USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 911 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.277 USER MOD Single : A 19 TYR OH : rot 180:sc= 0.0817 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 176:sc= 0 (180deg=-0.0182) USER MOD Single : A 30 SER OG : rot -157:sc= -0.0908 USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= -0.0509 K(o=-0.051,f=-3.1!) USER MOD Single : A 34 SER OG : rot 93:sc= -0.983 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -164:sc= 1.22 (180deg=0.462) USER MOD Single : A 52 GLN : amide:sc= -0.0148 K(o=-0.015,f=-3.2) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot -163:sc= 1.81 USER MOD Single : A 59 GLN : amide:sc= -0.924 K(o=-0.92,f=0) USER MOD Single : A 64 ASN : amide:sc= -0.825 K(o=-0.82,f=-0.15) USER MOD Single : A 66 ASN : amide:sc= -0.312 K(o=-0.31,f=-1.3!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 107:sc= 0.113 USER MOD Single : A 85 GLN : amide:sc= -0.0501 X(o=-0.05,f=-0.22) USER MOD Single : A 94 ASN : amide:sc= 0.912 K(o=0.91,f=-0.083) USER MOD Single : A 99 THR OG1 : rot 43:sc= 0.0588 USER MOD Single : A 100 MET CE :methyl 158:sc= -0.182 (180deg=-0.789) USER MOD Single : A 101 GLN : amide:sc= -0.0974 K(o=-0.097,f=-4.1!) USER MOD Single : A 102 THR OG1 : rot -135:sc= 1.45 USER MOD Single : A 108 THR OG1 : rot 69:sc= 0.773 USER MOD Single : A 109 TYR OH : rot -171:sc= 0.0188 USER MOD Single : A 110 ASN : amide:sc= 1.03 K(o=1,f=-0.086) USER MOD Single : A 112 MET CE :methyl 162:sc= -0.143 (180deg=-0.646) USER MOD ----------------------------------------------------------------- ATOM 148 N PHE A 10 -15.880 10.230 -15.703 1.00 0.00 N ATOM 149 CA PHE A 10 -16.063 10.398 -14.267 1.00 0.00 C ATOM 150 C PHE A 10 -14.880 11.165 -13.693 1.00 0.00 C ATOM 151 O PHE A 10 -13.747 10.683 -13.729 1.00 0.00 O ATOM 152 CB PHE A 10 -16.208 9.038 -13.578 1.00 0.00 C ATOM 153 CG PHE A 10 -17.398 8.250 -14.058 1.00 0.00 C ATOM 154 CD1 PHE A 10 -18.662 8.500 -13.545 1.00 0.00 C ATOM 155 CD2 PHE A 10 -17.252 7.265 -15.021 1.00 0.00 C ATOM 156 CE1 PHE A 10 -19.757 7.781 -13.984 1.00 0.00 C ATOM 157 CE2 PHE A 10 -18.345 6.542 -15.463 1.00 0.00 C ATOM 158 CZ PHE A 10 -19.597 6.801 -14.943 1.00 0.00 C ATOM 0 HA PHE A 10 -16.978 10.963 -14.088 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -15.303 8.455 -13.747 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -16.292 9.191 -12.502 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -18.792 9.265 -12.794 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -16.274 7.059 -15.431 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -20.737 7.985 -13.578 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -18.219 5.776 -16.214 1.00 0.00 H new ATOM 0 HZ PHE A 10 -20.452 6.237 -15.286 1.00 0.00 H new ATOM 168 N PRO A 11 -15.126 12.378 -13.177 1.00 0.00 N ATOM 169 CA PRO A 11 -14.073 13.272 -12.728 1.00 0.00 C ATOM 170 C PRO A 11 -13.660 13.050 -11.274 1.00 0.00 C ATOM 171 O PRO A 11 -14.232 13.644 -10.357 1.00 0.00 O ATOM 172 CB PRO A 11 -14.701 14.651 -12.913 1.00 0.00 C ATOM 173 CG PRO A 11 -16.173 14.442 -12.733 1.00 0.00 C ATOM 174 CD PRO A 11 -16.458 12.978 -12.992 1.00 0.00 C ATOM 0 HA PRO A 11 -13.148 13.120 -13.285 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -14.312 15.361 -12.183 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -14.479 15.055 -13.901 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -16.480 14.720 -11.725 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -16.737 15.070 -13.422 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -16.988 12.521 -12.156 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -17.081 12.844 -13.876 1.00 0.00 H new ATOM 182 N ARG A 12 -12.685 12.160 -11.085 1.00 0.00 N ATOM 183 CA ARG A 12 -12.018 11.962 -9.801 1.00 0.00 C ATOM 184 C ARG A 12 -12.963 11.455 -8.716 1.00 0.00 C ATOM 185 O ARG A 12 -13.760 12.203 -8.157 1.00 0.00 O ATOM 186 CB ARG A 12 -11.363 13.266 -9.341 1.00 0.00 C ATOM 187 CG ARG A 12 -10.628 13.149 -8.016 1.00 0.00 C ATOM 188 CD ARG A 12 -10.387 14.520 -7.406 1.00 0.00 C ATOM 189 NE ARG A 12 -11.646 15.193 -7.089 1.00 0.00 N ATOM 190 CZ ARG A 12 -12.059 16.319 -7.669 1.00 0.00 C ATOM 191 NH1 ARG A 12 -11.320 16.901 -8.607 1.00 0.00 N ATOM 192 NH2 ARG A 12 -13.223 16.848 -7.324 1.00 0.00 N ATOM 0 H ARG A 12 -12.334 11.552 -11.826 1.00 0.00 H new ATOM 0 HA ARG A 12 -11.259 11.195 -9.956 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -10.662 13.599 -10.106 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -12.130 14.036 -9.254 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -11.209 12.537 -7.326 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -9.675 12.642 -8.168 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -9.790 14.417 -6.500 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -9.810 15.132 -8.100 1.00 0.00 H new ATOM 0 HE ARG A 12 -12.246 14.774 -6.379 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -10.431 16.486 -8.887 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -11.641 17.763 -9.048 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -13.800 16.393 -6.616 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -13.542 17.710 -7.766 1.00 0.00 H new ATOM 206 N THR A 13 -12.856 10.181 -8.404 1.00 0.00 N ATOM 207 CA THR A 13 -13.563 9.634 -7.264 1.00 0.00 C ATOM 208 C THR A 13 -12.678 9.747 -6.026 1.00 0.00 C ATOM 209 O THR A 13 -11.721 8.995 -5.866 1.00 0.00 O ATOM 210 CB THR A 13 -13.954 8.162 -7.498 1.00 0.00 C ATOM 211 OG1 THR A 13 -14.648 8.038 -8.746 1.00 0.00 O ATOM 212 CG2 THR A 13 -14.838 7.645 -6.370 1.00 0.00 C ATOM 0 H THR A 13 -12.290 9.507 -8.920 1.00 0.00 H new ATOM 0 HA THR A 13 -14.482 10.202 -7.120 1.00 0.00 H new ATOM 0 HB THR A 13 -13.042 7.566 -7.522 1.00 0.00 H new ATOM 0 HG1 THR A 13 -14.893 7.101 -8.892 1.00 0.00 H new ATOM 0 HG21 THR A 13 -15.099 6.604 -6.560 1.00 0.00 H new ATOM 0 HG22 THR A 13 -14.301 7.717 -5.424 1.00 0.00 H new ATOM 0 HG23 THR A 13 -15.748 8.243 -6.317 1.00 0.00 H new ATOM 220 N ALA A 14 -12.979 10.719 -5.172 1.00 0.00 N ATOM 221 CA ALA A 14 -12.148 10.989 -4.005 1.00 0.00 C ATOM 222 C ALA A 14 -12.574 10.144 -2.812 1.00 0.00 C ATOM 223 O ALA A 14 -11.739 9.564 -2.117 1.00 0.00 O ATOM 224 CB ALA A 14 -12.196 12.467 -3.653 1.00 0.00 C ATOM 0 H ALA A 14 -13.790 11.331 -5.265 1.00 0.00 H new ATOM 0 HA ALA A 14 -11.122 10.719 -4.255 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -11.571 12.654 -2.780 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -11.828 13.054 -4.495 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -13.224 12.755 -3.432 1.00 0.00 H new ATOM 230 N ALA A 15 -13.870 10.081 -2.568 1.00 0.00 N ATOM 231 CA ALA A 15 -14.389 9.313 -1.452 1.00 0.00 C ATOM 232 C ALA A 15 -14.830 7.931 -1.912 1.00 0.00 C ATOM 233 O ALA A 15 -15.889 7.780 -2.525 1.00 0.00 O ATOM 234 CB ALA A 15 -15.534 10.056 -0.788 1.00 0.00 C ATOM 0 H ALA A 15 -14.582 10.552 -3.127 1.00 0.00 H new ATOM 0 HA ALA A 15 -13.594 9.185 -0.718 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.913 9.468 0.048 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.179 11.019 -0.422 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.333 10.215 -1.512 1.00 0.00 H new ATOM 240 N ILE A 16 -14.012 6.931 -1.635 1.00 0.00 N ATOM 241 CA ILE A 16 -14.317 5.562 -2.023 1.00 0.00 C ATOM 242 C ILE A 16 -14.880 4.795 -0.830 1.00 0.00 C ATOM 243 O ILE A 16 -14.437 4.984 0.306 1.00 0.00 O ATOM 244 CB ILE A 16 -13.061 4.843 -2.570 1.00 0.00 C ATOM 245 CG1 ILE A 16 -12.397 5.697 -3.657 1.00 0.00 C ATOM 246 CG2 ILE A 16 -13.428 3.468 -3.123 1.00 0.00 C ATOM 247 CD1 ILE A 16 -11.088 5.130 -4.167 1.00 0.00 C ATOM 0 H ILE A 16 -13.127 7.041 -1.140 1.00 0.00 H new ATOM 0 HA ILE A 16 -15.063 5.592 -2.817 1.00 0.00 H new ATOM 0 HB ILE A 16 -12.355 4.705 -1.751 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -13.087 5.803 -4.494 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -12.219 6.697 -3.262 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -12.532 2.978 -3.503 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -13.865 2.861 -2.330 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -14.150 3.582 -3.932 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -10.680 5.789 -4.933 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -10.380 5.050 -3.342 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -11.261 4.142 -4.594 1.00 0.00 H new ATOM 259 N ASP A 17 -15.871 3.954 -1.087 1.00 0.00 N ATOM 260 CA ASP A 17 -16.549 3.221 -0.027 1.00 0.00 C ATOM 261 C ASP A 17 -16.031 1.790 0.079 1.00 0.00 C ATOM 262 O ASP A 17 -14.990 1.458 -0.489 1.00 0.00 O ATOM 263 CB ASP A 17 -18.064 3.225 -0.264 1.00 0.00 C ATOM 264 CG ASP A 17 -18.703 4.543 0.117 1.00 0.00 C ATOM 265 OD1 ASP A 17 -18.882 4.793 1.328 1.00 0.00 O ATOM 266 OD2 ASP A 17 -19.037 5.336 -0.787 1.00 0.00 O ATOM 0 H ASP A 17 -16.225 3.762 -2.024 1.00 0.00 H new ATOM 0 HA ASP A 17 -16.337 3.723 0.917 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -18.265 3.017 -1.315 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -18.522 2.422 0.313 1.00 0.00 H new ATOM 271 N ALA A 18 -16.757 0.965 0.833 1.00 0.00 N ATOM 272 CA ALA A 18 -16.386 -0.424 1.078 1.00 0.00 C ATOM 273 C ALA A 18 -16.095 -1.196 -0.206 1.00 0.00 C ATOM 274 O ALA A 18 -16.694 -0.951 -1.257 1.00 0.00 O ATOM 275 CB ALA A 18 -17.488 -1.121 1.858 1.00 0.00 C ATOM 0 H ALA A 18 -17.623 1.245 1.292 1.00 0.00 H new ATOM 0 HA ALA A 18 -15.463 -0.410 1.658 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -17.206 -2.158 2.038 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -17.635 -0.614 2.812 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -18.414 -1.091 1.284 1.00 0.00 H new ATOM 281 N TYR A 19 -15.177 -2.143 -0.095 1.00 0.00 N ATOM 282 CA TYR A 19 -14.778 -2.972 -1.216 1.00 0.00 C ATOM 283 C TYR A 19 -14.738 -4.437 -0.793 1.00 0.00 C ATOM 284 O TYR A 19 -14.625 -4.745 0.397 1.00 0.00 O ATOM 285 CB TYR A 19 -13.400 -2.538 -1.734 1.00 0.00 C ATOM 286 CG TYR A 19 -12.281 -2.706 -0.724 1.00 0.00 C ATOM 287 CD1 TYR A 19 -12.059 -1.756 0.268 1.00 0.00 C ATOM 288 CD2 TYR A 19 -11.448 -3.820 -0.760 1.00 0.00 C ATOM 289 CE1 TYR A 19 -11.043 -1.912 1.193 1.00 0.00 C ATOM 290 CE2 TYR A 19 -10.431 -3.981 0.162 1.00 0.00 C ATOM 291 CZ TYR A 19 -10.233 -3.025 1.136 1.00 0.00 C ATOM 292 OH TYR A 19 -9.221 -3.182 2.055 1.00 0.00 O ATOM 0 H TYR A 19 -14.689 -2.357 0.775 1.00 0.00 H new ATOM 0 HA TYR A 19 -15.507 -2.853 -2.017 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -13.160 -3.116 -2.626 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -13.449 -1.492 -2.036 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -12.691 -0.882 0.316 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -11.599 -4.571 -1.521 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -10.885 -1.165 1.957 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -9.794 -4.852 0.120 1.00 0.00 H new ATOM 0 HH TYR A 19 -8.744 -4.019 1.877 1.00 0.00 H new ATOM 302 N GLY A 20 -14.841 -5.333 -1.760 1.00 0.00 N ATOM 303 CA GLY A 20 -14.759 -6.747 -1.470 1.00 0.00 C ATOM 304 C GLY A 20 -15.900 -7.523 -2.084 1.00 0.00 C ATOM 305 O GLY A 20 -15.767 -8.088 -3.169 1.00 0.00 O ATOM 0 H GLY A 20 -14.980 -5.105 -2.744 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -13.813 -7.138 -1.844 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -14.761 -6.895 -0.390 1.00 0.00 H new ATOM 309 N LYS A 21 -17.032 -7.539 -1.397 1.00 0.00 N ATOM 310 CA LYS A 21 -18.198 -8.266 -1.871 1.00 0.00 C ATOM 311 C LYS A 21 -18.843 -7.546 -3.039 1.00 0.00 C ATOM 312 O LYS A 21 -19.483 -6.508 -2.874 1.00 0.00 O ATOM 313 CB LYS A 21 -19.203 -8.483 -0.740 1.00 0.00 C ATOM 314 CG LYS A 21 -18.696 -9.458 0.305 1.00 0.00 C ATOM 315 CD LYS A 21 -18.350 -10.794 -0.331 1.00 0.00 C ATOM 316 CE LYS A 21 -17.473 -11.641 0.571 1.00 0.00 C ATOM 317 NZ LYS A 21 -18.200 -12.129 1.772 1.00 0.00 N ATOM 0 H LYS A 21 -17.167 -7.056 -0.509 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.868 -9.245 -2.218 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -19.423 -7.527 -0.265 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -20.139 -8.855 -1.156 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -17.816 -9.045 0.798 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -19.455 -9.601 1.074 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -19.268 -11.336 -0.558 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -17.838 -10.623 -1.278 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -17.094 -12.494 0.008 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -16.608 -11.057 0.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.559 -12.702 2.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -18.540 -11.317 2.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -19.010 -12.709 1.475 1.00 0.00 H new ATOM 331 N GLY A 22 -18.654 -8.108 -4.220 1.00 0.00 N ATOM 332 CA GLY A 22 -19.165 -7.496 -5.429 1.00 0.00 C ATOM 333 C GLY A 22 -18.130 -6.611 -6.095 1.00 0.00 C ATOM 334 O GLY A 22 -18.367 -6.065 -7.175 1.00 0.00 O ATOM 0 H GLY A 22 -18.152 -8.984 -4.365 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -19.479 -8.274 -6.125 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -20.049 -6.905 -5.191 1.00 0.00 H new ATOM 338 N GLY A 23 -16.976 -6.481 -5.453 1.00 0.00 N ATOM 339 CA GLY A 23 -15.924 -5.635 -5.978 1.00 0.00 C ATOM 340 C GLY A 23 -15.892 -4.289 -5.291 1.00 0.00 C ATOM 341 O GLY A 23 -15.823 -4.218 -4.064 1.00 0.00 O ATOM 0 H GLY A 23 -16.750 -6.949 -4.575 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.962 -6.131 -5.852 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -16.071 -5.493 -7.049 1.00 0.00 H new ATOM 345 N PHE A 24 -15.936 -3.223 -6.072 1.00 0.00 N ATOM 346 CA PHE A 24 -15.991 -1.878 -5.520 1.00 0.00 C ATOM 347 C PHE A 24 -17.423 -1.368 -5.528 1.00 0.00 C ATOM 348 O PHE A 24 -18.077 -1.345 -6.571 1.00 0.00 O ATOM 349 CB PHE A 24 -15.080 -0.930 -6.299 1.00 0.00 C ATOM 350 CG PHE A 24 -13.619 -1.171 -6.048 1.00 0.00 C ATOM 351 CD1 PHE A 24 -12.931 -2.144 -6.754 1.00 0.00 C ATOM 352 CD2 PHE A 24 -12.937 -0.427 -5.099 1.00 0.00 C ATOM 353 CE1 PHE A 24 -11.588 -2.368 -6.517 1.00 0.00 C ATOM 354 CE2 PHE A 24 -11.595 -0.648 -4.859 1.00 0.00 C ATOM 355 CZ PHE A 24 -10.920 -1.620 -5.569 1.00 0.00 C ATOM 0 H PHE A 24 -15.935 -3.262 -7.091 1.00 0.00 H new ATOM 0 HA PHE A 24 -15.636 -1.914 -4.490 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.281 -1.038 -7.365 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -15.323 0.098 -6.031 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -13.449 -2.733 -7.497 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -13.461 0.335 -4.540 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -11.061 -3.129 -7.074 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -11.075 -0.061 -4.117 1.00 0.00 H new ATOM 0 HZ PHE A 24 -9.871 -1.795 -5.383 1.00 0.00 H new ATOM 365 N TYR A 25 -17.903 -0.969 -4.362 1.00 0.00 N ATOM 366 CA TYR A 25 -19.291 -0.574 -4.202 1.00 0.00 C ATOM 367 C TYR A 25 -19.382 0.830 -3.608 1.00 0.00 C ATOM 368 O TYR A 25 -19.160 1.031 -2.414 1.00 0.00 O ATOM 369 CB TYR A 25 -19.996 -1.601 -3.310 1.00 0.00 C ATOM 370 CG TYR A 25 -21.487 -1.393 -3.138 1.00 0.00 C ATOM 371 CD1 TYR A 25 -21.985 -0.573 -2.133 1.00 0.00 C ATOM 372 CD2 TYR A 25 -22.397 -2.036 -3.968 1.00 0.00 C ATOM 373 CE1 TYR A 25 -23.344 -0.397 -1.962 1.00 0.00 C ATOM 374 CE2 TYR A 25 -23.758 -1.863 -3.806 1.00 0.00 C ATOM 375 CZ TYR A 25 -24.226 -1.043 -2.801 1.00 0.00 C ATOM 376 OH TYR A 25 -25.581 -0.874 -2.632 1.00 0.00 O ATOM 0 H TYR A 25 -17.348 -0.910 -3.508 1.00 0.00 H new ATOM 0 HA TYR A 25 -19.784 -0.548 -5.174 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -19.830 -2.594 -3.727 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -19.528 -1.586 -2.326 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -21.297 -0.064 -1.474 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -22.034 -2.682 -4.753 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -23.714 0.244 -1.175 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -24.451 -2.367 -4.463 1.00 0.00 H new ATOM 0 HH TYR A 25 -26.063 -1.397 -3.306 1.00 0.00 H new ATOM 386 N PHE A 26 -19.691 1.801 -4.457 1.00 0.00 N ATOM 387 CA PHE A 26 -19.791 3.192 -4.036 1.00 0.00 C ATOM 388 C PHE A 26 -20.935 3.891 -4.768 1.00 0.00 C ATOM 389 O PHE A 26 -21.581 3.296 -5.633 1.00 0.00 O ATOM 390 CB PHE A 26 -18.462 3.930 -4.267 1.00 0.00 C ATOM 391 CG PHE A 26 -17.967 3.900 -5.690 1.00 0.00 C ATOM 392 CD1 PHE A 26 -18.336 4.887 -6.590 1.00 0.00 C ATOM 393 CD2 PHE A 26 -17.120 2.890 -6.121 1.00 0.00 C ATOM 394 CE1 PHE A 26 -17.872 4.867 -7.891 1.00 0.00 C ATOM 395 CE2 PHE A 26 -16.654 2.865 -7.422 1.00 0.00 C ATOM 396 CZ PHE A 26 -17.030 3.855 -8.308 1.00 0.00 C ATOM 0 H PHE A 26 -19.878 1.649 -5.448 1.00 0.00 H new ATOM 0 HA PHE A 26 -20.005 3.212 -2.967 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -18.580 4.969 -3.959 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -17.701 3.491 -3.622 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -18.994 5.681 -6.270 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -16.821 2.114 -5.432 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -18.168 5.643 -8.582 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -15.996 2.072 -7.745 1.00 0.00 H new ATOM 0 HZ PHE A 26 -16.666 3.838 -9.325 1.00 0.00 H new ATOM 406 N ALA A 27 -21.168 5.155 -4.429 1.00 0.00 N ATOM 407 CA ALA A 27 -22.276 5.910 -4.999 1.00 0.00 C ATOM 408 C ALA A 27 -21.968 6.348 -6.426 1.00 0.00 C ATOM 409 O ALA A 27 -21.288 7.351 -6.656 1.00 0.00 O ATOM 410 CB ALA A 27 -22.608 7.111 -4.127 1.00 0.00 C ATOM 0 H ALA A 27 -20.602 5.678 -3.761 1.00 0.00 H new ATOM 0 HA ALA A 27 -23.147 5.256 -5.032 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -23.438 7.663 -4.568 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -22.888 6.771 -3.130 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -21.736 7.762 -4.057 1.00 0.00 H new ATOM 416 N GLY A 28 -22.462 5.570 -7.372 1.00 0.00 N ATOM 417 CA GLY A 28 -22.257 5.854 -8.776 1.00 0.00 C ATOM 418 C GLY A 28 -22.334 4.589 -9.598 1.00 0.00 C ATOM 419 O GLY A 28 -23.325 4.342 -10.288 1.00 0.00 O ATOM 0 H GLY A 28 -23.012 4.731 -7.189 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -23.009 6.563 -9.121 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -21.285 6.326 -8.918 1.00 0.00 H new ATOM 423 N MET A 29 -21.289 3.784 -9.506 1.00 0.00 N ATOM 424 CA MET A 29 -21.259 2.471 -10.129 1.00 0.00 C ATOM 425 C MET A 29 -20.570 1.489 -9.194 1.00 0.00 C ATOM 426 O MET A 29 -19.619 1.848 -8.503 1.00 0.00 O ATOM 427 CB MET A 29 -20.540 2.507 -11.485 1.00 0.00 C ATOM 428 CG MET A 29 -21.353 3.163 -12.590 1.00 0.00 C ATOM 429 SD MET A 29 -20.521 3.127 -14.189 1.00 0.00 S ATOM 430 CE MET A 29 -21.780 3.852 -15.237 1.00 0.00 C ATOM 0 H MET A 29 -20.437 4.022 -8.997 1.00 0.00 H new ATOM 0 HA MET A 29 -22.285 2.151 -10.311 1.00 0.00 H new ATOM 0 HB2 MET A 29 -19.597 3.043 -11.372 1.00 0.00 H new ATOM 0 HB3 MET A 29 -20.294 1.488 -11.783 1.00 0.00 H new ATOM 0 HG2 MET A 29 -22.315 2.658 -12.675 1.00 0.00 H new ATOM 0 HG3 MET A 29 -21.560 4.198 -12.317 1.00 0.00 H new ATOM 0 HE1 MET A 29 -21.391 3.965 -16.249 1.00 0.00 H new ATOM 0 HE2 MET A 29 -22.656 3.203 -15.256 1.00 0.00 H new ATOM 0 HE3 MET A 29 -22.061 4.830 -14.845 1.00 0.00 H new ATOM 440 N SER A 30 -21.073 0.268 -9.145 1.00 0.00 N ATOM 441 CA SER A 30 -20.520 -0.746 -8.263 1.00 0.00 C ATOM 442 C SER A 30 -20.314 -2.056 -9.012 1.00 0.00 C ATOM 443 O SER A 30 -21.282 -2.703 -9.417 1.00 0.00 O ATOM 444 CB SER A 30 -21.456 -0.960 -7.076 1.00 0.00 C ATOM 445 OG SER A 30 -21.713 0.264 -6.408 1.00 0.00 O ATOM 0 H SER A 30 -21.865 -0.046 -9.706 1.00 0.00 H new ATOM 0 HA SER A 30 -19.551 -0.404 -7.900 1.00 0.00 H new ATOM 0 HB2 SER A 30 -22.394 -1.395 -7.421 1.00 0.00 H new ATOM 0 HB3 SER A 30 -21.011 -1.672 -6.381 1.00 0.00 H new ATOM 0 HG SER A 30 -21.982 0.082 -5.484 1.00 0.00 H new ATOM 451 N HIS A 31 -19.053 -2.441 -9.182 1.00 0.00 N ATOM 452 CA HIS A 31 -18.698 -3.634 -9.953 1.00 0.00 C ATOM 453 C HIS A 31 -17.182 -3.749 -10.074 1.00 0.00 C ATOM 454 O HIS A 31 -16.457 -2.833 -9.687 1.00 0.00 O ATOM 455 CB HIS A 31 -19.313 -3.583 -11.361 1.00 0.00 C ATOM 456 CG HIS A 31 -19.924 -4.881 -11.802 1.00 0.00 C ATOM 457 ND1 HIS A 31 -19.310 -5.753 -12.680 1.00 0.00 N ATOM 458 CD2 HIS A 31 -21.112 -5.450 -11.485 1.00 0.00 C ATOM 459 CE1 HIS A 31 -20.094 -6.796 -12.879 1.00 0.00 C ATOM 460 NE2 HIS A 31 -21.192 -6.638 -12.167 1.00 0.00 N ATOM 0 H HIS A 31 -18.253 -1.942 -8.794 1.00 0.00 H new ATOM 0 HA HIS A 31 -19.093 -4.503 -9.426 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -20.077 -2.806 -11.386 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -18.541 -3.295 -12.074 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -21.858 -5.044 -10.819 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -19.873 -7.638 -13.518 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -21.974 -7.292 -12.129 1.00 0.00 H new ATOM 469 N GLN A 32 -16.730 -4.890 -10.601 1.00 0.00 N ATOM 470 CA GLN A 32 -15.316 -5.144 -10.900 1.00 0.00 C ATOM 471 C GLN A 32 -14.488 -5.341 -9.635 1.00 0.00 C ATOM 472 O GLN A 32 -14.780 -4.778 -8.582 1.00 0.00 O ATOM 473 CB GLN A 32 -14.698 -4.033 -11.760 1.00 0.00 C ATOM 474 CG GLN A 32 -15.374 -3.851 -13.109 1.00 0.00 C ATOM 475 CD GLN A 32 -14.493 -3.126 -14.107 1.00 0.00 C ATOM 476 OE1 GLN A 32 -14.492 -1.900 -14.180 1.00 0.00 O ATOM 477 NE2 GLN A 32 -13.750 -3.884 -14.897 1.00 0.00 N ATOM 0 H GLN A 32 -17.341 -5.672 -10.835 1.00 0.00 H new ATOM 0 HA GLN A 32 -15.294 -6.072 -11.472 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -14.746 -3.093 -11.211 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -13.643 -4.255 -11.920 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -15.645 -4.827 -13.511 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -16.301 -3.293 -12.975 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -13.779 -4.899 -14.805 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -13.148 -3.453 -15.598 1.00 0.00 H new ATOM 486 N GLY A 33 -13.448 -6.152 -9.756 1.00 0.00 N ATOM 487 CA GLY A 33 -12.588 -6.429 -8.628 1.00 0.00 C ATOM 488 C GLY A 33 -11.389 -5.507 -8.575 1.00 0.00 C ATOM 489 O GLY A 33 -10.539 -5.642 -7.702 1.00 0.00 O ATOM 0 H GLY A 33 -13.185 -6.625 -10.621 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.160 -6.329 -7.706 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.246 -7.463 -8.681 1.00 0.00 H new ATOM 493 N SER A 34 -11.306 -4.576 -9.518 1.00 0.00 N ATOM 494 CA SER A 34 -10.219 -3.608 -9.544 1.00 0.00 C ATOM 495 C SER A 34 -10.638 -2.356 -10.305 1.00 0.00 C ATOM 496 O SER A 34 -11.444 -2.420 -11.238 1.00 0.00 O ATOM 497 CB SER A 34 -8.967 -4.210 -10.189 1.00 0.00 C ATOM 498 OG SER A 34 -8.522 -5.357 -9.490 1.00 0.00 O ATOM 0 H SER A 34 -11.981 -4.472 -10.276 1.00 0.00 H new ATOM 0 HA SER A 34 -9.986 -3.338 -8.514 1.00 0.00 H new ATOM 0 HB2 SER A 34 -9.182 -4.475 -11.224 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.172 -3.464 -10.209 1.00 0.00 H new ATOM 0 HG SER A 34 -8.918 -6.159 -9.891 1.00 0.00 H new ATOM 504 N LEU A 35 -10.101 -1.221 -9.894 1.00 0.00 N ATOM 505 CA LEU A 35 -10.353 0.039 -10.573 1.00 0.00 C ATOM 506 C LEU A 35 -9.073 0.855 -10.643 1.00 0.00 C ATOM 507 O LEU A 35 -8.275 0.857 -9.702 1.00 0.00 O ATOM 508 CB LEU A 35 -11.451 0.837 -9.860 1.00 0.00 C ATOM 509 CG LEU A 35 -12.866 0.257 -9.959 1.00 0.00 C ATOM 510 CD1 LEU A 35 -13.841 1.091 -9.144 1.00 0.00 C ATOM 511 CD2 LEU A 35 -13.318 0.189 -11.412 1.00 0.00 C ATOM 0 H LEU A 35 -9.482 -1.146 -9.086 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.695 -0.178 -11.585 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -11.186 0.922 -8.806 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.463 1.848 -10.268 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.849 -0.755 -9.554 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.841 0.665 -9.226 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -13.532 1.094 -8.099 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -13.850 2.113 -9.522 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.325 -0.226 -11.461 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.317 1.191 -11.841 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.636 -0.447 -11.976 1.00 0.00 H new ATOM 523 N LEU A 36 -8.879 1.537 -11.759 1.00 0.00 N ATOM 524 CA LEU A 36 -7.695 2.351 -11.962 1.00 0.00 C ATOM 525 C LEU A 36 -8.076 3.819 -11.825 1.00 0.00 C ATOM 526 O LEU A 36 -8.720 4.393 -12.707 1.00 0.00 O ATOM 527 CB LEU A 36 -7.085 2.058 -13.343 1.00 0.00 C ATOM 528 CG LEU A 36 -5.612 2.452 -13.532 1.00 0.00 C ATOM 529 CD1 LEU A 36 -5.047 1.790 -14.780 1.00 0.00 C ATOM 530 CD2 LEU A 36 -5.452 3.963 -13.631 1.00 0.00 C ATOM 0 H LEU A 36 -9.532 1.542 -12.543 1.00 0.00 H new ATOM 0 HA LEU A 36 -6.942 2.112 -11.211 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.182 0.990 -13.541 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -7.678 2.577 -14.096 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.059 2.107 -12.658 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.003 2.077 -14.903 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -5.116 0.707 -14.680 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.617 2.111 -15.652 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.399 4.209 -13.764 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.022 4.334 -14.483 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.821 4.429 -12.717 1.00 0.00 H new ATOM 542 N PHE A 37 -7.704 4.413 -10.705 1.00 0.00 N ATOM 543 CA PHE A 37 -8.056 5.793 -10.425 1.00 0.00 C ATOM 544 C PHE A 37 -6.925 6.733 -10.806 1.00 0.00 C ATOM 545 O PHE A 37 -5.858 6.720 -10.192 1.00 0.00 O ATOM 546 CB PHE A 37 -8.394 5.977 -8.943 1.00 0.00 C ATOM 547 CG PHE A 37 -9.594 5.195 -8.488 1.00 0.00 C ATOM 548 CD1 PHE A 37 -10.872 5.705 -8.654 1.00 0.00 C ATOM 549 CD2 PHE A 37 -9.442 3.957 -7.887 1.00 0.00 C ATOM 550 CE1 PHE A 37 -11.977 4.991 -8.231 1.00 0.00 C ATOM 551 CE2 PHE A 37 -10.543 3.239 -7.462 1.00 0.00 C ATOM 552 CZ PHE A 37 -11.812 3.756 -7.634 1.00 0.00 C ATOM 0 H PHE A 37 -7.157 3.960 -9.973 1.00 0.00 H new ATOM 0 HA PHE A 37 -8.933 6.035 -11.025 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.532 5.681 -8.345 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.568 7.035 -8.749 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -11.006 6.671 -9.119 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -8.452 3.548 -7.749 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -12.968 5.398 -8.367 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -10.411 2.274 -6.995 1.00 0.00 H new ATOM 0 HZ PHE A 37 -12.674 3.196 -7.302 1.00 0.00 H new ATOM 562 N LEU A 38 -7.153 7.527 -11.837 1.00 0.00 N ATOM 563 CA LEU A 38 -6.239 8.598 -12.189 1.00 0.00 C ATOM 564 C LEU A 38 -6.658 9.861 -11.444 1.00 0.00 C ATOM 565 O LEU A 38 -7.780 9.934 -10.947 1.00 0.00 O ATOM 566 CB LEU A 38 -6.244 8.837 -13.705 1.00 0.00 C ATOM 567 CG LEU A 38 -5.675 7.694 -14.550 1.00 0.00 C ATOM 568 CD1 LEU A 38 -5.829 8.001 -16.031 1.00 0.00 C ATOM 569 CD2 LEU A 38 -4.211 7.454 -14.205 1.00 0.00 C ATOM 0 H LEU A 38 -7.967 7.449 -12.447 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.224 8.323 -11.902 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.269 9.026 -14.023 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.673 9.741 -13.915 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.235 6.786 -14.325 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.420 7.179 -16.618 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.885 8.126 -16.269 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.293 8.919 -16.270 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.822 6.638 -14.815 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.637 8.360 -14.402 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.124 7.192 -13.151 1.00 0.00 H new ATOM 581 N PRO A 39 -5.779 10.874 -11.353 1.00 0.00 N ATOM 582 CA PRO A 39 -6.068 12.114 -10.611 1.00 0.00 C ATOM 583 C PRO A 39 -7.204 12.957 -11.208 1.00 0.00 C ATOM 584 O PRO A 39 -7.408 14.105 -10.800 1.00 0.00 O ATOM 585 CB PRO A 39 -4.743 12.886 -10.676 1.00 0.00 C ATOM 586 CG PRO A 39 -4.022 12.325 -11.852 1.00 0.00 C ATOM 587 CD PRO A 39 -4.423 10.881 -11.929 1.00 0.00 C ATOM 0 HA PRO A 39 -6.413 11.887 -9.602 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -4.916 13.956 -10.794 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -4.166 12.755 -9.761 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -4.293 12.855 -12.765 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -2.943 12.425 -11.733 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -4.421 10.517 -12.957 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -3.743 10.244 -11.364 1.00 0.00 H new ATOM 595 N ASP A 40 -7.951 12.388 -12.148 1.00 0.00 N ATOM 596 CA ASP A 40 -9.064 13.090 -12.782 1.00 0.00 C ATOM 597 C ASP A 40 -9.998 12.107 -13.483 1.00 0.00 C ATOM 598 O ASP A 40 -11.216 12.240 -13.418 1.00 0.00 O ATOM 599 CB ASP A 40 -8.554 14.126 -13.789 1.00 0.00 C ATOM 600 CG ASP A 40 -9.671 14.989 -14.350 1.00 0.00 C ATOM 601 OD1 ASP A 40 -10.359 14.548 -15.289 1.00 0.00 O ATOM 602 OD2 ASP A 40 -9.862 16.119 -13.853 1.00 0.00 O ATOM 0 H ASP A 40 -7.806 11.438 -12.490 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.619 13.605 -11.998 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -7.814 14.764 -13.306 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.048 13.614 -14.608 1.00 0.00 H new ATOM 607 N ALA A 41 -9.426 11.112 -14.147 1.00 0.00 N ATOM 608 CA ALA A 41 -10.220 10.145 -14.896 1.00 0.00 C ATOM 609 C ALA A 41 -10.265 8.795 -14.190 1.00 0.00 C ATOM 610 O ALA A 41 -9.248 8.302 -13.709 1.00 0.00 O ATOM 611 CB ALA A 41 -9.666 9.987 -16.303 1.00 0.00 C ATOM 0 H ALA A 41 -8.419 10.953 -14.183 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.240 10.524 -14.956 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.268 9.262 -16.852 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -9.698 10.948 -16.817 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -8.635 9.637 -16.251 1.00 0.00 H new ATOM 617 N VAL A 42 -11.449 8.205 -14.129 1.00 0.00 N ATOM 618 CA VAL A 42 -11.621 6.894 -13.519 1.00 0.00 C ATOM 619 C VAL A 42 -11.741 5.822 -14.597 1.00 0.00 C ATOM 620 O VAL A 42 -12.554 5.943 -15.519 1.00 0.00 O ATOM 621 CB VAL A 42 -12.870 6.854 -12.612 1.00 0.00 C ATOM 622 CG1 VAL A 42 -13.010 5.492 -11.942 1.00 0.00 C ATOM 623 CG2 VAL A 42 -12.811 7.961 -11.569 1.00 0.00 C ATOM 0 H VAL A 42 -12.308 8.614 -14.496 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.742 6.698 -12.904 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.748 7.017 -13.237 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -13.897 5.488 -11.308 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -13.106 4.719 -12.705 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.128 5.294 -11.333 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -13.700 7.916 -10.940 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.922 7.832 -10.951 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -12.768 8.929 -12.068 1.00 0.00 H new ATOM 633 N TRP A 43 -10.918 4.787 -14.490 1.00 0.00 N ATOM 634 CA TRP A 43 -10.926 3.695 -15.456 1.00 0.00 C ATOM 635 C TRP A 43 -11.244 2.368 -14.776 1.00 0.00 C ATOM 636 O TRP A 43 -10.860 2.139 -13.628 1.00 0.00 O ATOM 637 CB TRP A 43 -9.572 3.597 -16.171 1.00 0.00 C ATOM 638 CG TRP A 43 -9.279 4.756 -17.077 1.00 0.00 C ATOM 639 CD1 TRP A 43 -8.886 6.010 -16.708 1.00 0.00 C ATOM 640 CD2 TRP A 43 -9.344 4.761 -18.508 1.00 0.00 C ATOM 641 NE1 TRP A 43 -8.714 6.798 -17.820 1.00 0.00 N ATOM 642 CE2 TRP A 43 -8.985 6.052 -18.937 1.00 0.00 C ATOM 643 CE3 TRP A 43 -9.669 3.798 -19.468 1.00 0.00 C ATOM 644 CZ2 TRP A 43 -8.947 6.406 -20.285 1.00 0.00 C ATOM 645 CZ3 TRP A 43 -9.630 4.149 -20.804 1.00 0.00 C ATOM 646 CH2 TRP A 43 -9.269 5.442 -21.201 1.00 0.00 C ATOM 0 H TRP A 43 -10.234 4.680 -13.741 1.00 0.00 H new ATOM 0 HA TRP A 43 -11.703 3.907 -16.191 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.782 3.524 -15.424 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -9.546 2.677 -16.754 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.733 6.335 -15.690 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -8.431 7.778 -17.815 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.946 2.797 -19.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -8.674 7.404 -20.595 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -9.882 3.414 -21.554 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -9.244 5.684 -22.253 1.00 0.00 H new ATOM 657 N GLY A 44 -11.954 1.503 -15.486 1.00 0.00 N ATOM 658 CA GLY A 44 -12.248 0.183 -14.968 1.00 0.00 C ATOM 659 C GLY A 44 -11.104 -0.774 -15.224 1.00 0.00 C ATOM 660 O GLY A 44 -10.595 -0.853 -16.342 1.00 0.00 O ATOM 0 H GLY A 44 -12.332 1.693 -16.414 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -12.441 0.245 -13.897 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.156 -0.199 -15.434 1.00 0.00 H new ATOM 664 N TRP A 45 -10.696 -1.507 -14.201 1.00 0.00 N ATOM 665 CA TRP A 45 -9.530 -2.365 -14.306 1.00 0.00 C ATOM 666 C TRP A 45 -9.928 -3.815 -14.046 1.00 0.00 C ATOM 667 O TRP A 45 -10.186 -4.201 -12.912 1.00 0.00 O ATOM 668 CB TRP A 45 -8.474 -1.897 -13.299 1.00 0.00 C ATOM 669 CG TRP A 45 -7.058 -2.175 -13.706 1.00 0.00 C ATOM 670 CD1 TRP A 45 -6.534 -2.099 -14.964 1.00 0.00 C ATOM 671 CD2 TRP A 45 -5.976 -2.539 -12.840 1.00 0.00 C ATOM 672 NE1 TRP A 45 -5.196 -2.410 -14.936 1.00 0.00 N ATOM 673 CE2 TRP A 45 -4.829 -2.684 -13.645 1.00 0.00 C ATOM 674 CE3 TRP A 45 -5.865 -2.767 -11.464 1.00 0.00 C ATOM 675 CZ2 TRP A 45 -3.590 -3.037 -13.117 1.00 0.00 C ATOM 676 CZ3 TRP A 45 -4.635 -3.117 -10.943 1.00 0.00 C ATOM 677 CH2 TRP A 45 -3.511 -3.252 -11.769 1.00 0.00 C ATOM 0 H TRP A 45 -11.155 -1.524 -13.290 1.00 0.00 H new ATOM 0 HA TRP A 45 -9.111 -2.305 -15.311 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -8.590 -0.824 -13.143 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -8.665 -2.381 -12.341 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -7.090 -1.833 -15.851 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -4.576 -2.433 -15.746 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -6.727 -2.671 -10.820 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -2.721 -3.138 -13.750 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -4.538 -3.290 -9.881 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -2.564 -3.531 -11.332 1.00 0.00 H new ATOM 688 N ASP A 46 -10.009 -4.616 -15.099 1.00 0.00 N ATOM 689 CA ASP A 46 -10.438 -6.003 -14.949 1.00 0.00 C ATOM 690 C ASP A 46 -9.298 -6.869 -14.430 1.00 0.00 C ATOM 691 O ASP A 46 -8.552 -7.476 -15.202 1.00 0.00 O ATOM 692 CB ASP A 46 -10.981 -6.569 -16.262 1.00 0.00 C ATOM 693 CG ASP A 46 -11.537 -7.969 -16.087 1.00 0.00 C ATOM 694 OD1 ASP A 46 -12.636 -8.109 -15.515 1.00 0.00 O ATOM 695 OD2 ASP A 46 -10.870 -8.938 -16.503 1.00 0.00 O ATOM 0 H ASP A 46 -9.787 -4.337 -16.055 1.00 0.00 H new ATOM 0 HA ASP A 46 -11.247 -6.017 -14.219 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -11.763 -5.913 -16.644 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.186 -6.585 -17.007 1.00 0.00 H new ATOM 700 N VAL A 47 -9.147 -6.877 -13.114 1.00 0.00 N ATOM 701 CA VAL A 47 -8.122 -7.662 -12.447 1.00 0.00 C ATOM 702 C VAL A 47 -8.734 -8.383 -11.248 1.00 0.00 C ATOM 703 O VAL A 47 -9.644 -7.862 -10.605 1.00 0.00 O ATOM 704 CB VAL A 47 -6.944 -6.765 -11.985 1.00 0.00 C ATOM 705 CG1 VAL A 47 -5.916 -7.555 -11.191 1.00 0.00 C ATOM 706 CG2 VAL A 47 -6.281 -6.098 -13.180 1.00 0.00 C ATOM 0 H VAL A 47 -9.734 -6.337 -12.478 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.730 -8.394 -13.153 1.00 0.00 H new ATOM 0 HB VAL A 47 -7.355 -5.996 -11.331 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -5.106 -6.893 -10.885 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -6.389 -7.983 -10.307 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -5.515 -8.356 -11.811 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -5.457 -5.473 -12.837 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.899 -6.862 -13.857 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.011 -5.481 -13.704 1.00 0.00 H new ATOM 716 N THR A 48 -8.280 -9.601 -10.986 1.00 0.00 N ATOM 717 CA THR A 48 -8.756 -10.357 -9.833 1.00 0.00 C ATOM 718 C THR A 48 -7.578 -10.925 -9.034 1.00 0.00 C ATOM 719 O THR A 48 -7.751 -11.499 -7.960 1.00 0.00 O ATOM 720 CB THR A 48 -9.693 -11.500 -10.282 1.00 0.00 C ATOM 721 OG1 THR A 48 -10.629 -11.001 -11.247 1.00 0.00 O ATOM 722 CG2 THR A 48 -10.460 -12.087 -9.103 1.00 0.00 C ATOM 0 H THR A 48 -7.585 -10.086 -11.553 1.00 0.00 H new ATOM 0 HA THR A 48 -9.316 -9.678 -9.191 1.00 0.00 H new ATOM 0 HB THR A 48 -9.078 -12.286 -10.720 1.00 0.00 H new ATOM 0 HG1 THR A 48 -11.222 -11.727 -11.533 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.110 -12.889 -9.454 1.00 0.00 H new ATOM 0 HG22 THR A 48 -9.756 -12.485 -8.372 1.00 0.00 H new ATOM 0 HG23 THR A 48 -11.064 -11.308 -8.638 1.00 0.00 H new ATOM 730 N LYS A 49 -6.372 -10.747 -9.561 1.00 0.00 N ATOM 731 CA LYS A 49 -5.173 -11.269 -8.919 1.00 0.00 C ATOM 732 C LYS A 49 -4.067 -10.224 -8.941 1.00 0.00 C ATOM 733 O LYS A 49 -3.857 -9.571 -9.959 1.00 0.00 O ATOM 734 CB LYS A 49 -4.671 -12.529 -9.640 1.00 0.00 C ATOM 735 CG LYS A 49 -5.698 -13.645 -9.758 1.00 0.00 C ATOM 736 CD LYS A 49 -5.122 -14.848 -10.491 1.00 0.00 C ATOM 737 CE LYS A 49 -4.023 -15.523 -9.684 1.00 0.00 C ATOM 738 NZ LYS A 49 -3.321 -16.575 -10.461 1.00 0.00 N ATOM 0 H LYS A 49 -6.199 -10.245 -10.432 1.00 0.00 H new ATOM 0 HA LYS A 49 -5.430 -11.519 -7.890 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -4.340 -12.251 -10.641 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.798 -12.911 -9.110 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.028 -13.946 -8.764 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.577 -13.279 -10.289 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -5.917 -15.565 -10.695 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -4.724 -14.531 -11.455 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.302 -14.773 -9.357 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.454 -15.964 -8.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.781 -17.183 -9.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -4.018 -17.150 -10.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.671 -16.130 -11.140 1.00 0.00 H new ATOM 752 N PRO A 50 -3.333 -10.053 -7.828 1.00 0.00 N ATOM 753 CA PRO A 50 -2.154 -9.173 -7.791 1.00 0.00 C ATOM 754 C PRO A 50 -1.071 -9.671 -8.745 1.00 0.00 C ATOM 755 O PRO A 50 -0.188 -8.927 -9.158 1.00 0.00 O ATOM 756 CB PRO A 50 -1.673 -9.265 -6.338 1.00 0.00 C ATOM 757 CG PRO A 50 -2.841 -9.785 -5.570 1.00 0.00 C ATOM 758 CD PRO A 50 -3.599 -10.670 -6.519 1.00 0.00 C ATOM 0 HA PRO A 50 -2.384 -8.153 -8.099 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -0.815 -9.932 -6.249 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -1.359 -8.290 -5.965 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -2.514 -10.343 -4.693 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -3.468 -8.968 -5.213 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -3.246 -11.701 -6.479 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -4.665 -10.689 -6.290 1.00 0.00 H new ATOM 766 N GLU A 51 -1.182 -10.946 -9.097 1.00 0.00 N ATOM 767 CA GLU A 51 -0.275 -11.604 -10.030 1.00 0.00 C ATOM 768 C GLU A 51 -0.522 -11.119 -11.465 1.00 0.00 C ATOM 769 O GLU A 51 0.289 -11.339 -12.362 1.00 0.00 O ATOM 770 CB GLU A 51 -0.508 -13.117 -9.928 1.00 0.00 C ATOM 771 CG GLU A 51 0.326 -13.963 -10.870 1.00 0.00 C ATOM 772 CD GLU A 51 -0.096 -15.416 -10.841 1.00 0.00 C ATOM 773 OE1 GLU A 51 -1.048 -15.780 -11.562 1.00 0.00 O ATOM 774 OE2 GLU A 51 0.506 -16.200 -10.085 1.00 0.00 O ATOM 0 H GLU A 51 -1.913 -11.560 -8.738 1.00 0.00 H new ATOM 0 HA GLU A 51 0.757 -11.362 -9.777 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.303 -13.432 -8.905 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.562 -13.320 -10.119 1.00 0.00 H new ATOM 0 HG2 GLU A 51 0.232 -13.577 -11.885 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.378 -13.884 -10.595 1.00 0.00 H new ATOM 781 N GLN A 52 -1.638 -10.428 -11.658 1.00 0.00 N ATOM 782 CA GLN A 52 -2.084 -10.025 -12.987 1.00 0.00 C ATOM 783 C GLN A 52 -1.551 -8.632 -13.347 1.00 0.00 C ATOM 784 O GLN A 52 -2.066 -7.968 -14.249 1.00 0.00 O ATOM 785 CB GLN A 52 -3.617 -10.036 -13.010 1.00 0.00 C ATOM 786 CG GLN A 52 -4.239 -9.992 -14.394 1.00 0.00 C ATOM 787 CD GLN A 52 -5.747 -9.842 -14.336 1.00 0.00 C ATOM 788 OE1 GLN A 52 -6.396 -10.292 -13.387 1.00 0.00 O ATOM 789 NE2 GLN A 52 -6.313 -9.201 -15.343 1.00 0.00 N ATOM 0 H GLN A 52 -2.257 -10.132 -10.903 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.696 -10.724 -13.728 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -3.966 -10.934 -12.500 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.980 -9.182 -12.438 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.814 -9.161 -14.956 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.986 -10.904 -14.934 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -5.740 -8.845 -16.108 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -7.323 -9.062 -15.356 1.00 0.00 H new ATOM 798 N ILE A 53 -0.508 -8.197 -12.653 1.00 0.00 N ATOM 799 CA ILE A 53 0.034 -6.862 -12.862 1.00 0.00 C ATOM 800 C ILE A 53 1.309 -6.895 -13.704 1.00 0.00 C ATOM 801 O ILE A 53 2.382 -7.262 -13.224 1.00 0.00 O ATOM 802 CB ILE A 53 0.322 -6.147 -11.523 1.00 0.00 C ATOM 803 CG1 ILE A 53 -0.948 -6.086 -10.668 1.00 0.00 C ATOM 804 CG2 ILE A 53 0.859 -4.744 -11.776 1.00 0.00 C ATOM 805 CD1 ILE A 53 -0.733 -5.463 -9.305 1.00 0.00 C ATOM 0 H ILE A 53 -0.023 -8.746 -11.944 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.729 -6.302 -13.403 1.00 0.00 H new ATOM 0 HB ILE A 53 1.078 -6.715 -10.981 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.708 -5.517 -11.202 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.338 -7.096 -10.539 1.00 0.00 H new ATOM 0 HG21 ILE A 53 1.057 -4.253 -10.823 1.00 0.00 H new ATOM 0 HG22 ILE A 53 1.783 -4.806 -12.351 1.00 0.00 H new ATOM 0 HG23 ILE A 53 0.122 -4.168 -12.335 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.675 -5.454 -8.757 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.004 -6.045 -8.751 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.373 -4.441 -9.425 1.00 0.00 H new ATOM 817 N ASP A 54 1.171 -6.523 -14.967 1.00 0.00 N ATOM 818 CA ASP A 54 2.308 -6.377 -15.869 1.00 0.00 C ATOM 819 C ASP A 54 2.327 -4.943 -16.399 1.00 0.00 C ATOM 820 O ASP A 54 1.439 -4.153 -16.068 1.00 0.00 O ATOM 821 CB ASP A 54 2.197 -7.389 -17.025 1.00 0.00 C ATOM 822 CG ASP A 54 3.399 -7.382 -17.957 1.00 0.00 C ATOM 823 OD1 ASP A 54 3.391 -6.612 -18.939 1.00 0.00 O ATOM 824 OD2 ASP A 54 4.360 -8.138 -17.707 1.00 0.00 O ATOM 0 H ASP A 54 0.270 -6.314 -15.397 1.00 0.00 H new ATOM 0 HA ASP A 54 3.239 -6.578 -15.338 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.075 -8.390 -16.610 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.299 -7.171 -17.603 1.00 0.00 H new ATOM 829 N ARG A 55 3.318 -4.600 -17.212 1.00 0.00 N ATOM 830 CA ARG A 55 3.378 -3.280 -17.825 1.00 0.00 C ATOM 831 C ARG A 55 2.190 -3.101 -18.771 1.00 0.00 C ATOM 832 O ARG A 55 1.750 -1.981 -19.028 1.00 0.00 O ATOM 833 CB ARG A 55 4.703 -3.091 -18.578 1.00 0.00 C ATOM 834 CG ARG A 55 4.748 -3.735 -19.956 1.00 0.00 C ATOM 835 CD ARG A 55 6.020 -4.538 -20.160 1.00 0.00 C ATOM 836 NE ARG A 55 5.954 -5.836 -19.486 1.00 0.00 N ATOM 837 CZ ARG A 55 7.010 -6.609 -19.242 1.00 0.00 C ATOM 838 NH1 ARG A 55 8.219 -6.235 -19.645 1.00 0.00 N ATOM 839 NH2 ARG A 55 6.849 -7.760 -18.601 1.00 0.00 N ATOM 0 H ARG A 55 4.091 -5.217 -17.462 1.00 0.00 H new ATOM 0 HA ARG A 55 3.327 -2.523 -17.043 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.896 -2.023 -18.684 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.511 -3.502 -17.973 1.00 0.00 H new ATOM 0 HG2 ARG A 55 3.883 -4.386 -20.082 1.00 0.00 H new ATOM 0 HG3 ARG A 55 4.679 -2.962 -20.721 1.00 0.00 H new ATOM 0 HD2 ARG A 55 6.188 -4.690 -21.226 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.872 -3.974 -19.780 1.00 0.00 H new ATOM 0 HE ARG A 55 5.039 -6.170 -19.184 1.00 0.00 H new ATOM 0 HH11 ARG A 55 8.340 -5.353 -20.143 1.00 0.00 H new ATOM 0 HH12 ARG A 55 9.026 -6.830 -19.456 1.00 0.00 H new ATOM 0 HH21 ARG A 55 5.919 -8.049 -18.298 1.00 0.00 H new ATOM 0 HH22 ARG A 55 7.655 -8.356 -18.412 1.00 0.00 H new ATOM 853 N TYR A 56 1.676 -4.224 -19.272 1.00 0.00 N ATOM 854 CA TYR A 56 0.466 -4.231 -20.085 1.00 0.00 C ATOM 855 C TYR A 56 -0.730 -3.790 -19.245 1.00 0.00 C ATOM 856 O TYR A 56 -1.586 -3.034 -19.704 1.00 0.00 O ATOM 857 CB TYR A 56 0.230 -5.638 -20.651 1.00 0.00 C ATOM 858 CG TYR A 56 -1.028 -5.778 -21.485 1.00 0.00 C ATOM 859 CD1 TYR A 56 -1.013 -5.522 -22.851 1.00 0.00 C ATOM 860 CD2 TYR A 56 -2.228 -6.178 -20.908 1.00 0.00 C ATOM 861 CE1 TYR A 56 -2.158 -5.656 -23.615 1.00 0.00 C ATOM 862 CE2 TYR A 56 -3.375 -6.316 -21.664 1.00 0.00 C ATOM 863 CZ TYR A 56 -3.336 -6.053 -23.017 1.00 0.00 C ATOM 864 OH TYR A 56 -4.477 -6.193 -23.776 1.00 0.00 O ATOM 0 H TYR A 56 2.085 -5.147 -19.126 1.00 0.00 H new ATOM 0 HA TYR A 56 0.586 -3.533 -20.913 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.088 -5.919 -21.261 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.182 -6.345 -19.823 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.092 -5.213 -23.324 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -2.264 -6.385 -19.849 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -2.130 -5.451 -24.675 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -4.298 -6.628 -21.198 1.00 0.00 H new ATOM 0 HH TYR A 56 -5.218 -6.480 -23.203 1.00 0.00 H new ATOM 874 N SER A 57 -0.772 -4.263 -18.006 1.00 0.00 N ATOM 875 CA SER A 57 -1.839 -3.909 -17.083 1.00 0.00 C ATOM 876 C SER A 57 -1.720 -2.441 -16.681 1.00 0.00 C ATOM 877 O SER A 57 -2.721 -1.756 -16.466 1.00 0.00 O ATOM 878 CB SER A 57 -1.761 -4.802 -15.845 1.00 0.00 C ATOM 879 OG SER A 57 -1.507 -6.151 -16.210 1.00 0.00 O ATOM 0 H SER A 57 -0.074 -4.897 -17.617 1.00 0.00 H new ATOM 0 HA SER A 57 -2.801 -4.058 -17.573 1.00 0.00 H new ATOM 0 HB2 SER A 57 -0.972 -4.445 -15.183 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.696 -4.741 -15.288 1.00 0.00 H new ATOM 0 HG SER A 57 -1.729 -6.740 -15.459 1.00 0.00 H new ATOM 885 N LEU A 58 -0.483 -1.965 -16.607 1.00 0.00 N ATOM 886 CA LEU A 58 -0.202 -0.586 -16.228 1.00 0.00 C ATOM 887 C LEU A 58 -0.046 0.292 -17.467 1.00 0.00 C ATOM 888 O LEU A 58 0.632 1.319 -17.431 1.00 0.00 O ATOM 889 CB LEU A 58 1.076 -0.526 -15.386 1.00 0.00 C ATOM 890 CG LEU A 58 1.055 -1.360 -14.101 1.00 0.00 C ATOM 891 CD1 LEU A 58 2.397 -1.275 -13.390 1.00 0.00 C ATOM 892 CD2 LEU A 58 -0.065 -0.898 -13.181 1.00 0.00 C ATOM 0 H LEU A 58 0.349 -2.520 -16.807 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.040 -0.212 -15.640 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.912 -0.858 -16.001 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.268 0.514 -15.121 1.00 0.00 H new ATOM 0 HG LEU A 58 0.871 -2.400 -14.370 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.365 -1.873 -12.479 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.181 -1.654 -14.046 1.00 0.00 H new ATOM 0 HD13 LEU A 58 2.608 -0.237 -13.135 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.063 -1.502 -12.274 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.088 0.149 -12.920 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.023 -1.009 -13.689 1.00 0.00 H new ATOM 904 N GLN A 59 -0.703 -0.114 -18.552 1.00 0.00 N ATOM 905 CA GLN A 59 -0.619 0.588 -19.833 1.00 0.00 C ATOM 906 C GLN A 59 -0.970 2.070 -19.682 1.00 0.00 C ATOM 907 O GLN A 59 -0.308 2.935 -20.252 1.00 0.00 O ATOM 908 CB GLN A 59 -1.554 -0.080 -20.846 1.00 0.00 C ATOM 909 CG GLN A 59 -1.438 0.471 -22.257 1.00 0.00 C ATOM 910 CD GLN A 59 -2.323 -0.269 -23.244 1.00 0.00 C ATOM 911 OE1 GLN A 59 -1.999 -0.375 -24.426 1.00 0.00 O ATOM 912 NE2 GLN A 59 -3.444 -0.791 -22.766 1.00 0.00 N ATOM 0 H GLN A 59 -1.307 -0.936 -18.569 1.00 0.00 H new ATOM 0 HA GLN A 59 0.409 0.528 -20.191 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -1.344 -1.149 -20.867 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -2.583 0.036 -20.506 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.706 1.527 -22.254 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.400 0.406 -22.585 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -3.677 -0.681 -21.779 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -4.073 -1.302 -23.385 1.00 0.00 H new ATOM 921 N ARG A 60 -2.002 2.357 -18.895 1.00 0.00 N ATOM 922 CA ARG A 60 -2.419 3.734 -18.648 1.00 0.00 C ATOM 923 C ARG A 60 -1.357 4.489 -17.852 1.00 0.00 C ATOM 924 O ARG A 60 -1.115 5.673 -18.087 1.00 0.00 O ATOM 925 CB ARG A 60 -3.750 3.764 -17.890 1.00 0.00 C ATOM 926 CG ARG A 60 -4.961 3.350 -18.718 1.00 0.00 C ATOM 927 CD ARG A 60 -5.394 4.448 -19.683 1.00 0.00 C ATOM 928 NE ARG A 60 -4.510 4.569 -20.845 1.00 0.00 N ATOM 929 CZ ARG A 60 -4.070 5.728 -21.333 1.00 0.00 C ATOM 930 NH1 ARG A 60 -4.356 6.870 -20.719 1.00 0.00 N ATOM 931 NH2 ARG A 60 -3.333 5.741 -22.436 1.00 0.00 N ATOM 0 H ARG A 60 -2.566 1.654 -18.417 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.547 4.223 -19.614 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.675 3.105 -17.025 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.914 4.772 -17.510 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.725 2.446 -19.279 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -5.789 3.105 -18.053 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.409 4.244 -20.025 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.421 5.400 -19.153 1.00 0.00 H new ATOM 0 HE ARG A 60 -4.212 3.711 -21.310 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -4.917 6.864 -19.867 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -4.015 7.753 -21.099 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -3.105 4.866 -22.907 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -2.994 6.626 -22.813 1.00 0.00 H new ATOM 945 N VAL A 61 -0.713 3.785 -16.927 1.00 0.00 N ATOM 946 CA VAL A 61 0.280 4.387 -16.043 1.00 0.00 C ATOM 947 C VAL A 61 1.532 4.783 -16.817 1.00 0.00 C ATOM 948 O VAL A 61 2.079 5.862 -16.615 1.00 0.00 O ATOM 949 CB VAL A 61 0.668 3.425 -14.897 1.00 0.00 C ATOM 950 CG1 VAL A 61 1.679 4.073 -13.961 1.00 0.00 C ATOM 951 CG2 VAL A 61 -0.571 2.984 -14.128 1.00 0.00 C ATOM 0 H VAL A 61 -0.863 2.788 -16.769 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.172 5.281 -15.614 1.00 0.00 H new ATOM 0 HB VAL A 61 1.133 2.543 -15.337 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.936 3.376 -13.163 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.578 4.332 -14.520 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.248 4.976 -13.529 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.279 2.307 -13.325 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.066 3.858 -13.704 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.255 2.471 -14.804 1.00 0.00 H new ATOM 961 N PHE A 62 1.974 3.911 -17.716 1.00 0.00 N ATOM 962 CA PHE A 62 3.158 4.185 -18.524 1.00 0.00 C ATOM 963 C PHE A 62 2.888 5.277 -19.554 1.00 0.00 C ATOM 964 O PHE A 62 3.817 5.901 -20.069 1.00 0.00 O ATOM 965 CB PHE A 62 3.644 2.914 -19.224 1.00 0.00 C ATOM 966 CG PHE A 62 4.420 1.989 -18.329 1.00 0.00 C ATOM 967 CD1 PHE A 62 5.771 2.201 -18.104 1.00 0.00 C ATOM 968 CD2 PHE A 62 3.806 0.906 -17.723 1.00 0.00 C ATOM 969 CE1 PHE A 62 6.495 1.352 -17.289 1.00 0.00 C ATOM 970 CE2 PHE A 62 4.525 0.053 -16.906 1.00 0.00 C ATOM 971 CZ PHE A 62 5.872 0.276 -16.690 1.00 0.00 C ATOM 0 H PHE A 62 1.532 3.011 -17.904 1.00 0.00 H new ATOM 0 HA PHE A 62 3.939 4.537 -17.850 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.783 2.379 -19.625 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.269 3.194 -20.072 1.00 0.00 H new ATOM 0 HD1 PHE A 62 6.264 3.040 -18.572 1.00 0.00 H new ATOM 0 HD2 PHE A 62 2.754 0.726 -17.890 1.00 0.00 H new ATOM 0 HE1 PHE A 62 7.547 1.530 -17.121 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.034 -0.787 -16.437 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.436 -0.390 -16.054 1.00 0.00 H new ATOM 981 N ASP A 63 1.618 5.504 -19.854 1.00 0.00 N ATOM 982 CA ASP A 63 1.237 6.528 -20.819 1.00 0.00 C ATOM 983 C ASP A 63 1.155 7.894 -20.144 1.00 0.00 C ATOM 984 O ASP A 63 1.772 8.860 -20.590 1.00 0.00 O ATOM 985 CB ASP A 63 -0.105 6.180 -21.464 1.00 0.00 C ATOM 986 CG ASP A 63 -0.480 7.142 -22.572 1.00 0.00 C ATOM 987 OD1 ASP A 63 0.116 7.055 -23.663 1.00 0.00 O ATOM 988 OD2 ASP A 63 -1.387 7.977 -22.366 1.00 0.00 O ATOM 0 H ASP A 63 0.834 4.995 -19.445 1.00 0.00 H new ATOM 0 HA ASP A 63 2.000 6.568 -21.596 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.060 5.168 -21.865 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -0.884 6.187 -20.702 1.00 0.00 H new ATOM 993 N ASN A 64 0.419 7.956 -19.041 1.00 0.00 N ATOM 994 CA ASN A 64 0.234 9.202 -18.301 1.00 0.00 C ATOM 995 C ASN A 64 1.320 9.360 -17.237 1.00 0.00 C ATOM 996 O ASN A 64 1.133 10.069 -16.247 1.00 0.00 O ATOM 997 CB ASN A 64 -1.147 9.222 -17.634 1.00 0.00 C ATOM 998 CG ASN A 64 -2.297 9.145 -18.627 1.00 0.00 C ATOM 999 OD1 ASN A 64 -3.358 8.597 -18.323 1.00 0.00 O ATOM 1000 ND2 ASN A 64 -2.101 9.692 -19.818 1.00 0.00 N ATOM 0 H ASN A 64 -0.063 7.153 -18.636 1.00 0.00 H new ATOM 0 HA ASN A 64 0.305 10.032 -19.004 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.219 8.385 -16.940 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -1.245 10.134 -17.045 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -2.842 9.668 -20.518 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.209 10.137 -20.034 1.00 0.00 H new ATOM 1007 N ALA A 65 2.465 8.730 -17.479 1.00 0.00 N ATOM 1008 CA ALA A 65 3.551 8.654 -16.501 1.00 0.00 C ATOM 1009 C ALA A 65 4.009 10.026 -16.015 1.00 0.00 C ATOM 1010 O ALA A 65 4.329 10.195 -14.842 1.00 0.00 O ATOM 1011 CB ALA A 65 4.726 7.890 -17.091 1.00 0.00 C ATOM 0 H ALA A 65 2.669 8.256 -18.359 1.00 0.00 H new ATOM 0 HA ALA A 65 3.161 8.125 -15.631 1.00 0.00 H new ATOM 0 HB1 ALA A 65 5.531 7.837 -16.358 1.00 0.00 H new ATOM 0 HB2 ALA A 65 4.409 6.881 -17.355 1.00 0.00 H new ATOM 0 HB3 ALA A 65 5.082 8.403 -17.984 1.00 0.00 H new ATOM 1017 N ASN A 66 4.032 11.005 -16.915 1.00 0.00 N ATOM 1018 CA ASN A 66 4.485 12.355 -16.568 1.00 0.00 C ATOM 1019 C ASN A 66 3.643 12.929 -15.424 1.00 0.00 C ATOM 1020 O ASN A 66 4.167 13.551 -14.500 1.00 0.00 O ATOM 1021 CB ASN A 66 4.409 13.271 -17.802 1.00 0.00 C ATOM 1022 CG ASN A 66 5.101 14.617 -17.609 1.00 0.00 C ATOM 1023 OD1 ASN A 66 5.136 15.178 -16.516 1.00 0.00 O ATOM 1024 ND2 ASN A 66 5.657 15.151 -18.684 1.00 0.00 N ATOM 0 H ASN A 66 3.744 10.893 -17.887 1.00 0.00 H new ATOM 0 HA ASN A 66 5.521 12.299 -16.235 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.860 12.759 -18.652 1.00 0.00 H new ATOM 0 HB3 ASN A 66 3.362 13.443 -18.052 1.00 0.00 H new ATOM 0 HD21 ASN A 66 6.131 16.052 -18.619 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.612 14.662 -19.578 1.00 0.00 H new ATOM 1031 N ALA A 67 2.342 12.670 -15.463 1.00 0.00 N ATOM 1032 CA ALA A 67 1.421 13.237 -14.485 1.00 0.00 C ATOM 1033 C ALA A 67 1.361 12.397 -13.213 1.00 0.00 C ATOM 1034 O ALA A 67 0.806 12.830 -12.200 1.00 0.00 O ATOM 1035 CB ALA A 67 0.033 13.376 -15.092 1.00 0.00 C ATOM 0 H ALA A 67 1.901 12.071 -16.161 1.00 0.00 H new ATOM 0 HA ALA A 67 1.793 14.224 -14.210 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.647 13.800 -14.353 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.080 14.032 -15.961 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.330 12.395 -15.398 1.00 0.00 H new ATOM 1041 N ILE A 68 1.929 11.201 -13.266 1.00 0.00 N ATOM 1042 CA ILE A 68 1.906 10.294 -12.129 1.00 0.00 C ATOM 1043 C ILE A 68 3.256 10.280 -11.420 1.00 0.00 C ATOM 1044 O ILE A 68 4.241 9.764 -11.945 1.00 0.00 O ATOM 1045 CB ILE A 68 1.536 8.855 -12.557 1.00 0.00 C ATOM 1046 CG1 ILE A 68 0.197 8.850 -13.301 1.00 0.00 C ATOM 1047 CG2 ILE A 68 1.473 7.940 -11.338 1.00 0.00 C ATOM 1048 CD1 ILE A 68 -0.185 7.495 -13.859 1.00 0.00 C ATOM 0 H ILE A 68 2.412 10.836 -14.087 1.00 0.00 H new ATOM 0 HA ILE A 68 1.141 10.659 -11.443 1.00 0.00 H new ATOM 0 HB ILE A 68 2.307 8.481 -13.230 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.587 9.188 -12.623 1.00 0.00 H new ATOM 0 HG13 ILE A 68 0.243 9.570 -14.118 1.00 0.00 H new ATOM 0 HG21 ILE A 68 1.211 6.930 -11.654 1.00 0.00 H new ATOM 0 HG22 ILE A 68 2.444 7.925 -10.843 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.718 8.310 -10.644 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.144 7.570 -14.372 1.00 0.00 H new ATOM 0 HD12 ILE A 68 0.578 7.163 -14.563 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -0.264 6.775 -13.044 1.00 0.00 H new ATOM 1060 N ASP A 69 3.297 10.864 -10.234 1.00 0.00 N ATOM 1061 CA ASP A 69 4.511 10.869 -9.428 1.00 0.00 C ATOM 1062 C ASP A 69 4.504 9.682 -8.479 1.00 0.00 C ATOM 1063 O ASP A 69 5.510 8.996 -8.307 1.00 0.00 O ATOM 1064 CB ASP A 69 4.624 12.172 -8.629 1.00 0.00 C ATOM 1065 CG ASP A 69 5.859 12.212 -7.746 1.00 0.00 C ATOM 1066 OD1 ASP A 69 6.925 12.664 -8.225 1.00 0.00 O ATOM 1067 OD2 ASP A 69 5.767 11.805 -6.569 1.00 0.00 O ATOM 0 H ASP A 69 2.504 11.342 -9.806 1.00 0.00 H new ATOM 0 HA ASP A 69 5.370 10.795 -10.095 1.00 0.00 H new ATOM 0 HB2 ASP A 69 4.648 13.016 -9.319 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.735 12.292 -8.009 1.00 0.00 H new ATOM 1072 N THR A 70 3.354 9.440 -7.872 1.00 0.00 N ATOM 1073 CA THR A 70 3.201 8.341 -6.938 1.00 0.00 C ATOM 1074 C THR A 70 2.122 7.372 -7.415 1.00 0.00 C ATOM 1075 O THR A 70 0.997 7.777 -7.714 1.00 0.00 O ATOM 1076 CB THR A 70 2.845 8.862 -5.533 1.00 0.00 C ATOM 1077 OG1 THR A 70 3.762 9.898 -5.158 1.00 0.00 O ATOM 1078 CG2 THR A 70 2.896 7.743 -4.500 1.00 0.00 C ATOM 0 H THR A 70 2.509 9.994 -8.012 1.00 0.00 H new ATOM 0 HA THR A 70 4.153 7.813 -6.887 1.00 0.00 H new ATOM 0 HB THR A 70 1.829 9.255 -5.564 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.533 10.230 -4.265 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.640 8.142 -3.518 1.00 0.00 H new ATOM 0 HG22 THR A 70 2.184 6.964 -4.772 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.901 7.321 -4.470 1.00 0.00 H new ATOM 1086 N LEU A 71 2.477 6.100 -7.501 1.00 0.00 N ATOM 1087 CA LEU A 71 1.540 5.065 -7.905 1.00 0.00 C ATOM 1088 C LEU A 71 1.245 4.147 -6.729 1.00 0.00 C ATOM 1089 O LEU A 71 2.079 3.323 -6.350 1.00 0.00 O ATOM 1090 CB LEU A 71 2.107 4.254 -9.073 1.00 0.00 C ATOM 1091 CG LEU A 71 1.219 3.110 -9.569 1.00 0.00 C ATOM 1092 CD1 LEU A 71 -0.075 3.649 -10.158 1.00 0.00 C ATOM 1093 CD2 LEU A 71 1.963 2.267 -10.594 1.00 0.00 C ATOM 0 H LEU A 71 3.415 5.758 -7.294 1.00 0.00 H new ATOM 0 HA LEU A 71 0.614 5.540 -8.230 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.297 4.931 -9.906 1.00 0.00 H new ATOM 0 HB3 LEU A 71 3.070 3.840 -8.773 1.00 0.00 H new ATOM 0 HG LEU A 71 0.967 2.477 -8.718 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -0.691 2.819 -10.504 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.616 4.209 -9.395 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.153 4.306 -10.997 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.318 1.458 -10.937 1.00 0.00 H new ATOM 0 HD22 LEU A 71 2.245 2.891 -11.442 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.860 1.848 -10.138 1.00 0.00 H new ATOM 1105 N ILE A 72 0.069 4.299 -6.150 1.00 0.00 N ATOM 1106 CA ILE A 72 -0.322 3.490 -5.011 1.00 0.00 C ATOM 1107 C ILE A 72 -1.132 2.288 -5.477 1.00 0.00 C ATOM 1108 O ILE A 72 -2.184 2.438 -6.098 1.00 0.00 O ATOM 1109 CB ILE A 72 -1.141 4.303 -3.985 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -0.343 5.529 -3.525 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -1.516 3.433 -2.791 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -1.086 6.410 -2.542 1.00 0.00 C ATOM 0 H ILE A 72 -0.633 4.976 -6.450 1.00 0.00 H new ATOM 0 HA ILE A 72 0.590 3.151 -4.520 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.060 4.643 -4.463 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.587 5.194 -3.067 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.072 6.123 -4.398 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.093 4.022 -2.078 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.114 2.587 -3.131 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.610 3.066 -2.309 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.457 7.256 -2.264 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.003 6.776 -3.003 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.333 5.833 -1.651 1.00 0.00 H new ATOM 1124 N VAL A 73 -0.625 1.103 -5.195 1.00 0.00 N ATOM 1125 CA VAL A 73 -1.279 -0.126 -5.598 1.00 0.00 C ATOM 1126 C VAL A 73 -1.803 -0.875 -4.381 1.00 0.00 C ATOM 1127 O VAL A 73 -1.034 -1.274 -3.503 1.00 0.00 O ATOM 1128 CB VAL A 73 -0.320 -1.044 -6.389 1.00 0.00 C ATOM 1129 CG1 VAL A 73 -1.028 -2.316 -6.828 1.00 0.00 C ATOM 1130 CG2 VAL A 73 0.256 -0.310 -7.589 1.00 0.00 C ATOM 0 H VAL A 73 0.247 0.966 -4.683 1.00 0.00 H new ATOM 0 HA VAL A 73 -2.112 0.147 -6.246 1.00 0.00 H new ATOM 0 HB VAL A 73 0.502 -1.323 -5.730 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.333 -2.946 -7.383 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.385 -2.855 -5.950 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.874 -2.060 -7.466 1.00 0.00 H new ATOM 0 HG21 VAL A 73 0.929 -0.973 -8.133 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.554 0.004 -8.247 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.807 0.567 -7.249 1.00 0.00 H new ATOM 1140 N GLY A 74 -3.113 -1.044 -4.332 1.00 0.00 N ATOM 1141 CA GLY A 74 -3.726 -1.801 -3.264 1.00 0.00 C ATOM 1142 C GLY A 74 -3.918 -3.240 -3.671 1.00 0.00 C ATOM 1143 O GLY A 74 -4.777 -3.541 -4.496 1.00 0.00 O ATOM 0 H GLY A 74 -3.767 -0.667 -5.018 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.102 -1.751 -2.372 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.689 -1.360 -3.005 1.00 0.00 H new ATOM 1147 N THR A 75 -3.124 -4.128 -3.101 1.00 0.00 N ATOM 1148 CA THR A 75 -3.116 -5.524 -3.524 1.00 0.00 C ATOM 1149 C THR A 75 -4.138 -6.366 -2.759 1.00 0.00 C ATOM 1150 O THR A 75 -3.948 -7.568 -2.560 1.00 0.00 O ATOM 1151 CB THR A 75 -1.711 -6.130 -3.358 1.00 0.00 C ATOM 1152 OG1 THR A 75 -1.204 -5.843 -2.049 1.00 0.00 O ATOM 1153 CG2 THR A 75 -0.757 -5.583 -4.408 1.00 0.00 C ATOM 0 H THR A 75 -2.475 -3.912 -2.344 1.00 0.00 H new ATOM 0 HA THR A 75 -3.396 -5.539 -4.577 1.00 0.00 H new ATOM 0 HB THR A 75 -1.788 -7.209 -3.488 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.218 -6.659 -1.506 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.229 -6.026 -4.270 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.130 -5.830 -5.402 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.686 -4.500 -4.306 1.00 0.00 H new ATOM 1161 N GLY A 76 -5.230 -5.736 -2.348 1.00 0.00 N ATOM 1162 CA GLY A 76 -6.281 -6.445 -1.650 1.00 0.00 C ATOM 1163 C GLY A 76 -5.999 -6.584 -0.170 1.00 0.00 C ATOM 1164 O GLY A 76 -6.588 -5.885 0.652 1.00 0.00 O ATOM 0 H GLY A 76 -5.406 -4.741 -2.487 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -7.225 -5.918 -1.789 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.401 -7.436 -2.089 1.00 0.00 H new ATOM 1168 N ALA A 77 -5.079 -7.476 0.166 1.00 0.00 N ATOM 1169 CA ALA A 77 -4.742 -7.735 1.557 1.00 0.00 C ATOM 1170 C ALA A 77 -3.238 -7.868 1.729 1.00 0.00 C ATOM 1171 O ALA A 77 -2.594 -7.014 2.338 1.00 0.00 O ATOM 1172 CB ALA A 77 -5.451 -8.988 2.053 1.00 0.00 C ATOM 0 H ALA A 77 -4.552 -8.033 -0.507 1.00 0.00 H new ATOM 0 HA ALA A 77 -5.080 -6.889 2.155 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -5.187 -9.167 3.095 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.529 -8.853 1.969 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -5.144 -9.842 1.450 1.00 0.00 H new ATOM 1178 N ASP A 78 -2.679 -8.939 1.190 1.00 0.00 N ATOM 1179 CA ASP A 78 -1.243 -9.170 1.276 1.00 0.00 C ATOM 1180 C ASP A 78 -0.519 -8.369 0.203 1.00 0.00 C ATOM 1181 O ASP A 78 -0.971 -8.300 -0.940 1.00 0.00 O ATOM 1182 CB ASP A 78 -0.931 -10.663 1.133 1.00 0.00 C ATOM 1183 CG ASP A 78 0.558 -10.958 1.167 1.00 0.00 C ATOM 1184 OD1 ASP A 78 1.247 -10.480 2.089 1.00 0.00 O ATOM 1185 OD2 ASP A 78 1.042 -11.689 0.277 1.00 0.00 O ATOM 0 H ASP A 78 -3.195 -9.662 0.689 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.894 -8.839 2.254 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -1.424 -11.211 1.936 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -1.348 -11.029 0.195 1.00 0.00 H new ATOM 1190 N VAL A 79 0.590 -7.751 0.581 1.00 0.00 N ATOM 1191 CA VAL A 79 1.357 -6.922 -0.333 1.00 0.00 C ATOM 1192 C VAL A 79 2.127 -7.781 -1.327 1.00 0.00 C ATOM 1193 O VAL A 79 2.920 -8.642 -0.943 1.00 0.00 O ATOM 1194 CB VAL A 79 2.340 -6.009 0.433 1.00 0.00 C ATOM 1195 CG1 VAL A 79 3.226 -5.229 -0.525 1.00 0.00 C ATOM 1196 CG2 VAL A 79 1.580 -5.060 1.347 1.00 0.00 C ATOM 0 H VAL A 79 0.980 -7.810 1.522 1.00 0.00 H new ATOM 0 HA VAL A 79 0.650 -6.296 -0.877 1.00 0.00 H new ATOM 0 HB VAL A 79 2.983 -6.643 1.043 1.00 0.00 H new ATOM 0 HG11 VAL A 79 3.907 -4.595 0.043 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.802 -5.924 -1.136 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.605 -4.607 -1.170 1.00 0.00 H new ATOM 0 HG21 VAL A 79 2.287 -4.424 1.880 1.00 0.00 H new ATOM 0 HG22 VAL A 79 0.910 -4.439 0.751 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.997 -5.636 2.066 1.00 0.00 H new ATOM 1206 N TRP A 80 1.876 -7.550 -2.603 1.00 0.00 N ATOM 1207 CA TRP A 80 2.563 -8.266 -3.660 1.00 0.00 C ATOM 1208 C TRP A 80 3.705 -7.419 -4.202 1.00 0.00 C ATOM 1209 O TRP A 80 3.516 -6.251 -4.543 1.00 0.00 O ATOM 1210 CB TRP A 80 1.577 -8.625 -4.774 1.00 0.00 C ATOM 1211 CG TRP A 80 2.206 -9.316 -5.945 1.00 0.00 C ATOM 1212 CD1 TRP A 80 2.583 -10.626 -6.024 1.00 0.00 C ATOM 1213 CD2 TRP A 80 2.524 -8.728 -7.210 1.00 0.00 C ATOM 1214 NE1 TRP A 80 3.121 -10.886 -7.263 1.00 0.00 N ATOM 1215 CE2 TRP A 80 3.092 -9.738 -8.008 1.00 0.00 C ATOM 1216 CE3 TRP A 80 2.380 -7.447 -7.746 1.00 0.00 C ATOM 1217 CZ2 TRP A 80 3.519 -9.503 -9.312 1.00 0.00 C ATOM 1218 CZ3 TRP A 80 2.803 -7.214 -9.040 1.00 0.00 C ATOM 1219 CH2 TRP A 80 3.366 -8.239 -9.813 1.00 0.00 C ATOM 0 H TRP A 80 1.195 -6.866 -2.933 1.00 0.00 H new ATOM 0 HA TRP A 80 2.979 -9.190 -3.258 1.00 0.00 H new ATOM 0 HB2 TRP A 80 0.798 -9.266 -4.363 1.00 0.00 H new ATOM 0 HB3 TRP A 80 1.090 -7.714 -5.122 1.00 0.00 H new ATOM 0 HD1 TRP A 80 2.475 -11.351 -5.231 1.00 0.00 H new ATOM 0 HE1 TRP A 80 3.483 -11.787 -7.576 1.00 0.00 H new ATOM 0 HE3 TRP A 80 1.945 -6.652 -7.159 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 3.956 -10.291 -9.907 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 2.698 -6.226 -9.463 1.00 0.00 H new ATOM 0 HH2 TRP A 80 3.685 -8.027 -10.823 1.00 0.00 H new ATOM 1230 N ILE A 81 4.889 -8.003 -4.262 1.00 0.00 N ATOM 1231 CA ILE A 81 6.062 -7.298 -4.743 1.00 0.00 C ATOM 1232 C ILE A 81 6.228 -7.505 -6.242 1.00 0.00 C ATOM 1233 O ILE A 81 6.421 -8.630 -6.710 1.00 0.00 O ATOM 1234 CB ILE A 81 7.342 -7.753 -4.009 1.00 0.00 C ATOM 1235 CG1 ILE A 81 7.177 -7.572 -2.497 1.00 0.00 C ATOM 1236 CG2 ILE A 81 8.551 -6.971 -4.513 1.00 0.00 C ATOM 1237 CD1 ILE A 81 8.356 -8.072 -1.691 1.00 0.00 C ATOM 0 H ILE A 81 5.063 -8.968 -3.982 1.00 0.00 H new ATOM 0 HA ILE A 81 5.912 -6.238 -4.537 1.00 0.00 H new ATOM 0 HB ILE A 81 7.507 -8.810 -4.216 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.023 -6.515 -2.281 1.00 0.00 H new ATOM 0 HG13 ILE A 81 6.278 -8.097 -2.173 1.00 0.00 H new ATOM 0 HG21 ILE A 81 9.445 -7.304 -3.986 1.00 0.00 H new ATOM 0 HG22 ILE A 81 8.675 -7.143 -5.582 1.00 0.00 H new ATOM 0 HG23 ILE A 81 8.398 -5.907 -4.332 1.00 0.00 H new ATOM 0 HD11 ILE A 81 8.166 -7.910 -0.630 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.498 -9.137 -1.876 1.00 0.00 H new ATOM 0 HD13 ILE A 81 9.254 -7.530 -1.986 1.00 0.00 H new ATOM 1249 N ALA A 82 6.139 -6.410 -6.985 1.00 0.00 N ATOM 1250 CA ALA A 82 6.277 -6.440 -8.433 1.00 0.00 C ATOM 1251 C ALA A 82 7.670 -6.911 -8.846 1.00 0.00 C ATOM 1252 O ALA A 82 8.624 -6.802 -8.068 1.00 0.00 O ATOM 1253 CB ALA A 82 5.992 -5.058 -9.006 1.00 0.00 C ATOM 0 H ALA A 82 5.970 -5.480 -6.602 1.00 0.00 H new ATOM 0 HA ALA A 82 5.554 -7.151 -8.833 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.097 -5.085 -10.091 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.976 -4.759 -8.747 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.699 -4.339 -8.591 1.00 0.00 H new ATOM 1259 N PRO A 83 7.796 -7.461 -10.068 1.00 0.00 N ATOM 1260 CA PRO A 83 9.083 -7.898 -10.616 1.00 0.00 C ATOM 1261 C PRO A 83 10.166 -6.830 -10.477 1.00 0.00 C ATOM 1262 O PRO A 83 9.901 -5.638 -10.645 1.00 0.00 O ATOM 1263 CB PRO A 83 8.769 -8.154 -12.089 1.00 0.00 C ATOM 1264 CG PRO A 83 7.329 -8.525 -12.101 1.00 0.00 C ATOM 1265 CD PRO A 83 6.685 -7.723 -11.003 1.00 0.00 C ATOM 0 HA PRO A 83 9.476 -8.769 -10.092 1.00 0.00 H new ATOM 0 HB2 PRO A 83 8.956 -7.268 -12.695 1.00 0.00 H new ATOM 0 HB3 PRO A 83 9.389 -8.954 -12.494 1.00 0.00 H new ATOM 0 HG2 PRO A 83 6.876 -8.299 -13.066 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.200 -9.594 -11.931 1.00 0.00 H new ATOM 0 HD2 PRO A 83 6.254 -6.797 -11.383 1.00 0.00 H new ATOM 0 HD3 PRO A 83 5.878 -8.277 -10.522 1.00 0.00 H new ATOM 1273 N ARG A 84 11.380 -7.278 -10.179 1.00 0.00 N ATOM 1274 CA ARG A 84 12.513 -6.390 -9.911 1.00 0.00 C ATOM 1275 C ARG A 84 12.687 -5.323 -10.990 1.00 0.00 C ATOM 1276 O ARG A 84 12.791 -4.135 -10.682 1.00 0.00 O ATOM 1277 CB ARG A 84 13.797 -7.214 -9.789 1.00 0.00 C ATOM 1278 CG ARG A 84 13.796 -8.170 -8.609 1.00 0.00 C ATOM 1279 CD ARG A 84 14.949 -9.158 -8.686 1.00 0.00 C ATOM 1280 NE ARG A 84 14.982 -10.041 -7.523 1.00 0.00 N ATOM 1281 CZ ARG A 84 14.479 -11.274 -7.501 1.00 0.00 C ATOM 1282 NH1 ARG A 84 13.937 -11.806 -8.591 1.00 0.00 N ATOM 1283 NH2 ARG A 84 14.533 -11.977 -6.379 1.00 0.00 N ATOM 0 H ARG A 84 11.611 -8.270 -10.115 1.00 0.00 H new ATOM 0 HA ARG A 84 12.306 -5.873 -8.974 1.00 0.00 H new ATOM 0 HB2 ARG A 84 13.942 -7.783 -10.707 1.00 0.00 H new ATOM 0 HB3 ARG A 84 14.646 -6.537 -9.697 1.00 0.00 H new ATOM 0 HG2 ARG A 84 13.864 -7.603 -7.681 1.00 0.00 H new ATOM 0 HG3 ARG A 84 12.852 -8.714 -8.582 1.00 0.00 H new ATOM 0 HD2 ARG A 84 14.857 -9.755 -9.594 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.891 -8.614 -8.757 1.00 0.00 H new ATOM 0 HE ARG A 84 15.419 -9.690 -6.671 1.00 0.00 H new ATOM 0 HH11 ARG A 84 13.903 -11.269 -9.458 1.00 0.00 H new ATOM 0 HH12 ARG A 84 13.555 -12.751 -8.561 1.00 0.00 H new ATOM 0 HH21 ARG A 84 14.957 -11.573 -5.544 1.00 0.00 H new ATOM 0 HH22 ARG A 84 14.151 -12.922 -6.351 1.00 0.00 H new ATOM 1297 N GLN A 85 12.705 -5.738 -12.249 1.00 0.00 N ATOM 1298 CA GLN A 85 12.949 -4.808 -13.342 1.00 0.00 C ATOM 1299 C GLN A 85 11.709 -3.980 -13.659 1.00 0.00 C ATOM 1300 O GLN A 85 11.813 -2.900 -14.239 1.00 0.00 O ATOM 1301 CB GLN A 85 13.437 -5.545 -14.590 1.00 0.00 C ATOM 1302 CG GLN A 85 14.802 -6.190 -14.407 1.00 0.00 C ATOM 1303 CD GLN A 85 15.875 -5.196 -13.990 1.00 0.00 C ATOM 1304 OE1 GLN A 85 16.808 -5.542 -13.269 1.00 0.00 O ATOM 1305 NE2 GLN A 85 15.762 -3.961 -14.452 1.00 0.00 N ATOM 0 H GLN A 85 12.555 -6.705 -12.537 1.00 0.00 H new ATOM 0 HA GLN A 85 13.733 -4.124 -13.018 1.00 0.00 H new ATOM 0 HB2 GLN A 85 12.712 -6.313 -14.858 1.00 0.00 H new ATOM 0 HB3 GLN A 85 13.482 -4.845 -15.424 1.00 0.00 H new ATOM 0 HG2 GLN A 85 14.729 -6.975 -13.655 1.00 0.00 H new ATOM 0 HG3 GLN A 85 15.100 -6.669 -15.340 1.00 0.00 H new ATOM 0 HE21 GLN A 85 14.974 -3.710 -15.048 1.00 0.00 H new ATOM 0 HE22 GLN A 85 16.463 -3.260 -14.212 1.00 0.00 H new ATOM 1314 N LEU A 86 10.541 -4.475 -13.268 1.00 0.00 N ATOM 1315 CA LEU A 86 9.307 -3.713 -13.430 1.00 0.00 C ATOM 1316 C LEU A 86 9.247 -2.617 -12.372 1.00 0.00 C ATOM 1317 O LEU A 86 8.840 -1.487 -12.645 1.00 0.00 O ATOM 1318 CB LEU A 86 8.084 -4.630 -13.324 1.00 0.00 C ATOM 1319 CG LEU A 86 6.732 -3.942 -13.546 1.00 0.00 C ATOM 1320 CD1 LEU A 86 6.657 -3.340 -14.941 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.592 -4.924 -13.329 1.00 0.00 C ATOM 0 H LEU A 86 10.421 -5.393 -12.840 1.00 0.00 H new ATOM 0 HA LEU A 86 9.298 -3.258 -14.420 1.00 0.00 H new ATOM 0 HB2 LEU A 86 8.188 -5.434 -14.052 1.00 0.00 H new ATOM 0 HB3 LEU A 86 8.081 -5.092 -12.337 1.00 0.00 H new ATOM 0 HG LEU A 86 6.637 -3.135 -12.819 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.689 -2.857 -15.077 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.451 -2.603 -15.062 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.777 -4.128 -15.684 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.640 -4.418 -13.491 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.687 -5.752 -14.031 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.631 -5.307 -12.309 1.00 0.00 H new ATOM 1333 N ARG A 87 9.677 -2.967 -11.168 1.00 0.00 N ATOM 1334 CA ARG A 87 9.802 -2.014 -10.075 1.00 0.00 C ATOM 1335 C ARG A 87 10.773 -0.906 -10.466 1.00 0.00 C ATOM 1336 O ARG A 87 10.483 0.283 -10.312 1.00 0.00 O ATOM 1337 CB ARG A 87 10.311 -2.736 -8.825 1.00 0.00 C ATOM 1338 CG ARG A 87 10.354 -1.872 -7.579 1.00 0.00 C ATOM 1339 CD ARG A 87 10.951 -2.638 -6.412 1.00 0.00 C ATOM 1340 NE ARG A 87 10.999 -1.844 -5.187 1.00 0.00 N ATOM 1341 CZ ARG A 87 11.796 -2.124 -4.154 1.00 0.00 C ATOM 1342 NH1 ARG A 87 12.688 -3.105 -4.248 1.00 0.00 N ATOM 1343 NH2 ARG A 87 11.722 -1.400 -3.045 1.00 0.00 N ATOM 0 H ARG A 87 9.949 -3.919 -10.922 1.00 0.00 H new ATOM 0 HA ARG A 87 8.827 -1.573 -9.865 1.00 0.00 H new ATOM 0 HB2 ARG A 87 9.673 -3.599 -8.633 1.00 0.00 H new ATOM 0 HB3 ARG A 87 11.313 -3.118 -9.023 1.00 0.00 H new ATOM 0 HG2 ARG A 87 10.945 -0.976 -7.772 1.00 0.00 H new ATOM 0 HG3 ARG A 87 9.347 -1.541 -7.326 1.00 0.00 H new ATOM 0 HD2 ARG A 87 10.363 -3.539 -6.234 1.00 0.00 H new ATOM 0 HD3 ARG A 87 11.959 -2.961 -6.671 1.00 0.00 H new ATOM 0 HE ARG A 87 10.389 -1.030 -5.117 1.00 0.00 H new ATOM 0 HH11 ARG A 87 12.764 -3.645 -5.110 1.00 0.00 H new ATOM 0 HH12 ARG A 87 13.297 -3.318 -3.458 1.00 0.00 H new ATOM 0 HH21 ARG A 87 11.056 -0.630 -2.982 1.00 0.00 H new ATOM 0 HH22 ARG A 87 12.331 -1.613 -2.255 1.00 0.00 H new ATOM 1357 N GLU A 88 11.921 -1.322 -10.994 1.00 0.00 N ATOM 1358 CA GLU A 88 12.949 -0.399 -11.451 1.00 0.00 C ATOM 1359 C GLU A 88 12.427 0.469 -12.593 1.00 0.00 C ATOM 1360 O GLU A 88 12.696 1.671 -12.643 1.00 0.00 O ATOM 1361 CB GLU A 88 14.180 -1.179 -11.916 1.00 0.00 C ATOM 1362 CG GLU A 88 15.308 -0.297 -12.417 1.00 0.00 C ATOM 1363 CD GLU A 88 15.844 -0.751 -13.756 1.00 0.00 C ATOM 1364 OE1 GLU A 88 15.288 -0.333 -14.796 1.00 0.00 O ATOM 1365 OE2 GLU A 88 16.814 -1.533 -13.781 1.00 0.00 O ATOM 0 H GLU A 88 12.162 -2.306 -11.116 1.00 0.00 H new ATOM 0 HA GLU A 88 13.224 0.250 -10.619 1.00 0.00 H new ATOM 0 HB2 GLU A 88 14.547 -1.788 -11.090 1.00 0.00 H new ATOM 0 HB3 GLU A 88 13.886 -1.864 -12.711 1.00 0.00 H new ATOM 0 HG2 GLU A 88 14.953 0.730 -12.500 1.00 0.00 H new ATOM 0 HG3 GLU A 88 16.117 -0.296 -11.686 1.00 0.00 H new ATOM 1372 N ALA A 89 11.683 -0.148 -13.506 1.00 0.00 N ATOM 1373 CA ALA A 89 11.125 0.559 -14.653 1.00 0.00 C ATOM 1374 C ALA A 89 10.271 1.737 -14.204 1.00 0.00 C ATOM 1375 O ALA A 89 10.449 2.856 -14.684 1.00 0.00 O ATOM 1376 CB ALA A 89 10.311 -0.388 -15.526 1.00 0.00 C ATOM 0 H ALA A 89 11.452 -1.141 -13.473 1.00 0.00 H new ATOM 0 HA ALA A 89 11.954 0.946 -15.245 1.00 0.00 H new ATOM 0 HB1 ALA A 89 9.904 0.160 -16.376 1.00 0.00 H new ATOM 0 HB2 ALA A 89 10.952 -1.192 -15.886 1.00 0.00 H new ATOM 0 HB3 ALA A 89 9.494 -0.810 -14.941 1.00 0.00 H new ATOM 1382 N LEU A 90 9.368 1.479 -13.263 1.00 0.00 N ATOM 1383 CA LEU A 90 8.477 2.510 -12.740 1.00 0.00 C ATOM 1384 C LEU A 90 9.262 3.656 -12.109 1.00 0.00 C ATOM 1385 O LEU A 90 9.084 4.817 -12.482 1.00 0.00 O ATOM 1386 CB LEU A 90 7.515 1.909 -11.713 1.00 0.00 C ATOM 1387 CG LEU A 90 6.511 0.900 -12.276 1.00 0.00 C ATOM 1388 CD1 LEU A 90 5.699 0.277 -11.154 1.00 0.00 C ATOM 1389 CD2 LEU A 90 5.593 1.571 -13.287 1.00 0.00 C ATOM 0 H LEU A 90 9.233 0.559 -12.845 1.00 0.00 H new ATOM 0 HA LEU A 90 7.905 2.911 -13.577 1.00 0.00 H new ATOM 0 HB2 LEU A 90 8.099 1.420 -10.933 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.964 2.720 -11.237 1.00 0.00 H new ATOM 0 HG LEU A 90 7.064 0.109 -12.783 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.990 -0.438 -11.572 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.367 -0.236 -10.463 1.00 0.00 H new ATOM 0 HD13 LEU A 90 5.156 1.058 -10.621 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.885 0.840 -13.678 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.048 2.381 -12.802 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.188 1.974 -14.107 1.00 0.00 H new ATOM 1401 N ARG A 91 10.152 3.326 -11.174 1.00 0.00 N ATOM 1402 CA ARG A 91 10.919 4.343 -10.460 1.00 0.00 C ATOM 1403 C ARG A 91 11.855 5.099 -11.397 1.00 0.00 C ATOM 1404 O ARG A 91 12.208 6.250 -11.139 1.00 0.00 O ATOM 1405 CB ARG A 91 11.721 3.724 -9.316 1.00 0.00 C ATOM 1406 CG ARG A 91 10.862 3.145 -8.206 1.00 0.00 C ATOM 1407 CD ARG A 91 11.699 2.799 -6.986 1.00 0.00 C ATOM 1408 NE ARG A 91 12.349 3.984 -6.421 1.00 0.00 N ATOM 1409 CZ ARG A 91 13.189 3.955 -5.386 1.00 0.00 C ATOM 1410 NH1 ARG A 91 13.493 2.803 -4.803 1.00 0.00 N ATOM 1411 NH2 ARG A 91 13.731 5.080 -4.937 1.00 0.00 N ATOM 0 H ARG A 91 10.358 2.367 -10.895 1.00 0.00 H new ATOM 0 HA ARG A 91 10.202 5.051 -10.045 1.00 0.00 H new ATOM 0 HB2 ARG A 91 12.359 2.936 -9.717 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.379 4.483 -8.894 1.00 0.00 H new ATOM 0 HG2 ARG A 91 10.090 3.862 -7.929 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.352 2.251 -8.566 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.065 2.336 -6.229 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.456 2.065 -7.261 1.00 0.00 H new ATOM 0 HE ARG A 91 12.146 4.889 -6.846 1.00 0.00 H new ATOM 0 HH11 ARG A 91 13.084 1.934 -5.146 1.00 0.00 H new ATOM 0 HH12 ARG A 91 14.136 2.786 -4.012 1.00 0.00 H new ATOM 0 HH21 ARG A 91 13.505 5.969 -5.384 1.00 0.00 H new ATOM 0 HH22 ARG A 91 14.373 5.056 -4.145 1.00 0.00 H new ATOM 1425 N GLY A 92 12.260 4.448 -12.480 1.00 0.00 N ATOM 1426 CA GLY A 92 13.091 5.107 -13.470 1.00 0.00 C ATOM 1427 C GLY A 92 12.360 6.247 -14.150 1.00 0.00 C ATOM 1428 O GLY A 92 12.970 7.233 -14.563 1.00 0.00 O ATOM 0 H GLY A 92 12.029 3.477 -12.691 1.00 0.00 H new ATOM 0 HA2 GLY A 92 13.993 5.488 -12.992 1.00 0.00 H new ATOM 0 HA3 GLY A 92 13.409 4.381 -14.219 1.00 0.00 H new ATOM 1432 N VAL A 93 11.041 6.117 -14.241 1.00 0.00 N ATOM 1433 CA VAL A 93 10.201 7.139 -14.852 1.00 0.00 C ATOM 1434 C VAL A 93 9.654 8.079 -13.769 1.00 0.00 C ATOM 1435 O VAL A 93 8.695 8.817 -13.992 1.00 0.00 O ATOM 1436 CB VAL A 93 9.032 6.495 -15.643 1.00 0.00 C ATOM 1437 CG1 VAL A 93 8.360 7.504 -16.562 1.00 0.00 C ATOM 1438 CG2 VAL A 93 9.522 5.300 -16.447 1.00 0.00 C ATOM 0 H VAL A 93 10.527 5.306 -13.896 1.00 0.00 H new ATOM 0 HA VAL A 93 10.808 7.713 -15.552 1.00 0.00 H new ATOM 0 HB VAL A 93 8.294 6.154 -14.917 1.00 0.00 H new ATOM 0 HG11 VAL A 93 7.546 7.019 -17.101 1.00 0.00 H new ATOM 0 HG12 VAL A 93 7.963 8.328 -15.969 1.00 0.00 H new ATOM 0 HG13 VAL A 93 9.089 7.888 -17.275 1.00 0.00 H new ATOM 0 HG21 VAL A 93 8.687 4.863 -16.994 1.00 0.00 H new ATOM 0 HG22 VAL A 93 10.288 5.625 -17.152 1.00 0.00 H new ATOM 0 HG23 VAL A 93 9.943 4.555 -15.772 1.00 0.00 H new ATOM 1448 N ASN A 94 10.288 8.024 -12.588 1.00 0.00 N ATOM 1449 CA ASN A 94 9.949 8.879 -11.438 1.00 0.00 C ATOM 1450 C ASN A 94 8.728 8.346 -10.686 1.00 0.00 C ATOM 1451 O ASN A 94 8.462 8.749 -9.553 1.00 0.00 O ATOM 1452 CB ASN A 94 9.731 10.339 -11.871 1.00 0.00 C ATOM 1453 CG ASN A 94 9.397 11.264 -10.716 1.00 0.00 C ATOM 1454 OD1 ASN A 94 10.286 11.804 -10.058 1.00 0.00 O ATOM 1455 ND2 ASN A 94 8.111 11.469 -10.472 1.00 0.00 N ATOM 0 H ASN A 94 11.057 7.380 -12.402 1.00 0.00 H new ATOM 0 HA ASN A 94 10.798 8.855 -10.755 1.00 0.00 H new ATOM 0 HB2 ASN A 94 10.630 10.701 -12.369 1.00 0.00 H new ATOM 0 HB3 ASN A 94 8.924 10.377 -12.603 1.00 0.00 H new ATOM 0 HD21 ASN A 94 7.828 12.093 -9.716 1.00 0.00 H new ATOM 0 HD22 ASN A 94 7.404 11.003 -11.040 1.00 0.00 H new ATOM 1462 N VAL A 95 8.017 7.415 -11.305 1.00 0.00 N ATOM 1463 CA VAL A 95 6.808 6.851 -10.719 1.00 0.00 C ATOM 1464 C VAL A 95 7.140 6.000 -9.494 1.00 0.00 C ATOM 1465 O VAL A 95 7.659 4.888 -9.612 1.00 0.00 O ATOM 1466 CB VAL A 95 6.034 5.994 -11.744 1.00 0.00 C ATOM 1467 CG1 VAL A 95 4.724 5.494 -11.155 1.00 0.00 C ATOM 1468 CG2 VAL A 95 5.783 6.784 -13.021 1.00 0.00 C ATOM 0 H VAL A 95 8.258 7.032 -12.219 1.00 0.00 H new ATOM 0 HA VAL A 95 6.179 7.687 -10.414 1.00 0.00 H new ATOM 0 HB VAL A 95 6.645 5.126 -11.991 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.198 4.893 -11.896 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.930 4.885 -10.274 1.00 0.00 H new ATOM 0 HG13 VAL A 95 4.104 6.345 -10.871 1.00 0.00 H new ATOM 0 HG21 VAL A 95 5.236 6.164 -13.731 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.196 7.673 -12.789 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.736 7.082 -13.458 1.00 0.00 H new ATOM 1478 N VAL A 96 6.851 6.534 -8.316 1.00 0.00 N ATOM 1479 CA VAL A 96 7.097 5.825 -7.072 1.00 0.00 C ATOM 1480 C VAL A 96 6.033 4.757 -6.843 1.00 0.00 C ATOM 1481 O VAL A 96 4.859 5.071 -6.646 1.00 0.00 O ATOM 1482 CB VAL A 96 7.127 6.789 -5.867 1.00 0.00 C ATOM 1483 CG1 VAL A 96 7.377 6.032 -4.571 1.00 0.00 C ATOM 1484 CG2 VAL A 96 8.187 7.858 -6.072 1.00 0.00 C ATOM 0 H VAL A 96 6.444 7.462 -8.197 1.00 0.00 H new ATOM 0 HA VAL A 96 8.074 5.350 -7.158 1.00 0.00 H new ATOM 0 HB VAL A 96 6.153 7.273 -5.793 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.394 6.734 -3.737 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.581 5.303 -4.416 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.335 5.516 -4.630 1.00 0.00 H new ATOM 0 HG21 VAL A 96 8.196 8.530 -5.214 1.00 0.00 H new ATOM 0 HG22 VAL A 96 9.164 7.386 -6.174 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.962 8.425 -6.975 1.00 0.00 H new ATOM 1494 N LEU A 97 6.451 3.501 -6.890 1.00 0.00 N ATOM 1495 CA LEU A 97 5.553 2.380 -6.663 1.00 0.00 C ATOM 1496 C LEU A 97 5.324 2.168 -5.169 1.00 0.00 C ATOM 1497 O LEU A 97 6.261 1.876 -4.421 1.00 0.00 O ATOM 1498 CB LEU A 97 6.131 1.108 -7.290 1.00 0.00 C ATOM 1499 CG LEU A 97 5.291 -0.157 -7.101 1.00 0.00 C ATOM 1500 CD1 LEU A 97 3.946 -0.020 -7.799 1.00 0.00 C ATOM 1501 CD2 LEU A 97 6.044 -1.374 -7.617 1.00 0.00 C ATOM 0 H LEU A 97 7.415 3.232 -7.085 1.00 0.00 H new ATOM 0 HA LEU A 97 4.595 2.605 -7.132 1.00 0.00 H new ATOM 0 HB2 LEU A 97 6.265 1.278 -8.358 1.00 0.00 H new ATOM 0 HB3 LEU A 97 7.121 0.933 -6.868 1.00 0.00 H new ATOM 0 HG LEU A 97 5.106 -0.292 -6.035 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.365 -0.931 -7.652 1.00 0.00 H new ATOM 0 HD12 LEU A 97 3.404 0.828 -7.381 1.00 0.00 H new ATOM 0 HD13 LEU A 97 4.104 0.141 -8.865 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.434 -2.266 -7.476 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.259 -1.246 -8.678 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.979 -1.483 -7.068 1.00 0.00 H new ATOM 1513 N ASP A 98 4.084 2.330 -4.734 1.00 0.00 N ATOM 1514 CA ASP A 98 3.737 2.122 -3.338 1.00 0.00 C ATOM 1515 C ASP A 98 2.719 1.001 -3.209 1.00 0.00 C ATOM 1516 O ASP A 98 1.582 1.130 -3.653 1.00 0.00 O ATOM 1517 CB ASP A 98 3.188 3.407 -2.715 1.00 0.00 C ATOM 1518 CG ASP A 98 3.003 3.283 -1.215 1.00 0.00 C ATOM 1519 OD1 ASP A 98 3.982 2.921 -0.525 1.00 0.00 O ATOM 1520 OD2 ASP A 98 1.891 3.554 -0.718 1.00 0.00 O ATOM 0 H ASP A 98 3.302 2.605 -5.328 1.00 0.00 H new ATOM 0 HA ASP A 98 4.643 1.841 -2.801 1.00 0.00 H new ATOM 0 HB2 ASP A 98 3.868 4.232 -2.928 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.233 3.654 -3.178 1.00 0.00 H new ATOM 1525 N THR A 99 3.139 -0.102 -2.619 1.00 0.00 N ATOM 1526 CA THR A 99 2.270 -1.250 -2.433 1.00 0.00 C ATOM 1527 C THR A 99 1.678 -1.251 -1.024 1.00 0.00 C ATOM 1528 O THR A 99 2.406 -1.328 -0.031 1.00 0.00 O ATOM 1529 CB THR A 99 3.044 -2.556 -2.684 1.00 0.00 C ATOM 1530 OG1 THR A 99 4.336 -2.480 -2.062 1.00 0.00 O ATOM 1531 CG2 THR A 99 3.204 -2.816 -4.176 1.00 0.00 C ATOM 0 H THR A 99 4.084 -0.228 -2.257 1.00 0.00 H new ATOM 0 HA THR A 99 1.454 -1.183 -3.153 1.00 0.00 H new ATOM 0 HB THR A 99 2.478 -3.381 -2.251 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.247 -2.084 -1.170 1.00 0.00 H new ATOM 0 HG21 THR A 99 3.754 -3.745 -4.327 1.00 0.00 H new ATOM 0 HG22 THR A 99 2.220 -2.898 -4.639 1.00 0.00 H new ATOM 0 HG23 THR A 99 3.752 -1.992 -4.632 1.00 0.00 H new ATOM 1539 N MET A 100 0.358 -1.163 -0.945 1.00 0.00 N ATOM 1540 CA MET A 100 -0.330 -1.012 0.330 1.00 0.00 C ATOM 1541 C MET A 100 -1.620 -1.829 0.337 1.00 0.00 C ATOM 1542 O MET A 100 -2.088 -2.266 -0.716 1.00 0.00 O ATOM 1543 CB MET A 100 -0.636 0.476 0.555 1.00 0.00 C ATOM 1544 CG MET A 100 -1.291 0.795 1.892 1.00 0.00 C ATOM 1545 SD MET A 100 -0.227 0.436 3.301 1.00 0.00 S ATOM 1546 CE MET A 100 1.150 1.532 2.966 1.00 0.00 C ATOM 0 H MET A 100 -0.262 -1.194 -1.754 1.00 0.00 H new ATOM 0 HA MET A 100 0.306 -1.379 1.135 1.00 0.00 H new ATOM 0 HB2 MET A 100 0.293 1.040 0.477 1.00 0.00 H new ATOM 0 HB3 MET A 100 -1.288 0.824 -0.246 1.00 0.00 H new ATOM 0 HG2 MET A 100 -1.568 1.849 1.912 1.00 0.00 H new ATOM 0 HG3 MET A 100 -2.213 0.221 1.985 1.00 0.00 H new ATOM 0 HE1 MET A 100 1.691 1.730 3.891 1.00 0.00 H new ATOM 0 HE2 MET A 100 1.821 1.063 2.246 1.00 0.00 H new ATOM 0 HE3 MET A 100 0.777 2.470 2.556 1.00 0.00 H new ATOM 1556 N GLN A 101 -2.174 -2.064 1.523 1.00 0.00 N ATOM 1557 CA GLN A 101 -3.496 -2.663 1.639 1.00 0.00 C ATOM 1558 C GLN A 101 -4.524 -1.696 1.062 1.00 0.00 C ATOM 1559 O GLN A 101 -4.417 -0.486 1.267 1.00 0.00 O ATOM 1560 CB GLN A 101 -3.843 -2.984 3.100 1.00 0.00 C ATOM 1561 CG GLN A 101 -3.001 -4.088 3.733 1.00 0.00 C ATOM 1562 CD GLN A 101 -1.555 -3.689 3.959 1.00 0.00 C ATOM 1563 OE1 GLN A 101 -1.246 -2.515 4.160 1.00 0.00 O ATOM 1564 NE2 GLN A 101 -0.663 -4.662 3.943 1.00 0.00 N ATOM 0 H GLN A 101 -1.728 -1.849 2.414 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.505 -3.602 1.085 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.730 -2.076 3.693 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.893 -3.272 3.154 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.445 -4.372 4.687 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.031 -4.970 3.093 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -0.960 -5.623 3.773 1.00 0.00 H new ATOM 0 HE22 GLN A 101 0.323 -4.453 4.101 1.00 0.00 H new ATOM 1573 N THR A 102 -5.510 -2.228 0.355 1.00 0.00 N ATOM 1574 CA THR A 102 -6.466 -1.410 -0.386 1.00 0.00 C ATOM 1575 C THR A 102 -7.163 -0.369 0.499 1.00 0.00 C ATOM 1576 O THR A 102 -7.270 0.792 0.115 1.00 0.00 O ATOM 1577 CB THR A 102 -7.511 -2.308 -1.071 1.00 0.00 C ATOM 1578 OG1 THR A 102 -6.833 -3.350 -1.783 1.00 0.00 O ATOM 1579 CG2 THR A 102 -8.377 -1.512 -2.035 1.00 0.00 C ATOM 0 H THR A 102 -5.672 -3.232 0.277 1.00 0.00 H new ATOM 0 HA THR A 102 -5.901 -0.861 -1.140 1.00 0.00 H new ATOM 0 HB THR A 102 -8.162 -2.732 -0.306 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.233 -3.453 -2.672 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.105 -2.175 -2.503 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.900 -0.726 -1.490 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.748 -1.064 -2.804 1.00 0.00 H new ATOM 1587 N GLY A 103 -7.616 -0.784 1.680 1.00 0.00 N ATOM 1588 CA GLY A 103 -8.307 0.126 2.589 1.00 0.00 C ATOM 1589 C GLY A 103 -7.513 1.389 2.904 1.00 0.00 C ATOM 1590 O GLY A 103 -7.909 2.492 2.506 1.00 0.00 O ATOM 0 H GLY A 103 -7.518 -1.738 2.028 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -9.264 0.408 2.150 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -8.525 -0.398 3.519 1.00 0.00 H new ATOM 1594 N PRO A 104 -6.392 1.268 3.637 1.00 0.00 N ATOM 1595 CA PRO A 104 -5.520 2.405 3.934 1.00 0.00 C ATOM 1596 C PRO A 104 -5.078 3.141 2.671 1.00 0.00 C ATOM 1597 O PRO A 104 -4.970 4.364 2.674 1.00 0.00 O ATOM 1598 CB PRO A 104 -4.312 1.781 4.649 1.00 0.00 C ATOM 1599 CG PRO A 104 -4.441 0.308 4.453 1.00 0.00 C ATOM 1600 CD PRO A 104 -5.904 0.033 4.260 1.00 0.00 C ATOM 0 HA PRO A 104 -6.033 3.154 4.537 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -3.376 2.151 4.231 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -4.310 2.036 5.709 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -3.866 -0.020 3.587 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -4.054 -0.234 5.316 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -6.071 -0.834 3.621 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -6.406 -0.167 5.207 1.00 0.00 H new ATOM 1608 N ALA A 105 -4.847 2.394 1.590 1.00 0.00 N ATOM 1609 CA ALA A 105 -4.449 2.989 0.316 1.00 0.00 C ATOM 1610 C ALA A 105 -5.519 3.947 -0.200 1.00 0.00 C ATOM 1611 O ALA A 105 -5.207 5.014 -0.728 1.00 0.00 O ATOM 1612 CB ALA A 105 -4.169 1.905 -0.715 1.00 0.00 C ATOM 0 H ALA A 105 -4.929 1.377 1.573 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.535 3.558 0.482 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -3.874 2.367 -1.657 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.364 1.263 -0.358 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.068 1.308 -0.869 1.00 0.00 H new ATOM 1618 N ILE A 106 -6.783 3.560 -0.035 1.00 0.00 N ATOM 1619 CA ILE A 106 -7.904 4.415 -0.405 1.00 0.00 C ATOM 1620 C ILE A 106 -7.832 5.735 0.349 1.00 0.00 C ATOM 1621 O ILE A 106 -7.994 6.807 -0.236 1.00 0.00 O ATOM 1622 CB ILE A 106 -9.266 3.736 -0.117 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -9.467 2.529 -1.037 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -10.410 4.730 -0.278 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -10.741 1.757 -0.763 1.00 0.00 C ATOM 0 H ILE A 106 -7.054 2.657 0.354 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.832 4.596 -1.477 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.263 3.386 0.915 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -9.476 2.870 -2.072 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -8.616 1.857 -0.930 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -11.357 4.232 -0.071 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.275 5.556 0.420 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.418 5.114 -1.298 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -10.813 0.917 -1.454 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -10.727 1.384 0.261 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.601 2.413 -0.899 1.00 0.00 H new ATOM 1637 N ARG A 107 -7.571 5.653 1.649 1.00 0.00 N ATOM 1638 CA ARG A 107 -7.485 6.854 2.471 1.00 0.00 C ATOM 1639 C ARG A 107 -6.266 7.693 2.093 1.00 0.00 C ATOM 1640 O ARG A 107 -6.355 8.920 2.031 1.00 0.00 O ATOM 1641 CB ARG A 107 -7.453 6.503 3.956 1.00 0.00 C ATOM 1642 CG ARG A 107 -8.681 5.740 4.422 1.00 0.00 C ATOM 1643 CD ARG A 107 -8.750 5.663 5.937 1.00 0.00 C ATOM 1644 NE ARG A 107 -7.502 5.179 6.518 1.00 0.00 N ATOM 1645 CZ ARG A 107 -7.427 4.229 7.445 1.00 0.00 C ATOM 1646 NH1 ARG A 107 -8.529 3.629 7.877 1.00 0.00 N ATOM 1647 NH2 ARG A 107 -6.244 3.876 7.929 1.00 0.00 N ATOM 0 H ARG A 107 -7.417 4.779 2.151 1.00 0.00 H new ATOM 0 HA ARG A 107 -8.379 7.447 2.281 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -6.564 5.907 4.162 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -7.363 7.421 4.537 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -9.579 6.227 4.041 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -8.663 4.733 4.006 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -8.979 6.650 6.340 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -9.566 5.002 6.229 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.631 5.597 6.192 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -9.437 3.896 7.498 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -8.468 2.901 8.588 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -5.397 4.333 7.590 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -6.181 3.148 8.640 1.00 0.00 H new ATOM 1661 N THR A 108 -5.135 7.037 1.830 1.00 0.00 N ATOM 1662 CA THR A 108 -3.935 7.737 1.383 1.00 0.00 C ATOM 1663 C THR A 108 -4.229 8.514 0.099 1.00 0.00 C ATOM 1664 O THR A 108 -3.883 9.692 -0.029 1.00 0.00 O ATOM 1665 CB THR A 108 -2.766 6.761 1.123 1.00 0.00 C ATOM 1666 OG1 THR A 108 -2.601 5.865 2.231 1.00 0.00 O ATOM 1667 CG2 THR A 108 -1.467 7.521 0.900 1.00 0.00 C ATOM 0 H THR A 108 -5.027 6.027 1.919 1.00 0.00 H new ATOM 0 HA THR A 108 -3.642 8.422 2.179 1.00 0.00 H new ATOM 0 HB THR A 108 -3.005 6.189 0.227 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.362 5.249 2.270 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.658 6.813 0.719 1.00 0.00 H new ATOM 0 HG22 THR A 108 -1.574 8.179 0.037 1.00 0.00 H new ATOM 0 HG23 THR A 108 -1.237 8.116 1.784 1.00 0.00 H new ATOM 1675 N TYR A 109 -4.892 7.845 -0.839 1.00 0.00 N ATOM 1676 CA TYR A 109 -5.289 8.460 -2.097 1.00 0.00 C ATOM 1677 C TYR A 109 -6.252 9.619 -1.854 1.00 0.00 C ATOM 1678 O TYR A 109 -6.074 10.703 -2.408 1.00 0.00 O ATOM 1679 CB TYR A 109 -5.925 7.407 -3.012 1.00 0.00 C ATOM 1680 CG TYR A 109 -6.702 7.979 -4.177 1.00 0.00 C ATOM 1681 CD1 TYR A 109 -6.063 8.642 -5.218 1.00 0.00 C ATOM 1682 CD2 TYR A 109 -8.085 7.860 -4.225 1.00 0.00 C ATOM 1683 CE1 TYR A 109 -6.783 9.169 -6.275 1.00 0.00 C ATOM 1684 CE2 TYR A 109 -8.809 8.384 -5.275 1.00 0.00 C ATOM 1685 CZ TYR A 109 -8.156 9.036 -6.298 1.00 0.00 C ATOM 1686 OH TYR A 109 -8.884 9.565 -7.339 1.00 0.00 O ATOM 0 H TYR A 109 -5.167 6.867 -0.748 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.402 8.862 -2.587 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -5.140 6.757 -3.399 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.592 6.782 -2.418 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -4.988 8.747 -5.201 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -8.602 7.348 -3.427 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -6.273 9.682 -7.077 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -9.884 8.284 -5.295 1.00 0.00 H new ATOM 0 HH TYR A 109 -9.840 9.509 -7.131 1.00 0.00 H new ATOM 1696 N ASN A 110 -7.254 9.384 -1.009 1.00 0.00 N ATOM 1697 CA ASN A 110 -8.255 10.398 -0.673 1.00 0.00 C ATOM 1698 C ASN A 110 -7.607 11.695 -0.197 1.00 0.00 C ATOM 1699 O ASN A 110 -7.990 12.786 -0.624 1.00 0.00 O ATOM 1700 CB ASN A 110 -9.202 9.862 0.408 1.00 0.00 C ATOM 1701 CG ASN A 110 -10.161 10.918 0.927 1.00 0.00 C ATOM 1702 OD1 ASN A 110 -9.878 11.606 1.912 1.00 0.00 O ATOM 1703 ND2 ASN A 110 -11.299 11.055 0.267 1.00 0.00 N ATOM 0 H ASN A 110 -7.396 8.490 -0.539 1.00 0.00 H new ATOM 0 HA ASN A 110 -8.820 10.619 -1.579 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -9.773 9.027 0.002 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -8.614 9.472 1.239 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -11.982 11.750 0.567 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -11.493 10.466 -0.542 1.00 0.00 H new ATOM 1710 N ILE A 111 -6.625 11.573 0.681 1.00 0.00 N ATOM 1711 CA ILE A 111 -5.932 12.735 1.215 1.00 0.00 C ATOM 1712 C ILE A 111 -5.048 13.378 0.148 1.00 0.00 C ATOM 1713 O ILE A 111 -5.105 14.588 -0.075 1.00 0.00 O ATOM 1714 CB ILE A 111 -5.063 12.355 2.434 1.00 0.00 C ATOM 1715 CG1 ILE A 111 -5.916 11.665 3.501 1.00 0.00 C ATOM 1716 CG2 ILE A 111 -4.387 13.592 3.013 1.00 0.00 C ATOM 1717 CD1 ILE A 111 -5.108 11.069 4.632 1.00 0.00 C ATOM 0 H ILE A 111 -6.289 10.679 1.040 1.00 0.00 H new ATOM 0 HA ILE A 111 -6.693 13.449 1.531 1.00 0.00 H new ATOM 0 HB ILE A 111 -4.290 11.661 2.105 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -6.622 12.386 3.912 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -6.503 10.876 3.030 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -3.779 13.306 3.871 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -3.752 14.048 2.254 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -5.146 14.307 3.329 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -5.779 10.597 5.350 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -4.420 10.323 4.234 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -4.541 11.857 5.129 1.00 0.00 H new ATOM 1729 N MET A 112 -4.254 12.554 -0.525 1.00 0.00 N ATOM 1730 CA MET A 112 -3.267 13.046 -1.481 1.00 0.00 C ATOM 1731 C MET A 112 -3.924 13.708 -2.690 1.00 0.00 C ATOM 1732 O MET A 112 -3.420 14.707 -3.207 1.00 0.00 O ATOM 1733 CB MET A 112 -2.361 11.903 -1.945 1.00 0.00 C ATOM 1734 CG MET A 112 -1.177 12.366 -2.780 1.00 0.00 C ATOM 1735 SD MET A 112 -0.095 13.495 -1.879 1.00 0.00 S ATOM 1736 CE MET A 112 0.394 12.463 -0.497 1.00 0.00 C ATOM 0 H MET A 112 -4.274 11.539 -0.427 1.00 0.00 H new ATOM 0 HA MET A 112 -2.670 13.801 -0.970 1.00 0.00 H new ATOM 0 HB2 MET A 112 -1.991 11.366 -1.072 1.00 0.00 H new ATOM 0 HB3 MET A 112 -2.952 11.196 -2.528 1.00 0.00 H new ATOM 0 HG2 MET A 112 -0.603 11.498 -3.103 1.00 0.00 H new ATOM 0 HG3 MET A 112 -1.542 12.859 -3.681 1.00 0.00 H new ATOM 0 HE1 MET A 112 1.287 12.878 -0.031 1.00 0.00 H new ATOM 0 HE2 MET A 112 -0.414 12.427 0.234 1.00 0.00 H new ATOM 0 HE3 MET A 112 0.606 11.455 -0.853 1.00 0.00 H new ATOM 1746 N ILE A 113 -5.057 13.165 -3.125 1.00 0.00 N ATOM 1747 CA ILE A 113 -5.733 13.667 -4.317 1.00 0.00 C ATOM 1748 C ILE A 113 -6.285 15.074 -4.086 1.00 0.00 C ATOM 1749 O ILE A 113 -6.462 15.844 -5.030 1.00 0.00 O ATOM 1750 CB ILE A 113 -6.872 12.719 -4.774 1.00 0.00 C ATOM 1751 CG1 ILE A 113 -7.332 13.074 -6.190 1.00 0.00 C ATOM 1752 CG2 ILE A 113 -8.052 12.770 -3.814 1.00 0.00 C ATOM 1753 CD1 ILE A 113 -6.252 12.906 -7.235 1.00 0.00 C ATOM 0 H ILE A 113 -5.525 12.380 -2.672 1.00 0.00 H new ATOM 0 HA ILE A 113 -4.987 13.708 -5.111 1.00 0.00 H new ATOM 0 HB ILE A 113 -6.477 11.703 -4.774 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -8.183 12.447 -6.455 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.681 14.107 -6.202 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -8.834 12.095 -4.162 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.726 12.465 -2.820 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -8.443 13.787 -3.772 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.648 13.175 -8.214 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -5.409 13.553 -6.994 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.919 11.868 -7.251 1.00 0.00 H new ATOM 1765 N GLY A 114 -6.540 15.411 -2.828 1.00 0.00 N ATOM 1766 CA GLY A 114 -7.042 16.733 -2.506 1.00 0.00 C ATOM 1767 C GLY A 114 -5.934 17.678 -2.093 1.00 0.00 C ATOM 1768 O GLY A 114 -6.112 18.897 -2.087 1.00 0.00 O ATOM 0 H GLY A 114 -6.409 14.794 -2.026 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.564 17.143 -3.371 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.772 16.657 -1.700 1.00 0.00 H new ATOM 1772 N GLU A 115 -4.784 17.115 -1.753 1.00 0.00 N ATOM 1773 CA GLU A 115 -3.654 17.907 -1.296 1.00 0.00 C ATOM 1774 C GLU A 115 -2.791 18.360 -2.470 1.00 0.00 C ATOM 1775 O GLU A 115 -2.673 19.556 -2.746 1.00 0.00 O ATOM 1776 CB GLU A 115 -2.803 17.100 -0.311 1.00 0.00 C ATOM 1777 CG GLU A 115 -1.640 17.886 0.273 1.00 0.00 C ATOM 1778 CD GLU A 115 -0.700 17.026 1.093 1.00 0.00 C ATOM 1779 OE1 GLU A 115 -1.055 16.670 2.234 1.00 0.00 O ATOM 1780 OE2 GLU A 115 0.407 16.718 0.604 1.00 0.00 O ATOM 0 H GLU A 115 -4.610 16.111 -1.785 1.00 0.00 H new ATOM 0 HA GLU A 115 -4.046 18.791 -0.793 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -3.438 16.749 0.502 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.416 16.216 -0.818 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -1.082 18.355 -0.537 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -2.029 18.689 0.899 1.00 0.00 H new ATOM 1787 N ARG A 116 -2.197 17.401 -3.166 1.00 0.00 N ATOM 1788 CA ARG A 116 -1.218 17.709 -4.200 1.00 0.00 C ATOM 1789 C ARG A 116 -1.545 17.019 -5.524 1.00 0.00 C ATOM 1790 O ARG A 116 -1.111 17.473 -6.584 1.00 0.00 O ATOM 1791 CB ARG A 116 0.177 17.286 -3.722 1.00 0.00 C ATOM 1792 CG ARG A 116 1.261 17.413 -4.779 1.00 0.00 C ATOM 1793 CD ARG A 116 2.591 16.864 -4.293 1.00 0.00 C ATOM 1794 NE ARG A 116 3.256 17.760 -3.347 1.00 0.00 N ATOM 1795 CZ ARG A 116 4.569 17.982 -3.351 1.00 0.00 C ATOM 1796 NH1 ARG A 116 5.352 17.324 -4.194 1.00 0.00 N ATOM 1797 NH2 ARG A 116 5.110 18.851 -2.507 1.00 0.00 N ATOM 0 H ARG A 116 -2.375 16.405 -3.034 1.00 0.00 H new ATOM 0 HA ARG A 116 -1.245 18.784 -4.378 1.00 0.00 H new ATOM 0 HB2 ARG A 116 0.453 17.893 -2.859 1.00 0.00 H new ATOM 0 HB3 ARG A 116 0.135 16.251 -3.383 1.00 0.00 H new ATOM 0 HG2 ARG A 116 0.955 16.880 -5.679 1.00 0.00 H new ATOM 0 HG3 ARG A 116 1.379 18.461 -5.054 1.00 0.00 H new ATOM 0 HD2 ARG A 116 2.429 15.896 -3.819 1.00 0.00 H new ATOM 0 HD3 ARG A 116 3.245 16.695 -5.149 1.00 0.00 H new ATOM 0 HE ARG A 116 2.686 18.238 -2.650 1.00 0.00 H new ATOM 0 HH11 ARG A 116 4.949 16.646 -4.841 1.00 0.00 H new ATOM 0 HH12 ARG A 116 6.358 17.495 -4.196 1.00 0.00 H new ATOM 0 HH21 ARG A 116 4.519 19.356 -1.847 1.00 0.00 H new ATOM 0 HH22 ARG A 116 6.117 19.014 -2.518 1.00 0.00 H new ATOM 1811 N ARG A 117 -2.328 15.939 -5.462 1.00 0.00 N ATOM 1812 CA ARG A 117 -2.574 15.090 -6.629 1.00 0.00 C ATOM 1813 C ARG A 117 -1.275 14.401 -7.044 1.00 0.00 C ATOM 1814 O ARG A 117 -0.488 14.006 -6.188 1.00 0.00 O ATOM 1815 CB ARG A 117 -3.158 15.892 -7.802 1.00 0.00 C ATOM 1816 CG ARG A 117 -4.586 16.356 -7.579 1.00 0.00 C ATOM 1817 CD ARG A 117 -5.069 17.227 -8.729 1.00 0.00 C ATOM 1818 NE ARG A 117 -6.479 17.586 -8.595 1.00 0.00 N ATOM 1819 CZ ARG A 117 -6.909 18.707 -8.023 1.00 0.00 C ATOM 1820 NH1 ARG A 117 -6.045 19.563 -7.485 1.00 0.00 N ATOM 1821 NH2 ARG A 117 -8.207 18.974 -7.993 1.00 0.00 N ATOM 0 H ARG A 117 -2.803 15.632 -4.613 1.00 0.00 H new ATOM 0 HA ARG A 117 -3.312 14.337 -6.354 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -2.528 16.762 -7.984 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -3.122 15.279 -8.702 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -5.240 15.490 -7.476 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -4.648 16.915 -6.645 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -4.467 18.135 -8.773 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -4.918 16.699 -9.671 1.00 0.00 H new ATOM 0 HE ARG A 117 -7.176 16.938 -8.962 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -5.045 19.362 -7.509 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -6.382 20.421 -7.048 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -8.872 18.321 -8.408 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -8.541 19.833 -7.555 1.00 0.00 H new ATOM 1835 N ARG A 118 -1.067 14.252 -8.357 1.00 0.00 N ATOM 1836 CA ARG A 118 0.128 13.591 -8.897 1.00 0.00 C ATOM 1837 C ARG A 118 0.171 12.127 -8.478 1.00 0.00 C ATOM 1838 O ARG A 118 1.221 11.486 -8.504 1.00 0.00 O ATOM 1839 CB ARG A 118 1.415 14.294 -8.438 1.00 0.00 C ATOM 1840 CG ARG A 118 1.558 15.733 -8.909 1.00 0.00 C ATOM 1841 CD ARG A 118 1.652 15.825 -10.423 1.00 0.00 C ATOM 1842 NE ARG A 118 2.105 17.145 -10.856 1.00 0.00 N ATOM 1843 CZ ARG A 118 1.711 17.748 -11.977 1.00 0.00 C ATOM 1844 NH1 ARG A 118 0.825 17.164 -12.779 1.00 0.00 N ATOM 1845 NH2 ARG A 118 2.201 18.938 -12.295 1.00 0.00 N ATOM 0 H ARG A 118 -1.716 14.583 -9.071 1.00 0.00 H new ATOM 0 HA ARG A 118 0.068 13.653 -9.984 1.00 0.00 H new ATOM 0 HB2 ARG A 118 1.453 14.278 -7.349 1.00 0.00 H new ATOM 0 HB3 ARG A 118 2.272 13.723 -8.795 1.00 0.00 H new ATOM 0 HG2 ARG A 118 0.705 16.315 -8.562 1.00 0.00 H new ATOM 0 HG3 ARG A 118 2.449 16.175 -8.462 1.00 0.00 H new ATOM 0 HD2 ARG A 118 2.340 15.065 -10.792 1.00 0.00 H new ATOM 0 HD3 ARG A 118 0.677 15.612 -10.862 1.00 0.00 H new ATOM 0 HE ARG A 118 2.768 17.639 -10.259 1.00 0.00 H new ATOM 0 HH11 ARG A 118 0.443 16.250 -12.537 1.00 0.00 H new ATOM 0 HH12 ARG A 118 0.527 17.631 -13.636 1.00 0.00 H new ATOM 0 HH21 ARG A 118 2.879 19.391 -11.682 1.00 0.00 H new ATOM 0 HH22 ARG A 118 1.900 19.401 -13.153 1.00 0.00 H new ATOM 1859 N VAL A 119 -0.984 11.599 -8.131 1.00 0.00 N ATOM 1860 CA VAL A 119 -1.079 10.248 -7.614 1.00 0.00 C ATOM 1861 C VAL A 119 -2.097 9.441 -8.410 1.00 0.00 C ATOM 1862 O VAL A 119 -3.138 9.960 -8.817 1.00 0.00 O ATOM 1863 CB VAL A 119 -1.460 10.253 -6.111 1.00 0.00 C ATOM 1864 CG1 VAL A 119 -2.810 10.923 -5.888 1.00 0.00 C ATOM 1865 CG2 VAL A 119 -1.454 8.841 -5.539 1.00 0.00 C ATOM 0 H VAL A 119 -1.877 12.088 -8.198 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.100 9.780 -7.718 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.706 10.834 -5.581 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.051 10.912 -4.825 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.767 11.954 -6.239 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.580 10.383 -6.440 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.725 8.875 -4.484 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.174 8.227 -6.079 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.458 8.410 -5.645 1.00 0.00 H new ATOM 1875 N ALA A 120 -1.764 8.188 -8.661 1.00 0.00 N ATOM 1876 CA ALA A 120 -2.678 7.262 -9.305 1.00 0.00 C ATOM 1877 C ALA A 120 -2.901 6.063 -8.399 1.00 0.00 C ATOM 1878 O ALA A 120 -1.955 5.553 -7.792 1.00 0.00 O ATOM 1879 CB ALA A 120 -2.141 6.823 -10.659 1.00 0.00 C ATOM 0 H ALA A 120 -0.857 7.785 -8.426 1.00 0.00 H new ATOM 0 HA ALA A 120 -3.631 7.763 -9.476 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -2.843 6.130 -11.122 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.016 7.695 -11.301 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.178 6.329 -10.526 1.00 0.00 H new ATOM 1885 N ALA A 121 -4.139 5.623 -8.297 1.00 0.00 N ATOM 1886 CA ALA A 121 -4.482 4.535 -7.399 1.00 0.00 C ATOM 1887 C ALA A 121 -4.923 3.302 -8.168 1.00 0.00 C ATOM 1888 O ALA A 121 -5.986 3.288 -8.793 1.00 0.00 O ATOM 1889 CB ALA A 121 -5.564 4.975 -6.425 1.00 0.00 C ATOM 0 H ALA A 121 -4.926 6.001 -8.825 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.589 4.270 -6.834 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.811 4.149 -5.758 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.204 5.820 -5.838 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.454 5.272 -6.980 1.00 0.00 H new ATOM 1895 N ALA A 122 -4.095 2.273 -8.135 1.00 0.00 N ATOM 1896 CA ALA A 122 -4.450 0.988 -8.704 1.00 0.00 C ATOM 1897 C ALA A 122 -4.958 0.085 -7.598 1.00 0.00 C ATOM 1898 O ALA A 122 -4.176 -0.540 -6.880 1.00 0.00 O ATOM 1899 CB ALA A 122 -3.259 0.362 -9.417 1.00 0.00 C ATOM 0 H ALA A 122 -3.165 2.305 -7.716 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.236 1.125 -9.447 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.551 -0.601 -9.835 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.928 1.021 -10.220 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -2.445 0.218 -8.707 1.00 0.00 H new ATOM 1905 N LEU A 123 -6.266 0.045 -7.428 1.00 0.00 N ATOM 1906 CA LEU A 123 -6.857 -0.642 -6.295 1.00 0.00 C ATOM 1907 C LEU A 123 -7.473 -1.970 -6.706 1.00 0.00 C ATOM 1908 O LEU A 123 -8.360 -2.018 -7.559 1.00 0.00 O ATOM 1909 CB LEU A 123 -7.906 0.247 -5.630 1.00 0.00 C ATOM 1910 CG LEU A 123 -7.370 1.568 -5.070 1.00 0.00 C ATOM 1911 CD1 LEU A 123 -8.503 2.395 -4.488 1.00 0.00 C ATOM 1912 CD2 LEU A 123 -6.302 1.309 -4.016 1.00 0.00 C ATOM 0 H LEU A 123 -6.939 0.480 -8.059 1.00 0.00 H new ATOM 0 HA LEU A 123 -6.062 -0.854 -5.580 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.688 0.468 -6.357 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.373 -0.312 -4.819 1.00 0.00 H new ATOM 0 HG LEU A 123 -6.916 2.129 -5.887 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -8.106 3.330 -4.094 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.234 2.611 -5.268 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -8.984 1.838 -3.684 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.934 2.260 -3.630 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.730 0.727 -3.200 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.477 0.754 -4.463 1.00 0.00 H new ATOM 1924 N ILE A 124 -6.982 -3.038 -6.099 1.00 0.00 N ATOM 1925 CA ILE A 124 -7.507 -4.372 -6.328 1.00 0.00 C ATOM 1926 C ILE A 124 -8.257 -4.844 -5.084 1.00 0.00 C ATOM 1927 O ILE A 124 -7.864 -4.531 -3.958 1.00 0.00 O ATOM 1928 CB ILE A 124 -6.369 -5.371 -6.654 1.00 0.00 C ATOM 1929 CG1 ILE A 124 -5.519 -4.849 -7.815 1.00 0.00 C ATOM 1930 CG2 ILE A 124 -6.931 -6.748 -6.985 1.00 0.00 C ATOM 1931 CD1 ILE A 124 -4.333 -5.730 -8.147 1.00 0.00 C ATOM 0 H ILE A 124 -6.209 -3.004 -5.434 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.185 -4.333 -7.181 1.00 0.00 H new ATOM 0 HB ILE A 124 -5.737 -5.466 -5.771 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.148 -4.754 -8.700 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.160 -3.849 -7.570 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.112 -7.431 -7.210 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.494 -7.126 -6.132 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.590 -6.674 -7.850 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -3.779 -5.296 -8.979 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.681 -5.806 -7.277 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.684 -6.724 -8.424 1.00 0.00 H new ATOM 1943 N ALA A 125 -9.349 -5.560 -5.287 1.00 0.00 N ATOM 1944 CA ALA A 125 -10.107 -6.123 -4.183 1.00 0.00 C ATOM 1945 C ALA A 125 -9.629 -7.540 -3.890 1.00 0.00 C ATOM 1946 O ALA A 125 -8.746 -8.057 -4.572 1.00 0.00 O ATOM 1947 CB ALA A 125 -11.597 -6.112 -4.504 1.00 0.00 C ATOM 0 H ALA A 125 -9.732 -5.766 -6.210 1.00 0.00 H new ATOM 0 HA ALA A 125 -9.945 -5.512 -3.295 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -12.152 -6.537 -3.668 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -11.925 -5.087 -4.674 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -11.781 -6.705 -5.400 1.00 0.00 H new ATOM 1953 N VAL A 126 -10.204 -8.163 -2.873 1.00 0.00 N ATOM 1954 CA VAL A 126 -9.851 -9.531 -2.528 1.00 0.00 C ATOM 1955 C VAL A 126 -10.420 -10.503 -3.560 1.00 0.00 C ATOM 1956 O VAL A 126 -11.531 -10.306 -4.060 1.00 0.00 O ATOM 1957 CB VAL A 126 -10.350 -9.906 -1.113 1.00 0.00 C ATOM 1958 CG1 VAL A 126 -9.634 -9.070 -0.064 1.00 0.00 C ATOM 1959 CG2 VAL A 126 -11.858 -9.726 -0.997 1.00 0.00 C ATOM 0 H VAL A 126 -10.915 -7.744 -2.274 1.00 0.00 H new ATOM 0 HA VAL A 126 -8.763 -9.603 -2.530 1.00 0.00 H new ATOM 0 HB VAL A 126 -10.123 -10.958 -0.941 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -9.994 -9.344 0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -8.561 -9.253 -0.123 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -9.833 -8.013 -0.243 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -12.181 -9.997 0.008 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -12.116 -8.685 -1.193 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -12.358 -10.367 -1.723 1.00 0.00 H new