.00 0.00 O ATOM 0 H GLU A 51 -1.337 -11.414 -9.307 1.00 0.00 H new ATOM 0 HA GLU A 51 1.473 -10.995 -9.405 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.390 -13.117 -8.739 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.263 -13.304 -10.354 1.00 0.00 H new ATOM 0 HG2 GLU A 51 1.991 -13.498 -11.291 1.00 0.00 H new ATOM 0 HG3 GLU A 51 2.706 -13.174 -9.724 1.00 0.00 H new ATOM 781 N GLN A 52 -0.174 -10.712 -12.176 1.00 0.00 N ATOM 782 CA GLN A 52 -0.078 -10.428 -13.601 1.00 0.00 C ATOM 783 C GLN A 52 0.144 -8.942 -13.866 1.00 0.00 C ATOM 784 O GLN A 52 -0.185 -8.443 -14.940 1.00 0.00 O ATOM 785 CB GLN A 52 -1.332 -10.913 -14.331 1.00 0.00 C ATOM 786 CG GLN A 52 -1.483 -12.427 -14.333 1.00 0.00 C ATOM 787 CD GLN A 52 -0.256 -13.134 -14.882 1.00 0.00 C ATOM 788 OE1 GLN A 52 0.659 -13.488 -14.137 1.00 0.00 O ATOM 789 NE2 GLN A 52 -0.221 -13.341 -16.188 1.00 0.00 N ATOM 0 H GLN A 52 -1.114 -10.624 -11.790 1.00 0.00 H new ATOM 0 HA GLN A 52 0.788 -10.968 -13.984 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.210 -10.468 -13.863 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.305 -10.557 -15.361 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -1.672 -12.771 -13.316 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -2.353 -12.701 -14.929 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -0.997 -13.034 -16.774 1.00 0.00 H new ATOM 0 HE22 GLN A 52 0.582 -13.808 -16.609 1.00 0.00 H new ATOM 798 N ILE A 53 0.706 -8.238 -12.889 1.00 0.00 N ATOM 799 CA ILE A 53 1.104 -6.854 -13.096 1.00 0.00 C ATOM 800 C ILE A 53 2.391 -6.813 -13.916 1.00 0.00 C ATOM 801 O ILE A 53 3.481 -7.085 -13.409 1.00 0.00 O ATOM 802 CB ILE A 53 1.292 -6.091 -11.763 1.00 0.00 C ATOM 803 CG1 ILE A 53 -0.050 -5.960 -11.036 1.00 0.00 C ATOM 804 CG2 ILE A 53 1.900 -4.717 -12.009 1.00 0.00 C ATOM 805 CD1 ILE A 53 0.049 -5.263 -9.694 1.00 0.00 C ATOM 0 H ILE A 53 0.894 -8.601 -11.954 1.00 0.00 H new ATOM 0 HA ILE A 53 0.302 -6.353 -13.638 1.00 0.00 H new ATOM 0 HB ILE A 53 1.978 -6.658 -11.134 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.745 -5.410 -11.671 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -0.472 -6.954 -10.889 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.023 -4.198 -11.058 1.00 0.00 H new ATOM 0 HG22 ILE A 53 2.872 -4.830 -12.490 1.00 0.00 H new ATOM 0 HG23 ILE A 53 1.241 -4.138 -12.656 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.940 -5.207 -9.239 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.718 -5.824 -9.041 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.441 -4.256 -9.835 1.00 0.00 H new ATOM 817 N ASP A 54 2.240 -6.494 -15.190 1.00 0.00 N ATOM 818 CA ASP A 54 3.341 -6.528 -16.138 1.00 0.00 C ATOM 819 C ASP A 54 3.302 -5.279 -17.016 1.00 0.00 C ATOM 820 O ASP A 54 2.587 -4.331 -16.712 1.00 0.00 O ATOM 821 CB ASP A 54 3.241 -7.784 -17.010 1.00 0.00 C ATOM 822 CG ASP A 54 2.276 -7.610 -18.167 1.00 0.00 C ATOM 823 OD1 ASP A 54 1.071 -7.380 -17.927 1.00 0.00 O ATOM 824 OD2 ASP A 54 2.741 -7.653 -19.324 1.00 0.00 O ATOM 0 H ASP A 54 1.351 -6.204 -15.597 1.00 0.00 H new ATOM 0 HA ASP A 54 4.284 -6.552 -15.592 1.00 0.00 H new ATOM 0 HB2 ASP A 54 4.229 -8.033 -17.399 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.919 -8.625 -16.396 1.00 0.00 H new ATOM 829 N ARG A 55 4.047 -5.287 -18.115 1.00 0.00 N ATOM 830 CA ARG A 55 4.123 -4.121 -18.986 1.00 0.00 C ATOM 831 C ARG A 55 2.837 -3.938 -19.792 1.00 0.00 C ATOM 832 O ARG A 55 2.481 -2.815 -20.141 1.00 0.00 O ATOM 833 CB ARG A 55 5.319 -4.222 -19.935 1.00 0.00 C ATOM 834 CG ARG A 55 6.640 -4.479 -19.228 1.00 0.00 C ATOM 835 CD ARG A 55 7.825 -4.096 -20.096 1.00 0.00 C ATOM 836 NE ARG A 55 7.734 -4.649 -21.445 1.00 0.00 N ATOM 837 CZ ARG A 55 8.600 -4.379 -22.419 1.00 0.00 C ATOM 838 NH1 ARG A 55 9.614 -3.547 -22.205 1.00 0.00 N ATOM 839 NH2 ARG A 55 8.433 -4.921 -23.615 1.00 0.00 N ATOM 0 H ARG A 55 4.604 -6.084 -18.423 1.00 0.00 H new ATOM 0 HA ARG A 55 4.253 -3.250 -18.344 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.138 -5.025 -20.650 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.397 -3.297 -20.507 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.672 -3.911 -18.298 1.00 0.00 H new ATOM 0 HG3 ARG A 55 6.711 -5.533 -18.960 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.891 -3.010 -20.156 1.00 0.00 H new ATOM 0 HD3 ARG A 55 8.744 -4.445 -19.625 1.00 0.00 H new ATOM 0 HE ARG A 55 6.960 -5.280 -21.653 1.00 0.00 H new ATOM 0 HH11 ARG A 55 9.732 -3.111 -21.290 1.00 0.00 H new ATOM 0 HH12 ARG A 55 10.274 -3.344 -22.955 1.00 0.00 H new ATOM 0 HH21 ARG A 55 7.643 -5.543 -23.787 1.00 0.00 H new ATOM 0 HH22 ARG A 55 9.094 -4.717 -24.364 1.00 0.00 H new ATOM 853 N TYR A 56 2.139 -5.035 -20.085 1.00 0.00 N ATOM 854 CA TYR A 56 0.883 -4.954 -20.828 1.00 0.00 C ATOM 855 C TYR A 56 -0.213 -4.358 -19.960 1.00 0.00 C ATOM 856 O TYR A 56 -0.966 -3.490 -20.399 1.00 0.00 O ATOM 857 CB TYR A 56 0.436 -6.328 -21.336 1.00 0.00 C ATOM 858 CG TYR A 56 1.316 -6.911 -22.420 1.00 0.00 C ATOM 859 CD1 TYR A 56 1.364 -6.344 -23.688 1.00 0.00 C ATOM 860 CD2 TYR A 56 2.085 -8.037 -22.177 1.00 0.00 C ATOM 861 CE1 TYR A 56 2.160 -6.887 -24.680 1.00 0.00 C ATOM 862 CE2 TYR A 56 2.882 -8.582 -23.159 1.00 0.00 C ATOM 863 CZ TYR A 56 2.917 -8.006 -24.408 1.00 0.00 C ATOM 864 OH TYR A 56 3.714 -8.556 -25.389 1.00 0.00 O ATOM 0 H TYR A 56 2.418 -5.980 -19.822 1.00 0.00 H new ATOM 0 HA TYR A 56 1.060 -4.309 -21.689 1.00 0.00 H new ATOM 0 HB2 TYR A 56 0.409 -7.021 -20.495 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -0.582 -6.248 -21.716 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.771 -5.467 -23.902 1.00 0.00 H new ATOM 0 HD2 TYR A 56 2.059 -8.496 -21.200 1.00 0.00 H new ATOM 0 HE1 TYR A 56 2.188 -6.437 -25.661 1.00 0.00 H new ATOM 0 HE2 TYR A 56 3.477 -9.458 -22.949 1.00 0.00 H new ATOM 0 HH TYR A 56 4.181 -9.339 -25.030 1.00 0.00 H new ATOM 874 N SER A 57 -0.306 -4.825 -18.727 1.00 0.00 N ATOM 875 CA SER A 57 -1.295 -4.310 -17.797 1.00 0.00 C ATOM 876 C SER A 57 -0.943 -2.888 -17.357 1.00 0.00 C ATOM 877 O SER A 57 -1.828 -2.046 -17.175 1.00 0.00 O ATOM 878 CB SER A 57 -1.419 -5.248 -16.598 1.00 0.00 C ATOM 879 OG SER A 57 -0.148 -5.725 -16.202 1.00 0.00 O ATOM 0 H SER A 57 0.291 -5.560 -18.347 1.00 0.00 H new ATOM 0 HA SER A 57 -2.261 -4.264 -18.300 1.00 0.00 H new ATOM 0 HB2 SER A 57 -1.891 -4.724 -15.767 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.065 -6.088 -16.853 1.00 0.00 H new ATOM 0 HG SER A 57 0.062 -6.545 -16.695 1.00 0.00 H new ATOM 885 N LEU A 58 0.351 -2.611 -17.220 1.00 0.00 N ATOM 886 CA LEU A 58 0.813 -1.278 -16.842 1.00 0.00 C ATOM 887 C LEU A 58 0.948 -0.372 -18.063 1.00 0.00 C ATOM 888 O LEU A 58 1.466 0.741 -17.958 1.00 0.00 O ATOM 889 CB LEU A 58 2.157 -1.352 -16.110 1.00 0.00 C ATOM 890 CG LEU A 58 2.133 -2.053 -14.749 1.00 0.00 C ATOM 891 CD1 LEU A 58 3.530 -2.083 -14.148 1.00 0.00 C ATOM 892 CD2 LEU A 58 1.161 -1.363 -13.805 1.00 0.00 C ATOM 0 H LEU A 58 1.098 -3.291 -17.365 1.00 0.00 H new ATOM 0 HA LEU A 58 0.065 -0.854 -16.172 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.871 -1.868 -16.751 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.530 -0.337 -15.969 1.00 0.00 H new ATOM 0 HG LEU A 58 1.794 -3.079 -14.895 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.499 -2.584 -13.180 1.00 0.00 H new ATOM 0 HD12 LEU A 58 4.202 -2.623 -14.815 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.892 -1.063 -14.017 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.160 -1.877 -12.844 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.467 -0.327 -13.661 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.158 -1.390 -14.232 1.00 0.00 H new ATOM 904 N GLN A 59 0.475 -0.842 -19.215 1.00 0.00 N ATOM 905 CA GLN A 59 0.507 -0.048 -20.442 1.00 0.00 C ATOM 906 C GLN A 59 -0.172 1.298 -20.223 1.00 0.00 C ATOM 907 O GLN A 59 0.321 2.333 -20.661 1.00 0.00 O ATOM 908 CB GLN A 59 -0.183 -0.797 -21.588 1.00 0.00 C ATOM 909 CG GLN A 59 -0.241 -0.018 -22.897 1.00 0.00 C ATOM 910 CD GLN A 59 1.132 0.281 -23.471 1.00 0.00 C ATOM 911 OE1 GLN A 59 2.079 -0.480 -23.279 1.00 0.00 O ATOM 912 NE2 GLN A 59 1.248 1.389 -24.187 1.00 0.00 N ATOM 0 H GLN A 59 0.065 -1.769 -19.325 1.00 0.00 H new ATOM 0 HA GLN A 59 1.550 0.120 -20.710 1.00 0.00 H new ATOM 0 HB2 GLN A 59 0.341 -1.737 -21.760 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.199 -1.049 -21.283 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -0.818 -0.587 -23.627 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.772 0.920 -22.732 1.00 0.00 H new ATOM 0 HE21 GLN A 59 0.439 1.995 -24.324 1.00 0.00 H new ATOM 0 HE22 GLN A 59 2.146 1.636 -24.602 1.00 0.00 H new ATOM 921 N ARG A 60 -1.293 1.272 -19.515 1.00 0.00 N ATOM 922 CA ARG A 60 -2.051 2.483 -19.234 1.00 0.00 C ATOM 923 C ARG A 60 -1.262 3.403 -18.307 1.00 0.00 C ATOM 924 O ARG A 60 -1.377 4.624 -18.381 1.00 0.00 O ATOM 925 CB ARG A 60 -3.396 2.121 -18.604 1.00 0.00 C ATOM 926 CG ARG A 60 -4.383 3.276 -18.558 1.00 0.00 C ATOM 927 CD ARG A 60 -5.706 2.842 -17.953 1.00 0.00 C ATOM 928 NE ARG A 60 -6.211 1.620 -18.580 1.00 0.00 N ATOM 929 CZ ARG A 60 -7.315 0.983 -18.197 1.00 0.00 C ATOM 930 NH1 ARG A 60 -8.066 1.472 -17.219 1.00 0.00 N ATOM 931 NH2 ARG A 60 -7.663 -0.147 -18.796 1.00 0.00 N ATOM 0 H ARG A 60 -1.699 0.422 -19.124 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.230 3.011 -20.171 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.840 1.298 -19.165 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.226 1.760 -17.590 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -3.963 4.094 -17.973 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -4.548 3.657 -19.566 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.581 2.677 -16.883 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -6.439 3.640 -18.069 1.00 0.00 H new ATOM 0 HE ARG A 60 -5.683 1.231 -19.361 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -7.798 2.341 -16.756 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -8.911 0.979 -16.930 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -7.086 -0.525 -19.547 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -8.508 -0.639 -18.506 1.00 0.00 H new ATOM 945 N VAL A 61 -0.445 2.806 -17.449 1.00 0.00 N ATOM 946 CA VAL A 61 0.382 3.566 -16.522 1.00 0.00 C ATOM 947 C VAL A 61 1.506 4.272 -17.268 1.00 0.00 C ATOM 948 O VAL A 61 1.755 5.453 -17.054 1.00 0.00 O ATOM 949 CB VAL A 61 0.978 2.663 -15.420 1.00 0.00 C ATOM 950 CG1 VAL A 61 1.865 3.465 -14.478 1.00 0.00 C ATOM 951 CG2 VAL A 61 -0.132 1.967 -14.646 1.00 0.00 C ATOM 0 H VAL A 61 -0.337 1.794 -17.376 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.260 4.307 -16.046 1.00 0.00 H new ATOM 0 HB VAL A 61 1.596 1.904 -15.900 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.272 2.805 -13.712 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.683 3.914 -15.042 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.276 4.251 -14.005 1.00 0.00 H new ATOM 0 HG21 VAL A 61 0.305 1.334 -13.873 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -0.776 2.714 -14.182 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -0.721 1.353 -15.327 1.00 0.00 H new ATOM 961 N PHE A 62 2.170 3.545 -18.160 1.00 0.00 N ATOM 962 CA PHE A 62 3.231 4.124 -18.978 1.00 0.00 C ATOM 963 C PHE A 62 2.661 5.141 -19.963 1.00 0.00 C ATOM 964 O PHE A 62 3.312 6.133 -20.294 1.00 0.00 O ATOM 965 CB PHE A 62 3.987 3.035 -19.745 1.00 0.00 C ATOM 966 CG PHE A 62 4.871 2.173 -18.888 1.00 0.00 C ATOM 967 CD1 PHE A 62 6.098 2.643 -18.448 1.00 0.00 C ATOM 968 CD2 PHE A 62 4.483 0.892 -18.527 1.00 0.00 C ATOM 969 CE1 PHE A 62 6.919 1.854 -17.665 1.00 0.00 C ATOM 970 CE2 PHE A 62 5.299 0.098 -17.744 1.00 0.00 C ATOM 971 CZ PHE A 62 6.520 0.580 -17.314 1.00 0.00 C ATOM 0 H PHE A 62 1.993 2.556 -18.335 1.00 0.00 H new ATOM 0 HA PHE A 62 3.926 4.629 -18.307 1.00 0.00 H new ATOM 0 HB2 PHE A 62 3.264 2.399 -20.256 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.597 3.507 -20.516 1.00 0.00 H new ATOM 0 HD1 PHE A 62 6.417 3.638 -18.720 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.530 0.510 -18.862 1.00 0.00 H new ATOM 0 HE1 PHE A 62 7.872 2.234 -17.328 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.983 -0.897 -17.469 1.00 0.00 H new ATOM 0 HZ PHE A 62 7.161 -0.039 -16.704 1.00 0.00 H new ATOM 981 N ASP A 63 1.446 4.885 -20.425 1.00 0.00 N ATOM 982 CA ASP A 63 0.792 5.756 -21.394 1.00 0.00 C ATOM 983 C ASP A 63 0.345 7.062 -20.746 1.00 0.00 C ATOM 984 O ASP A 63 0.613 8.147 -21.263 1.00 0.00 O ATOM 985 CB ASP A 63 -0.405 5.034 -22.020 1.00 0.00 C ATOM 986 CG ASP A 63 -1.107 5.865 -23.072 1.00 0.00 C ATOM 987 OD1 ASP A 63 -0.471 6.201 -24.094 1.00 0.00 O ATOM 988 OD2 ASP A 63 -2.305 6.163 -22.895 1.00 0.00 O ATOM 0 H ASP A 63 0.890 4.078 -20.144 1.00 0.00 H new ATOM 0 HA ASP A 63 1.511 6.000 -22.176 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.066 4.100 -22.468 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.116 4.772 -21.236 1.00 0.00 H new ATOM 993 N ASN A 64 -0.311 6.957 -19.598 1.00 0.00 N ATOM 994 CA ASN A 64 -0.813 8.134 -18.892 1.00 0.00 C ATOM 995 C ASN A 64 0.199 8.591 -17.837 1.00 0.00 C ATOM 996 O ASN A 64 -0.142 9.283 -16.879 1.00 0.00 O ATOM 997 CB ASN A 64 -2.171 7.815 -18.245 1.00 0.00 C ATOM 998 CG ASN A 64 -2.973 9.056 -17.879 1.00 0.00 C ATOM 999 OD1 ASN A 64 -3.680 9.616 -18.716 1.00 0.00 O ATOM 1000 ND2 ASN A 64 -2.890 9.484 -16.626 1.00 0.00 N ATOM 0 H ASN A 64 -0.509 6.071 -19.134 1.00 0.00 H new ATOM 0 HA ASN A 64 -0.951 8.947 -19.605 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -2.757 7.202 -18.930 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -2.006 7.220 -17.347 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.423 10.302 -16.330 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.294 8.995 -15.959 1.00 0.00 H new ATOM 1007 N ALA A 65 1.462 8.231 -18.050 1.00 0.00 N ATOM 1008 CA ALA A 65 2.533 8.545 -17.105 1.00 0.00 C ATOM 1009 C ALA A 65 2.770 10.047 -16.998 1.00 0.00 C ATOM 1010 O ALA A 65 3.450 10.511 -16.089 1.00 0.00 O ATOM 1011 CB ALA A 65 3.821 7.843 -17.513 1.00 0.00 C ATOM 0 H ALA A 65 1.772 7.718 -18.875 1.00 0.00 H new ATOM 0 HA ALA A 65 2.220 8.185 -16.125 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.609 8.086 -16.800 1.00 0.00 H new ATOM 0 HB2 ALA A 65 3.660 6.765 -17.523 1.00 0.00 H new ATOM 0 HB3 ALA A 65 4.117 8.175 -18.508 1.00 0.00 H new ATOM 1017 N ASN A 66 2.196 10.806 -17.923 1.00 0.00 N ATOM 1018 CA ASN A 66 2.357 12.255 -17.921 1.00 0.00 C ATOM 1019 C ASN A 66 1.641 12.865 -16.722 1.00 0.00 C ATOM 1020 O ASN A 66 2.001 13.945 -16.252 1.00 0.00 O ATOM 1021 CB ASN A 66 1.817 12.869 -19.218 1.00 0.00 C ATOM 1022 CG ASN A 66 2.390 12.212 -20.460 1.00 0.00 C ATOM 1023 OD1 ASN A 66 3.476 12.565 -20.919 1.00 0.00 O ATOM 1024 ND2 ASN A 66 1.650 11.266 -21.025 1.00 0.00 N ATOM 0 H ASN A 66 1.617 10.445 -18.681 1.00 0.00 H new ATOM 0 HA ASN A 66 3.422 12.476 -17.852 1.00 0.00 H new ATOM 0 HB2 ASN A 66 0.731 12.779 -19.233 1.00 0.00 H new ATOM 0 HB3 ASN A 66 2.049 13.934 -19.235 1.00 0.00 H new ATOM 0 HD21 ASN A 66 1.976 10.802 -21.873 1.00 0.00 H new ATOM 0 HD22 ASN A 66 0.755 11.003 -20.612 1.00 0.00 H new ATOM 1031 N ALA A 67 0.630 12.163 -16.225 1.00 0.00 N ATOM 1032 CA ALA A 67 -0.126 12.625 -15.071 1.00 0.00 C ATOM 1033 C ALA A 67 0.074 11.697 -13.878 1.00 0.00 C ATOM 1034 O ALA A 67 -0.483 11.919 -12.805 1.00 0.00 O ATOM 1035 CB ALA A 67 -1.602 12.726 -15.417 1.00 0.00 C ATOM 0 H ALA A 67 0.315 11.270 -16.605 1.00 0.00 H new ATOM 0 HA ALA A 67 0.243 13.613 -14.797 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -2.157 13.073 -14.545 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.736 13.432 -16.237 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.973 11.746 -15.717 1.00 0.00 H new ATOM 1041 N ILE A 68 0.876 10.657 -14.067 1.00 0.00 N ATOM 1042 CA ILE A 68 1.106 9.681 -13.015 1.00 0.00 C ATOM 1043 C ILE A 68 2.548 9.745 -12.525 1.00 0.00 C ATOM 1044 O ILE A 68 3.454 9.194 -13.146 1.00 0.00 O ATOM 1045 CB ILE A 68 0.784 8.241 -13.478 1.00 0.00 C ATOM 1046 CG1 ILE A 68 -0.666 8.146 -13.964 1.00 0.00 C ATOM 1047 CG2 ILE A 68 1.026 7.253 -12.343 1.00 0.00 C ATOM 1048 CD1 ILE A 68 -1.042 6.780 -14.498 1.00 0.00 C ATOM 0 H ILE A 68 1.376 10.470 -14.936 1.00 0.00 H new ATOM 0 HA ILE A 68 0.431 9.934 -12.198 1.00 0.00 H new ATOM 0 HB ILE A 68 1.445 7.989 -14.307 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.333 8.400 -13.140 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.827 8.889 -14.746 1.00 0.00 H new ATOM 0 HG21 ILE A 68 0.795 6.244 -12.684 1.00 0.00 H new ATOM 0 HG22 ILE A 68 2.070 7.302 -12.035 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.386 7.506 -11.498 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -2.082 6.790 -14.823 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.400 6.530 -15.343 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -0.914 6.035 -13.713 1.00 0.00 H new ATOM 1060 N ASP A 69 2.747 10.448 -11.423 1.00 0.00 N ATOM 1061 CA ASP A 69 4.059 10.547 -10.794 1.00 0.00 C ATOM 1062 C ASP A 69 4.123 9.632 -9.580 1.00 0.00 C ATOM 1063 O ASP A 69 5.159 9.053 -9.275 1.00 0.00 O ATOM 1064 CB ASP A 69 4.343 11.997 -10.394 1.00 0.00 C ATOM 1065 CG ASP A 69 5.421 12.134 -9.333 1.00 0.00 C ATOM 1066 OD1 ASP A 69 5.093 11.998 -8.135 1.00 0.00 O ATOM 1067 OD2 ASP A 69 6.586 12.418 -9.685 1.00 0.00 O ATOM 0 H ASP A 69 2.012 10.964 -10.940 1.00 0.00 H new ATOM 0 HA ASP A 69 4.821 10.232 -11.506 1.00 0.00 H new ATOM 0 HB2 ASP A 69 4.643 12.557 -11.279 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.423 12.451 -10.026 1.00 0.00 H new ATOM 1072 N THR A 70 3.002 9.507 -8.892 1.00 0.00 N ATOM 1073 CA THR A 70 2.901 8.631 -7.744 1.00 0.00 C ATOM 1074 C THR A 70 1.807 7.594 -7.989 1.00 0.00 C ATOM 1075 O THR A 70 0.687 7.944 -8.365 1.00 0.00 O ATOM 1076 CB THR A 70 2.584 9.438 -6.467 1.00 0.00 C ATOM 1077 OG1 THR A 70 3.444 10.587 -6.388 1.00 0.00 O ATOM 1078 CG2 THR A 70 2.765 8.583 -5.222 1.00 0.00 C ATOM 0 H THR A 70 2.142 10.008 -9.114 1.00 0.00 H new ATOM 0 HA THR A 70 3.857 8.127 -7.602 1.00 0.00 H new ATOM 0 HB THR A 70 1.544 9.760 -6.519 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.962 10.666 -7.216 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.535 9.176 -4.337 1.00 0.00 H new ATOM 0 HG22 THR A 70 2.094 7.726 -5.269 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.796 8.234 -5.167 1.00 0.00 H new ATOM 1086 N LEU A 71 2.127 6.323 -7.800 1.00 0.00 N ATOM 1087 CA LEU A 71 1.173 5.260 -8.068 1.00 0.00 C ATOM 1088 C LEU A 71 1.076 4.307 -6.887 1.00 0.00 C ATOM 1089 O LEU A 71 2.024 3.581 -6.577 1.00 0.00 O ATOM 1090 CB LEU A 71 1.572 4.488 -9.329 1.00 0.00 C ATOM 1091 CG LEU A 71 0.605 3.377 -9.747 1.00 0.00 C ATOM 1092 CD1 LEU A 71 -0.755 3.956 -10.107 1.00 0.00 C ATOM 1093 CD2 LEU A 71 1.178 2.589 -10.914 1.00 0.00 C ATOM 0 H LEU A 71 3.036 6.004 -7.464 1.00 0.00 H new ATOM 0 HA LEU A 71 0.196 5.717 -8.226 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.666 5.195 -10.154 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.557 4.049 -9.171 1.00 0.00 H new ATOM 0 HG LEU A 71 0.473 2.699 -8.904 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.427 3.150 -10.401 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.169 4.477 -9.244 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.645 4.657 -10.935 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.479 1.803 -11.200 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.339 3.257 -11.760 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.127 2.141 -10.620 1.00 0.00 H new ATOM 1105 N ILE A 72 -0.069 4.321 -6.226 1.00 0.00 N ATOM 1106 CA ILE A 72 -0.316 3.419 -5.116 1.00 0.00 C ATOM 1107 C ILE A 72 -1.256 2.306 -5.561 1.00 0.00 C ATOM 1108 O ILE A 72 -2.415 2.556 -5.903 1.00 0.00 O ATOM 1109 CB ILE A 72 -0.926 4.151 -3.900 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -0.034 5.323 -3.479 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -1.116 3.184 -2.738 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -0.593 6.133 -2.326 1.00 0.00 C ATOM 0 H ILE A 72 -0.844 4.949 -6.440 1.00 0.00 H new ATOM 0 HA ILE A 72 0.644 3.003 -4.808 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.902 4.544 -4.186 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.947 4.939 -3.199 1.00 0.00 H new ATOM 0 HG13 ILE A 72 0.114 5.981 -4.335 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -1.547 3.715 -1.889 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -1.786 2.379 -3.040 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.151 2.765 -2.452 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.094 6.945 -2.085 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.561 6.548 -2.608 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.714 5.490 -1.455 1.00 0.00 H new ATOM 1124 N VAL A 73 -0.748 1.086 -5.581 1.00 0.00 N ATOM 1125 CA VAL A 73 -1.539 -0.051 -6.011 1.00 0.00 C ATOM 1126 C VAL A 73 -2.038 -0.840 -4.809 1.00 0.00 C ATOM 1127 O VAL A 73 -1.249 -1.395 -4.046 1.00 0.00 O ATOM 1128 CB VAL A 73 -0.740 -0.984 -6.948 1.00 0.00 C ATOM 1129 CG1 VAL A 73 -1.599 -2.156 -7.407 1.00 0.00 C ATOM 1130 CG2 VAL A 73 -0.210 -0.211 -8.146 1.00 0.00 C ATOM 0 H VAL A 73 0.207 0.859 -5.305 1.00 0.00 H new ATOM 0 HA VAL A 73 -2.391 0.341 -6.567 1.00 0.00 H new ATOM 0 HB VAL A 73 0.108 -1.381 -6.390 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.015 -2.799 -8.066 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.928 -2.728 -6.539 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.469 -1.780 -7.945 1.00 0.00 H new ATOM 0 HG21 VAL A 73 0.350 -0.884 -8.795 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -1.045 0.217 -8.701 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.445 0.589 -7.802 1.00 0.00 H new ATOM 1140 N GLY A 74 -3.350 -0.861 -4.642 1.00 0.00 N ATOM 1141 CA GLY A 74 -3.957 -1.637 -3.588 1.00 0.00 C ATOM 1142 C GLY A 74 -4.500 -2.940 -4.128 1.00 0.00 C ATOM 1143 O GLY A 74 -5.587 -2.972 -4.706 1.00 0.00 O ATOM 0 H GLY A 74 -4.010 -0.348 -5.226 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.222 -1.839 -2.809 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.762 -1.065 -3.126 1.00 0.00 H new ATOM 1147 N THR A 75 -3.752 -4.014 -3.932 1.00 0.00 N ATOM 1148 CA THR A 75 -4.075 -5.301 -4.533 1.00 0.00 C ATOM 1149 C THR A 75 -5.165 -6.038 -3.747 1.00 0.00 C ATOM 1150 O THR A 75 -5.086 -7.246 -3.523 1.00 0.00 O ATOM 1151 CB THR A 75 -2.809 -6.175 -4.630 1.00 0.00 C ATOM 1152 OG1 THR A 75 -2.231 -6.349 -3.333 1.00 0.00 O ATOM 1153 CG2 THR A 75 -1.784 -5.534 -5.555 1.00 0.00 C ATOM 0 H THR A 75 -2.910 -4.021 -3.357 1.00 0.00 H new ATOM 0 HA THR A 75 -4.460 -5.110 -5.535 1.00 0.00 H new ATOM 0 HB THR A 75 -3.096 -7.145 -5.035 1.00 0.00 H new ATOM 0 HG1 THR A 75 -2.118 -7.305 -3.151 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.898 -6.166 -5.610 1.00 0.00 H new ATOM 0 HG22 THR A 75 -2.212 -5.422 -6.551 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.507 -4.554 -5.167 1.00 0.00 H new ATOM 1161 N GLY A 76 -6.198 -5.301 -3.354 1.00 0.00 N ATOM 1162 CA GLY A 76 -7.279 -5.878 -2.585 1.00 0.00 C ATOM 1163 C GLY A 76 -6.843 -6.224 -1.182 1.00 0.00 C ATOM 1164 O GLY A 76 -6.572 -5.333 -0.373 1.00 0.00 O ATOM 0 H GLY A 76 -6.304 -4.307 -3.557 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -8.112 -5.176 -2.545 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -7.643 -6.776 -3.085 1.00 0.00 H new ATOM 1168 N ALA A 77 -6.775 -7.516 -0.901 1.00 0.00 N ATOM 1169 CA ALA A 77 -6.290 -8.002 0.382 1.00 0.00 C ATOM 1170 C ALA A 77 -5.063 -8.884 0.182 1.00 0.00 C ATOM 1171 O ALA A 77 -4.314 -9.155 1.121 1.00 0.00 O ATOM 1172 CB ALA A 77 -7.385 -8.770 1.108 1.00 0.00 C ATOM 0 H ALA A 77 -7.052 -8.252 -1.550 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.007 -7.146 0.994 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.006 -9.127 2.066 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -8.239 -8.114 1.277 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.696 -9.621 0.502 1.00 0.00 H new ATOM 1178 N ASP A 78 -4.857 -9.317 -1.055 1.00 0.00 N ATOM 1179 CA ASP A 78 -3.738 -10.183 -1.387 1.00 0.00 C ATOM 1180 C ASP A 78 -2.572 -9.338 -1.875 1.00 0.00 C ATOM 1181 O ASP A 78 -2.468 -9.021 -3.061 1.00 0.00 O ATOM 1182 CB ASP A 78 -4.150 -11.204 -2.453 1.00 0.00 C ATOM 1183 CG ASP A 78 -3.088 -12.258 -2.698 1.00 0.00 C ATOM 1184 OD1 ASP A 78 -2.766 -13.011 -1.755 1.00 0.00 O ATOM 1185 OD2 ASP A 78 -2.592 -12.360 -3.837 1.00 0.00 O ATOM 0 H ASP A 78 -5.455 -9.080 -1.847 1.00 0.00 H new ATOM 0 HA ASP A 78 -3.431 -10.731 -0.497 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.075 -11.691 -2.145 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.360 -10.683 -3.387 1.00 0.00 H new ATOM 1190 N VAL A 79 -1.719 -8.936 -0.944 1.00 0.00 N ATOM 1191 CA VAL A 79 -0.635 -8.010 -1.242 1.00 0.00 C ATOM 1192 C VAL A 79 0.415 -8.641 -2.160 1.00 0.00 C ATOM 1193 O VAL A 79 0.952 -9.715 -1.878 1.00 0.00 O ATOM 1194 CB VAL A 79 0.027 -7.477 0.053 1.00 0.00 C ATOM 1195 CG1 VAL A 79 0.560 -8.615 0.914 1.00 0.00 C ATOM 1196 CG2 VAL A 79 1.132 -6.482 -0.274 1.00 0.00 C ATOM 0 H VAL A 79 -1.757 -9.238 0.029 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.078 -7.166 -1.771 1.00 0.00 H new ATOM 0 HB VAL A 79 -0.741 -6.959 0.628 1.00 0.00 H new ATOM 0 HG11 VAL A 79 1.018 -8.206 1.815 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -0.261 -9.276 1.192 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.305 -9.178 0.352 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.582 -6.121 0.651 1.00 0.00 H new ATOM 0 HG22 VAL A 79 1.893 -6.971 -0.882 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.712 -5.641 -0.825 1.00 0.00 H new ATOM 1206 N TRP A 80 0.681 -7.976 -3.274 1.00 0.00 N ATOM 1207 CA TRP A 80 1.688 -8.435 -4.212 1.00 0.00 C ATOM 1208 C TRP A 80 2.879 -7.489 -4.201 1.00 0.00 C ATOM 1209 O TRP A 80 2.748 -6.307 -4.514 1.00 0.00 O ATOM 1210 CB TRP A 80 1.104 -8.529 -5.623 1.00 0.00 C ATOM 1211 CG TRP A 80 2.017 -9.207 -6.601 1.00 0.00 C ATOM 1212 CD1 TRP A 80 2.267 -10.545 -6.686 1.00 0.00 C ATOM 1213 CD2 TRP A 80 2.789 -8.589 -7.636 1.00 0.00 C ATOM 1214 NE1 TRP A 80 3.154 -10.796 -7.702 1.00 0.00 N ATOM 1215 CE2 TRP A 80 3.488 -9.611 -8.303 1.00 0.00 C ATOM 1216 CE3 TRP A 80 2.959 -7.268 -8.063 1.00 0.00 C ATOM 1217 CZ2 TRP A 80 4.342 -9.356 -9.373 1.00 0.00 C ATOM 1218 CZ3 TRP A 80 3.807 -7.017 -9.125 1.00 0.00 C ATOM 1219 CH2 TRP A 80 4.488 -8.055 -9.770 1.00 0.00 C ATOM 0 H TRP A 80 0.210 -7.114 -3.549 1.00 0.00 H new ATOM 0 HA TRP A 80 2.020 -9.428 -3.908 1.00 0.00 H new ATOM 0 HB2 TRP A 80 0.160 -9.072 -5.582 1.00 0.00 H new ATOM 0 HB3 TRP A 80 0.879 -7.525 -5.983 1.00 0.00 H new ATOM 0 HD1 TRP A 80 1.830 -11.298 -6.046 1.00 0.00 H new ATOM 0 HE1 TRP A 80 3.507 -11.715 -7.967 1.00 0.00 H new ATOM 0 HE3 TRP A 80 2.438 -6.460 -7.572 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 4.870 -10.156 -9.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 3.947 -6.001 -9.463 1.00 0.00 H new ATOM 0 HH2 TRP A 80 5.142 -7.825 -10.598 1.00 0.00 H new ATOM 1230 N ILE A 81 4.035 -8.012 -3.820 1.00 0.00 N ATOM 1231 CA ILE A 81 5.248 -7.214 -3.771 1.00 0.00 C ATOM 1232 C ILE A 81 5.948 -7.234 -5.126 1.00 0.00 C ATOM 1233 O ILE A 81 6.313 -8.294 -5.633 1.00 0.00 O ATOM 1234 CB ILE A 81 6.216 -7.731 -2.680 1.00 0.00 C ATOM 1235 CG1 ILE A 81 5.522 -7.712 -1.314 1.00 0.00 C ATOM 1236 CG2 ILE A 81 7.484 -6.885 -2.650 1.00 0.00 C ATOM 1237 CD1 ILE A 81 6.377 -8.258 -0.188 1.00 0.00 C ATOM 0 H ILE A 81 4.157 -8.985 -3.541 1.00 0.00 H new ATOM 0 HA ILE A 81 4.963 -6.191 -3.523 1.00 0.00 H new ATOM 0 HB ILE A 81 6.497 -8.758 -2.915 1.00 0.00 H new ATOM 0 HG12 ILE A 81 5.235 -6.688 -1.076 1.00 0.00 H new ATOM 0 HG13 ILE A 81 4.603 -8.294 -1.375 1.00 0.00 H new ATOM 0 HG21 ILE A 81 8.154 -7.262 -1.877 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.980 -6.939 -3.619 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.225 -5.849 -2.432 1.00 0.00 H new ATOM 0 HD11 ILE A 81 5.819 -8.212 0.747 1.00 0.00 H new ATOM 0 HD12 ILE A 81 6.643 -9.293 -0.402 1.00 0.00 H new ATOM 0 HD13 ILE A 81 7.285 -7.662 -0.098 1.00 0.00 H new ATOM 1249 N ALA A 82 6.109 -6.054 -5.708 1.00 0.00 N ATOM 1250 CA ALA A 82 6.745 -5.929 -7.014 1.00 0.00 C ATOM 1251 C ALA A 82 8.256 -6.129 -6.915 1.00 0.00 C ATOM 1252 O ALA A 82 8.903 -5.593 -6.013 1.00 0.00 O ATOM 1253 CB ALA A 82 6.430 -4.565 -7.618 1.00 0.00 C ATOM 0 H ALA A 82 5.809 -5.170 -5.298 1.00 0.00 H new ATOM 0 HA ALA A 82 6.347 -6.709 -7.663 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.909 -4.480 -8.593 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.351 -4.458 -7.733 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.804 -3.781 -6.960 1.00 0.00 H new ATOM 1259 N PRO A 83 8.829 -6.918 -7.840 1.00 0.00 N ATOM 1260 CA PRO A 83 10.279 -7.153 -7.903 1.00 0.00 C ATOM 1261 C PRO A 83 11.059 -5.859 -8.125 1.00 0.00 C ATOM 1262 O PRO A 83 10.513 -4.872 -8.630 1.00 0.00 O ATOM 1263 CB PRO A 83 10.445 -8.088 -9.106 1.00 0.00 C ATOM 1264 CG PRO A 83 9.102 -8.699 -9.312 1.00 0.00 C ATOM 1265 CD PRO A 83 8.108 -7.658 -8.888 1.00 0.00 C ATOM 0 HA PRO A 83 10.664 -7.570 -6.972 1.00 0.00 H new ATOM 0 HB2 PRO A 83 10.768 -7.539 -9.990 1.00 0.00 H new ATOM 0 HB3 PRO A 83 11.199 -8.851 -8.911 1.00 0.00 H new ATOM 0 HG2 PRO A 83 8.955 -8.977 -10.356 1.00 0.00 H new ATOM 0 HG3 PRO A 83 8.992 -9.608 -8.721 1.00 0.00 H new ATOM 0 HD2 PRO A 83 7.824 -7.010 -9.717 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.191 -8.107 -8.506 1.00 0.00 H new ATOM 1273 N ARG A 84 12.340 -5.876 -7.773 1.00 0.00 N ATOM 1274 CA ARG A 84 13.177 -4.680 -7.849 1.00 0.00 C ATOM 1275 C ARG A 84 13.285 -4.170 -9.279 1.00 0.00 C ATOM 1276 O ARG A 84 13.347 -2.968 -9.511 1.00 0.00 O ATOM 1277 CB ARG A 84 14.581 -4.955 -7.316 1.00 0.00 C ATOM 1278 CG ARG A 84 14.613 -5.570 -5.929 1.00 0.00 C ATOM 1279 CD ARG A 84 16.040 -5.693 -5.421 1.00 0.00 C ATOM 1280 NE ARG A 84 16.953 -6.178 -6.457 1.00 0.00 N ATOM 1281 CZ ARG A 84 17.464 -7.406 -6.490 1.00 0.00 C ATOM 1282 NH1 ARG A 84 17.097 -8.312 -5.592 1.00 0.00 N ATOM 1283 NH2 ARG A 84 18.331 -7.729 -7.440 1.00 0.00 N ATOM 0 H ARG A 84 12.824 -6.706 -7.431 1.00 0.00 H new ATOM 0 HA ARG A 84 12.698 -3.920 -7.232 1.00 0.00 H new ATOM 0 HB2 ARG A 84 15.096 -5.621 -8.008 1.00 0.00 H new ATOM 0 HB3 ARG A 84 15.140 -4.020 -7.299 1.00 0.00 H new ATOM 0 HG2 ARG A 84 14.030 -4.957 -5.242 1.00 0.00 H new ATOM 0 HG3 ARG A 84 14.145 -6.554 -5.953 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.382 -4.722 -5.063 1.00 0.00 H new ATOM 0 HD3 ARG A 84 16.064 -6.373 -4.570 1.00 0.00 H new ATOM 0 HE ARG A 84 17.215 -5.533 -7.202 1.00 0.00 H new ATOM 0 HH11 ARG A 84 16.419 -8.069 -4.870 1.00 0.00 H new ATOM 0 HH12 ARG A 84 17.493 -9.251 -5.624 1.00 0.00 H new ATOM 0 HH21 ARG A 84 18.602 -7.038 -8.139 1.00 0.00 H new ATOM 0 HH22 ARG A 84 18.727 -8.669 -7.471 1.00 0.00 H new ATOM 1297 N GLN A 85 13.308 -5.092 -10.234 1.00 0.00 N ATOM 1298 CA GLN A 85 13.418 -4.725 -11.641 1.00 0.00 C ATOM 1299 C GLN A 85 12.175 -3.967 -12.102 1.00 0.00 C ATOM 1300 O GLN A 85 12.273 -2.999 -12.850 1.00 0.00 O ATOM 1301 CB GLN A 85 13.634 -5.970 -12.506 1.00 0.00 C ATOM 1302 CG GLN A 85 14.916 -6.725 -12.177 1.00 0.00 C ATOM 1303 CD GLN A 85 16.173 -5.903 -12.414 1.00 0.00 C ATOM 1304 OE1 GLN A 85 17.175 -6.070 -11.721 1.00 0.00 O ATOM 1305 NE2 GLN A 85 16.136 -5.022 -13.403 1.00 0.00 N ATOM 0 H GLN A 85 13.252 -6.096 -10.061 1.00 0.00 H new ATOM 0 HA GLN A 85 14.281 -4.069 -11.754 1.00 0.00 H new ATOM 0 HB2 GLN A 85 12.784 -6.641 -12.381 1.00 0.00 H new ATOM 0 HB3 GLN A 85 13.655 -5.674 -13.555 1.00 0.00 H new ATOM 0 HG2 GLN A 85 14.887 -7.040 -11.134 1.00 0.00 H new ATOM 0 HG3 GLN A 85 14.962 -7.630 -12.782 1.00 0.00 H new ATOM 0 HE21 GLN A 85 15.286 -4.912 -13.956 1.00 0.00 H new ATOM 0 HE22 GLN A 85 16.957 -4.454 -13.611 1.00 0.00 H new ATOM 1314 N LEU A 86 11.011 -4.394 -11.628 1.00 0.00 N ATOM 1315 CA LEU A 86 9.758 -3.736 -11.978 1.00 0.00 C ATOM 1316 C LEU A 86 9.644 -2.405 -11.242 1.00 0.00 C ATOM 1317 O LEU A 86 9.198 -1.401 -11.804 1.00 0.00 O ATOM 1318 CB LEU A 86 8.568 -4.636 -11.632 1.00 0.00 C ATOM 1319 CG LEU A 86 7.197 -4.095 -12.045 1.00 0.00 C ATOM 1320 CD1 LEU A 86 7.112 -3.946 -13.557 1.00 0.00 C ATOM 1321 CD2 LEU A 86 6.090 -5.006 -11.533 1.00 0.00 C ATOM 0 H LEU A 86 10.908 -5.192 -11.001 1.00 0.00 H new ATOM 0 HA LEU A 86 9.749 -3.548 -13.052 1.00 0.00 H new ATOM 0 HB2 LEU A 86 8.716 -5.605 -12.108 1.00 0.00 H new ATOM 0 HB3 LEU A 86 8.564 -4.807 -10.555 1.00 0.00 H new ATOM 0 HG LEU A 86 7.067 -3.109 -11.598 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.130 -3.560 -13.830 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.881 -3.253 -13.898 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.264 -4.917 -14.027 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.122 -4.607 -11.835 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.218 -6.004 -11.951 1.00 0.00 H new ATOM 0 HD23 LEU A 86 6.137 -5.060 -10.445 1.00 0.00 H new ATOM 1333 N ARG A 87 10.072 -2.410 -9.985 1.00 0.00 N ATOM 1334 CA ARG A 87 10.082 -1.206 -9.163 1.00 0.00 C ATOM 1335 C ARG A 87 10.986 -0.153 -9.806 1.00 0.00 C ATOM 1336 O ARG A 87 10.643 1.027 -9.879 1.00 0.00 O ATOM 1337 CB ARG A 87 10.598 -1.548 -7.760 1.00 0.00 C ATOM 1338 CG ARG A 87 10.176 -0.567 -6.677 1.00 0.00 C ATOM 1339 CD ARG A 87 8.723 -0.774 -6.278 1.00 0.00 C ATOM 1340 NE ARG A 87 8.351 0.045 -5.124 1.00 0.00 N ATOM 1341 CZ ARG A 87 7.725 -0.422 -4.043 1.00 0.00 C ATOM 1342 NH1 ARG A 87 7.388 -1.704 -3.964 1.00 0.00 N ATOM 1343 NH2 ARG A 87 7.438 0.403 -3.044 1.00 0.00 N ATOM 0 H ARG A 87 10.420 -3.243 -9.509 1.00 0.00 H new ATOM 0 HA ARG A 87 9.069 -0.810 -9.087 1.00 0.00 H new ATOM 0 HB2 ARG A 87 10.245 -2.543 -7.489 1.00 0.00 H new ATOM 0 HB3 ARG A 87 11.687 -1.593 -7.788 1.00 0.00 H new ATOM 0 HG2 ARG A 87 10.816 -0.689 -5.803 1.00 0.00 H new ATOM 0 HG3 ARG A 87 10.315 0.454 -7.034 1.00 0.00 H new ATOM 0 HD2 ARG A 87 8.077 -0.528 -7.121 1.00 0.00 H new ATOM 0 HD3 ARG A 87 8.557 -1.826 -6.045 1.00 0.00 H new ATOM 0 HE ARG A 87 8.586 1.037 -5.148 1.00 0.00 H new ATOM 0 HH11 ARG A 87 7.608 -2.337 -4.733 1.00 0.00 H new ATOM 0 HH12 ARG A 87 6.909 -2.055 -3.135 1.00 0.00 H new ATOM 0 HH21 ARG A 87 7.696 1.388 -3.106 1.00 0.00 H new ATOM 0 HH22 ARG A 87 6.959 0.052 -2.214 1.00 0.00 H new ATOM 1357 N GLU A 88 12.136 -0.612 -10.290 1.00 0.00 N ATOM 1358 CA GLU A 88 13.122 0.250 -10.932 1.00 0.00 C ATOM 1359 C GLU A 88 12.614 0.758 -12.280 1.00 0.00 C ATOM 1360 O GLU A 88 12.891 1.896 -12.668 1.00 0.00 O ATOM 1361 CB GLU A 88 14.428 -0.526 -11.116 1.00 0.00 C ATOM 1362 CG GLU A 88 15.563 0.286 -11.714 1.00 0.00 C ATOM 1363 CD GLU A 88 16.818 -0.540 -11.896 1.00 0.00 C ATOM 1364 OE1 GLU A 88 17.618 -0.632 -10.940 1.00 0.00 O ATOM 1365 OE2 GLU A 88 17.000 -1.120 -12.983 1.00 0.00 O ATOM 0 H GLU A 88 12.411 -1.593 -10.248 1.00 0.00 H new ATOM 0 HA GLU A 88 13.298 1.117 -10.295 1.00 0.00 H new ATOM 0 HB2 GLU A 88 14.746 -0.913 -10.148 1.00 0.00 H new ATOM 0 HB3 GLU A 88 14.237 -1.387 -11.756 1.00 0.00 H new ATOM 0 HG2 GLU A 88 15.252 0.689 -12.678 1.00 0.00 H new ATOM 0 HG3 GLU A 88 15.780 1.137 -11.068 1.00 0.00 H new ATOM 1372 N ALA A 89 11.865 -0.087 -12.984 1.00 0.00 N ATOM 1373 CA ALA A 89 11.323 0.264 -14.293 1.00 0.00 C ATOM 1374 C ALA A 89 10.454 1.513 -14.211 1.00 0.00 C ATOM 1375 O ALA A 89 10.649 2.470 -14.963 1.00 0.00 O ATOM 1376 CB ALA A 89 10.528 -0.900 -14.867 1.00 0.00 C ATOM 0 H ALA A 89 11.619 -1.025 -12.667 1.00 0.00 H new ATOM 0 HA ALA A 89 12.159 0.479 -14.958 1.00 0.00 H new ATOM 0 HB1 ALA A 89 10.130 -0.623 -15.843 1.00 0.00 H new ATOM 0 HB2 ALA A 89 11.179 -1.768 -14.973 1.00 0.00 H new ATOM 0 HB3 ALA A 89 9.705 -1.144 -14.196 1.00 0.00 H new ATOM 1382 N LEU A 90 9.503 1.511 -13.284 1.00 0.00 N ATOM 1383 CA LEU A 90 8.639 2.668 -13.084 1.00 0.00 C ATOM 1384 C LEU A 90 9.423 3.828 -12.484 1.00 0.00 C ATOM 1385 O LEU A 90 9.158 4.992 -12.788 1.00 0.00 O ATOM 1386 CB LEU A 90 7.449 2.310 -12.189 1.00 0.00 C ATOM 1387 CG LEU A 90 6.405 1.397 -12.834 1.00 0.00 C ATOM 1388 CD1 LEU A 90 5.297 1.074 -11.848 1.00 0.00 C ATOM 1389 CD2 LEU A 90 5.828 2.048 -14.081 1.00 0.00 C ATOM 0 H LEU A 90 9.311 0.726 -12.662 1.00 0.00 H new ATOM 0 HA LEU A 90 8.257 2.976 -14.057 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.825 1.826 -11.287 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.959 3.232 -11.876 1.00 0.00 H new ATOM 0 HG LEU A 90 6.894 0.466 -13.122 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.564 0.424 -12.325 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.719 0.569 -10.979 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.811 1.997 -11.531 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.087 1.385 -14.528 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.355 2.993 -13.813 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.628 2.233 -14.798 1.00 0.00 H new ATOM 1401 N ARG A 91 10.408 3.501 -11.654 1.00 0.00 N ATOM 1402 CA ARG A 91 11.252 4.509 -11.022 1.00 0.00 C ATOM 1403 C ARG A 91 12.010 5.322 -12.073 1.00 0.00 C ATOM 1404 O ARG A 91 12.289 6.503 -11.871 1.00 0.00 O ATOM 1405 CB ARG A 91 12.238 3.846 -10.052 1.00 0.00 C ATOM 1406 CG ARG A 91 13.079 4.839 -9.267 1.00 0.00 C ATOM 1407 CD ARG A 91 12.223 5.681 -8.330 1.00 0.00 C ATOM 1408 NE ARG A 91 12.968 6.809 -7.781 1.00 0.00 N ATOM 1409 CZ ARG A 91 12.609 7.498 -6.700 1.00 0.00 C ATOM 1410 NH1 ARG A 91 11.551 7.136 -5.985 1.00 0.00 N ATOM 1411 NH2 ARG A 91 13.323 8.548 -6.323 1.00 0.00 N ATOM 0 H ARG A 91 10.642 2.541 -11.402 1.00 0.00 H new ATOM 0 HA ARG A 91 10.609 5.188 -10.462 1.00 0.00 H new ATOM 0 HB2 ARG A 91 11.682 3.221 -9.353 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.899 3.186 -10.614 1.00 0.00 H new ATOM 0 HG2 ARG A 91 13.832 4.303 -8.690 1.00 0.00 H new ATOM 0 HG3 ARG A 91 13.613 5.491 -9.958 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.350 6.050 -8.868 1.00 0.00 H new ATOM 0 HD3 ARG A 91 11.855 5.057 -7.515 1.00 0.00 H new ATOM 0 HE ARG A 91 13.824 7.089 -8.259 1.00 0.00 H new ATOM 0 HH11 ARG A 91 11.003 6.322 -6.262 1.00 0.00 H new ATOM 0 HH12 ARG A 91 11.286 7.672 -5.159 1.00 0.00 H new ATOM 0 HH21 ARG A 91 14.144 8.826 -6.860 1.00 0.00 H new ATOM 0 HH22 ARG A 91 13.052 9.079 -5.495 1.00 0.00 H new ATOM 1425 N GLY A 92 12.324 4.684 -13.198 1.00 0.00 N ATOM 1426 CA GLY A 92 13.013 5.365 -14.283 1.00 0.00 C ATOM 1427 C GLY A 92 12.168 6.463 -14.899 1.00 0.00 C ATOM 1428 O GLY A 92 12.690 7.474 -15.368 1.00 0.00 O ATOM 0 H GLY A 92 12.113 3.703 -13.378 1.00 0.00 H new ATOM 0 HA2 GLY A 92 13.944 5.792 -13.909 1.00 0.00 H new ATOM 0 HA3 GLY A 92 13.281 4.641 -15.052 1.00 0.00 H new ATOM 1432 N VAL A 93 10.856 6.264 -14.886 1.00 0.00 N ATOM 1433 CA VAL A 93 9.921 7.268 -15.378 1.00 0.00 C ATOM 1434 C VAL A 93 9.536 8.208 -14.233 1.00 0.00 C ATOM 1435 O VAL A 93 8.689 9.087 -14.380 1.00 0.00 O ATOM 1436 CB VAL A 93 8.648 6.607 -15.968 1.00 0.00 C ATOM 1437 CG1 VAL A 93 7.843 7.601 -16.793 1.00 0.00 C ATOM 1438 CG2 VAL A 93 9.011 5.391 -16.809 1.00 0.00 C ATOM 0 H VAL A 93 10.414 5.413 -14.539 1.00 0.00 H new ATOM 0 HA VAL A 93 10.407 7.833 -16.173 1.00 0.00 H new ATOM 0 HB VAL A 93 8.028 6.279 -15.133 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.957 7.108 -17.193 1.00 0.00 H new ATOM 0 HG12 VAL A 93 7.540 8.436 -16.162 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.455 7.971 -17.616 1.00 0.00 H new ATOM 0 HG21 VAL A 93 8.103 4.943 -17.213 1.00 0.00 H new ATOM 0 HG22 VAL A 93 9.660 5.697 -17.629 1.00 0.00 H new ATOM 0 HG23 VAL A 93 9.530 4.661 -16.188 1.00 0.00 H new ATOM 1448 N ASN A 94 10.191 7.995 -13.088 1.00 0.00 N ATOM 1449 CA ASN A 94 9.961 8.771 -11.864 1.00 0.00 C ATOM 1450 C ASN A 94 8.622 8.433 -11.230 1.00 0.00 C ATOM 1451 O ASN A 94 8.164 9.127 -10.324 1.00 0.00 O ATOM 1452 CB ASN A 94 10.068 10.280 -12.115 1.00 0.00 C ATOM 1453 CG ASN A 94 11.501 10.739 -12.301 1.00 0.00 C ATOM 1454 OD1 ASN A 94 11.766 11.699 -13.023 1.00 0.00 O ATOM 1455 ND2 ASN A 94 12.435 10.060 -11.651 1.00 0.00 N ATOM 0 H ASN A 94 10.903 7.272 -12.983 1.00 0.00 H new ATOM 0 HA ASN A 94 10.749 8.491 -11.165 1.00 0.00 H new ATOM 0 HB2 ASN A 94 9.489 10.539 -13.002 1.00 0.00 H new ATOM 0 HB3 ASN A 94 9.624 10.817 -11.276 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.415 10.328 -11.740 1.00 0.00 H new ATOM 0 HD22 ASN A 94 12.174 9.269 -11.062 1.00 0.00 H new ATOM 1462 N VAL A 95 8.018 7.347 -11.682 1.00 0.00 N ATOM 1463 CA VAL A 95 6.765 6.886 -11.114 1.00 0.00 C ATOM 1464 C VAL A 95 7.023 6.211 -9.774 1.00 0.00 C ATOM 1465 O VAL A 95 7.631 5.137 -9.708 1.00 0.00 O ATOM 1466 CB VAL A 95 6.030 5.907 -12.055 1.00 0.00 C ATOM 1467 CG1 VAL A 95 4.699 5.478 -11.457 1.00 0.00 C ATOM 1468 CG2 VAL A 95 5.824 6.532 -13.427 1.00 0.00 C ATOM 0 H VAL A 95 8.377 6.768 -12.442 1.00 0.00 H new ATOM 0 HA VAL A 95 6.126 7.758 -10.975 1.00 0.00 H new ATOM 0 HB VAL A 95 6.652 5.020 -12.172 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.200 4.789 -12.138 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.872 4.983 -10.502 1.00 0.00 H new ATOM 0 HG13 VAL A 95 4.070 6.355 -11.303 1.00 0.00 H new ATOM 0 HG21 VAL A 95 5.304 5.826 -14.074 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.228 7.439 -13.328 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.792 6.780 -13.863 1.00 0.00 H new ATOM 1478 N VAL A 96 6.594 6.864 -8.709 1.00 0.00 N ATOM 1479 CA VAL A 96 6.739 6.330 -7.369 1.00 0.00 C ATOM 1480 C VAL A 96 5.687 5.259 -7.119 1.00 0.00 C ATOM 1481 O VAL A 96 4.539 5.561 -6.793 1.00 0.00 O ATOM 1482 CB VAL A 96 6.616 7.438 -6.298 1.00 0.00 C ATOM 1483 CG1 VAL A 96 6.852 6.874 -4.903 1.00 0.00 C ATOM 1484 CG2 VAL A 96 7.585 8.575 -6.586 1.00 0.00 C ATOM 0 H VAL A 96 6.137 7.775 -8.749 1.00 0.00 H new ATOM 0 HA VAL A 96 7.735 5.894 -7.292 1.00 0.00 H new ATOM 0 HB VAL A 96 5.601 7.834 -6.337 1.00 0.00 H new ATOM 0 HG11 VAL A 96 6.760 7.673 -4.167 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.113 6.101 -4.693 1.00 0.00 H new ATOM 0 HG13 VAL A 96 7.852 6.444 -4.849 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.482 9.344 -5.820 1.00 0.00 H new ATOM 0 HG22 VAL A 96 8.606 8.193 -6.581 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.363 9.004 -7.563 1.00 0.00 H new ATOM 1494 N LEU A 97 6.079 4.012 -7.308 1.00 0.00 N ATOM 1495 CA LEU A 97 5.180 2.888 -7.123 1.00 0.00 C ATOM 1496 C LEU A 97 5.248 2.393 -5.687 1.00 0.00 C ATOM 1497 O LEU A 97 6.328 2.323 -5.101 1.00 0.00 O ATOM 1498 CB LEU A 97 5.555 1.750 -8.078 1.00 0.00 C ATOM 1499 CG LEU A 97 4.740 0.464 -7.914 1.00 0.00 C ATOM 1500 CD1 LEU A 97 3.299 0.681 -8.352 1.00 0.00 C ATOM 1501 CD2 LEU A 97 5.375 -0.677 -8.693 1.00 0.00 C ATOM 0 H LEU A 97 7.023 3.751 -7.592 1.00 0.00 H new ATOM 0 HA LEU A 97 4.163 3.216 -7.340 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.441 2.105 -9.102 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.610 1.513 -7.938 1.00 0.00 H new ATOM 0 HG LEU A 97 4.737 0.194 -6.858 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.737 -0.245 -8.227 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.848 1.464 -7.743 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.278 0.980 -9.400 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.781 -1.581 -8.563 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.415 -0.418 -9.751 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.386 -0.851 -8.324 1.00 0.00 H new ATOM 1513 N ASP A 98 4.100 2.074 -5.118 1.00 0.00 N ATOM 1514 CA ASP A 98 4.058 1.441 -3.811 1.00 0.00 C ATOM 1515 C ASP A 98 2.993 0.355 -3.806 1.00 0.00 C ATOM 1516 O ASP A 98 1.937 0.506 -4.426 1.00 0.00 O ATOM 1517 CB ASP A 98 3.785 2.463 -2.706 1.00 0.00 C ATOM 1518 CG ASP A 98 4.259 1.969 -1.351 1.00 0.00 C ATOM 1519 OD1 ASP A 98 3.575 1.124 -0.745 1.00 0.00 O ATOM 1520 OD2 ASP A 98 5.343 2.408 -0.903 1.00 0.00 O ATOM 0 H ASP A 98 3.186 2.242 -5.538 1.00 0.00 H new ATOM 0 HA ASP A 98 5.032 0.994 -3.612 1.00 0.00 H new ATOM 0 HB2 ASP A 98 4.286 3.401 -2.946 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.717 2.674 -2.662 1.00 0.00 H new ATOM 1525 N THR A 99 3.281 -0.741 -3.125 1.00 0.00 N ATOM 1526 CA THR A 99 2.399 -1.894 -3.112 1.00 0.00 C ATOM 1527 C THR A 99 1.673 -2.007 -1.774 1.00 0.00 C ATOM 1528 O THR A 99 2.280 -2.333 -0.753 1.00 0.00 O ATOM 1529 CB THR A 99 3.200 -3.180 -3.386 1.00 0.00 C ATOM 1530 OG1 THR A 99 4.369 -3.212 -2.552 1.00 0.00 O ATOM 1531 CG2 THR A 99 3.614 -3.254 -4.850 1.00 0.00 C ATOM 0 H THR A 99 4.128 -0.856 -2.569 1.00 0.00 H new ATOM 0 HA THR A 99 1.655 -1.763 -3.898 1.00 0.00 H new ATOM 0 HB THR A 99 2.566 -4.037 -3.159 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.130 -2.934 -1.643 1.00 0.00 H new ATOM 0 HG21 THR A 99 4.179 -4.170 -5.023 1.00 0.00 H new ATOM 0 HG22 THR A 99 2.725 -3.252 -5.480 1.00 0.00 H new ATOM 0 HG23 THR A 99 4.235 -2.393 -5.096 1.00 0.00 H new ATOM 1539 N MET A 100 0.375 -1.741 -1.785 1.00 0.00 N ATOM 1540 CA MET A 100 -0.408 -1.705 -0.557 1.00 0.00 C ATOM 1541 C MET A 100 -1.700 -2.496 -0.694 1.00 0.00 C ATOM 1542 O MET A 100 -1.962 -3.119 -1.724 1.00 0.00 O ATOM 1543 CB MET A 100 -0.746 -0.256 -0.187 1.00 0.00 C ATOM 1544 CG MET A 100 0.423 0.526 0.384 1.00 0.00 C ATOM 1545 SD MET A 100 0.938 -0.086 1.999 1.00 0.00 S ATOM 1546 CE MET A 100 2.246 1.073 2.381 1.00 0.00 C ATOM 0 H MET A 100 -0.160 -1.547 -2.632 1.00 0.00 H new ATOM 0 HA MET A 100 0.196 -2.159 0.228 1.00 0.00 H new ATOM 0 HB2 MET A 100 -1.114 0.258 -1.075 1.00 0.00 H new ATOM 0 HB3 MET A 100 -1.558 -0.258 0.540 1.00 0.00 H new ATOM 0 HG2 MET A 100 1.264 0.472 -0.307 1.00 0.00 H new ATOM 0 HG3 MET A 100 0.147 1.577 0.468 1.00 0.00 H new ATOM 0 HE1 MET A 100 2.515 0.984 3.433 1.00 0.00 H new ATOM 0 HE2 MET A 100 3.117 0.855 1.764 1.00 0.00 H new ATOM 0 HE3 MET A 100 1.903 2.088 2.179 1.00 0.00 H new ATOM 1556 N GLN A 101 -2.497 -2.472 0.363 1.00 0.00 N ATOM 1557 CA GLN A 101 -3.829 -3.043 0.336 1.00 0.00 C ATOM 1558 C GLN A 101 -4.848 -1.917 0.228 1.00 0.00 C ATOM 1559 O GLN A 101 -4.523 -0.766 0.517 1.00 0.00 O ATOM 1560 CB GLN A 101 -4.075 -3.893 1.585 1.00 0.00 C ATOM 1561 CG GLN A 101 -3.243 -5.167 1.610 1.00 0.00 C ATOM 1562 CD GLN A 101 -3.426 -5.972 2.881 1.00 0.00 C ATOM 1563 OE1 GLN A 101 -4.481 -5.931 3.514 1.00 0.00 O ATOM 1564 NE2 GLN A 101 -2.396 -6.709 3.262 1.00 0.00 N ATOM 0 H GLN A 101 -2.238 -2.058 1.258 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.930 -3.698 -0.529 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.849 -3.300 2.471 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.132 -4.155 1.637 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.511 -5.786 0.754 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -2.190 -4.908 1.499 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.540 -6.714 2.708 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -2.458 -7.272 4.110 1.00 0.00 H new ATOM 1573 N THR A 102 -6.065 -2.253 -0.178 1.00 0.00 N ATOM 1574 CA THR A 102 -7.086 -1.254 -0.497 1.00 0.00 C ATOM 1575 C THR A 102 -7.299 -0.236 0.625 1.00 0.00 C ATOM 1576 O THR A 102 -7.061 0.956 0.429 1.00 0.00 O ATOM 1577 CB THR A 102 -8.422 -1.934 -0.828 1.00 0.00 C ATOM 1578 OG1 THR A 102 -8.669 -2.992 0.111 1.00 0.00 O ATOM 1579 CG2 THR A 102 -8.409 -2.486 -2.246 1.00 0.00 C ATOM 0 H THR A 102 -6.375 -3.218 -0.296 1.00 0.00 H new ATOM 0 HA THR A 102 -6.717 -0.710 -1.367 1.00 0.00 H new ATOM 0 HB THR A 102 -9.219 -1.194 -0.758 1.00 0.00 H new ATOM 0 HG1 THR A 102 -9.504 -2.814 0.593 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.365 -2.964 -2.459 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.244 -1.672 -2.952 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.608 -3.219 -2.344 1.00 0.00 H new ATOM 1587 N GLY A 103 -7.737 -0.716 1.787 1.00 0.00 N ATOM 1588 CA GLY A 103 -8.034 0.160 2.917 1.00 0.00 C ATOM 1589 C GLY A 103 -6.952 1.195 3.197 1.00 0.00 C ATOM 1590 O GLY A 103 -7.203 2.398 3.082 1.00 0.00 O ATOM 0 H GLY A 103 -7.894 -1.707 1.970 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.975 0.675 2.727 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -8.179 -0.450 3.809 1.00 0.00 H new ATOM 1594 N PRO A 104 -5.737 0.758 3.579 1.00 0.00 N ATOM 1595 CA PRO A 104 -4.618 1.666 3.860 1.00 0.00 C ATOM 1596 C PRO A 104 -4.302 2.602 2.692 1.00 0.00 C ATOM 1597 O PRO A 104 -3.959 3.769 2.897 1.00 0.00 O ATOM 1598 CB PRO A 104 -3.440 0.721 4.110 1.00 0.00 C ATOM 1599 CG PRO A 104 -4.062 -0.561 4.534 1.00 0.00 C ATOM 1600 CD PRO A 104 -5.364 -0.653 3.794 1.00 0.00 C ATOM 0 HA PRO A 104 -4.844 2.326 4.697 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -2.840 0.590 3.209 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -2.776 1.112 4.881 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -3.416 -1.406 4.295 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -4.224 -0.579 5.612 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -5.253 -1.187 2.850 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -6.119 -1.184 4.374 1.00 0.00 H new ATOM 1608 N ALA A 105 -4.429 2.091 1.473 1.00 0.00 N ATOM 1609 CA ALA A 105 -4.104 2.866 0.281 1.00 0.00 C ATOM 1610 C ALA A 105 -5.104 3.995 0.061 1.00 0.00 C ATOM 1611 O ALA A 105 -4.714 5.114 -0.263 1.00 0.00 O ATOM 1612 CB ALA A 105 -4.040 1.963 -0.941 1.00 0.00 C ATOM 0 H ALA A 105 -4.755 1.143 1.284 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.123 3.316 0.434 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -3.796 2.558 -1.821 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.272 1.204 -0.793 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.006 1.479 -1.087 1.00 0.00 H new ATOM 1618 N ILE A 106 -6.389 3.701 0.249 1.00 0.00 N ATOM 1619 CA ILE A 106 -7.442 4.701 0.071 1.00 0.00 C ATOM 1620 C ILE A 106 -7.235 5.879 1.020 1.00 0.00 C ATOM 1621 O ILE A 106 -7.245 7.038 0.602 1.00 0.00 O ATOM 1622 CB ILE A 106 -8.847 4.099 0.311 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -9.112 2.949 -0.664 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -9.922 5.173 0.173 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -10.420 2.226 -0.415 1.00 0.00 C ATOM 0 H ILE A 106 -6.727 2.779 0.525 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.381 5.047 -0.961 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.882 3.706 1.327 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -9.112 3.340 -1.681 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -8.293 2.233 -0.598 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.903 4.730 0.345 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -9.746 5.961 0.906 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.886 5.597 -0.831 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -10.538 1.425 -1.145 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -10.417 1.804 0.590 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.248 2.928 -0.511 1.00 0.00 H new ATOM 1637 N ARG A 107 -7.029 5.569 2.293 1.00 0.00 N ATOM 1638 CA ARG A 107 -6.844 6.592 3.317 1.00 0.00 C ATOM 1639 C ARG A 107 -5.605 7.441 3.017 1.00 0.00 C ATOM 1640 O ARG A 107 -5.642 8.674 3.106 1.00 0.00 O ATOM 1641 CB ARG A 107 -6.739 5.917 4.688 1.00 0.00 C ATOM 1642 CG ARG A 107 -6.622 6.877 5.860 1.00 0.00 C ATOM 1643 CD ARG A 107 -6.803 6.142 7.180 1.00 0.00 C ATOM 1644 NE ARG A 107 -6.478 6.978 8.336 1.00 0.00 N ATOM 1645 CZ ARG A 107 -6.771 6.656 9.597 1.00 0.00 C ATOM 1646 NH1 ARG A 107 -7.500 5.582 9.869 1.00 0.00 N ATOM 1647 NH2 ARG A 107 -6.355 7.425 10.595 1.00 0.00 N ATOM 0 H ARG A 107 -6.985 4.612 2.644 1.00 0.00 H new ATOM 0 HA ARG A 107 -7.702 7.264 3.320 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -7.617 5.288 4.837 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.871 5.257 4.688 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -5.647 7.365 5.841 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -7.373 7.662 5.770 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -7.834 5.799 7.262 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -6.170 5.255 7.188 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.998 7.862 8.167 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -7.843 4.993 9.110 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -7.718 5.345 10.837 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -5.810 8.265 10.399 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -6.580 7.177 11.558 1.00 0.00 H new ATOM 1661 N THR A 108 -4.522 6.780 2.627 1.00 0.00 N ATOM 1662 CA THR A 108 -3.290 7.470 2.273 1.00 0.00 C ATOM 1663 C THR A 108 -3.498 8.345 1.033 1.00 0.00 C ATOM 1664 O THR A 108 -3.038 9.488 0.982 1.00 0.00 O ATOM 1665 CB THR A 108 -2.148 6.466 2.015 1.00 0.00 C ATOM 1666 OG1 THR A 108 -2.014 5.585 3.139 1.00 0.00 O ATOM 1667 CG2 THR A 108 -0.828 7.180 1.777 1.00 0.00 C ATOM 0 H THR A 108 -4.473 5.764 2.548 1.00 0.00 H new ATOM 0 HA THR A 108 -3.013 8.105 3.114 1.00 0.00 H new ATOM 0 HB THR A 108 -2.398 5.895 1.120 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.552 4.779 2.989 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.044 6.445 1.598 1.00 0.00 H new ATOM 0 HG22 THR A 108 -0.919 7.832 0.908 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.574 7.776 2.653 1.00 0.00 H new ATOM 1675 N TYR A 109 -4.211 7.805 0.047 1.00 0.00 N ATOM 1676 CA TYR A 109 -4.516 8.533 -1.179 1.00 0.00 C ATOM 1677 C TYR A 109 -5.292 9.810 -0.877 1.00 0.00 C ATOM 1678 O TYR A 109 -5.002 10.866 -1.436 1.00 0.00 O ATOM 1679 CB TYR A 109 -5.314 7.639 -2.141 1.00 0.00 C ATOM 1680 CG TYR A 109 -5.912 8.374 -3.322 1.00 0.00 C ATOM 1681 CD1 TYR A 109 -5.118 8.817 -4.374 1.00 0.00 C ATOM 1682 CD2 TYR A 109 -7.280 8.623 -3.384 1.00 0.00 C ATOM 1683 CE1 TYR A 109 -5.668 9.488 -5.449 1.00 0.00 C ATOM 1684 CE2 TYR A 109 -7.835 9.291 -4.456 1.00 0.00 C ATOM 1685 CZ TYR A 109 -7.028 9.721 -5.485 1.00 0.00 C ATOM 1686 OH TYR A 109 -7.582 10.390 -6.552 1.00 0.00 O ATOM 0 H TYR A 109 -4.590 6.858 0.076 1.00 0.00 H new ATOM 0 HA TYR A 109 -3.575 8.813 -1.653 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -4.660 6.850 -2.512 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.116 7.153 -1.586 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -4.054 8.634 -4.350 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -7.918 8.288 -2.579 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -5.037 9.828 -6.257 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -8.899 9.476 -4.488 1.00 0.00 H new ATOM 0 HH TYR A 109 -8.550 10.469 -6.421 1.00 0.00 H new ATOM 1696 N ASN A 110 -6.265 9.712 0.020 1.00 0.00 N ATOM 1697 CA ASN A 110 -7.090 10.861 0.380 1.00 0.00 C ATOM 1698 C ASN A 110 -6.253 11.967 1.010 1.00 0.00 C ATOM 1699 O ASN A 110 -6.533 13.148 0.821 1.00 0.00 O ATOM 1700 CB ASN A 110 -8.230 10.454 1.318 1.00 0.00 C ATOM 1701 CG ASN A 110 -9.294 9.640 0.607 1.00 0.00 C ATOM 1702 OD1 ASN A 110 -9.472 9.757 -0.604 1.00 0.00 O ATOM 1703 ND2 ASN A 110 -10.022 8.826 1.354 1.00 0.00 N ATOM 0 H ASN A 110 -6.503 8.851 0.512 1.00 0.00 H new ATOM 0 HA ASN A 110 -7.527 11.247 -0.541 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -7.826 9.875 2.148 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -8.684 11.348 1.745 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -10.762 8.268 0.928 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -9.844 8.757 2.356 1.00 0.00 H new ATOM 1710 N ILE A 111 -5.223 11.589 1.753 1.00 0.00 N ATOM 1711 CA ILE A 111 -4.305 12.575 2.313 1.00 0.00 C ATOM 1712 C ILE A 111 -3.408 13.164 1.223 1.00 0.00 C ATOM 1713 O ILE A 111 -3.188 14.378 1.170 1.00 0.00 O ATOM 1714 CB ILE A 111 -3.427 11.973 3.430 1.00 0.00 C ATOM 1715 CG1 ILE A 111 -4.299 11.515 4.599 1.00 0.00 C ATOM 1716 CG2 ILE A 111 -2.385 12.981 3.902 1.00 0.00 C ATOM 1717 CD1 ILE A 111 -3.509 10.963 5.763 1.00 0.00 C ATOM 0 H ILE A 111 -5.002 10.620 1.981 1.00 0.00 H new ATOM 0 HA ILE A 111 -4.917 13.366 2.746 1.00 0.00 H new ATOM 0 HB ILE A 111 -2.902 11.107 3.026 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -4.900 12.356 4.945 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -4.993 10.752 4.247 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -1.778 12.535 4.689 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -1.745 13.262 3.065 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -2.886 13.868 4.289 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -4.193 10.658 6.555 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -2.929 10.101 5.433 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -2.835 11.731 6.142 1.00 0.00 H new ATOM 1729 N MET A 112 -2.911 12.305 0.342 1.00 0.00 N ATOM 1730 CA MET A 112 -1.965 12.721 -0.687 1.00 0.00 C ATOM 1731 C MET A 112 -2.629 13.553 -1.781 1.00 0.00 C ATOM 1732 O MET A 112 -1.995 14.425 -2.367 1.00 0.00 O ATOM 1733 CB MET A 112 -1.264 11.511 -1.307 1.00 0.00 C ATOM 1734 CG MET A 112 -0.253 10.853 -0.381 1.00 0.00 C ATOM 1735 SD MET A 112 0.661 9.525 -1.188 1.00 0.00 S ATOM 1736 CE MET A 112 1.826 9.088 0.099 1.00 0.00 C ATOM 0 H MET A 112 -3.148 11.313 0.319 1.00 0.00 H new ATOM 0 HA MET A 112 -1.224 13.350 -0.194 1.00 0.00 H new ATOM 0 HB2 MET A 112 -2.014 10.774 -1.594 1.00 0.00 H new ATOM 0 HB3 MET A 112 -0.758 11.823 -2.221 1.00 0.00 H new ATOM 0 HG2 MET A 112 0.448 11.606 -0.021 1.00 0.00 H new ATOM 0 HG3 MET A 112 -0.770 10.455 0.492 1.00 0.00 H new ATOM 0 HE1 MET A 112 2.317 8.150 -0.158 1.00 0.00 H new ATOM 0 HE2 MET A 112 2.574 9.875 0.195 1.00 0.00 H new ATOM 0 HE3 MET A 112 1.297 8.973 1.045 1.00 0.00 H new ATOM 1746 N ILE A 113 -3.906 13.304 -2.046 1.00 0.00 N ATOM 1747 CA ILE A 113 -4.621 14.033 -3.097 1.00 0.00 C ATOM 1748 C ILE A 113 -4.795 15.512 -2.719 1.00 0.00 C ATOM 1749 O ILE A 113 -5.222 16.334 -3.533 1.00 0.00 O ATOM 1750 CB ILE A 113 -5.998 13.387 -3.401 1.00 0.00 C ATOM 1751 CG1 ILE A 113 -6.559 13.904 -4.731 1.00 0.00 C ATOM 1752 CG2 ILE A 113 -6.987 13.650 -2.273 1.00 0.00 C ATOM 1753 CD1 ILE A 113 -5.699 13.559 -5.929 1.00 0.00 C ATOM 0 H ILE A 113 -4.468 12.609 -1.554 1.00 0.00 H new ATOM 0 HA ILE A 113 -4.016 13.976 -4.002 1.00 0.00 H new ATOM 0 HB ILE A 113 -5.850 12.310 -3.481 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -7.557 13.491 -4.880 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -6.668 14.987 -4.673 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.944 13.186 -2.512 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -6.601 13.228 -1.345 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.125 14.725 -2.153 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.159 13.957 -6.834 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -4.708 13.995 -5.803 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.610 12.476 -6.013 1.00 0.00 H new ATOM 1765 N GLY A 114 -4.450 15.846 -1.482 1.00 0.00 N ATOM 1766 CA GLY A 114 -4.481 17.227 -1.046 1.00 0.00 C ATOM 1767 C GLY A 114 -3.121 17.700 -0.569 1.00 0.00 C ATOM 1768 O GLY A 114 -3.025 18.627 0.234 1.00 0.00 O ATOM 0 H GLY A 114 -4.148 15.181 -0.770 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -4.818 17.860 -1.867 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -5.207 17.337 -0.240 1.00 0.00 H new ATOM 1772 N GLU A 115 -2.066 17.062 -1.066 1.00 0.00 N ATOM 1773 CA GLU A 115 -0.705 17.396 -0.649 1.00 0.00 C ATOM 1774 C GLU A 115 0.293 17.163 -1.784 1.00 0.00 C ATOM 1775 O GLU A 115 1.257 17.911 -1.943 1.00 0.00 O ATOM 1776 CB GLU A 115 -0.319 16.556 0.568 1.00 0.00 C ATOM 1777 CG GLU A 115 1.009 16.949 1.186 1.00 0.00 C ATOM 1778 CD GLU A 115 1.305 16.173 2.447 1.00 0.00 C ATOM 1779 OE1 GLU A 115 0.678 16.472 3.487 1.00 0.00 O ATOM 1780 OE2 GLU A 115 2.165 15.270 2.406 1.00 0.00 O ATOM 0 H GLU A 115 -2.125 16.313 -1.756 1.00 0.00 H new ATOM 0 HA GLU A 115 -0.676 18.453 -0.386 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.101 16.645 1.322 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -0.277 15.507 0.275 1.00 0.00 H new ATOM 0 HG2 GLU A 115 1.807 16.782 0.463 1.00 0.00 H new ATOM 0 HG3 GLU A 115 1.001 18.015 1.411 1.00 0.00 H new ATOM 1787 N ARG A 116 0.049 16.122 -2.565 1.00 0.00 N ATOM 1788 CA ARG A 116 0.885 15.773 -3.695 1.00 0.00 C ATOM 1789 C ARG A 116 -0.009 15.213 -4.787 1.00 0.00 C ATOM 1790 O ARG A 116 -0.150 13.998 -4.946 1.00 0.00 O ATOM 1791 CB ARG A 116 1.967 14.758 -3.299 1.00 0.00 C ATOM 1792 CG ARG A 116 2.885 14.362 -4.447 1.00 0.00 C ATOM 1793 CD ARG A 116 3.976 13.403 -3.993 1.00 0.00 C ATOM 1794 NE ARG A 116 4.787 12.931 -5.114 1.00 0.00 N ATOM 1795 CZ ARG A 116 6.119 12.917 -5.125 1.00 0.00 C ATOM 1796 NH1 ARG A 116 6.809 13.331 -4.069 1.00 0.00 N ATOM 1797 NH2 ARG A 116 6.767 12.481 -6.194 1.00 0.00 N ATOM 0 H ARG A 116 -0.742 15.493 -2.428 1.00 0.00 H new ATOM 0 HA ARG A 116 1.405 16.661 -4.054 1.00 0.00 H new ATOM 0 HB2 ARG A 116 2.569 15.178 -2.493 1.00 0.00 H new ATOM 0 HB3 ARG A 116 1.486 13.863 -2.905 1.00 0.00 H new ATOM 0 HG2 ARG A 116 2.298 13.896 -5.238 1.00 0.00 H new ATOM 0 HG3 ARG A 116 3.341 15.256 -4.873 1.00 0.00 H new ATOM 0 HD2 ARG A 116 4.617 13.900 -3.265 1.00 0.00 H new ATOM 0 HD3 ARG A 116 3.523 12.550 -3.488 1.00 0.00 H new ATOM 0 HE ARG A 116 4.301 12.590 -5.943 1.00 0.00 H new ATOM 0 HH11 ARG A 116 6.319 13.664 -3.238 1.00 0.00 H new ATOM 0 HH12 ARG A 116 7.829 13.316 -4.088 1.00 0.00 H new ATOM 0 HH21 ARG A 116 6.246 12.156 -7.009 1.00 0.00 H new ATOM 0 HH22 ARG A 116 7.787 12.470 -6.203 1.00 0.00 H new ATOM 1811 N ARG A 117 -0.659 16.120 -5.492 1.00 0.00 N ATOM 1812 CA ARG A 117 -1.634 15.770 -6.519 1.00 0.00 C ATOM 1813 C ARG A 117 -0.953 15.246 -7.782 1.00 0.00 C ATOM 1814 O ARG A 117 -1.065 15.828 -8.862 1.00 0.00 O ATOM 1815 CB ARG A 117 -2.515 16.980 -6.837 1.00 0.00 C ATOM 1816 CG ARG A 117 -3.280 17.488 -5.626 1.00 0.00 C ATOM 1817 CD ARG A 117 -4.140 18.696 -5.957 1.00 0.00 C ATOM 1818 NE ARG A 117 -4.881 19.172 -4.788 1.00 0.00 N ATOM 1819 CZ ARG A 117 -5.095 20.461 -4.517 1.00 0.00 C ATOM 1820 NH1 ARG A 117 -4.638 21.403 -5.330 1.00 0.00 N ATOM 1821 NH2 ARG A 117 -5.769 20.808 -3.430 1.00 0.00 N ATOM 0 H ARG A 117 -0.528 17.124 -5.371 1.00 0.00 H new ATOM 0 HA ARG A 117 -2.262 14.967 -6.133 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -1.892 17.783 -7.230 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -3.223 16.712 -7.621 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -3.912 16.690 -5.236 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -2.575 17.751 -4.837 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -3.508 19.498 -6.339 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -4.841 18.437 -6.751 1.00 0.00 H new ATOM 0 HE ARG A 117 -5.256 18.477 -4.142 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -4.119 21.145 -6.169 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -4.805 22.386 -5.116 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -6.125 20.089 -2.799 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -5.932 21.794 -3.224 1.00 0.00 H new ATOM 1835 N ARG A 118 -0.231 14.148 -7.617 1.00 0.00 N ATOM 1836 CA ARG A 118 0.416 13.449 -8.716 1.00 0.00 C ATOM 1837 C ARG A 118 0.178 11.961 -8.570 1.00 0.00 C ATOM 1838 O ARG A 118 0.823 11.140 -9.222 1.00 0.00 O ATOM 1839 CB ARG A 118 1.923 13.708 -8.712 1.00 0.00 C ATOM 1840 CG ARG A 118 2.355 15.053 -9.267 1.00 0.00 C ATOM 1841 CD ARG A 118 3.863 15.201 -9.145 1.00 0.00 C ATOM 1842 NE ARG A 118 4.402 16.280 -9.966 1.00 0.00 N ATOM 1843 CZ ARG A 118 5.698 16.400 -10.261 1.00 0.00 C ATOM 1844 NH1 ARG A 118 6.561 15.482 -9.839 1.00 0.00 N ATOM 1845 NH2 ARG A 118 6.126 17.419 -10.997 1.00 0.00 N ATOM 0 H ARG A 118 -0.077 13.713 -6.707 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.004 13.814 -9.653 1.00 0.00 H new ATOM 0 HB2 ARG A 118 2.286 13.623 -7.688 1.00 0.00 H new ATOM 0 HB3 ARG A 118 2.411 12.922 -9.289 1.00 0.00 H new ATOM 0 HG2 ARG A 118 2.055 15.139 -10.312 1.00 0.00 H new ATOM 0 HG3 ARG A 118 1.857 15.857 -8.725 1.00 0.00 H new ATOM 0 HD2 ARG A 118 4.121 15.383 -8.102 1.00 0.00 H new ATOM 0 HD3 ARG A 118 4.338 14.263 -9.431 1.00 0.00 H new ATOM 0 HE ARG A 118 3.755 16.978 -10.333 1.00 0.00 H new ATOM 0 HH11 ARG A 118 6.233 14.687 -9.291 1.00 0.00 H new ATOM 0 HH12 ARG A 118 7.552 15.572 -10.064 1.00 0.00 H new ATOM 0 HH21 ARG A 118 5.463 18.115 -11.340 1.00 0.00 H new ATOM 0 HH22 ARG A 118 7.118 17.506 -11.220 1.00 0.00 H new ATOM 1859 N VAL A 119 -0.770 11.634 -7.720 1.00 0.00 N ATOM 1860 CA VAL A 119 -0.976 10.263 -7.290 1.00 0.00 C ATOM 1861 C VAL A 119 -2.232 9.655 -7.905 1.00 0.00 C ATOM 1862 O VAL A 119 -3.290 10.283 -7.953 1.00 0.00 O ATOM 1863 CB VAL A 119 -1.037 10.170 -5.743 1.00 0.00 C ATOM 1864 CG1 VAL A 119 -2.135 11.061 -5.177 1.00 0.00 C ATOM 1865 CG2 VAL A 119 -1.225 8.729 -5.287 1.00 0.00 C ATOM 0 H VAL A 119 -1.418 12.305 -7.307 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.121 9.687 -7.643 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.083 10.527 -5.356 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -2.151 10.973 -4.091 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -1.942 12.097 -5.454 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.099 10.751 -5.581 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.264 8.694 -4.198 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.156 8.336 -5.696 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.390 8.124 -5.640 1.00 0.00 H new ATOM 1875 N ALA A 120 -2.083 8.437 -8.401 1.00 0.00 N ATOM 1876 CA ALA A 120 -3.201 7.659 -8.901 1.00 0.00 C ATOM 1877 C ALA A 120 -3.337 6.386 -8.075 1.00 0.00 C ATOM 1878 O ALA A 120 -2.337 5.847 -7.591 1.00 0.00 O ATOM 1879 CB ALA A 120 -3.006 7.329 -10.374 1.00 0.00 C ATOM 0 H ALA A 120 -1.183 7.962 -8.468 1.00 0.00 H new ATOM 0 HA ALA A 120 -4.117 8.243 -8.809 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.854 6.745 -10.731 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.934 8.253 -10.947 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.090 6.752 -10.499 1.00 0.00 H new ATOM 1885 N ALA A 121 -4.559 5.911 -7.905 1.00 0.00 N ATOM 1886 CA ALA A 121 -4.806 4.751 -7.061 1.00 0.00 C ATOM 1887 C ALA A 121 -5.451 3.618 -7.846 1.00 0.00 C ATOM 1888 O ALA A 121 -6.502 3.791 -8.458 1.00 0.00 O ATOM 1889 CB ALA A 121 -5.681 5.139 -5.877 1.00 0.00 C ATOM 0 H ALA A 121 -5.393 6.308 -8.337 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.844 4.395 -6.692 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.859 4.263 -5.253 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.178 5.907 -5.289 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.634 5.525 -6.240 1.00 0.00 H new ATOM 1895 N ALA A 122 -4.814 2.459 -7.829 1.00 0.00 N ATOM 1896 CA ALA A 122 -5.362 1.277 -8.475 1.00 0.00 C ATOM 1897 C ALA A 122 -5.841 0.293 -7.419 1.00 0.00 C ATOM 1898 O ALA A 122 -5.042 -0.220 -6.638 1.00 0.00 O ATOM 1899 CB ALA A 122 -4.319 0.633 -9.378 1.00 0.00 C ATOM 0 H ALA A 122 -3.914 2.311 -7.373 1.00 0.00 H new ATOM 0 HA ALA A 122 -6.210 1.569 -9.094 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.745 -0.250 -9.854 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -4.011 1.345 -10.144 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.453 0.343 -8.784 1.00 0.00 H new ATOM 1905 N LEU A 123 -7.139 0.041 -7.380 1.00 0.00 N ATOM 1906 CA LEU A 123 -7.714 -0.804 -6.343 1.00 0.00 C ATOM 1907 C LEU A 123 -8.285 -2.088 -6.929 1.00 0.00 C ATOM 1908 O LEU A 123 -9.136 -2.054 -7.818 1.00 0.00 O ATOM 1909 CB LEU A 123 -8.806 -0.050 -5.579 1.00 0.00 C ATOM 1910 CG LEU A 123 -8.343 1.210 -4.845 1.00 0.00 C ATOM 1911 CD1 LEU A 123 -9.516 1.869 -4.141 1.00 0.00 C ATOM 1912 CD2 LEU A 123 -7.242 0.880 -3.846 1.00 0.00 C ATOM 0 H LEU A 123 -7.814 0.407 -8.051 1.00 0.00 H new ATOM 0 HA LEU A 123 -6.913 -1.069 -5.652 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.592 0.227 -6.282 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -9.253 -0.729 -4.853 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.939 1.906 -5.580 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -9.173 2.764 -3.623 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -10.274 2.143 -4.875 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -9.944 1.174 -3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.928 1.791 -3.336 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -7.617 0.165 -3.114 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -6.391 0.447 -4.372 1.00 0.00 H new ATOM 1924 N ILE A 124 -7.802 -3.214 -6.429 1.00 0.00 N ATOM 1925 CA ILE A 124 -8.286 -4.519 -6.856 1.00 0.00 C ATOM 1926 C ILE A 124 -9.382 -5.009 -5.906 1.00 0.00 C ATOM 1927 O ILE A 124 -9.378 -4.662 -4.722 1.00 0.00 O ATOM 1928 CB ILE A 124 -7.124 -5.545 -6.913 1.00 0.00 C ATOM 1929 CG1 ILE A 124 -6.049 -5.061 -7.891 1.00 0.00 C ATOM 1930 CG2 ILE A 124 -7.624 -6.928 -7.312 1.00 0.00 C ATOM 1931 CD1 ILE A 124 -4.863 -5.995 -8.016 1.00 0.00 C ATOM 0 H ILE A 124 -7.069 -3.251 -5.721 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.704 -4.422 -7.858 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.691 -5.626 -5.916 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.500 -4.930 -8.875 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.695 -4.082 -7.570 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.785 -7.623 -7.343 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -8.356 -7.275 -6.583 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -8.089 -6.877 -8.297 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -4.147 -5.581 -8.727 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -4.385 -6.108 -7.043 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -5.202 -6.969 -8.368 1.00 0.00 H new ATOM 1943 N ALA A 125 -10.330 -5.775 -6.449 1.00 0.00 N ATOM 1944 CA ALA A 125 -11.443 -6.339 -5.683 1.00 0.00 C ATOM 1945 C ALA A 125 -10.998 -6.954 -4.361 1.00 0.00 C ATOM 1946 O ALA A 125 -9.960 -7.612 -4.275 1.00 0.00 O ATOM 1947 CB ALA A 125 -12.169 -7.385 -6.513 1.00 0.00 C ATOM 0 H ALA A 125 -10.347 -6.023 -7.438 1.00 0.00 H new ATOM 0 HA ALA A 125 -12.114 -5.513 -5.447 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -12.995 -7.799 -5.935 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -12.557 -6.924 -7.421 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -11.476 -8.184 -6.779 1.00 0.00 H new ATOM 1953 N VAL A 126 -11.809 -6.743 -3.335 1.00 0.00 N ATOM 1954 CA VAL A 126 -11.519 -7.256 -2.007 1.00 0.00 C ATOM 1955 C VAL A 126 -12.470 -8.395 -1.659 1.00 0.00 C ATOM 1956 O VAL A 126 -13.669 -8.178 -1.491 1.00 0.00 O ATOM 1957 CB VAL A 126 -11.650 -6.151 -0.937 1.00 0.00 C ATOM 1958 CG1 VAL A 126 -11.164 -6.646 0.417 1.00 0.00 C ATOM 1959 CG2 VAL A 126 -10.897 -4.900 -1.357 1.00 0.00 C ATOM 0 H VAL A 126 -12.680 -6.215 -3.399 1.00 0.00 H new ATOM 0 HA VAL A 126 -10.492 -7.620 -2.015 1.00 0.00 H new ATOM 0 HB VAL A 126 -12.706 -5.896 -0.844 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -11.266 -5.849 1.154 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -11.760 -7.505 0.726 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -10.117 -6.939 0.343 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -11.004 -4.135 -0.587 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -9.841 -5.138 -1.488 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -11.305 -4.528 -2.297 1.00 0.00 H new