USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 498 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 81 HIS : no HD1:sc= -2.28! C(o=-2.3!,f=-2.8!) USER MOD Single : A 85 SER OG : rot 98:sc= 0.0583 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 117:sc= 1.2 USER MOD Single : A 96 SER OG : rot -150:sc= -1.16 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 157:sc= -0.0232 (180deg=-0.251) USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 139:sc= -1.82! USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl 148:sc= -0.394 (180deg=-0.882) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.0089 X(o=-0.0089,f=-0.0089) USER MOD Single : A 126 GLN : amide:sc= -0.433 K(o=-0.43,f=-2.9!) USER MOD Single : A 131 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.106) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 144 GLN :FLIP amide:sc= -0.302 F(o=-2.5,f=-0.3) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.185 8.400 3.381 1.00 1.00 N ATOM 131 CA HIS A 81 -5.429 7.064 3.898 1.00 1.00 C ATOM 132 C HIS A 81 -4.106 6.301 3.993 1.00 1.00 C ATOM 133 O HIS A 81 -3.577 5.839 2.983 1.00 1.00 O ATOM 134 CB HIS A 81 -6.473 6.335 3.051 1.00 1.00 C ATOM 135 CG HIS A 81 -6.259 4.844 2.959 1.00 1.00 C ATOM 136 ND1 HIS A 81 -5.855 4.077 4.039 1.00 1.00 N ATOM 137 CD2 HIS A 81 -6.396 3.986 1.908 1.00 1.00 C ATOM 138 CE1 HIS A 81 -5.757 2.816 3.643 1.00 1.00 C ATOM 139 NE2 HIS A 81 -6.092 2.762 2.321 1.00 1.00 N ATOM 0 HA HIS A 81 -5.844 7.130 4.904 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -7.461 6.524 3.470 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -6.467 6.755 2.045 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -6.701 4.257 0.908 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -5.464 1.978 4.258 1.00 1.00 H new ATOM 0 HE2 HIS A 81 -6.106 1.920 1.746 1.00 1.00 H new ATOM 146 N ILE A 82 -3.608 6.193 5.216 1.00 1.00 N ATOM 147 CA ILE A 82 -2.357 5.494 5.455 1.00 1.00 C ATOM 148 C ILE A 82 -2.649 4.020 5.749 1.00 1.00 C ATOM 149 O ILE A 82 -3.365 3.702 6.697 1.00 1.00 O ATOM 150 CB ILE A 82 -1.556 6.192 6.556 1.00 1.00 C ATOM 151 CG1 ILE A 82 -1.090 7.576 6.101 1.00 1.00 C ATOM 152 CG2 ILE A 82 -0.388 5.320 7.023 1.00 1.00 C ATOM 153 CD1 ILE A 82 -2.090 8.656 6.517 1.00 1.00 C ATOM 0 H ILE A 82 -4.048 6.578 6.052 1.00 1.00 H new ATOM 0 HA ILE A 82 -1.728 5.524 4.565 1.00 1.00 H new ATOM 0 HB ILE A 82 -2.212 6.338 7.414 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -0.113 7.795 6.532 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -0.969 7.585 5.018 1.00 1.00 H new ATOM 0 HG21 ILE A 82 0.164 5.840 7.806 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -0.771 4.378 7.414 1.00 1.00 H new ATOM 0 HG23 ILE A 82 0.276 5.120 6.182 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -1.734 9.630 6.181 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -3.060 8.448 6.064 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -2.190 8.661 7.602 1.00 1.00 H new ATOM 164 N VAL A 83 -2.079 3.161 4.916 1.00 1.00 N ATOM 165 CA VAL A 83 -2.269 1.729 5.074 1.00 1.00 C ATOM 166 C VAL A 83 -1.437 1.236 6.259 1.00 1.00 C ATOM 167 O VAL A 83 -0.219 1.403 6.280 1.00 1.00 O ATOM 168 CB VAL A 83 -1.932 1.009 3.766 1.00 1.00 C ATOM 169 CG1 VAL A 83 -2.044 -0.507 3.931 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.820 1.503 2.624 1.00 1.00 C ATOM 0 H VAL A 83 -1.486 3.429 4.130 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.313 1.504 5.294 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.898 1.243 3.511 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.800 -0.995 2.987 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -1.350 -0.841 4.703 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -3.062 -0.767 4.221 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -2.560 0.975 1.706 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.865 1.313 2.868 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.669 2.573 2.482 1.00 1.00 H new ATOM 180 N ARG A 84 -2.129 0.639 7.219 1.00 1.00 N ATOM 181 CA ARG A 84 -1.470 0.120 8.406 1.00 1.00 C ATOM 182 C ARG A 84 -1.287 -1.394 8.292 1.00 1.00 C ATOM 183 O ARG A 84 -2.265 -2.139 8.249 1.00 1.00 O ATOM 184 CB ARG A 84 -2.275 0.438 9.667 1.00 1.00 C ATOM 185 CG ARG A 84 -2.264 1.940 9.961 1.00 1.00 C ATOM 186 CD ARG A 84 -2.972 2.244 11.283 1.00 1.00 C ATOM 187 NE ARG A 84 -2.011 2.147 12.405 1.00 1.00 N ATOM 188 CZ ARG A 84 -2.145 2.808 13.575 1.00 1.00 C ATOM 189 NH1 ARG A 84 -3.203 3.620 13.786 1.00 1.00 N ATOM 190 NH2 ARG A 84 -1.227 2.647 14.509 1.00 1.00 N ATOM 0 H ARG A 84 -3.140 0.503 7.199 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.495 0.602 8.482 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -3.302 0.096 9.543 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.858 -0.105 10.515 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.236 2.298 10.004 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.755 2.477 9.149 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -3.407 3.243 11.251 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -3.793 1.544 11.435 1.00 1.00 H new ATOM 0 HE ARG A 84 -1.197 1.543 12.287 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -3.909 3.738 13.059 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -3.297 4.116 14.673 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -0.432 2.031 14.341 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -1.313 3.139 15.399 1.00 1.00 H new ATOM 199 N SER A 85 -0.028 -1.806 8.248 1.00 1.00 N ATOM 200 CA SER A 85 0.293 -3.219 8.141 1.00 1.00 C ATOM 201 C SER A 85 -0.645 -4.038 9.029 1.00 1.00 C ATOM 202 O SER A 85 -0.449 -4.115 10.240 1.00 1.00 O ATOM 203 CB SER A 85 1.751 -3.481 8.525 1.00 1.00 C ATOM 204 OG SER A 85 2.234 -2.532 9.471 1.00 1.00 O ATOM 0 H SER A 85 0.781 -1.186 8.285 1.00 1.00 H new ATOM 0 HA SER A 85 0.157 -3.524 7.103 1.00 1.00 H new ATOM 0 HB2 SER A 85 1.841 -4.485 8.940 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.373 -3.449 7.630 1.00 1.00 H new ATOM 0 HG SER A 85 2.184 -2.914 10.372 1.00 1.00 H new ATOM 209 N PRO A 86 -1.671 -4.645 8.375 1.00 1.00 N ATOM 210 CA PRO A 86 -2.640 -5.456 9.091 1.00 1.00 C ATOM 211 C PRO A 86 -2.042 -6.809 9.480 1.00 1.00 C ATOM 212 O PRO A 86 -2.716 -7.637 10.090 1.00 1.00 O ATOM 213 CB PRO A 86 -3.825 -5.580 8.146 1.00 1.00 C ATOM 214 CG PRO A 86 -3.295 -5.231 6.765 1.00 1.00 C ATOM 215 CD PRO A 86 -1.934 -4.576 6.940 1.00 1.00 C ATOM 0 HA PRO A 86 -2.947 -5.008 10.036 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.234 -6.590 8.163 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.629 -4.905 8.438 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -3.211 -6.127 6.151 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.980 -4.556 6.252 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -1.166 -5.100 6.371 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.943 -3.544 6.588 1.00 1.00 H new ATOM 220 N MET A 87 -0.783 -6.993 9.111 1.00 1.00 N ATOM 221 CA MET A 87 -0.086 -8.231 9.414 1.00 1.00 C ATOM 222 C MET A 87 1.416 -7.991 9.571 1.00 1.00 C ATOM 223 O MET A 87 2.063 -7.462 8.667 1.00 1.00 O ATOM 224 CB MET A 87 -0.328 -9.240 8.289 1.00 1.00 C ATOM 225 CG MET A 87 0.122 -10.642 8.706 1.00 1.00 C ATOM 226 SD MET A 87 -0.854 -11.874 7.858 1.00 1.00 S ATOM 227 CE MET A 87 -0.970 -13.113 9.138 1.00 1.00 C ATOM 0 H MET A 87 -0.227 -6.304 8.604 1.00 1.00 H new ATOM 0 HA MET A 87 -0.471 -8.623 10.355 1.00 1.00 H new ATOM 0 HB2 MET A 87 -1.387 -9.256 8.031 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.214 -8.931 7.395 1.00 1.00 H new ATOM 0 HG2 MET A 87 1.178 -10.779 8.472 1.00 1.00 H new ATOM 0 HG3 MET A 87 0.016 -10.761 9.784 1.00 1.00 H new ATOM 0 HE1 MET A 87 -1.552 -13.959 8.773 1.00 1.00 H new ATOM 0 HE2 MET A 87 0.030 -13.450 9.409 1.00 1.00 H new ATOM 0 HE3 MET A 87 -1.459 -12.687 10.014 1.00 1.00 H new ATOM 235 N VAL A 88 1.930 -8.390 10.725 1.00 1.00 N ATOM 236 CA VAL A 88 3.345 -8.224 11.012 1.00 1.00 C ATOM 237 C VAL A 88 4.153 -9.194 10.147 1.00 1.00 C ATOM 238 O VAL A 88 3.751 -10.340 9.951 1.00 1.00 O ATOM 239 CB VAL A 88 3.599 -8.405 12.510 1.00 1.00 C ATOM 240 CG1 VAL A 88 4.962 -7.835 12.907 1.00 1.00 C ATOM 241 CG2 VAL A 88 2.478 -7.772 13.337 1.00 1.00 C ATOM 0 H VAL A 88 1.392 -8.828 11.473 1.00 1.00 H new ATOM 0 HA VAL A 88 3.671 -7.215 10.760 1.00 1.00 H new ATOM 0 HB VAL A 88 3.608 -9.474 12.722 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.118 -7.976 13.976 1.00 1.00 H new ATOM 0 HG12 VAL A 88 5.747 -8.351 12.354 1.00 1.00 H new ATOM 0 HG13 VAL A 88 4.993 -6.771 12.673 1.00 1.00 H new ATOM 0 HG21 VAL A 88 2.683 -7.915 14.398 1.00 1.00 H new ATOM 0 HG22 VAL A 88 2.422 -6.706 13.119 1.00 1.00 H new ATOM 0 HG23 VAL A 88 1.529 -8.244 13.084 1.00 1.00 H new ATOM 251 N GLY A 89 5.277 -8.699 9.652 1.00 1.00 N ATOM 252 CA GLY A 89 6.146 -9.507 8.813 1.00 1.00 C ATOM 253 C GLY A 89 6.985 -8.627 7.885 1.00 1.00 C ATOM 254 O GLY A 89 7.778 -7.808 8.349 1.00 1.00 O ATOM 0 H GLY A 89 5.607 -7.748 9.816 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.803 -10.111 9.439 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.546 -10.198 8.221 1.00 1.00 H new ATOM 258 N THR A 90 6.783 -8.826 6.590 1.00 1.00 N ATOM 259 CA THR A 90 7.511 -8.060 5.593 1.00 1.00 C ATOM 260 C THR A 90 6.537 -7.366 4.638 1.00 1.00 C ATOM 261 O THR A 90 5.345 -7.669 4.633 1.00 1.00 O ATOM 262 CB THR A 90 8.483 -9.008 4.887 1.00 1.00 C ATOM 263 OG1 THR A 90 9.271 -9.547 5.944 1.00 1.00 O ATOM 264 CG2 THR A 90 9.494 -8.263 4.011 1.00 1.00 C ATOM 0 H THR A 90 6.126 -9.507 6.209 1.00 1.00 H new ATOM 0 HA THR A 90 8.091 -7.260 6.054 1.00 1.00 H new ATOM 0 HB THR A 90 7.922 -9.714 4.275 1.00 1.00 H new ATOM 0 HG1 THR A 90 9.928 -10.174 5.575 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.160 -8.981 3.533 1.00 1.00 H new ATOM 0 HG22 THR A 90 8.964 -7.695 3.247 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.079 -7.582 4.629 1.00 1.00 H new ATOM 272 N PHE A 91 7.082 -6.448 3.854 1.00 1.00 N ATOM 273 CA PHE A 91 6.277 -5.707 2.896 1.00 1.00 C ATOM 274 C PHE A 91 7.037 -5.500 1.585 1.00 1.00 C ATOM 275 O PHE A 91 8.218 -5.154 1.595 1.00 1.00 O ATOM 276 CB PHE A 91 5.980 -4.344 3.521 1.00 1.00 C ATOM 277 CG PHE A 91 5.315 -3.352 2.565 1.00 1.00 C ATOM 278 CD1 PHE A 91 6.022 -2.831 1.527 1.00 1.00 C ATOM 279 CD2 PHE A 91 4.017 -2.991 2.753 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.405 -1.911 0.638 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.401 -2.071 1.865 1.00 1.00 C ATOM 282 CZ PHE A 91 4.108 -1.549 0.827 1.00 1.00 C ATOM 0 H PHE A 91 8.071 -6.200 3.862 1.00 1.00 H new ATOM 0 HA PHE A 91 5.364 -6.259 2.672 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.334 -4.486 4.387 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.912 -3.912 3.886 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.053 -3.117 1.378 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.455 -3.404 3.578 1.00 1.00 H new ATOM 0 HE1 PHE A 91 5.966 -1.499 -0.188 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.370 -1.785 2.014 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.639 -0.847 0.153 1.00 1.00 H new ATOM 291 N TYR A 92 6.330 -5.720 0.486 1.00 1.00 N ATOM 292 CA TYR A 92 6.923 -5.561 -0.831 1.00 1.00 C ATOM 293 C TYR A 92 6.072 -4.640 -1.707 1.00 1.00 C ATOM 294 O TYR A 92 4.869 -4.505 -1.488 1.00 1.00 O ATOM 295 CB TYR A 92 6.947 -6.959 -1.453 1.00 1.00 C ATOM 296 CG TYR A 92 7.993 -7.893 -0.843 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.326 -7.742 -1.166 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.604 -8.889 0.030 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.311 -8.621 -0.592 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.589 -9.768 0.604 1.00 1.00 C ATOM 301 CZ TYR A 92 9.894 -9.591 0.266 1.00 1.00 C ATOM 302 OH TYR A 92 10.824 -10.422 0.808 1.00 1.00 O ATOM 0 H TYR A 92 5.351 -6.007 0.481 1.00 1.00 H new ATOM 0 HA TYR A 92 7.917 -5.120 -0.755 1.00 1.00 H new ATOM 0 HB2 TYR A 92 5.962 -7.412 -1.342 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.137 -6.867 -2.522 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.631 -6.964 -1.850 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.561 -9.009 0.282 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.357 -8.513 -0.837 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.298 -10.551 1.288 1.00 1.00 H new ATOM 0 HH TYR A 92 10.382 -11.064 1.402 1.00 1.00 H new ATOM 311 N ARG A 93 6.730 -4.030 -2.682 1.00 1.00 N ATOM 312 CA ARG A 93 6.050 -3.126 -3.592 1.00 1.00 C ATOM 313 C ARG A 93 5.803 -3.812 -4.937 1.00 1.00 C ATOM 314 O ARG A 93 5.030 -3.320 -5.758 1.00 1.00 O ATOM 315 CB ARG A 93 6.869 -1.854 -3.821 1.00 1.00 C ATOM 316 CG ARG A 93 7.152 -1.139 -2.498 1.00 1.00 C ATOM 317 CD ARG A 93 6.045 -0.135 -2.169 1.00 1.00 C ATOM 318 NE ARG A 93 5.892 0.831 -3.279 1.00 1.00 N ATOM 319 CZ ARG A 93 6.803 1.778 -3.590 1.00 1.00 C ATOM 320 NH1 ARG A 93 7.942 1.894 -2.874 1.00 1.00 N ATOM 321 NH2 ARG A 93 6.563 2.589 -4.603 1.00 1.00 N ATOM 0 H ARG A 93 7.728 -4.145 -2.861 1.00 1.00 H new ATOM 0 HA ARG A 93 5.097 -2.855 -3.137 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.810 -2.106 -4.311 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.329 -1.185 -4.492 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.234 -1.872 -1.695 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.110 -0.623 -2.557 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.105 -0.660 -2.001 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.285 0.394 -1.246 1.00 1.00 H new ATOM 0 HE ARG A 93 5.045 0.778 -3.845 1.00 1.00 H new ATOM 0 HH11 ARG A 93 8.119 1.264 -2.092 1.00 1.00 H new ATOM 0 HH12 ARG A 93 8.625 2.612 -3.115 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.700 2.495 -5.138 1.00 1.00 H new ATOM 0 HH22 ARG A 93 7.241 3.310 -4.851 1.00 1.00 H new ATOM 330 N THR A 94 6.473 -4.940 -5.121 1.00 1.00 N ATOM 331 CA THR A 94 6.336 -5.700 -6.352 1.00 1.00 C ATOM 332 C THR A 94 6.056 -7.172 -6.042 1.00 1.00 C ATOM 333 O THR A 94 6.406 -7.661 -4.969 1.00 1.00 O ATOM 334 CB THR A 94 7.601 -5.484 -7.185 1.00 1.00 C ATOM 335 OG1 THR A 94 8.641 -6.047 -6.389 1.00 1.00 O ATOM 336 CG2 THR A 94 7.981 -4.006 -7.301 1.00 1.00 C ATOM 0 H THR A 94 7.113 -5.346 -4.438 1.00 1.00 H new ATOM 0 HA THR A 94 5.483 -5.356 -6.936 1.00 1.00 H new ATOM 0 HB THR A 94 7.454 -5.901 -8.181 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.039 -6.808 -6.861 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.885 -3.909 -7.902 1.00 1.00 H new ATOM 0 HG22 THR A 94 7.168 -3.458 -7.777 1.00 1.00 H new ATOM 0 HG23 THR A 94 8.161 -3.597 -6.307 1.00 1.00 H new ATOM 344 N PRO A 95 5.413 -7.854 -7.027 1.00 1.00 N ATOM 345 CA PRO A 95 5.083 -9.260 -6.870 1.00 1.00 C ATOM 346 C PRO A 95 6.328 -10.137 -7.028 1.00 1.00 C ATOM 347 O PRO A 95 6.367 -11.261 -6.530 1.00 1.00 O ATOM 348 CB PRO A 95 4.024 -9.537 -7.924 1.00 1.00 C ATOM 349 CG PRO A 95 4.136 -8.405 -8.933 1.00 1.00 C ATOM 350 CD PRO A 95 4.984 -7.307 -8.311 1.00 1.00 C ATOM 0 HA PRO A 95 4.705 -9.494 -5.875 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.190 -10.503 -8.401 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.029 -9.568 -7.480 1.00 1.00 H new ATOM 0 HG2 PRO A 95 4.591 -8.761 -9.857 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.148 -8.024 -9.191 1.00 1.00 H new ATOM 0 HD2 PRO A 95 5.838 -7.061 -8.942 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.410 -6.390 -8.179 1.00 1.00 H new ATOM 355 N SER A 96 7.314 -9.589 -7.722 1.00 1.00 N ATOM 356 CA SER A 96 8.556 -10.307 -7.952 1.00 1.00 C ATOM 357 C SER A 96 9.720 -9.320 -8.051 1.00 1.00 C ATOM 358 O SER A 96 9.517 -8.108 -7.993 1.00 1.00 O ATOM 359 CB SER A 96 8.474 -11.158 -9.221 1.00 1.00 C ATOM 360 OG SER A 96 8.770 -12.528 -8.966 1.00 1.00 O ATOM 0 H SER A 96 7.278 -8.656 -8.133 1.00 1.00 H new ATOM 0 HA SER A 96 8.725 -10.976 -7.108 1.00 1.00 H new ATOM 0 HB2 SER A 96 7.474 -11.077 -9.648 1.00 1.00 H new ATOM 0 HB3 SER A 96 9.170 -10.769 -9.964 1.00 1.00 H new ATOM 0 HG SER A 96 9.170 -12.931 -9.765 1.00 1.00 H new ATOM 365 N PRO A 97 10.946 -9.889 -8.200 1.00 1.00 N ATOM 366 CA PRO A 97 12.143 -9.073 -8.306 1.00 1.00 C ATOM 367 C PRO A 97 12.240 -8.419 -9.686 1.00 1.00 C ATOM 368 O PRO A 97 12.464 -7.214 -9.792 1.00 1.00 O ATOM 369 CB PRO A 97 13.294 -10.022 -8.016 1.00 1.00 C ATOM 370 CG PRO A 97 12.740 -11.423 -8.216 1.00 1.00 C ATOM 371 CD PRO A 97 11.224 -11.321 -8.272 1.00 1.00 C ATOM 0 HA PRO A 97 12.147 -8.239 -7.605 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.133 -9.835 -8.686 1.00 1.00 H new ATOM 0 HB3 PRO A 97 13.663 -9.889 -6.999 1.00 1.00 H new ATOM 0 HG2 PRO A 97 13.128 -11.859 -9.137 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.049 -12.076 -7.400 1.00 1.00 H new ATOM 0 HD2 PRO A 97 10.832 -11.755 -9.192 1.00 1.00 H new ATOM 0 HD3 PRO A 97 10.760 -11.857 -7.444 1.00 1.00 H new ATOM 376 N ASP A 98 12.066 -9.243 -10.709 1.00 1.00 N ATOM 377 CA ASP A 98 12.133 -8.760 -12.078 1.00 1.00 C ATOM 378 C ASP A 98 10.727 -8.384 -12.549 1.00 1.00 C ATOM 379 O ASP A 98 10.387 -8.576 -13.716 1.00 1.00 O ATOM 380 CB ASP A 98 12.672 -9.841 -13.018 1.00 1.00 C ATOM 381 CG ASP A 98 12.876 -9.394 -14.467 1.00 1.00 C ATOM 382 OD1 ASP A 98 13.772 -8.591 -14.768 1.00 1.00 O ATOM 383 OD2 ASP A 98 12.057 -9.914 -15.317 1.00 1.00 O ATOM 0 H ASP A 98 11.879 -10.241 -10.617 1.00 1.00 H new ATOM 0 HA ASP A 98 12.800 -7.898 -12.100 1.00 1.00 H new ATOM 0 HB2 ASP A 98 13.624 -10.200 -12.627 1.00 1.00 H new ATOM 0 HB3 ASP A 98 11.984 -10.686 -13.008 1.00 1.00 H new ATOM 388 N ALA A 99 9.946 -7.856 -11.618 1.00 1.00 N ATOM 389 CA ALA A 99 8.585 -7.450 -11.924 1.00 1.00 C ATOM 390 C ALA A 99 8.420 -5.960 -11.620 1.00 1.00 C ATOM 391 O ALA A 99 9.040 -5.439 -10.694 1.00 1.00 O ATOM 392 CB ALA A 99 7.604 -8.318 -11.132 1.00 1.00 C ATOM 0 H ALA A 99 10.230 -7.700 -10.651 1.00 1.00 H new ATOM 0 HA ALA A 99 8.370 -7.596 -12.983 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.583 -8.014 -11.361 1.00 1.00 H new ATOM 0 HB2 ALA A 99 7.741 -9.364 -11.405 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.789 -8.195 -10.065 1.00 1.00 H new ATOM 398 N LYS A 100 7.582 -5.315 -12.418 1.00 1.00 N ATOM 399 CA LYS A 100 7.329 -3.895 -12.247 1.00 1.00 C ATOM 400 C LYS A 100 6.665 -3.660 -10.888 1.00 1.00 C ATOM 401 O LYS A 100 6.219 -4.606 -10.239 1.00 1.00 O ATOM 402 CB LYS A 100 6.524 -3.348 -13.427 1.00 1.00 C ATOM 403 CG LYS A 100 6.962 -4.002 -14.740 1.00 1.00 C ATOM 404 CD LYS A 100 6.622 -3.112 -15.937 1.00 1.00 C ATOM 405 CE LYS A 100 5.170 -3.312 -16.374 1.00 1.00 C ATOM 406 NZ LYS A 100 4.747 -2.221 -17.281 1.00 1.00 N ATOM 0 H LYS A 100 7.069 -5.750 -13.185 1.00 1.00 H new ATOM 0 HA LYS A 100 8.266 -3.339 -12.245 1.00 1.00 H new ATOM 0 HB2 LYS A 100 5.462 -3.530 -13.263 1.00 1.00 H new ATOM 0 HB3 LYS A 100 6.656 -2.268 -13.493 1.00 1.00 H new ATOM 0 HG2 LYS A 100 8.035 -4.191 -14.716 1.00 1.00 H new ATOM 0 HG3 LYS A 100 6.471 -4.969 -14.850 1.00 1.00 H new ATOM 0 HD2 LYS A 100 6.786 -2.067 -15.676 1.00 1.00 H new ATOM 0 HD3 LYS A 100 7.290 -3.342 -16.767 1.00 1.00 H new ATOM 0 HE2 LYS A 100 5.065 -4.273 -16.877 1.00 1.00 H new ATOM 0 HE3 LYS A 100 4.521 -3.338 -15.499 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 3.759 -2.372 -17.568 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 4.829 -1.309 -16.788 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 5.356 -2.215 -18.124 1.00 1.00 H new ATOM 415 N ALA A 101 6.619 -2.394 -10.499 1.00 1.00 N ATOM 416 CA ALA A 101 6.016 -2.023 -9.230 1.00 1.00 C ATOM 417 C ALA A 101 4.492 -2.046 -9.367 1.00 1.00 C ATOM 418 O ALA A 101 3.945 -1.508 -10.329 1.00 1.00 O ATOM 419 CB ALA A 101 6.543 -0.654 -8.796 1.00 1.00 C ATOM 0 H ALA A 101 6.989 -1.613 -11.040 1.00 1.00 H new ATOM 0 HA ALA A 101 6.287 -2.738 -8.453 1.00 1.00 H new ATOM 0 HB1 ALA A 101 6.091 -0.375 -7.844 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.626 -0.700 -8.684 1.00 1.00 H new ATOM 0 HB3 ALA A 101 6.288 0.090 -9.551 1.00 1.00 H new ATOM 425 N PHE A 102 3.852 -2.674 -8.393 1.00 1.00 N ATOM 426 CA PHE A 102 2.402 -2.773 -8.393 1.00 1.00 C ATOM 427 C PHE A 102 1.759 -1.413 -8.671 1.00 1.00 C ATOM 428 O PHE A 102 0.801 -1.320 -9.438 1.00 1.00 O ATOM 429 CB PHE A 102 1.986 -3.245 -6.999 1.00 1.00 C ATOM 430 CG PHE A 102 1.863 -4.765 -6.867 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.867 -5.426 -7.516 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.749 -5.455 -6.100 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.753 -6.835 -7.394 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.636 -6.866 -5.979 1.00 1.00 C ATOM 435 CZ PHE A 102 1.640 -7.526 -6.628 1.00 1.00 C ATOM 0 H PHE A 102 4.310 -3.120 -7.598 1.00 1.00 H new ATOM 0 HA PHE A 102 2.077 -3.464 -9.171 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.715 -2.885 -6.272 1.00 1.00 H new ATOM 0 HB3 PHE A 102 1.029 -2.790 -6.743 1.00 1.00 H new ATOM 0 HD1 PHE A 102 0.163 -4.878 -8.124 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.539 -4.930 -5.583 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.038 -7.359 -7.909 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.341 -7.414 -5.372 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.553 -8.599 -6.535 1.00 1.00 H new ATOM 444 N ILE A 103 2.311 -0.392 -8.032 1.00 1.00 N ATOM 445 CA ILE A 103 1.803 0.959 -8.201 1.00 1.00 C ATOM 446 C ILE A 103 2.979 1.930 -8.316 1.00 1.00 C ATOM 447 O ILE A 103 3.799 2.029 -7.403 1.00 1.00 O ATOM 448 CB ILE A 103 0.825 1.307 -7.078 1.00 1.00 C ATOM 449 CG1 ILE A 103 -0.161 0.162 -6.834 1.00 1.00 C ATOM 450 CG2 ILE A 103 0.108 2.629 -7.365 1.00 1.00 C ATOM 451 CD1 ILE A 103 0.313 -0.733 -5.687 1.00 1.00 C ATOM 0 H ILE A 103 3.105 -0.473 -7.397 1.00 1.00 H new ATOM 0 HA ILE A 103 1.232 1.039 -9.126 1.00 1.00 H new ATOM 0 HB ILE A 103 1.395 1.442 -6.159 1.00 1.00 H new ATOM 0 HG12 ILE A 103 -1.145 0.568 -6.601 1.00 1.00 H new ATOM 0 HG13 ILE A 103 -0.268 -0.431 -7.742 1.00 1.00 H new ATOM 0 HG21 ILE A 103 -0.582 2.853 -6.551 1.00 1.00 H new ATOM 0 HG22 ILE A 103 0.842 3.430 -7.450 1.00 1.00 H new ATOM 0 HG23 ILE A 103 -0.448 2.546 -8.299 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -0.405 -1.539 -5.534 1.00 1.00 H new ATOM 0 HD12 ILE A 103 1.286 -1.156 -5.934 1.00 1.00 H new ATOM 0 HD13 ILE A 103 0.396 -0.142 -4.775 1.00 1.00 H new ATOM 462 N GLU A 104 3.025 2.624 -9.443 1.00 1.00 N ATOM 463 CA GLU A 104 4.087 3.584 -9.689 1.00 1.00 C ATOM 464 C GLU A 104 3.717 4.947 -9.100 1.00 1.00 C ATOM 465 O GLU A 104 2.738 5.564 -9.519 1.00 1.00 O ATOM 466 CB GLU A 104 4.390 3.697 -11.185 1.00 1.00 C ATOM 467 CG GLU A 104 5.762 4.331 -11.420 1.00 1.00 C ATOM 468 CD GLU A 104 6.871 3.490 -10.785 1.00 1.00 C ATOM 469 OE1 GLU A 104 7.153 2.379 -11.257 1.00 1.00 O ATOM 470 OE2 GLU A 104 7.450 4.031 -9.767 1.00 1.00 O ATOM 0 H GLU A 104 2.343 2.540 -10.197 1.00 1.00 H new ATOM 0 HA GLU A 104 4.992 3.230 -9.195 1.00 1.00 H new ATOM 0 HB2 GLU A 104 4.360 2.708 -11.642 1.00 1.00 H new ATOM 0 HB3 GLU A 104 3.620 4.296 -11.671 1.00 1.00 H new ATOM 0 HG2 GLU A 104 5.943 4.429 -12.490 1.00 1.00 H new ATOM 0 HG3 GLU A 104 5.778 5.337 -11.001 1.00 1.00 H new ATOM 476 N VAL A 105 4.520 5.379 -8.138 1.00 1.00 N ATOM 477 CA VAL A 105 4.289 6.657 -7.488 1.00 1.00 C ATOM 478 C VAL A 105 3.848 7.684 -8.534 1.00 1.00 C ATOM 479 O VAL A 105 4.605 8.009 -9.447 1.00 1.00 O ATOM 480 CB VAL A 105 5.539 7.087 -6.719 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.392 8.512 -6.184 1.00 1.00 C ATOM 482 CG2 VAL A 105 5.850 6.105 -5.587 1.00 1.00 C ATOM 0 H VAL A 105 5.331 4.866 -7.793 1.00 1.00 H new ATOM 0 HA VAL A 105 3.486 6.573 -6.756 1.00 1.00 H new ATOM 0 HB VAL A 105 6.379 7.076 -7.413 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.295 8.792 -5.641 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.241 9.199 -7.016 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.535 8.562 -5.512 1.00 1.00 H new ATOM 0 HG21 VAL A 105 6.743 6.433 -5.056 1.00 1.00 H new ATOM 0 HG22 VAL A 105 5.009 6.069 -4.895 1.00 1.00 H new ATOM 0 HG23 VAL A 105 6.020 5.112 -6.003 1.00 1.00 H new ATOM 492 N GLY A 106 2.625 8.165 -8.365 1.00 1.00 N ATOM 493 CA GLY A 106 2.075 9.148 -9.283 1.00 1.00 C ATOM 494 C GLY A 106 0.857 8.588 -10.021 1.00 1.00 C ATOM 495 O GLY A 106 0.315 9.238 -10.914 1.00 1.00 O ATOM 0 H GLY A 106 2.000 7.893 -7.607 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.791 10.045 -8.733 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.837 9.444 -10.004 1.00 1.00 H new ATOM 499 N GLN A 107 0.464 7.387 -9.622 1.00 1.00 N ATOM 500 CA GLN A 107 -0.678 6.732 -10.235 1.00 1.00 C ATOM 501 C GLN A 107 -1.827 6.618 -9.230 1.00 1.00 C ATOM 502 O GLN A 107 -1.650 6.901 -8.046 1.00 1.00 O ATOM 503 CB GLN A 107 -0.293 5.357 -10.785 1.00 1.00 C ATOM 504 CG GLN A 107 -1.349 4.842 -11.764 1.00 1.00 C ATOM 505 CD GLN A 107 -0.716 3.959 -12.841 1.00 1.00 C ATOM 506 OE1 GLN A 107 -0.679 4.294 -14.014 1.00 1.00 O ATOM 507 NE2 GLN A 107 -0.219 2.815 -12.378 1.00 1.00 N ATOM 0 H GLN A 107 0.917 6.851 -8.882 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.013 7.341 -11.074 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.673 5.420 -11.286 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.180 4.651 -9.962 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -2.106 4.275 -11.222 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -1.857 5.685 -12.232 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -0.283 2.596 -11.384 1.00 1.00 H new ATOM 0 HE22 GLN A 107 0.226 2.157 -13.017 1.00 1.00 H new ATOM 514 N LYS A 108 -2.978 6.203 -9.740 1.00 1.00 N ATOM 515 CA LYS A 108 -4.154 6.048 -8.901 1.00 1.00 C ATOM 516 C LYS A 108 -4.493 4.561 -8.777 1.00 1.00 C ATOM 517 O LYS A 108 -3.990 3.739 -9.541 1.00 1.00 O ATOM 518 CB LYS A 108 -5.308 6.900 -9.434 1.00 1.00 C ATOM 519 CG LYS A 108 -4.812 8.276 -9.880 1.00 1.00 C ATOM 520 CD LYS A 108 -4.499 8.290 -11.378 1.00 1.00 C ATOM 521 CE LYS A 108 -5.635 8.940 -12.169 1.00 1.00 C ATOM 522 NZ LYS A 108 -5.678 10.397 -11.912 1.00 1.00 N ATOM 0 H LYS A 108 -3.121 5.970 -10.723 1.00 1.00 H new ATOM 0 HA LYS A 108 -3.956 6.416 -7.894 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -5.783 6.391 -10.273 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -6.067 7.016 -8.660 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -5.568 9.029 -9.656 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -3.919 8.544 -9.316 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -3.571 8.834 -11.554 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -4.343 7.270 -11.730 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -5.496 8.757 -13.234 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -6.586 8.487 -11.889 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -6.156 10.875 -12.703 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -6.200 10.579 -11.031 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -4.708 10.762 -11.821 1.00 1.00 H new ATOM 531 N VAL A 109 -5.346 4.261 -7.808 1.00 1.00 N ATOM 532 CA VAL A 109 -5.759 2.888 -7.574 1.00 1.00 C ATOM 533 C VAL A 109 -7.247 2.861 -7.218 1.00 1.00 C ATOM 534 O VAL A 109 -7.721 3.700 -6.455 1.00 1.00 O ATOM 535 CB VAL A 109 -4.876 2.252 -6.498 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.403 2.284 -6.909 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.083 2.936 -5.144 1.00 1.00 C ATOM 0 H VAL A 109 -5.762 4.945 -7.176 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.629 2.291 -8.477 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.172 1.208 -6.395 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.797 1.826 -6.127 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.273 1.731 -7.839 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.088 3.317 -7.054 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.444 2.465 -4.397 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.827 3.992 -5.227 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.126 2.838 -4.843 1.00 1.00 H new ATOM 547 N ASN A 110 -7.941 1.887 -7.789 1.00 1.00 N ATOM 548 CA ASN A 110 -9.365 1.740 -7.542 1.00 1.00 C ATOM 549 C ASN A 110 -9.630 0.372 -6.910 1.00 1.00 C ATOM 550 O ASN A 110 -8.893 -0.582 -7.155 1.00 1.00 O ATOM 551 CB ASN A 110 -10.161 1.820 -8.846 1.00 1.00 C ATOM 552 CG ASN A 110 -11.577 2.344 -8.592 1.00 1.00 C ATOM 553 OD1 ASN A 110 -12.541 1.598 -8.531 1.00 1.00 O ATOM 554 ND2 ASN A 110 -11.648 3.664 -8.450 1.00 1.00 N ATOM 0 H ASN A 110 -7.544 1.192 -8.422 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.677 2.546 -6.878 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -9.648 2.475 -9.550 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -10.211 0.833 -9.307 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -12.549 4.111 -8.279 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -10.802 4.230 -8.512 1.00 1.00 H new ATOM 560 N VAL A 111 -10.684 0.319 -6.110 1.00 1.00 N ATOM 561 CA VAL A 111 -11.056 -0.916 -5.441 1.00 1.00 C ATOM 562 C VAL A 111 -10.871 -2.089 -6.406 1.00 1.00 C ATOM 563 O VAL A 111 -11.627 -2.232 -7.366 1.00 1.00 O ATOM 564 CB VAL A 111 -12.481 -0.808 -4.896 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.511 -1.080 -5.996 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.688 -1.751 -3.708 1.00 1.00 C ATOM 0 H VAL A 111 -11.293 1.112 -5.910 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.408 -1.096 -4.583 1.00 1.00 H new ATOM 0 HB VAL A 111 -12.627 0.213 -4.543 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.516 -0.997 -5.582 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.388 -0.352 -6.798 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -13.364 -2.085 -6.392 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.709 -1.654 -3.340 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -12.513 -2.779 -4.025 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -11.990 -1.492 -2.912 1.00 1.00 H new ATOM 576 N GLY A 112 -9.863 -2.898 -6.118 1.00 1.00 N ATOM 577 CA GLY A 112 -9.570 -4.054 -6.949 1.00 1.00 C ATOM 578 C GLY A 112 -8.115 -4.033 -7.423 1.00 1.00 C ATOM 579 O GLY A 112 -7.573 -5.065 -7.816 1.00 1.00 O ATOM 0 H GLY A 112 -9.238 -2.776 -5.321 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.760 -4.968 -6.387 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.237 -4.065 -7.811 1.00 1.00 H new ATOM 583 N ASP A 113 -7.526 -2.849 -7.370 1.00 1.00 N ATOM 584 CA ASP A 113 -6.144 -2.681 -7.788 1.00 1.00 C ATOM 585 C ASP A 113 -5.217 -2.998 -6.614 1.00 1.00 C ATOM 586 O ASP A 113 -5.468 -2.572 -5.487 1.00 1.00 O ATOM 587 CB ASP A 113 -5.874 -1.240 -8.228 1.00 1.00 C ATOM 588 CG ASP A 113 -5.851 -1.019 -9.742 1.00 1.00 C ATOM 589 OD1 ASP A 113 -4.808 -0.681 -10.322 1.00 1.00 O ATOM 590 OD2 ASP A 113 -6.978 -1.212 -10.338 1.00 1.00 O ATOM 0 H ASP A 113 -7.980 -1.996 -7.044 1.00 1.00 H new ATOM 0 HA ASP A 113 -5.961 -3.355 -8.625 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.637 -0.594 -7.793 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -4.916 -0.924 -7.815 1.00 1.00 H new ATOM 595 N THR A 114 -4.165 -3.745 -6.917 1.00 1.00 N ATOM 596 CA THR A 114 -3.200 -4.125 -5.900 1.00 1.00 C ATOM 597 C THR A 114 -2.548 -2.882 -5.292 1.00 1.00 C ATOM 598 O THR A 114 -2.494 -1.830 -5.929 1.00 1.00 O ATOM 599 CB THR A 114 -2.195 -5.087 -6.538 1.00 1.00 C ATOM 600 OG1 THR A 114 -2.986 -6.207 -6.927 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.208 -5.663 -5.520 1.00 1.00 C ATOM 0 H THR A 114 -3.960 -4.097 -7.852 1.00 1.00 H new ATOM 0 HA THR A 114 -3.683 -4.639 -5.069 1.00 1.00 H new ATOM 0 HB THR A 114 -1.645 -4.569 -7.323 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.414 -6.880 -7.352 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.518 -6.339 -6.025 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.647 -4.851 -5.057 1.00 1.00 H new ATOM 0 HG23 THR A 114 -1.755 -6.210 -4.752 1.00 1.00 H new ATOM 609 N LEU A 115 -2.070 -3.043 -4.067 1.00 1.00 N ATOM 610 CA LEU A 115 -1.423 -1.946 -3.365 1.00 1.00 C ATOM 611 C LEU A 115 0.015 -2.340 -3.027 1.00 1.00 C ATOM 612 O LEU A 115 0.931 -1.528 -3.151 1.00 1.00 O ATOM 613 CB LEU A 115 -2.250 -1.529 -2.147 1.00 1.00 C ATOM 614 CG LEU A 115 -2.476 -0.025 -1.974 1.00 1.00 C ATOM 615 CD1 LEU A 115 -3.237 0.556 -3.168 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.176 0.274 -0.647 1.00 1.00 C ATOM 0 H LEU A 115 -2.117 -3.916 -3.542 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.370 -1.064 -4.003 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -3.222 -2.018 -2.208 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -1.758 -1.908 -1.251 1.00 1.00 H new ATOM 0 HG LEU A 115 -1.503 0.466 -1.943 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -3.384 1.626 -3.020 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -2.663 0.392 -4.080 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -4.206 0.065 -3.256 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.325 1.349 -0.548 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -4.142 -0.230 -0.624 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -2.560 -0.084 0.178 1.00 1.00 H new ATOM 627 N CYS A 116 0.170 -3.587 -2.606 1.00 1.00 N ATOM 628 CA CYS A 116 1.482 -4.098 -2.249 1.00 1.00 C ATOM 629 C CYS A 116 1.316 -5.530 -1.735 1.00 1.00 C ATOM 630 O CYS A 116 0.224 -6.093 -1.798 1.00 1.00 O ATOM 631 CB CYS A 116 2.179 -3.203 -1.223 1.00 1.00 C ATOM 632 SG CYS A 116 0.957 -2.559 -0.021 1.00 1.00 S ATOM 0 H CYS A 116 -0.591 -4.258 -2.504 1.00 1.00 H new ATOM 0 HA CYS A 116 2.125 -4.099 -3.129 1.00 1.00 H new ATOM 0 HB2 CYS A 116 2.952 -3.767 -0.701 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.676 -2.375 -1.728 1.00 1.00 H new ATOM 0 HG CYS A 116 1.469 -2.584 1.174 1.00 1.00 H new ATOM 637 N ILE A 117 2.416 -6.078 -1.238 1.00 1.00 N ATOM 638 CA ILE A 117 2.405 -7.434 -0.715 1.00 1.00 C ATOM 639 C ILE A 117 3.004 -7.436 0.694 1.00 1.00 C ATOM 640 O ILE A 117 3.746 -6.525 1.058 1.00 1.00 O ATOM 641 CB ILE A 117 3.107 -8.387 -1.682 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.477 -8.318 -3.075 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.123 -9.814 -1.131 1.00 1.00 C ATOM 644 CD1 ILE A 117 3.077 -9.377 -4.002 1.00 1.00 C ATOM 0 H ILE A 117 3.320 -5.608 -1.187 1.00 1.00 H new ATOM 0 HA ILE A 117 1.382 -7.801 -0.629 1.00 1.00 H new ATOM 0 HB ILE A 117 4.145 -8.068 -1.782 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.400 -8.465 -2.998 1.00 1.00 H new ATOM 0 HG13 ILE A 117 2.634 -7.327 -3.500 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.628 -10.472 -1.838 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.653 -9.830 -0.178 1.00 1.00 H new ATOM 0 HG23 ILE A 117 2.099 -10.158 -0.983 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.612 -9.306 -4.985 1.00 1.00 H new ATOM 0 HD12 ILE A 117 4.150 -9.212 -4.096 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.897 -10.368 -3.586 1.00 1.00 H new ATOM 655 N VAL A 118 2.658 -8.469 1.448 1.00 1.00 N ATOM 656 CA VAL A 118 3.152 -8.601 2.807 1.00 1.00 C ATOM 657 C VAL A 118 3.504 -10.065 3.077 1.00 1.00 C ATOM 658 O VAL A 118 2.719 -10.963 2.776 1.00 1.00 O ATOM 659 CB VAL A 118 2.123 -8.044 3.794 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.426 -8.507 5.221 1.00 1.00 C ATOM 661 CG2 VAL A 118 2.061 -6.517 3.716 1.00 1.00 C ATOM 0 H VAL A 118 2.041 -9.222 1.143 1.00 1.00 H new ATOM 0 HA VAL A 118 4.062 -8.017 2.940 1.00 1.00 H new ATOM 0 HB VAL A 118 1.145 -8.435 3.515 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.680 -8.097 5.902 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.398 -9.596 5.264 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.416 -8.158 5.514 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.323 -6.146 4.427 1.00 1.00 H new ATOM 0 HG22 VAL A 118 3.039 -6.100 3.958 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.777 -6.215 2.708 1.00 1.00 H new ATOM 671 N GLU A 119 4.687 -10.262 3.640 1.00 1.00 N ATOM 672 CA GLU A 119 5.154 -11.601 3.953 1.00 1.00 C ATOM 673 C GLU A 119 4.806 -11.960 5.399 1.00 1.00 C ATOM 674 O GLU A 119 5.074 -11.185 6.317 1.00 1.00 O ATOM 675 CB GLU A 119 6.658 -11.731 3.703 1.00 1.00 C ATOM 676 CG GLU A 119 7.001 -13.102 3.119 1.00 1.00 C ATOM 677 CD GLU A 119 8.333 -13.060 2.367 1.00 1.00 C ATOM 678 OE1 GLU A 119 9.347 -12.616 2.925 1.00 1.00 O ATOM 679 OE2 GLU A 119 8.291 -13.512 1.159 1.00 1.00 O ATOM 0 H GLU A 119 5.336 -9.515 3.888 1.00 1.00 H new ATOM 0 HA GLU A 119 4.647 -12.304 3.292 1.00 1.00 H new ATOM 0 HB2 GLU A 119 6.985 -10.948 3.019 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.199 -11.584 4.638 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.055 -13.839 3.920 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.208 -13.422 2.443 1.00 1.00 H new ATOM 685 N ALA A 120 4.216 -13.136 5.559 1.00 1.00 N ATOM 686 CA ALA A 120 3.829 -13.607 6.877 1.00 1.00 C ATOM 687 C ALA A 120 3.771 -15.137 6.871 1.00 1.00 C ATOM 688 O ALA A 120 3.487 -15.746 5.842 1.00 1.00 O ATOM 689 CB ALA A 120 2.493 -12.975 7.273 1.00 1.00 C ATOM 0 H ALA A 120 3.997 -13.777 4.796 1.00 1.00 H new ATOM 0 HA ALA A 120 4.565 -13.308 7.623 1.00 1.00 H new ATOM 0 HB1 ALA A 120 2.202 -13.328 8.262 1.00 1.00 H new ATOM 0 HB2 ALA A 120 2.595 -11.890 7.291 1.00 1.00 H new ATOM 0 HB3 ALA A 120 1.729 -13.256 6.548 1.00 1.00 H new ATOM 695 N MET A 121 4.046 -15.712 8.033 1.00 1.00 N ATOM 696 CA MET A 121 4.029 -17.157 8.174 1.00 1.00 C ATOM 697 C MET A 121 4.923 -17.821 7.125 1.00 1.00 C ATOM 698 O MET A 121 4.779 -19.011 6.845 1.00 1.00 O ATOM 699 CB MET A 121 2.595 -17.668 8.021 1.00 1.00 C ATOM 700 CG MET A 121 1.824 -17.538 9.336 1.00 1.00 C ATOM 701 SD MET A 121 1.585 -19.149 10.067 1.00 1.00 S ATOM 702 CE MET A 121 1.040 -18.672 11.698 1.00 1.00 C ATOM 0 H MET A 121 4.282 -15.203 8.885 1.00 1.00 H new ATOM 0 HA MET A 121 4.411 -17.411 9.163 1.00 1.00 H new ATOM 0 HB2 MET A 121 2.086 -17.104 7.239 1.00 1.00 H new ATOM 0 HB3 MET A 121 2.608 -18.711 7.705 1.00 1.00 H new ATOM 0 HG2 MET A 121 2.371 -16.895 10.025 1.00 1.00 H new ATOM 0 HG3 MET A 121 0.859 -17.065 9.156 1.00 1.00 H new ATOM 0 HE1 MET A 121 0.845 -19.565 12.292 1.00 1.00 H new ATOM 0 HE2 MET A 121 1.815 -18.077 12.181 1.00 1.00 H new ATOM 0 HE3 MET A 121 0.127 -18.082 11.618 1.00 1.00 H new ATOM 710 N LYS A 122 5.826 -17.024 6.573 1.00 1.00 N ATOM 711 CA LYS A 122 6.743 -17.520 5.561 1.00 1.00 C ATOM 712 C LYS A 122 5.984 -17.725 4.248 1.00 1.00 C ATOM 713 O LYS A 122 6.196 -18.718 3.554 1.00 1.00 O ATOM 714 CB LYS A 122 7.463 -18.776 6.058 1.00 1.00 C ATOM 715 CG LYS A 122 8.947 -18.740 5.688 1.00 1.00 C ATOM 716 CD LYS A 122 9.335 -19.967 4.862 1.00 1.00 C ATOM 717 CE LYS A 122 10.060 -21.002 5.726 1.00 1.00 C ATOM 718 NZ LYS A 122 9.227 -22.214 5.891 1.00 1.00 N ATOM 0 H LYS A 122 5.942 -16.038 6.807 1.00 1.00 H new ATOM 0 HA LYS A 122 7.527 -16.788 5.366 1.00 1.00 H new ATOM 0 HB2 LYS A 122 7.356 -18.857 7.140 1.00 1.00 H new ATOM 0 HB3 LYS A 122 6.998 -19.662 5.625 1.00 1.00 H new ATOM 0 HG2 LYS A 122 9.163 -17.833 5.123 1.00 1.00 H new ATOM 0 HG3 LYS A 122 9.551 -18.702 6.595 1.00 1.00 H new ATOM 0 HD2 LYS A 122 8.442 -20.414 4.426 1.00 1.00 H new ATOM 0 HD3 LYS A 122 9.977 -19.665 4.034 1.00 1.00 H new ATOM 0 HE2 LYS A 122 11.011 -21.267 5.265 1.00 1.00 H new ATOM 0 HE3 LYS A 122 10.288 -20.574 6.702 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 9.733 -22.906 6.480 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 8.330 -21.959 6.351 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 9.031 -22.630 4.958 1.00 1.00 H new ATOM 727 N MET A 123 5.116 -16.770 3.949 1.00 1.00 N ATOM 728 CA MET A 123 4.325 -16.834 2.732 1.00 1.00 C ATOM 729 C MET A 123 3.957 -15.431 2.242 1.00 1.00 C ATOM 730 O MET A 123 3.752 -14.524 3.047 1.00 1.00 O ATOM 731 CB MET A 123 3.047 -17.634 2.994 1.00 1.00 C ATOM 732 CG MET A 123 3.084 -18.980 2.267 1.00 1.00 C ATOM 733 SD MET A 123 3.095 -18.720 0.501 1.00 1.00 S ATOM 734 CE MET A 123 4.724 -19.336 0.108 1.00 1.00 C ATOM 0 H MET A 123 4.943 -15.948 4.528 1.00 1.00 H new ATOM 0 HA MET A 123 4.919 -17.324 1.961 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.930 -17.798 4.065 1.00 1.00 H new ATOM 0 HB3 MET A 123 2.181 -17.061 2.663 1.00 1.00 H new ATOM 0 HG2 MET A 123 3.970 -19.540 2.566 1.00 1.00 H new ATOM 0 HG3 MET A 123 2.218 -19.579 2.549 1.00 1.00 H new ATOM 0 HE1 MET A 123 4.715 -19.778 -0.888 1.00 1.00 H new ATOM 0 HE2 MET A 123 5.440 -18.514 0.134 1.00 1.00 H new ATOM 0 HE3 MET A 123 5.013 -20.092 0.838 1.00 1.00 H new ATOM 742 N MET A 124 3.886 -15.298 0.926 1.00 1.00 N ATOM 743 CA MET A 124 3.548 -14.022 0.320 1.00 1.00 C ATOM 744 C MET A 124 2.033 -13.803 0.313 1.00 1.00 C ATOM 745 O MET A 124 1.277 -14.689 -0.080 1.00 1.00 O ATOM 746 CB MET A 124 4.077 -13.982 -1.116 1.00 1.00 C ATOM 747 CG MET A 124 5.163 -12.916 -1.270 1.00 1.00 C ATOM 748 SD MET A 124 5.434 -12.566 -2.998 1.00 1.00 S ATOM 749 CE MET A 124 6.540 -13.902 -3.416 1.00 1.00 C ATOM 0 H MET A 124 4.057 -16.053 0.262 1.00 1.00 H new ATOM 0 HA MET A 124 4.008 -13.228 0.908 1.00 1.00 H new ATOM 0 HB2 MET A 124 4.480 -14.958 -1.386 1.00 1.00 H new ATOM 0 HB3 MET A 124 3.257 -13.773 -1.804 1.00 1.00 H new ATOM 0 HG2 MET A 124 4.867 -12.006 -0.748 1.00 1.00 H new ATOM 0 HG3 MET A 124 6.090 -13.260 -0.811 1.00 1.00 H new ATOM 0 HE1 MET A 124 6.811 -13.834 -4.469 1.00 1.00 H new ATOM 0 HE2 MET A 124 7.440 -13.834 -2.804 1.00 1.00 H new ATOM 0 HE3 MET A 124 6.046 -14.855 -3.230 1.00 1.00 H new ATOM 757 N ASN A 125 1.637 -12.618 0.753 1.00 1.00 N ATOM 758 CA ASN A 125 0.227 -12.271 0.802 1.00 1.00 C ATOM 759 C ASN A 125 0.023 -10.890 0.177 1.00 1.00 C ATOM 760 O ASN A 125 0.432 -9.880 0.749 1.00 1.00 O ATOM 761 CB ASN A 125 -0.277 -12.217 2.245 1.00 1.00 C ATOM 762 CG ASN A 125 -0.043 -13.550 2.959 1.00 1.00 C ATOM 763 OD1 ASN A 125 -0.742 -14.527 2.747 1.00 1.00 O ATOM 764 ND2 ASN A 125 0.976 -13.535 3.813 1.00 1.00 N ATOM 0 H ASN A 125 2.268 -11.886 1.079 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.327 -13.034 0.255 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.234 -11.418 2.783 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.340 -11.978 2.254 1.00 1.00 H new ATOM 0 HD21 ASN A 125 1.213 -14.376 4.339 1.00 1.00 H new ATOM 0 HD22 ASN A 125 1.520 -12.682 3.943 1.00 1.00 H new ATOM 770 N GLN A 126 -0.608 -10.889 -0.987 1.00 1.00 N ATOM 771 CA GLN A 126 -0.870 -9.648 -1.696 1.00 1.00 C ATOM 772 C GLN A 126 -1.989 -8.868 -1.003 1.00 1.00 C ATOM 773 O GLN A 126 -2.832 -9.453 -0.323 1.00 1.00 O ATOM 774 CB GLN A 126 -1.216 -9.916 -3.162 1.00 1.00 C ATOM 775 CG GLN A 126 0.046 -10.186 -3.983 1.00 1.00 C ATOM 776 CD GLN A 126 -0.189 -11.307 -4.997 1.00 1.00 C ATOM 777 OE1 GLN A 126 -1.201 -11.990 -4.983 1.00 1.00 O ATOM 778 NE2 GLN A 126 0.799 -11.458 -5.875 1.00 1.00 N ATOM 0 H GLN A 126 -0.946 -11.728 -1.458 1.00 1.00 H new ATOM 0 HA GLN A 126 0.036 -9.042 -1.676 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -1.888 -10.771 -3.230 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -1.747 -9.059 -3.576 1.00 1.00 H new ATOM 0 HG2 GLN A 126 0.347 -9.277 -4.504 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.866 -10.458 -3.318 1.00 1.00 H new ATOM 0 HE21 GLN A 126 1.618 -10.852 -5.830 1.00 1.00 H new ATOM 0 HE22 GLN A 126 0.737 -12.180 -6.593 1.00 1.00 H new ATOM 785 N ILE A 127 -1.961 -7.557 -1.197 1.00 1.00 N ATOM 786 CA ILE A 127 -2.963 -6.690 -0.599 1.00 1.00 C ATOM 787 C ILE A 127 -3.695 -5.926 -1.704 1.00 1.00 C ATOM 788 O ILE A 127 -3.088 -5.133 -2.421 1.00 1.00 O ATOM 789 CB ILE A 127 -2.326 -5.785 0.457 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.276 -6.545 1.270 1.00 1.00 C ATOM 791 CG2 ILE A 127 -3.392 -5.149 1.349 1.00 1.00 C ATOM 792 CD1 ILE A 127 -0.974 -5.824 2.585 1.00 1.00 C ATOM 0 H ILE A 127 -1.260 -7.074 -1.760 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.711 -7.280 -0.070 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.810 -4.973 -0.056 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -1.632 -7.554 1.478 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.361 -6.644 0.687 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.912 -4.511 2.091 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -4.068 -4.551 0.738 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.957 -5.932 1.855 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -0.225 -6.385 3.144 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.595 -4.824 2.373 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -1.886 -5.749 3.176 1.00 1.00 H new ATOM 803 N GLU A 128 -4.989 -6.192 -1.805 1.00 1.00 N ATOM 804 CA GLU A 128 -5.810 -5.539 -2.810 1.00 1.00 C ATOM 805 C GLU A 128 -6.462 -4.282 -2.229 1.00 1.00 C ATOM 806 O GLU A 128 -7.077 -4.333 -1.165 1.00 1.00 O ATOM 807 CB GLU A 128 -6.867 -6.498 -3.363 1.00 1.00 C ATOM 808 CG GLU A 128 -7.539 -5.915 -4.608 1.00 1.00 C ATOM 809 CD GLU A 128 -8.864 -6.623 -4.897 1.00 1.00 C ATOM 810 OE1 GLU A 128 -9.861 -6.382 -4.199 1.00 1.00 O ATOM 811 OE2 GLU A 128 -8.837 -7.448 -5.888 1.00 1.00 O ATOM 0 H GLU A 128 -5.489 -6.851 -1.208 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.167 -5.242 -3.638 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.403 -7.453 -3.609 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.619 -6.696 -2.599 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -7.716 -4.849 -4.465 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.874 -6.016 -5.466 1.00 1.00 H new ATOM 817 N ALA A 129 -6.304 -3.184 -2.952 1.00 1.00 N ATOM 818 CA ALA A 129 -6.868 -1.916 -2.522 1.00 1.00 C ATOM 819 C ALA A 129 -8.332 -2.123 -2.127 1.00 1.00 C ATOM 820 O ALA A 129 -9.091 -2.760 -2.856 1.00 1.00 O ATOM 821 CB ALA A 129 -6.706 -0.879 -3.636 1.00 1.00 C ATOM 0 H ALA A 129 -5.793 -3.146 -3.834 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.339 -1.538 -1.647 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -7.129 0.072 -3.312 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.647 -0.747 -3.859 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.226 -1.222 -4.531 1.00 1.00 H new ATOM 827 N ASP A 130 -8.685 -1.572 -0.975 1.00 1.00 N ATOM 828 CA ASP A 130 -10.043 -1.689 -0.474 1.00 1.00 C ATOM 829 C ASP A 130 -10.633 -0.290 -0.283 1.00 1.00 C ATOM 830 O ASP A 130 -11.627 -0.122 0.423 1.00 1.00 O ATOM 831 CB ASP A 130 -10.073 -2.401 0.879 1.00 1.00 C ATOM 832 CG ASP A 130 -11.471 -2.739 1.402 1.00 1.00 C ATOM 833 OD1 ASP A 130 -11.917 -2.200 2.426 1.00 1.00 O ATOM 834 OD2 ASP A 130 -12.120 -3.607 0.702 1.00 1.00 O ATOM 0 H ASP A 130 -8.053 -1.043 -0.374 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.620 -2.265 -1.197 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -9.498 -3.324 0.800 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -9.569 -1.774 1.614 1.00 1.00 H new ATOM 839 N LYS A 131 -9.997 0.679 -0.925 1.00 1.00 N ATOM 840 CA LYS A 131 -10.446 2.058 -0.835 1.00 1.00 C ATOM 841 C LYS A 131 -9.714 2.898 -1.884 1.00 1.00 C ATOM 842 O LYS A 131 -8.663 3.471 -1.602 1.00 1.00 O ATOM 843 CB LYS A 131 -10.284 2.582 0.594 1.00 1.00 C ATOM 844 CG LYS A 131 -11.566 3.266 1.075 1.00 1.00 C ATOM 845 CD LYS A 131 -11.258 4.622 1.711 1.00 1.00 C ATOM 846 CE LYS A 131 -12.529 5.268 2.267 1.00 1.00 C ATOM 847 NZ LYS A 131 -12.980 4.559 3.486 1.00 1.00 N ATOM 0 H LYS A 131 -9.174 0.536 -1.510 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.511 2.127 -1.057 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -10.035 1.757 1.262 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -9.454 3.287 0.635 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -12.248 3.401 0.235 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -12.074 2.628 1.798 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -10.530 4.495 2.512 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -10.805 5.281 0.970 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -12.340 6.316 2.498 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -13.316 5.244 1.513 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -13.725 5.113 3.954 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -13.355 3.625 3.225 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -12.177 4.441 4.136 1.00 1.00 H new ATOM 856 N SER A 132 -10.298 2.943 -3.072 1.00 1.00 N ATOM 857 CA SER A 132 -9.715 3.703 -4.164 1.00 1.00 C ATOM 858 C SER A 132 -9.133 5.016 -3.636 1.00 1.00 C ATOM 859 O SER A 132 -9.754 5.689 -2.815 1.00 1.00 O ATOM 860 CB SER A 132 -10.751 3.984 -5.255 1.00 1.00 C ATOM 861 OG SER A 132 -11.748 4.903 -4.822 1.00 1.00 O ATOM 0 H SER A 132 -11.169 2.465 -3.302 1.00 1.00 H new ATOM 0 HA SER A 132 -8.915 3.108 -4.604 1.00 1.00 H new ATOM 0 HB2 SER A 132 -10.249 4.383 -6.137 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.225 3.049 -5.554 1.00 1.00 H new ATOM 0 HG SER A 132 -12.389 5.057 -5.548 1.00 1.00 H new ATOM 866 N GLY A 133 -7.947 5.342 -4.129 1.00 1.00 N ATOM 867 CA GLY A 133 -7.274 6.562 -3.718 1.00 1.00 C ATOM 868 C GLY A 133 -6.109 6.889 -4.654 1.00 1.00 C ATOM 869 O GLY A 133 -5.938 6.242 -5.686 1.00 1.00 O ATOM 0 H GLY A 133 -7.435 4.782 -4.810 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.984 7.389 -3.713 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.906 6.452 -2.698 1.00 1.00 H new ATOM 873 N THR A 134 -5.340 7.893 -4.261 1.00 1.00 N ATOM 874 CA THR A 134 -4.196 8.314 -5.053 1.00 1.00 C ATOM 875 C THR A 134 -2.931 8.338 -4.192 1.00 1.00 C ATOM 876 O THR A 134 -2.978 8.726 -3.026 1.00 1.00 O ATOM 877 CB THR A 134 -4.529 9.668 -5.681 1.00 1.00 C ATOM 878 OG1 THR A 134 -5.027 9.337 -6.975 1.00 1.00 O ATOM 879 CG2 THR A 134 -3.280 10.505 -5.966 1.00 1.00 C ATOM 0 H THR A 134 -5.486 8.428 -3.405 1.00 1.00 H new ATOM 0 HA THR A 134 -3.990 7.608 -5.858 1.00 1.00 H new ATOM 0 HB THR A 134 -5.193 10.222 -5.018 1.00 1.00 H new ATOM 0 HG1 THR A 134 -5.269 10.158 -7.452 1.00 1.00 H new ATOM 0 HG21 THR A 134 -3.573 11.456 -6.411 1.00 1.00 H new ATOM 0 HG22 THR A 134 -2.746 10.690 -5.034 1.00 1.00 H new ATOM 0 HG23 THR A 134 -2.631 9.966 -6.656 1.00 1.00 H new ATOM 887 N VAL A 135 -1.832 7.918 -4.800 1.00 1.00 N ATOM 888 CA VAL A 135 -0.557 7.888 -4.104 1.00 1.00 C ATOM 889 C VAL A 135 -0.425 9.141 -3.237 1.00 1.00 C ATOM 890 O VAL A 135 -1.100 10.140 -3.474 1.00 1.00 O ATOM 891 CB VAL A 135 0.585 7.734 -5.111 1.00 1.00 C ATOM 892 CG1 VAL A 135 0.682 8.960 -6.021 1.00 1.00 C ATOM 893 CG2 VAL A 135 1.914 7.474 -4.398 1.00 1.00 C ATOM 0 H VAL A 135 -1.798 7.596 -5.767 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.505 7.026 -3.439 1.00 1.00 H new ATOM 0 HB VAL A 135 0.366 6.869 -5.736 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.501 8.825 -6.727 1.00 1.00 H new ATOM 0 HG12 VAL A 135 -0.253 9.082 -6.569 1.00 1.00 H new ATOM 0 HG13 VAL A 135 0.867 9.848 -5.417 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.709 7.368 -5.137 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.142 8.310 -3.737 1.00 1.00 H new ATOM 0 HG23 VAL A 135 1.839 6.558 -3.812 1.00 1.00 H new ATOM 903 N LYS A 136 0.453 9.046 -2.247 1.00 1.00 N ATOM 904 CA LYS A 136 0.683 10.160 -1.342 1.00 1.00 C ATOM 905 C LYS A 136 2.131 10.120 -0.850 1.00 1.00 C ATOM 906 O LYS A 136 2.813 11.143 -0.834 1.00 1.00 O ATOM 907 CB LYS A 136 -0.350 10.154 -0.214 1.00 1.00 C ATOM 908 CG LYS A 136 -0.420 11.522 0.471 1.00 1.00 C ATOM 909 CD LYS A 136 -0.676 12.634 -0.548 1.00 1.00 C ATOM 910 CE LYS A 136 -1.678 13.654 -0.006 1.00 1.00 C ATOM 911 NZ LYS A 136 -0.973 14.762 0.675 1.00 1.00 N ATOM 0 H LYS A 136 1.013 8.216 -2.053 1.00 1.00 H new ATOM 0 HA LYS A 136 0.549 11.109 -1.862 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.330 9.893 -0.614 1.00 1.00 H new ATOM 0 HB3 LYS A 136 -0.090 9.389 0.518 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.214 11.518 1.218 1.00 1.00 H new ATOM 0 HG3 LYS A 136 0.513 11.716 0.999 1.00 1.00 H new ATOM 0 HD2 LYS A 136 0.262 13.134 -0.790 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -1.056 12.203 -1.474 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -2.283 14.048 -0.823 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -2.361 13.167 0.690 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -1.668 15.445 1.037 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -0.415 14.384 1.467 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -0.339 15.237 0.001 1.00 1.00 H new ATOM 920 N ALA A 137 2.558 8.927 -0.461 1.00 1.00 N ATOM 921 CA ALA A 137 3.912 8.741 0.030 1.00 1.00 C ATOM 922 C ALA A 137 4.047 7.337 0.622 1.00 1.00 C ATOM 923 O ALA A 137 3.197 6.903 1.398 1.00 1.00 O ATOM 924 CB ALA A 137 4.242 9.836 1.046 1.00 1.00 C ATOM 0 H ALA A 137 1.990 8.080 -0.476 1.00 1.00 H new ATOM 0 HA ALA A 137 4.630 8.826 -0.785 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.258 9.696 1.414 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.160 10.812 0.568 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.543 9.781 1.880 1.00 1.00 H new ATOM 930 N ILE A 138 5.122 6.667 0.234 1.00 1.00 N ATOM 931 CA ILE A 138 5.378 5.320 0.717 1.00 1.00 C ATOM 932 C ILE A 138 6.447 5.370 1.811 1.00 1.00 C ATOM 933 O ILE A 138 7.537 5.898 1.596 1.00 1.00 O ATOM 934 CB ILE A 138 5.734 4.392 -0.447 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.107 4.885 -1.752 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.343 2.946 -0.134 1.00 1.00 C ATOM 937 CD1 ILE A 138 6.030 5.879 -2.462 1.00 1.00 C ATOM 0 H ILE A 138 5.825 7.031 -0.409 1.00 1.00 H new ATOM 0 HA ILE A 138 4.479 4.900 1.167 1.00 1.00 H new ATOM 0 HB ILE A 138 6.815 4.412 -0.582 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.907 4.037 -2.407 1.00 1.00 H new ATOM 0 HG13 ILE A 138 4.148 5.359 -1.543 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.607 2.307 -0.977 1.00 1.00 H new ATOM 0 HG22 ILE A 138 5.875 2.610 0.756 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.269 2.890 0.042 1.00 1.00 H new ATOM 0 HD11 ILE A 138 5.561 6.214 -3.387 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.208 6.737 -1.814 1.00 1.00 H new ATOM 0 HD13 ILE A 138 6.979 5.394 -2.691 1.00 1.00 H new ATOM 948 N LEU A 139 6.097 4.814 2.962 1.00 1.00 N ATOM 949 CA LEU A 139 7.013 4.789 4.090 1.00 1.00 C ATOM 950 C LEU A 139 7.815 3.486 4.061 1.00 1.00 C ATOM 951 O LEU A 139 9.028 3.496 4.266 1.00 1.00 O ATOM 952 CB LEU A 139 6.255 5.015 5.399 1.00 1.00 C ATOM 953 CG LEU A 139 4.844 5.595 5.267 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.211 5.814 6.642 1.00 1.00 C ATOM 955 CD2 LEU A 139 4.854 6.874 4.428 1.00 1.00 C ATOM 0 H LEU A 139 5.192 4.378 3.138 1.00 1.00 H new ATOM 0 HA LEU A 139 7.730 5.607 4.018 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.187 4.063 5.925 1.00 1.00 H new ATOM 0 HB3 LEU A 139 6.844 5.684 6.026 1.00 1.00 H new ATOM 0 HG LEU A 139 4.224 4.870 4.740 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.209 6.227 6.520 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.150 4.862 7.170 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.822 6.509 7.217 1.00 1.00 H new ATOM 0 HD21 LEU A 139 3.840 7.266 4.350 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.494 7.617 4.904 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.235 6.652 3.431 1.00 1.00 H new ATOM 966 N VAL A 140 7.106 2.397 3.804 1.00 1.00 N ATOM 967 CA VAL A 140 7.737 1.090 3.745 1.00 1.00 C ATOM 968 C VAL A 140 8.415 0.915 2.385 1.00 1.00 C ATOM 969 O VAL A 140 8.044 1.574 1.414 1.00 1.00 O ATOM 970 CB VAL A 140 6.708 -0.002 4.045 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.607 -0.024 2.983 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.381 -1.371 4.166 1.00 1.00 C ATOM 0 H VAL A 140 6.100 2.393 3.634 1.00 1.00 H new ATOM 0 HA VAL A 140 8.512 1.006 4.507 1.00 1.00 H new ATOM 0 HB VAL A 140 6.244 0.229 5.004 1.00 1.00 H new ATOM 0 HG11 VAL A 140 4.889 -0.809 3.220 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.099 0.940 2.966 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.048 -0.219 2.005 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.628 -2.129 4.379 1.00 1.00 H new ATOM 0 HG22 VAL A 140 7.884 -1.613 3.230 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.111 -1.347 4.975 1.00 1.00 H new ATOM 982 N GLU A 141 9.396 0.026 2.358 1.00 1.00 N ATOM 983 CA GLU A 141 10.129 -0.242 1.132 1.00 1.00 C ATOM 984 C GLU A 141 9.829 -1.658 0.634 1.00 1.00 C ATOM 985 O GLU A 141 9.158 -2.430 1.316 1.00 1.00 O ATOM 986 CB GLU A 141 11.632 -0.040 1.336 1.00 1.00 C ATOM 987 CG GLU A 141 12.056 1.369 0.917 1.00 1.00 C ATOM 988 CD GLU A 141 13.429 1.350 0.240 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.460 1.330 0.928 1.00 1.00 O ATOM 990 OE2 GLU A 141 13.400 1.354 -1.050 1.00 1.00 O ATOM 0 H GLU A 141 9.701 -0.518 3.165 1.00 1.00 H new ATOM 0 HA GLU A 141 9.800 0.467 0.373 1.00 1.00 H new ATOM 0 HB2 GLU A 141 11.886 -0.204 2.383 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.184 -0.778 0.755 1.00 1.00 H new ATOM 0 HG2 GLU A 141 11.316 1.788 0.235 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.087 2.019 1.792 1.00 1.00 H new ATOM 996 N SER A 142 10.343 -1.956 -0.551 1.00 1.00 N ATOM 997 CA SER A 142 10.138 -3.264 -1.147 1.00 1.00 C ATOM 998 C SER A 142 11.115 -4.274 -0.541 1.00 1.00 C ATOM 999 O SER A 142 12.268 -4.357 -0.962 1.00 1.00 O ATOM 1000 CB SER A 142 10.307 -3.209 -2.667 1.00 1.00 C ATOM 1001 OG SER A 142 10.234 -4.502 -3.260 1.00 1.00 O ATOM 0 H SER A 142 10.901 -1.313 -1.114 1.00 1.00 H new ATOM 0 HA SER A 142 9.117 -3.581 -0.933 1.00 1.00 H new ATOM 0 HB2 SER A 142 9.534 -2.570 -3.095 1.00 1.00 H new ATOM 0 HB3 SER A 142 11.267 -2.753 -2.909 1.00 1.00 H new ATOM 0 HG SER A 142 10.345 -4.424 -4.231 1.00 1.00 H new ATOM 1006 N GLY A 143 10.617 -5.017 0.436 1.00 1.00 N ATOM 1007 CA GLY A 143 11.431 -6.017 1.105 1.00 1.00 C ATOM 1008 C GLY A 143 11.669 -5.643 2.569 1.00 1.00 C ATOM 1009 O GLY A 143 12.252 -6.419 3.325 1.00 1.00 O ATOM 0 H GLY A 143 9.660 -4.946 0.780 1.00 1.00 H new ATOM 0 HA2 GLY A 143 10.938 -6.988 1.050 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.387 -6.115 0.591 1.00 1.00 H new ATOM 1013 N GLN A 144 11.207 -4.454 2.924 1.00 1.00 N ATOM 1014 CA GLN A 144 11.361 -3.967 4.285 1.00 1.00 C ATOM 1015 C GLN A 144 10.345 -4.641 5.209 1.00 1.00 C ATOM 1016 O GLN A 144 9.256 -5.012 4.774 1.00 1.00 O ATOM 1017 CB GLN A 144 11.226 -2.444 4.341 1.00 1.00 C ATOM 1018 CG GLN A 144 12.579 -1.783 4.611 1.00 1.00 C ATOM 1019 CD GLN A 144 13.652 -2.324 3.664 1.00 1.00 C ATOM 1020 OE1 GLN A 144 13.248 -2.451 2.404 1.00 1.00 O flip ATOM 1021 NE2 GLN A 144 14.773 -2.608 4.053 1.00 1.00 N flip ATOM 0 H GLN A 144 10.726 -3.813 2.293 1.00 1.00 H new ATOM 0 HA GLN A 144 12.363 -4.224 4.630 1.00 1.00 H new ATOM 0 HB2 GLN A 144 10.819 -2.077 3.399 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.519 -2.167 5.123 1.00 1.00 H new ATOM 0 HG2 GLN A 144 12.491 -0.703 4.488 1.00 1.00 H new ATOM 0 HG3 GLN A 144 12.876 -1.963 5.644 1.00 1.00 H new ATOM 0 HE21 GLN A 144 15.018 -2.486 5.036 1.00 1.00 H new ATOM 0 HE22 GLN A 144 15.465 -2.967 3.396 1.00 1.00 H new ATOM 1028 N PRO A 145 10.748 -4.784 6.500 1.00 1.00 N ATOM 1029 CA PRO A 145 9.885 -5.407 7.489 1.00 1.00 C ATOM 1030 C PRO A 145 8.760 -4.461 7.909 1.00 1.00 C ATOM 1031 O PRO A 145 8.851 -3.251 7.703 1.00 1.00 O ATOM 1032 CB PRO A 145 10.809 -5.779 8.638 1.00 1.00 C ATOM 1033 CG PRO A 145 12.062 -4.938 8.454 1.00 1.00 C ATOM 1034 CD PRO A 145 12.031 -4.357 7.050 1.00 1.00 C ATOM 0 HA PRO A 145 9.373 -6.289 7.105 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.339 -5.574 9.600 1.00 1.00 H new ATOM 0 HB3 PRO A 145 11.046 -6.843 8.620 1.00 1.00 H new ATOM 0 HG2 PRO A 145 12.099 -4.141 9.196 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.955 -5.547 8.596 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.111 -3.270 7.069 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.862 -4.727 6.450 1.00 1.00 H new ATOM 1039 N VAL A 146 7.724 -5.047 8.491 1.00 1.00 N ATOM 1040 CA VAL A 146 6.581 -4.271 8.942 1.00 1.00 C ATOM 1041 C VAL A 146 6.053 -4.862 10.250 1.00 1.00 C ATOM 1042 O VAL A 146 6.288 -6.033 10.546 1.00 1.00 O ATOM 1043 CB VAL A 146 5.520 -4.213 7.841 1.00 1.00 C ATOM 1044 CG1 VAL A 146 6.116 -3.690 6.532 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.866 -5.580 7.637 1.00 1.00 C ATOM 0 H VAL A 146 7.652 -6.050 8.661 1.00 1.00 H new ATOM 0 HA VAL A 146 6.875 -3.241 9.146 1.00 1.00 H new ATOM 0 HB VAL A 146 4.745 -3.515 8.159 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.341 -3.659 5.766 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.513 -2.687 6.688 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.920 -4.351 6.208 1.00 1.00 H new ATOM 0 HG21 VAL A 146 4.116 -5.511 6.849 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.626 -6.308 7.352 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.390 -5.897 8.565 1.00 1.00 H new ATOM 1055 N GLU A 147 5.349 -4.026 10.998 1.00 1.00 N ATOM 1056 CA GLU A 147 4.786 -4.451 12.269 1.00 1.00 C ATOM 1057 C GLU A 147 3.354 -3.930 12.416 1.00 1.00 C ATOM 1058 O GLU A 147 2.968 -2.970 11.751 1.00 1.00 O ATOM 1059 CB GLU A 147 5.658 -3.991 13.438 1.00 1.00 C ATOM 1060 CG GLU A 147 6.514 -5.143 13.970 1.00 1.00 C ATOM 1061 CD GLU A 147 5.974 -5.655 15.306 1.00 1.00 C ATOM 1062 OE1 GLU A 147 5.364 -4.886 16.065 1.00 1.00 O ATOM 1063 OE2 GLU A 147 6.206 -6.901 15.548 1.00 1.00 O ATOM 0 H GLU A 147 5.155 -3.056 10.749 1.00 1.00 H new ATOM 0 HA GLU A 147 4.760 -5.541 12.285 1.00 1.00 H new ATOM 0 HB2 GLU A 147 6.302 -3.173 13.116 1.00 1.00 H new ATOM 0 HB3 GLU A 147 5.026 -3.603 14.237 1.00 1.00 H new ATOM 0 HG2 GLU A 147 6.528 -5.956 13.244 1.00 1.00 H new ATOM 0 HG3 GLU A 147 7.544 -4.808 14.094 1.00 1.00 H new ATOM 1069 N PHE A 148 2.606 -4.587 13.291 1.00 1.00 N ATOM 1070 CA PHE A 148 1.227 -4.201 13.533 1.00 1.00 C ATOM 1071 C PHE A 148 1.142 -2.768 14.061 1.00 1.00 C ATOM 1072 O PHE A 148 1.928 -2.371 14.921 1.00 1.00 O ATOM 1073 CB PHE A 148 0.676 -5.157 14.594 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.851 -5.254 14.610 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.494 -6.021 13.688 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.566 -4.573 15.545 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.911 -6.111 13.703 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -2.983 -4.664 15.560 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.626 -5.431 14.639 1.00 1.00 C ATOM 0 H PHE A 148 2.929 -5.383 13.840 1.00 1.00 H new ATOM 0 HA PHE A 148 0.658 -4.251 12.605 1.00 1.00 H new ATOM 0 HB2 PHE A 148 1.091 -6.150 14.424 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.020 -4.831 15.576 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.926 -6.561 12.945 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.056 -3.963 16.276 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.421 -6.720 12.971 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -3.551 -4.124 16.303 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.704 -5.500 14.651 1.00 1.00 H new ATOM 1088 N ASP A 149 0.182 -2.029 13.527 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.016 -0.648 13.933 1.00 1.00 C ATOM 1090 C ASP A 149 0.957 0.250 13.167 1.00 1.00 C ATOM 1091 O ASP A 149 0.889 1.473 13.266 1.00 1.00 O ATOM 1092 CB ASP A 149 0.255 -0.471 15.429 1.00 1.00 C ATOM 1093 CG ASP A 149 1.648 0.059 15.775 1.00 1.00 C ATOM 1094 OD1 ASP A 149 2.051 1.141 15.322 1.00 1.00 O ATOM 1095 OD2 ASP A 149 2.341 -0.700 16.556 1.00 1.00 O ATOM 0 H ASP A 149 -0.469 -2.361 12.815 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.050 -0.378 13.718 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.489 0.211 15.840 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.115 -1.432 15.925 1.00 1.00 H new ATOM 1100 N GLU A 150 1.842 -0.394 12.419 1.00 1.00 N ATOM 1101 CA GLU A 150 2.828 0.330 11.636 1.00 1.00 C ATOM 1102 C GLU A 150 2.264 0.670 10.255 1.00 1.00 C ATOM 1103 O GLU A 150 1.592 -0.153 9.634 1.00 1.00 O ATOM 1104 CB GLU A 150 4.127 -0.469 11.515 1.00 1.00 C ATOM 1105 CG GLU A 150 5.344 0.459 11.515 1.00 1.00 C ATOM 1106 CD GLU A 150 5.818 0.743 10.089 1.00 1.00 C ATOM 1107 OE1 GLU A 150 6.323 1.841 9.810 1.00 1.00 O ATOM 1108 OE2 GLU A 150 5.647 -0.226 9.255 1.00 1.00 O ATOM 0 H GLU A 150 1.896 -1.409 12.339 1.00 1.00 H new ATOM 0 HA GLU A 150 3.059 1.262 12.152 1.00 1.00 H new ATOM 0 HB2 GLU A 150 4.203 -1.174 12.343 1.00 1.00 H new ATOM 0 HB3 GLU A 150 4.113 -1.056 10.597 1.00 1.00 H new ATOM 0 HG2 GLU A 150 5.091 1.396 12.011 1.00 1.00 H new ATOM 0 HG3 GLU A 150 6.153 0.004 12.087 1.00 1.00 H new ATOM 1114 N PRO A 151 2.564 1.917 9.802 1.00 1.00 N ATOM 1115 CA PRO A 151 2.095 2.377 8.506 1.00 1.00 C ATOM 1116 C PRO A 151 2.897 1.734 7.373 1.00 1.00 C ATOM 1117 O PRO A 151 4.040 1.326 7.571 1.00 1.00 O ATOM 1118 CB PRO A 151 2.236 3.889 8.550 1.00 1.00 C ATOM 1119 CG PRO A 151 3.208 4.184 9.681 1.00 1.00 C ATOM 1120 CD PRO A 151 3.357 2.918 10.509 1.00 1.00 C ATOM 0 HA PRO A 151 1.062 2.093 8.308 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.611 4.274 7.602 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.272 4.366 8.729 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.174 4.496 9.283 1.00 1.00 H new ATOM 0 HG3 PRO A 151 2.838 5.003 10.298 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.401 2.615 10.584 1.00 1.00 H new ATOM 0 HD3 PRO A 151 2.994 3.065 11.526 1.00 1.00 H new ATOM 1125 N LEU A 152 2.265 1.663 6.210 1.00 1.00 N ATOM 1126 CA LEU A 152 2.905 1.076 5.045 1.00 1.00 C ATOM 1127 C LEU A 152 3.036 2.138 3.951 1.00 1.00 C ATOM 1128 O LEU A 152 4.095 2.741 3.788 1.00 1.00 O ATOM 1129 CB LEU A 152 2.155 -0.180 4.597 1.00 1.00 C ATOM 1130 CG LEU A 152 2.006 -1.282 5.648 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.057 -2.378 5.160 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.371 -1.844 6.051 1.00 1.00 C ATOM 0 H LEU A 152 1.317 2.002 6.050 1.00 1.00 H new ATOM 0 HA LEU A 152 3.914 0.745 5.291 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.160 0.114 4.264 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.670 -0.598 3.732 1.00 1.00 H new ATOM 0 HG LEU A 152 1.562 -0.844 6.542 1.00 1.00 H new ATOM 0 HD11 LEU A 152 0.968 -3.149 5.925 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.075 -1.948 4.963 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.451 -2.819 4.244 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.236 -2.625 6.799 1.00 1.00 H new ATOM 0 HD22 LEU A 152 3.866 -2.262 5.174 1.00 1.00 H new ATOM 0 HD23 LEU A 152 3.985 -1.045 6.467 1.00 1.00 H new ATOM 1143 N VAL A 153 1.942 2.337 3.231 1.00 1.00 N ATOM 1144 CA VAL A 153 1.920 3.314 2.157 1.00 1.00 C ATOM 1145 C VAL A 153 0.855 4.372 2.458 1.00 1.00 C ATOM 1146 O VAL A 153 -0.239 4.044 2.912 1.00 1.00 O ATOM 1147 CB VAL A 153 1.703 2.614 0.814 1.00 1.00 C ATOM 1148 CG1 VAL A 153 1.885 3.591 -0.350 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.634 1.408 0.669 1.00 1.00 C ATOM 0 H VAL A 153 1.064 1.837 3.371 1.00 1.00 H new ATOM 0 HA VAL A 153 2.879 3.827 2.089 1.00 1.00 H new ATOM 0 HB VAL A 153 0.676 2.250 0.787 1.00 1.00 H new ATOM 0 HG11 VAL A 153 1.725 3.068 -1.293 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.164 4.403 -0.259 1.00 1.00 H new ATOM 0 HG13 VAL A 153 2.896 3.999 -0.328 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.460 0.928 -0.294 1.00 1.00 H new ATOM 0 HG22 VAL A 153 3.671 1.740 0.727 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.435 0.696 1.470 1.00 1.00 H new ATOM 1159 N VAL A 154 1.214 5.620 2.192 1.00 1.00 N ATOM 1160 CA VAL A 154 0.304 6.727 2.429 1.00 1.00 C ATOM 1161 C VAL A 154 -0.411 7.082 1.124 1.00 1.00 C ATOM 1162 O VAL A 154 0.232 7.271 0.092 1.00 1.00 O ATOM 1163 CB VAL A 154 1.064 7.908 3.035 1.00 1.00 C ATOM 1164 CG1 VAL A 154 0.104 9.036 3.424 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.902 7.464 4.236 1.00 1.00 C ATOM 0 H VAL A 154 2.123 5.888 1.815 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.461 6.445 3.152 1.00 1.00 H new ATOM 0 HB VAL A 154 1.745 8.293 2.276 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.670 9.864 3.852 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.430 9.381 2.538 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.612 8.667 4.158 1.00 1.00 H new ATOM 0 HG21 VAL A 154 2.432 8.323 4.648 1.00 1.00 H new ATOM 0 HG22 VAL A 154 1.249 7.041 4.999 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.623 6.711 3.918 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.730 7.162 1.211 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.540 7.492 0.050 1.00 1.00 C ATOM 1177 C ILE A 155 -3.302 8.791 0.317 1.00 1.00 C ATOM 1178 O ILE A 155 -3.414 9.225 1.463 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.442 6.315 -0.324 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.643 5.211 -1.020 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.629 6.782 -1.170 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -2.287 5.611 -2.453 1.00 1.00 C ATOM 0 H ILE A 155 -2.259 7.004 2.068 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.907 7.668 -0.820 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.847 5.890 0.594 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -1.731 5.008 -0.458 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -3.223 4.288 -1.030 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.255 5.926 -1.423 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.216 7.506 -0.605 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.263 7.247 -2.086 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.719 4.809 -2.924 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -3.201 5.790 -3.019 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -1.686 6.520 -2.438 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.806 9.375 -0.760 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.554 10.616 -0.656 1.00 1.00 C ATOM 1195 C GLU A 156 -6.045 10.358 -0.886 1.00 1.00 C ATOM 1196 O GLU A 156 -6.541 9.271 -0.598 1.00 1.00 O ATOM 1197 CB GLU A 156 -4.021 11.661 -1.638 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.642 11.479 -3.025 1.00 1.00 C ATOM 1199 CD GLU A 156 -5.681 12.564 -3.308 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -6.868 12.255 -3.489 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -5.218 13.769 -3.337 1.00 1.00 O ATOM 0 H GLU A 156 -3.711 9.012 -1.708 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.425 11.012 0.351 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -4.242 12.661 -1.265 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -2.936 11.579 -1.708 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -3.861 11.512 -3.784 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -5.110 10.497 -3.092 1.00 1.00 H new