USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 680 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 389 THR OG1 : rot 180:sc= 0.00281 USER MOD Set 1.2: B 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.3: B 400 SER OG : rot -151:sc= -4.07! USER MOD Set 2.1: B 380 TYR OH : rot -63:sc= 0.958 USER MOD Set 2.2: B 444 GLN : amide:sc= -2.86! C(o=-1.9!,f=-7.6!) USER MOD Set 3.1: B 368 MET CE :methyl -157:sc= -2.71! (180deg=-1.92!) USER MOD Set 3.2: B 369 ASN :FLIP amide:sc= -0.089 F(o=-3.7,f=-2.8) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD Single : B 371 LYS NZ :NH3+ -149:sc= 0.335 (180deg=-0.681) USER MOD Single : B 373 GLN :FLIP amide:sc= -12.1! C(o=-14!,f=-12!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 180:sc= 0 USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS :FLIP no HE2:sc= -5.86! C(o=-6.7!,f=-5.9!) USER MOD Single : B 387 TYR OH : rot 158:sc= -5.92! USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot 177:sc= -0.831! USER MOD Single : B 399 ASN :FLIP amide:sc= -0.0117 F(o=-0.65,f=-0.012) USER MOD Single : B 404 CYS SG : rot 73:sc= -1.63! USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 180:sc= 0.0577 USER MOD Single : B 419 ASN : amide:sc= -3.9! C(o=-3.9!,f=-17!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -2.52! C(o=-2.5!,f=-2.5!) USER MOD Single : B 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 437 MET CE :methyl -143:sc= -0.614 (180deg=-3.13!) USER MOD Single : B 441 TYR OH : rot -30:sc= -1.27 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1036 N SER B 365 -2.242 3.277 13.015 1.00 0.00 N ATOM 1037 CA SER B 365 -1.444 2.353 12.214 1.00 0.00 C ATOM 1038 C SER B 365 -2.286 1.717 11.114 1.00 0.00 C ATOM 1039 O SER B 365 -2.913 0.677 11.320 1.00 0.00 O ATOM 1040 CB SER B 365 -0.846 1.263 13.105 1.00 0.00 C ATOM 1041 OG SER B 365 -0.284 0.220 12.327 1.00 0.00 O ATOM 0 HA SER B 365 -0.638 2.919 11.748 1.00 0.00 H new ATOM 0 HB2 SER B 365 -0.079 1.695 13.748 1.00 0.00 H new ATOM 0 HB3 SER B 365 -1.619 0.858 13.758 1.00 0.00 H new ATOM 0 HG SER B 365 0.093 -0.463 12.920 1.00 0.00 H new ATOM 1047 N LEU B 366 -2.305 2.352 9.946 1.00 0.00 N ATOM 1048 CA LEU B 366 -3.079 1.851 8.817 1.00 0.00 C ATOM 1049 C LEU B 366 -2.524 2.380 7.497 1.00 0.00 C ATOM 1050 O LEU B 366 -1.862 3.416 7.462 1.00 0.00 O ATOM 1051 CB LEU B 366 -4.544 2.267 8.965 1.00 0.00 C ATOM 1052 CG LEU B 366 -5.566 1.290 8.383 1.00 0.00 C ATOM 1053 CD1 LEU B 366 -6.946 1.567 8.953 1.00 0.00 C ATOM 1054 CD2 LEU B 366 -5.589 1.381 6.864 1.00 0.00 C ATOM 0 H LEU B 366 -1.793 3.214 9.757 1.00 0.00 H new ATOM 0 HA LEU B 366 -3.008 0.763 8.810 1.00 0.00 H new ATOM 0 HB2 LEU B 366 -4.760 2.403 10.025 1.00 0.00 H new ATOM 0 HB3 LEU B 366 -4.679 3.236 8.485 1.00 0.00 H new ATOM 0 HG LEU B 366 -5.273 0.278 8.661 1.00 0.00 H new ATOM 0 HD11 LEU B 366 -7.663 0.863 8.529 1.00 0.00 H new ATOM 0 HD12 LEU B 366 -6.922 1.452 10.037 1.00 0.00 H new ATOM 0 HD13 LEU B 366 -7.245 2.585 8.703 1.00 0.00 H new ATOM 0 HD21 LEU B 366 -6.322 0.678 6.468 1.00 0.00 H new ATOM 0 HD22 LEU B 366 -5.858 2.394 6.564 1.00 0.00 H new ATOM 0 HD23 LEU B 366 -4.603 1.136 6.470 1.00 0.00 H new ATOM 1066 N ASP B 367 -2.816 1.670 6.412 1.00 0.00 N ATOM 1067 CA ASP B 367 -2.363 2.083 5.091 1.00 0.00 C ATOM 1068 C ASP B 367 -2.845 3.499 4.795 1.00 0.00 C ATOM 1069 O ASP B 367 -2.050 4.435 4.718 1.00 0.00 O ATOM 1070 CB ASP B 367 -2.882 1.118 4.024 1.00 0.00 C ATOM 1071 CG ASP B 367 -2.753 1.679 2.621 1.00 0.00 C ATOM 1072 OD1 ASP B 367 -1.648 1.591 2.046 1.00 0.00 O ATOM 1073 OD2 ASP B 367 -3.758 2.207 2.098 1.00 0.00 O ATOM 0 H ASP B 367 -3.363 0.809 6.422 1.00 0.00 H new ATOM 0 HA ASP B 367 -1.273 2.067 5.074 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -2.331 0.180 4.089 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -3.928 0.888 4.225 1.00 0.00 H new ATOM 1078 N MET B 368 -4.159 3.639 4.629 1.00 0.00 N ATOM 1079 CA MET B 368 -4.764 4.937 4.342 1.00 0.00 C ATOM 1080 C MET B 368 -3.992 6.056 5.037 1.00 0.00 C ATOM 1081 O MET B 368 -3.622 7.049 4.414 1.00 0.00 O ATOM 1082 CB MET B 368 -6.228 4.959 4.786 1.00 0.00 C ATOM 1083 CG MET B 368 -6.497 4.149 6.043 1.00 0.00 C ATOM 1084 SD MET B 368 -7.615 4.986 7.183 1.00 0.00 S ATOM 1085 CE MET B 368 -6.754 6.539 7.421 1.00 0.00 C ATOM 0 H MET B 368 -4.825 2.869 4.688 1.00 0.00 H new ATOM 0 HA MET B 368 -4.722 5.099 3.265 1.00 0.00 H new ATOM 0 HB2 MET B 368 -6.531 5.992 4.958 1.00 0.00 H new ATOM 0 HB3 MET B 368 -6.850 4.575 3.977 1.00 0.00 H new ATOM 0 HG2 MET B 368 -6.923 3.185 5.765 1.00 0.00 H new ATOM 0 HG3 MET B 368 -5.553 3.947 6.549 1.00 0.00 H new ATOM 0 HE1 MET B 368 -7.065 6.986 8.365 1.00 0.00 H new ATOM 0 HE2 MET B 368 -5.679 6.360 7.441 1.00 0.00 H new ATOM 0 HE3 MET B 368 -6.994 7.217 6.602 1.00 0.00 H new ATOM 1095 N ASN B 369 -3.753 5.887 6.332 1.00 0.00 N ATOM 1096 CA ASN B 369 -3.022 6.883 7.103 1.00 0.00 C ATOM 1097 C ASN B 369 -1.671 7.181 6.458 1.00 0.00 C ATOM 1098 O ASN B 369 -1.312 8.341 6.250 1.00 0.00 O ATOM 1099 CB ASN B 369 -2.809 6.396 8.537 1.00 0.00 C ATOM 1100 CG ASN B 369 -3.869 6.913 9.490 1.00 0.00 C ATOM 1101 OD1 ASN B 369 -4.845 6.070 9.803 1.00 0.00 O flip ATOM 1102 ND2 ASN B 369 -3.809 8.057 9.942 1.00 0.00 N flip ATOM 0 H ASN B 369 -4.054 5.073 6.868 1.00 0.00 H new ATOM 0 HA ASN B 369 -3.614 7.798 7.119 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -2.813 5.306 8.551 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -1.826 6.716 8.884 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -3.040 8.672 9.674 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -4.528 8.390 10.584 1.00 0.00 H new ATOM 1109 N ALA B 370 -0.922 6.125 6.156 1.00 0.00 N ATOM 1110 CA ALA B 370 0.395 6.277 5.549 1.00 0.00 C ATOM 1111 C ALA B 370 0.310 7.047 4.234 1.00 0.00 C ATOM 1112 O ALA B 370 0.894 8.122 4.101 1.00 0.00 O ATOM 1113 CB ALA B 370 1.048 4.923 5.325 1.00 0.00 C ATOM 0 H ALA B 370 -1.203 5.159 6.321 1.00 0.00 H new ATOM 0 HA ALA B 370 1.013 6.850 6.241 1.00 0.00 H new ATOM 0 HB1 ALA B 370 2.029 5.063 4.871 1.00 0.00 H new ATOM 0 HB2 ALA B 370 1.160 4.410 6.280 1.00 0.00 H new ATOM 0 HB3 ALA B 370 0.424 4.323 4.662 1.00 0.00 H new ATOM 1119 N LYS B 371 -0.397 6.487 3.255 1.00 0.00 N ATOM 1120 CA LYS B 371 -0.513 7.130 1.951 1.00 0.00 C ATOM 1121 C LYS B 371 -0.833 8.610 2.105 1.00 0.00 C ATOM 1122 O LYS B 371 -0.316 9.442 1.363 1.00 0.00 O ATOM 1123 CB LYS B 371 -1.588 6.445 1.099 1.00 0.00 C ATOM 1124 CG LYS B 371 -2.916 6.263 1.815 1.00 0.00 C ATOM 1125 CD LYS B 371 -3.778 7.515 1.725 1.00 0.00 C ATOM 1126 CE LYS B 371 -5.256 7.173 1.607 1.00 0.00 C ATOM 1127 NZ LYS B 371 -6.036 7.671 2.774 1.00 0.00 N ATOM 0 H LYS B 371 -0.893 5.599 3.339 1.00 0.00 H new ATOM 0 HA LYS B 371 0.447 7.032 1.444 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -1.751 7.033 0.195 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -1.220 5.469 0.783 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -3.452 5.420 1.380 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -2.735 6.020 2.862 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -3.617 8.132 2.609 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -3.471 8.107 0.863 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -5.657 7.606 0.691 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -5.373 6.092 1.526 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -6.839 7.034 2.952 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -5.424 7.699 3.614 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -6.391 8.627 2.572 1.00 0.00 H new ATOM 1141 N ARG B 372 -1.669 8.941 3.080 1.00 0.00 N ATOM 1142 CA ARG B 372 -2.022 10.331 3.322 1.00 0.00 C ATOM 1143 C ARG B 372 -0.796 11.104 3.796 1.00 0.00 C ATOM 1144 O ARG B 372 -0.527 12.210 3.343 1.00 0.00 O ATOM 1145 CB ARG B 372 -3.143 10.432 4.358 1.00 0.00 C ATOM 1146 CG ARG B 372 -4.301 11.312 3.910 1.00 0.00 C ATOM 1147 CD ARG B 372 -4.945 12.049 5.076 1.00 0.00 C ATOM 1148 NE ARG B 372 -3.972 12.427 6.099 1.00 0.00 N ATOM 1149 CZ ARG B 372 -3.728 11.716 7.199 1.00 0.00 C ATOM 1150 NH1 ARG B 372 -4.390 10.588 7.436 1.00 0.00 N ATOM 1151 NH2 ARG B 372 -2.819 12.133 8.068 1.00 0.00 N ATOM 0 H ARG B 372 -2.111 8.272 3.710 1.00 0.00 H new ATOM 0 HA ARG B 372 -2.379 10.766 2.388 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -3.519 9.432 4.575 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -2.734 10.827 5.288 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -3.943 12.036 3.177 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -5.051 10.698 3.412 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -5.445 12.944 4.706 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -5.712 11.417 5.523 1.00 0.00 H new ATOM 0 HE ARG B 372 -3.446 13.290 5.962 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -5.092 10.260 6.773 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -4.196 10.051 8.281 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -2.307 12.998 7.895 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -2.632 11.589 8.910 1.00 0.00 H new ATOM 1165 N GLN B 373 -0.056 10.510 4.715 1.00 0.00 N ATOM 1166 CA GLN B 373 1.141 11.140 5.251 1.00 0.00 C ATOM 1167 C GLN B 373 2.175 11.409 4.158 1.00 0.00 C ATOM 1168 O GLN B 373 2.666 12.522 4.010 1.00 0.00 O ATOM 1169 CB GLN B 373 1.760 10.244 6.324 1.00 0.00 C ATOM 1170 CG GLN B 373 2.022 10.950 7.642 1.00 0.00 C ATOM 1171 CD GLN B 373 2.530 12.366 7.460 1.00 0.00 C ATOM 1172 OE1 GLN B 373 3.422 12.555 6.496 1.00 0.00 O flip ATOM 1173 NE2 GLN B 373 2.124 13.280 8.177 1.00 0.00 N flip ATOM 0 H GLN B 373 -0.262 9.591 5.107 1.00 0.00 H new ATOM 0 HA GLN B 373 0.848 12.096 5.684 1.00 0.00 H new ATOM 0 HB2 GLN B 373 1.097 9.397 6.503 1.00 0.00 H new ATOM 0 HB3 GLN B 373 2.699 9.839 5.947 1.00 0.00 H new ATOM 0 HG2 GLN B 373 1.102 10.971 8.226 1.00 0.00 H new ATOM 0 HG3 GLN B 373 2.751 10.378 8.216 1.00 0.00 H new ATOM 0 HE21 GLN B 373 1.437 13.089 8.907 1.00 0.00 H new ATOM 0 HE22 GLN B 373 2.474 14.228 8.042 1.00 0.00 H new ATOM 1182 N LEU B 374 2.507 10.378 3.399 1.00 0.00 N ATOM 1183 CA LEU B 374 3.502 10.514 2.340 1.00 0.00 C ATOM 1184 C LEU B 374 2.991 11.343 1.161 1.00 0.00 C ATOM 1185 O LEU B 374 3.624 12.324 0.770 1.00 0.00 O ATOM 1186 CB LEU B 374 3.945 9.130 1.868 1.00 0.00 C ATOM 1187 CG LEU B 374 4.016 8.081 2.978 1.00 0.00 C ATOM 1188 CD1 LEU B 374 4.777 6.853 2.511 1.00 0.00 C ATOM 1189 CD2 LEU B 374 4.666 8.671 4.221 1.00 0.00 C ATOM 0 H LEU B 374 2.108 9.444 3.492 1.00 0.00 H new ATOM 0 HA LEU B 374 4.355 11.051 2.756 1.00 0.00 H new ATOM 0 HB2 LEU B 374 3.255 8.783 1.099 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.926 9.215 1.401 1.00 0.00 H new ATOM 0 HG LEU B 374 3.000 7.776 3.228 1.00 0.00 H new ATOM 0 HD11 LEU B 374 4.815 6.120 3.317 1.00 0.00 H new ATOM 0 HD12 LEU B 374 4.272 6.418 1.649 1.00 0.00 H new ATOM 0 HD13 LEU B 374 5.791 7.138 2.232 1.00 0.00 H new ATOM 0 HD21 LEU B 374 4.710 7.913 5.003 1.00 0.00 H new ATOM 0 HD22 LEU B 374 5.676 9.003 3.981 1.00 0.00 H new ATOM 0 HD23 LEU B 374 4.078 9.520 4.571 1.00 0.00 H new ATOM 1201 N TYR B 375 1.870 10.939 0.578 1.00 0.00 N ATOM 1202 CA TYR B 375 1.323 11.650 -0.577 1.00 0.00 C ATOM 1203 C TYR B 375 0.717 13.002 -0.199 1.00 0.00 C ATOM 1204 O TYR B 375 0.970 14.003 -0.869 1.00 0.00 O ATOM 1205 CB TYR B 375 0.281 10.790 -1.294 1.00 0.00 C ATOM 1206 CG TYR B 375 0.880 9.830 -2.299 1.00 0.00 C ATOM 1207 CD1 TYR B 375 1.200 10.251 -3.585 1.00 0.00 C ATOM 1208 CD2 TYR B 375 1.125 8.505 -1.964 1.00 0.00 C ATOM 1209 CE1 TYR B 375 1.744 9.376 -4.507 1.00 0.00 C ATOM 1210 CE2 TYR B 375 1.670 7.625 -2.880 1.00 0.00 C ATOM 1211 CZ TYR B 375 1.977 8.066 -4.150 1.00 0.00 C ATOM 1212 OH TYR B 375 2.518 7.192 -5.066 1.00 0.00 O ATOM 0 H TYR B 375 1.324 10.132 0.880 1.00 0.00 H new ATOM 0 HA TYR B 375 2.157 11.845 -1.251 1.00 0.00 H new ATOM 0 HB2 TYR B 375 -0.283 10.223 -0.553 1.00 0.00 H new ATOM 0 HB3 TYR B 375 -0.428 11.442 -1.804 1.00 0.00 H new ATOM 0 HD1 TYR B 375 1.021 11.278 -3.868 1.00 0.00 H new ATOM 0 HD2 TYR B 375 0.886 8.156 -0.970 1.00 0.00 H new ATOM 0 HE1 TYR B 375 1.985 9.718 -5.503 1.00 0.00 H new ATOM 0 HE2 TYR B 375 1.854 6.598 -2.603 1.00 0.00 H new ATOM 0 HH TYR B 375 2.619 6.308 -4.655 1.00 0.00 H new ATOM 1222 N SER B 376 -0.081 13.039 0.865 1.00 0.00 N ATOM 1223 CA SER B 376 -0.695 14.292 1.284 1.00 0.00 C ATOM 1224 C SER B 376 0.334 15.198 1.946 1.00 0.00 C ATOM 1225 O SER B 376 0.514 16.344 1.535 1.00 0.00 O ATOM 1226 CB SER B 376 -1.875 14.039 2.227 1.00 0.00 C ATOM 1227 OG SER B 376 -3.027 14.747 1.802 1.00 0.00 O ATOM 0 H SER B 376 -0.314 12.231 1.442 1.00 0.00 H new ATOM 0 HA SER B 376 -1.076 14.794 0.394 1.00 0.00 H new ATOM 0 HB2 SER B 376 -2.093 12.972 2.264 1.00 0.00 H new ATOM 0 HB3 SER B 376 -1.609 14.345 3.239 1.00 0.00 H new ATOM 0 HG SER B 376 -3.767 14.568 2.419 1.00 0.00 H new ATOM 1233 N LEU B 377 1.003 14.692 2.981 1.00 0.00 N ATOM 1234 CA LEU B 377 1.995 15.490 3.683 1.00 0.00 C ATOM 1235 C LEU B 377 3.192 15.785 2.786 1.00 0.00 C ATOM 1236 O LEU B 377 3.599 16.940 2.654 1.00 0.00 O ATOM 1237 CB LEU B 377 2.437 14.804 4.974 1.00 0.00 C ATOM 1238 CG LEU B 377 2.463 15.712 6.199 1.00 0.00 C ATOM 1239 CD1 LEU B 377 2.857 17.118 5.787 1.00 0.00 C ATOM 1240 CD2 LEU B 377 1.105 15.719 6.888 1.00 0.00 C ATOM 0 H LEU B 377 0.876 13.747 3.344 1.00 0.00 H new ATOM 0 HA LEU B 377 1.532 16.440 3.950 1.00 0.00 H new ATOM 0 HB2 LEU B 377 1.768 13.967 5.173 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.433 14.387 4.826 1.00 0.00 H new ATOM 0 HG LEU B 377 3.200 15.331 6.906 1.00 0.00 H new ATOM 0 HD11 LEU B 377 2.874 17.763 6.665 1.00 0.00 H new ATOM 0 HD12 LEU B 377 3.847 17.100 5.331 1.00 0.00 H new ATOM 0 HD13 LEU B 377 2.133 17.503 5.068 1.00 0.00 H new ATOM 0 HD21 LEU B 377 1.143 16.372 7.760 1.00 0.00 H new ATOM 0 HD22 LEU B 377 0.347 16.083 6.194 1.00 0.00 H new ATOM 0 HD23 LEU B 377 0.852 14.707 7.204 1.00 0.00 H new ATOM 1252 N ILE B 378 3.759 14.752 2.168 1.00 0.00 N ATOM 1253 CA ILE B 378 4.910 14.932 1.287 1.00 0.00 C ATOM 1254 C ILE B 378 4.531 14.687 -0.172 1.00 0.00 C ATOM 1255 O ILE B 378 3.368 14.820 -0.553 1.00 0.00 O ATOM 1256 CB ILE B 378 6.064 13.981 1.662 1.00 0.00 C ATOM 1257 CG1 ILE B 378 5.886 13.452 3.086 1.00 0.00 C ATOM 1258 CG2 ILE B 378 7.400 14.693 1.524 1.00 0.00 C ATOM 1259 CD1 ILE B 378 6.198 14.479 4.150 1.00 0.00 C ATOM 0 H ILE B 378 3.443 13.787 2.260 1.00 0.00 H new ATOM 0 HA ILE B 378 5.239 15.963 1.412 1.00 0.00 H new ATOM 0 HB ILE B 378 6.048 13.133 0.977 1.00 0.00 H new ATOM 0 HG12 ILE B 378 4.859 13.109 3.213 1.00 0.00 H new ATOM 0 HG13 ILE B 378 6.532 12.585 3.227 1.00 0.00 H new ATOM 0 HG21 ILE B 378 8.206 14.010 1.792 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.532 15.023 0.494 1.00 0.00 H new ATOM 0 HG23 ILE B 378 7.422 15.558 2.187 1.00 0.00 H new ATOM 0 HD11 ILE B 378 6.051 14.038 5.136 1.00 0.00 H new ATOM 0 HD12 ILE B 378 7.233 14.805 4.049 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.535 15.336 4.034 1.00 0.00 H new ATOM 1271 N GLY B 379 5.522 14.322 -0.983 1.00 0.00 N ATOM 1272 CA GLY B 379 5.277 14.056 -2.388 1.00 0.00 C ATOM 1273 C GLY B 379 4.631 15.225 -3.106 1.00 0.00 C ATOM 1274 O GLY B 379 3.552 15.678 -2.726 1.00 0.00 O ATOM 0 H GLY B 379 6.492 14.206 -0.689 1.00 0.00 H new ATOM 0 HA2 GLY B 379 6.221 13.813 -2.876 1.00 0.00 H new ATOM 0 HA3 GLY B 379 4.635 13.180 -2.480 1.00 0.00 H new ATOM 1278 N TYR B 380 5.293 15.709 -4.154 1.00 0.00 N ATOM 1279 CA TYR B 380 4.777 16.826 -4.936 1.00 0.00 C ATOM 1280 C TYR B 380 5.091 16.639 -6.418 1.00 0.00 C ATOM 1281 O TYR B 380 5.558 15.579 -6.834 1.00 0.00 O ATOM 1282 CB TYR B 380 5.357 18.151 -4.433 1.00 0.00 C ATOM 1283 CG TYR B 380 6.856 18.132 -4.236 1.00 0.00 C ATOM 1284 CD1 TYR B 380 7.438 17.341 -3.254 1.00 0.00 C ATOM 1285 CD2 TYR B 380 7.689 18.912 -5.030 1.00 0.00 C ATOM 1286 CE1 TYR B 380 8.807 17.326 -3.069 1.00 0.00 C ATOM 1287 CE2 TYR B 380 9.059 18.902 -4.850 1.00 0.00 C ATOM 1288 CZ TYR B 380 9.613 18.107 -3.869 1.00 0.00 C ATOM 1289 OH TYR B 380 10.976 18.094 -3.688 1.00 0.00 O ATOM 0 H TYR B 380 6.188 15.344 -4.480 1.00 0.00 H new ATOM 0 HA TYR B 380 3.694 16.853 -4.814 1.00 0.00 H new ATOM 0 HB2 TYR B 380 5.104 18.939 -5.143 1.00 0.00 H new ATOM 0 HB3 TYR B 380 4.880 18.409 -3.487 1.00 0.00 H new ATOM 0 HD1 TYR B 380 6.810 16.728 -2.625 1.00 0.00 H new ATOM 0 HD2 TYR B 380 7.259 19.536 -5.800 1.00 0.00 H new ATOM 0 HE1 TYR B 380 9.244 16.705 -2.301 1.00 0.00 H new ATOM 0 HE2 TYR B 380 9.693 19.514 -5.475 1.00 0.00 H new ATOM 0 HH TYR B 380 11.191 18.438 -2.796 1.00 0.00 H new ATOM 1299 N ALA B 381 4.821 17.669 -7.211 1.00 0.00 N ATOM 1300 CA ALA B 381 5.064 17.613 -8.648 1.00 0.00 C ATOM 1301 C ALA B 381 6.550 17.458 -8.965 1.00 0.00 C ATOM 1302 O ALA B 381 6.918 16.768 -9.916 1.00 0.00 O ATOM 1303 CB ALA B 381 4.510 18.851 -9.338 1.00 0.00 C ATOM 0 H ALA B 381 4.433 18.554 -6.883 1.00 0.00 H new ATOM 0 HA ALA B 381 4.545 16.733 -9.028 1.00 0.00 H new ATOM 0 HB1 ALA B 381 4.703 18.788 -10.409 1.00 0.00 H new ATOM 0 HB2 ALA B 381 3.436 18.913 -9.166 1.00 0.00 H new ATOM 0 HB3 ALA B 381 4.994 19.740 -8.934 1.00 0.00 H new ATOM 1309 N SER B 382 7.399 18.108 -8.177 1.00 0.00 N ATOM 1310 CA SER B 382 8.842 18.044 -8.392 1.00 0.00 C ATOM 1311 C SER B 382 9.447 16.790 -7.764 1.00 0.00 C ATOM 1312 O SER B 382 10.615 16.474 -7.993 1.00 0.00 O ATOM 1313 CB SER B 382 9.520 19.290 -7.823 1.00 0.00 C ATOM 1314 OG SER B 382 10.013 20.121 -8.859 1.00 0.00 O ATOM 0 H SER B 382 7.115 18.684 -7.385 1.00 0.00 H new ATOM 0 HA SER B 382 9.014 18.000 -9.468 1.00 0.00 H new ATOM 0 HB2 SER B 382 8.810 19.847 -7.213 1.00 0.00 H new ATOM 0 HB3 SER B 382 10.340 18.995 -7.168 1.00 0.00 H new ATOM 0 HG SER B 382 10.440 20.912 -8.469 1.00 0.00 H new ATOM 1320 N LEU B 383 8.651 16.081 -6.971 1.00 0.00 N ATOM 1321 CA LEU B 383 9.121 14.865 -6.315 1.00 0.00 C ATOM 1322 C LEU B 383 8.283 13.661 -6.735 1.00 0.00 C ATOM 1323 O LEU B 383 7.191 13.812 -7.282 1.00 0.00 O ATOM 1324 CB LEU B 383 9.087 15.035 -4.795 1.00 0.00 C ATOM 1325 CG LEU B 383 9.464 13.792 -3.988 1.00 0.00 C ATOM 1326 CD1 LEU B 383 10.945 13.484 -4.146 1.00 0.00 C ATOM 1327 CD2 LEU B 383 9.114 13.986 -2.520 1.00 0.00 C ATOM 0 H LEU B 383 7.682 16.325 -6.767 1.00 0.00 H new ATOM 0 HA LEU B 383 10.151 14.686 -6.625 1.00 0.00 H new ATOM 0 HB2 LEU B 383 9.764 15.844 -4.522 1.00 0.00 H new ATOM 0 HB3 LEU B 383 8.084 15.346 -4.503 1.00 0.00 H new ATOM 0 HG LEU B 383 8.894 12.945 -4.370 1.00 0.00 H new ATOM 0 HD11 LEU B 383 11.196 12.597 -3.565 1.00 0.00 H new ATOM 0 HD12 LEU B 383 11.169 13.305 -5.198 1.00 0.00 H new ATOM 0 HD13 LEU B 383 11.533 14.330 -3.789 1.00 0.00 H new ATOM 0 HD21 LEU B 383 9.389 13.092 -1.959 1.00 0.00 H new ATOM 0 HD22 LEU B 383 9.660 14.843 -2.126 1.00 0.00 H new ATOM 0 HD23 LEU B 383 8.043 14.161 -2.421 1.00 0.00 H new ATOM 1339 N ARG B 384 8.809 12.466 -6.485 1.00 0.00 N ATOM 1340 CA ARG B 384 8.115 11.237 -6.847 1.00 0.00 C ATOM 1341 C ARG B 384 8.647 10.052 -6.050 1.00 0.00 C ATOM 1342 O ARG B 384 9.720 9.536 -6.347 1.00 0.00 O ATOM 1343 CB ARG B 384 8.291 10.961 -8.339 1.00 0.00 C ATOM 1344 CG ARG B 384 6.982 10.845 -9.095 1.00 0.00 C ATOM 1345 CD ARG B 384 7.038 11.597 -10.414 1.00 0.00 C ATOM 1346 NE ARG B 384 6.719 10.734 -11.549 1.00 0.00 N ATOM 1347 CZ ARG B 384 7.605 9.940 -12.141 1.00 0.00 C ATOM 1348 NH1 ARG B 384 8.859 9.908 -11.711 1.00 0.00 N ATOM 1349 NH2 ARG B 384 7.239 9.180 -13.163 1.00 0.00 N ATOM 0 H ARG B 384 9.713 12.324 -6.034 1.00 0.00 H new ATOM 0 HA ARG B 384 7.058 11.366 -6.616 1.00 0.00 H new ATOM 0 HB2 ARG B 384 8.886 11.761 -8.780 1.00 0.00 H new ATOM 0 HB3 ARG B 384 8.856 10.037 -8.465 1.00 0.00 H new ATOM 0 HG2 ARG B 384 6.759 9.794 -9.282 1.00 0.00 H new ATOM 0 HG3 ARG B 384 6.170 11.239 -8.483 1.00 0.00 H new ATOM 0 HD2 ARG B 384 6.338 12.432 -10.385 1.00 0.00 H new ATOM 0 HD3 ARG B 384 8.034 12.020 -10.548 1.00 0.00 H new ATOM 0 HE ARG B 384 5.764 10.741 -11.907 1.00 0.00 H new ATOM 0 HH11 ARG B 384 9.144 10.493 -10.925 1.00 0.00 H new ATOM 0 HH12 ARG B 384 9.539 9.298 -12.166 1.00 0.00 H new ATOM 0 HH21 ARG B 384 6.275 9.204 -13.497 1.00 0.00 H new ATOM 0 HH22 ARG B 384 7.921 8.571 -13.616 1.00 0.00 H new ATOM 1363 N LEU B 385 7.873 9.592 -5.073 1.00 0.00 N ATOM 1364 CA LEU B 385 8.254 8.437 -4.267 1.00 0.00 C ATOM 1365 C LEU B 385 7.327 7.280 -4.617 1.00 0.00 C ATOM 1366 O LEU B 385 6.125 7.486 -4.782 1.00 0.00 O ATOM 1367 CB LEU B 385 8.152 8.773 -2.773 1.00 0.00 C ATOM 1368 CG LEU B 385 6.734 8.760 -2.201 1.00 0.00 C ATOM 1369 CD1 LEU B 385 6.758 8.954 -0.693 1.00 0.00 C ATOM 1370 CD2 LEU B 385 5.893 9.836 -2.859 1.00 0.00 C ATOM 0 H LEU B 385 6.975 10.003 -4.819 1.00 0.00 H new ATOM 0 HA LEU B 385 9.287 8.160 -4.478 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.759 8.061 -2.214 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.585 9.760 -2.608 1.00 0.00 H new ATOM 0 HG LEU B 385 6.288 7.788 -2.412 1.00 0.00 H new ATOM 0 HD11 LEU B 385 5.738 8.941 -0.308 1.00 0.00 H new ATOM 0 HD12 LEU B 385 7.330 8.149 -0.232 1.00 0.00 H new ATOM 0 HD13 LEU B 385 7.223 9.911 -0.457 1.00 0.00 H new ATOM 0 HD21 LEU B 385 4.886 9.816 -2.443 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.342 10.812 -2.675 1.00 0.00 H new ATOM 0 HD23 LEU B 385 5.845 9.655 -3.933 1.00 0.00 H new ATOM 1382 N HIS B 386 7.854 6.063 -4.702 1.00 0.00 N ATOM 1383 CA HIS B 386 7.027 4.901 -4.998 1.00 0.00 C ATOM 1384 C HIS B 386 7.284 3.791 -3.981 1.00 0.00 C ATOM 1385 O HIS B 386 8.282 3.829 -3.252 1.00 0.00 O ATOM 1386 CB HIS B 386 7.314 4.391 -6.409 1.00 0.00 C ATOM 1387 CG HIS B 386 8.651 3.734 -6.534 1.00 0.00 C ATOM 1388 ND1 HIS B 386 9.703 3.715 -5.683 1.00 0.00 N flip ATOM 1389 CD2 HIS B 386 9.033 2.992 -7.631 1.00 0.00 C flip ATOM 1390 CE1 HIS B 386 10.692 2.969 -6.275 1.00 0.00 C flip ATOM 1391 NE2 HIS B 386 10.264 2.545 -7.449 1.00 0.00 N flip ATOM 0 H HIS B 386 8.844 5.857 -4.571 1.00 0.00 H new ATOM 0 HA HIS B 386 5.980 5.199 -4.936 1.00 0.00 H new ATOM 0 HB2 HIS B 386 6.539 3.681 -6.697 1.00 0.00 H new ATOM 0 HB3 HIS B 386 7.259 5.225 -7.109 1.00 0.00 H new ATOM 0 HD1 HIS B 386 9.752 4.170 -4.771 1.00 0.00 H new ATOM 0 HD2 HIS B 386 8.423 2.805 -8.502 1.00 0.00 H new ATOM 0 HE1 HIS B 386 11.663 2.763 -5.849 1.00 0.00 H new ATOM 1400 N TYR B 387 6.414 2.786 -3.954 1.00 0.00 N ATOM 1401 CA TYR B 387 6.591 1.654 -3.052 1.00 0.00 C ATOM 1402 C TYR B 387 7.156 0.460 -3.813 1.00 0.00 C ATOM 1403 O TYR B 387 6.467 -0.138 -4.640 1.00 0.00 O ATOM 1404 CB TYR B 387 5.260 1.269 -2.409 1.00 0.00 C ATOM 1405 CG TYR B 387 4.720 2.327 -1.485 1.00 0.00 C ATOM 1406 CD1 TYR B 387 4.005 3.405 -1.983 1.00 0.00 C ATOM 1407 CD2 TYR B 387 4.931 2.253 -0.117 1.00 0.00 C ATOM 1408 CE1 TYR B 387 3.515 4.381 -1.142 1.00 0.00 C ATOM 1409 CE2 TYR B 387 4.443 3.226 0.731 1.00 0.00 C ATOM 1410 CZ TYR B 387 3.735 4.288 0.214 1.00 0.00 C ATOM 1411 OH TYR B 387 3.248 5.262 1.057 1.00 0.00 O ATOM 0 H TYR B 387 5.583 2.733 -4.543 1.00 0.00 H new ATOM 0 HA TYR B 387 7.291 1.945 -2.268 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.529 1.073 -3.193 1.00 0.00 H new ATOM 0 HB3 TYR B 387 5.388 0.341 -1.852 1.00 0.00 H new ATOM 0 HD1 TYR B 387 3.829 3.481 -3.046 1.00 0.00 H new ATOM 0 HD2 TYR B 387 5.486 1.421 0.291 1.00 0.00 H new ATOM 0 HE1 TYR B 387 2.961 5.216 -1.545 1.00 0.00 H new ATOM 0 HE2 TYR B 387 4.615 3.155 1.795 1.00 0.00 H new ATOM 0 HH TYR B 387 3.171 4.901 1.965 1.00 0.00 H new ATOM 1421 N VAL B 388 8.408 0.118 -3.538 1.00 0.00 N ATOM 1422 CA VAL B 388 9.052 -1.005 -4.206 1.00 0.00 C ATOM 1423 C VAL B 388 8.871 -2.289 -3.404 1.00 0.00 C ATOM 1424 O VAL B 388 9.278 -2.371 -2.247 1.00 0.00 O ATOM 1425 CB VAL B 388 10.555 -0.744 -4.415 1.00 0.00 C ATOM 1426 CG1 VAL B 388 10.785 0.084 -5.670 1.00 0.00 C ATOM 1427 CG2 VAL B 388 11.147 -0.054 -3.195 1.00 0.00 C ATOM 0 H VAL B 388 8.996 0.601 -2.859 1.00 0.00 H new ATOM 0 HA VAL B 388 8.576 -1.118 -5.180 1.00 0.00 H new ATOM 0 HB VAL B 388 11.059 -1.702 -4.545 1.00 0.00 H new ATOM 0 HG11 VAL B 388 11.853 0.258 -5.800 1.00 0.00 H new ATOM 0 HG12 VAL B 388 10.396 -0.452 -6.536 1.00 0.00 H new ATOM 0 HG13 VAL B 388 10.271 1.040 -5.574 1.00 0.00 H new ATOM 0 HG21 VAL B 388 12.210 0.124 -3.358 1.00 0.00 H new ATOM 0 HG22 VAL B 388 10.640 0.898 -3.034 1.00 0.00 H new ATOM 0 HG23 VAL B 388 11.015 -0.688 -2.319 1.00 0.00 H new ATOM 1437 N THR B 389 8.245 -3.285 -4.023 1.00 0.00 N ATOM 1438 CA THR B 389 7.999 -4.558 -3.357 1.00 0.00 C ATOM 1439 C THR B 389 8.936 -5.653 -3.862 1.00 0.00 C ATOM 1440 O THR B 389 8.998 -5.932 -5.058 1.00 0.00 O ATOM 1441 CB THR B 389 6.542 -5.018 -3.555 1.00 0.00 C ATOM 1442 OG1 THR B 389 6.354 -6.364 -3.100 1.00 0.00 O ATOM 1443 CG2 THR B 389 6.147 -4.946 -5.022 1.00 0.00 C ATOM 0 H THR B 389 7.900 -3.235 -4.982 1.00 0.00 H new ATOM 0 HA THR B 389 8.188 -4.393 -2.296 1.00 0.00 H new ATOM 0 HB THR B 389 5.914 -4.347 -2.968 1.00 0.00 H new ATOM 0 HG1 THR B 389 5.420 -6.628 -3.237 1.00 0.00 H new ATOM 0 HG21 THR B 389 5.114 -5.276 -5.137 1.00 0.00 H new ATOM 0 HG22 THR B 389 6.242 -3.919 -5.374 1.00 0.00 H new ATOM 0 HG23 THR B 389 6.801 -5.592 -5.607 1.00 0.00 H new ATOM 1451 N VAL B 390 9.654 -6.274 -2.930 1.00 0.00 N ATOM 1452 CA VAL B 390 10.584 -7.348 -3.260 1.00 0.00 C ATOM 1453 C VAL B 390 10.362 -8.547 -2.345 1.00 0.00 C ATOM 1454 O VAL B 390 10.331 -8.408 -1.121 1.00 0.00 O ATOM 1455 CB VAL B 390 12.048 -6.888 -3.134 1.00 0.00 C ATOM 1456 CG1 VAL B 390 12.403 -5.917 -4.249 1.00 0.00 C ATOM 1457 CG2 VAL B 390 12.295 -6.264 -1.768 1.00 0.00 C ATOM 0 H VAL B 390 9.608 -6.050 -1.936 1.00 0.00 H new ATOM 0 HA VAL B 390 10.393 -7.631 -4.295 1.00 0.00 H new ATOM 0 HB VAL B 390 12.694 -7.761 -3.230 1.00 0.00 H new ATOM 0 HG11 VAL B 390 13.442 -5.604 -4.142 1.00 0.00 H new ATOM 0 HG12 VAL B 390 12.269 -6.406 -5.214 1.00 0.00 H new ATOM 0 HG13 VAL B 390 11.753 -5.044 -4.192 1.00 0.00 H new ATOM 0 HG21 VAL B 390 13.335 -5.945 -1.696 1.00 0.00 H new ATOM 0 HG22 VAL B 390 11.641 -5.402 -1.638 1.00 0.00 H new ATOM 0 HG23 VAL B 390 12.087 -6.998 -0.990 1.00 0.00 H new ATOM 1467 N LYS B 391 10.175 -9.721 -2.936 1.00 0.00 N ATOM 1468 CA LYS B 391 9.932 -10.922 -2.155 1.00 0.00 C ATOM 1469 C LYS B 391 9.824 -12.153 -3.045 1.00 0.00 C ATOM 1470 O LYS B 391 9.600 -12.045 -4.252 1.00 0.00 O ATOM 1471 CB LYS B 391 8.664 -10.750 -1.314 1.00 0.00 C ATOM 1472 CG LYS B 391 7.423 -11.425 -1.890 1.00 0.00 C ATOM 1473 CD LYS B 391 6.845 -10.633 -3.053 1.00 0.00 C ATOM 1474 CE LYS B 391 5.409 -11.040 -3.345 1.00 0.00 C ATOM 1475 NZ LYS B 391 4.509 -9.859 -3.455 1.00 0.00 N ATOM 0 H LYS B 391 10.187 -9.864 -3.946 1.00 0.00 H new ATOM 0 HA LYS B 391 10.782 -11.074 -1.490 1.00 0.00 H new ATOM 0 HB2 LYS B 391 8.849 -11.149 -0.317 1.00 0.00 H new ATOM 0 HB3 LYS B 391 8.462 -9.685 -1.199 1.00 0.00 H new ATOM 0 HG2 LYS B 391 7.677 -12.431 -2.224 1.00 0.00 H new ATOM 0 HG3 LYS B 391 6.669 -11.529 -1.110 1.00 0.00 H new ATOM 0 HD2 LYS B 391 6.883 -9.568 -2.824 1.00 0.00 H new ATOM 0 HD3 LYS B 391 7.457 -10.790 -3.941 1.00 0.00 H new ATOM 0 HE2 LYS B 391 5.375 -11.610 -4.273 1.00 0.00 H new ATOM 0 HE3 LYS B 391 5.050 -11.698 -2.553 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 3.540 -10.179 -3.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 4.522 -9.328 -2.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 4.836 -9.244 -4.227 1.00 0.00 H new ATOM 1489 N LYS B 392 9.943 -13.324 -2.432 1.00 0.00 N ATOM 1490 CA LYS B 392 9.813 -14.579 -3.154 1.00 0.00 C ATOM 1491 C LYS B 392 8.424 -15.154 -2.902 1.00 0.00 C ATOM 1492 O LYS B 392 8.244 -16.021 -2.047 1.00 0.00 O ATOM 1493 CB LYS B 392 10.884 -15.576 -2.704 1.00 0.00 C ATOM 1494 CG LYS B 392 12.267 -15.273 -3.256 1.00 0.00 C ATOM 1495 CD LYS B 392 12.306 -15.413 -4.769 1.00 0.00 C ATOM 1496 CE LYS B 392 12.618 -14.087 -5.444 1.00 0.00 C ATOM 1497 NZ LYS B 392 12.218 -14.086 -6.877 1.00 0.00 N ATOM 0 H LYS B 392 10.130 -13.429 -1.435 1.00 0.00 H new ATOM 0 HA LYS B 392 9.949 -14.395 -4.220 1.00 0.00 H new ATOM 0 HB2 LYS B 392 10.930 -15.581 -1.615 1.00 0.00 H new ATOM 0 HB3 LYS B 392 10.589 -16.578 -3.015 1.00 0.00 H new ATOM 0 HG2 LYS B 392 12.558 -14.261 -2.976 1.00 0.00 H new ATOM 0 HG3 LYS B 392 12.995 -15.949 -2.808 1.00 0.00 H new ATOM 0 HD2 LYS B 392 13.059 -16.150 -5.048 1.00 0.00 H new ATOM 0 HD3 LYS B 392 11.346 -15.787 -5.126 1.00 0.00 H new ATOM 0 HE2 LYS B 392 12.099 -13.283 -4.922 1.00 0.00 H new ATOM 0 HE3 LYS B 392 13.686 -13.882 -5.365 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 12.447 -13.164 -7.301 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 12.732 -14.837 -7.381 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 11.195 -14.256 -6.952 1.00 0.00 H new ATOM 1511 N PRO B 393 7.419 -14.661 -3.639 1.00 0.00 N ATOM 1512 CA PRO B 393 6.033 -15.110 -3.489 1.00 0.00 C ATOM 1513 C PRO B 393 5.880 -16.596 -3.763 1.00 0.00 C ATOM 1514 O PRO B 393 6.192 -17.072 -4.855 1.00 0.00 O ATOM 1515 CB PRO B 393 5.261 -14.287 -4.528 1.00 0.00 C ATOM 1516 CG PRO B 393 6.296 -13.784 -5.476 1.00 0.00 C ATOM 1517 CD PRO B 393 7.551 -13.620 -4.668 1.00 0.00 C ATOM 0 HA PRO B 393 5.670 -14.967 -2.471 1.00 0.00 H new ATOM 0 HB2 PRO B 393 4.520 -14.898 -5.043 1.00 0.00 H new ATOM 0 HB3 PRO B 393 4.724 -13.463 -4.058 1.00 0.00 H new ATOM 0 HG2 PRO B 393 6.449 -14.486 -6.296 1.00 0.00 H new ATOM 0 HG3 PRO B 393 5.991 -12.836 -5.920 1.00 0.00 H new ATOM 0 HD2 PRO B 393 8.444 -13.764 -5.276 1.00 0.00 H new ATOM 0 HD3 PRO B 393 7.621 -12.625 -4.229 1.00 0.00 H new ATOM 1525 N THR B 394 5.401 -17.327 -2.766 1.00 0.00 N ATOM 1526 CA THR B 394 5.211 -18.760 -2.903 1.00 0.00 C ATOM 1527 C THR B 394 3.822 -19.179 -2.444 1.00 0.00 C ATOM 1528 O THR B 394 3.156 -18.469 -1.690 1.00 0.00 O ATOM 1529 CB THR B 394 6.256 -19.547 -2.096 1.00 0.00 C ATOM 1530 OG1 THR B 394 7.469 -18.799 -1.939 1.00 0.00 O ATOM 1531 CG2 THR B 394 6.585 -20.865 -2.779 1.00 0.00 C ATOM 0 H THR B 394 5.138 -16.950 -1.856 1.00 0.00 H new ATOM 0 HA THR B 394 5.328 -18.989 -3.962 1.00 0.00 H new ATOM 0 HB THR B 394 5.822 -19.736 -1.114 1.00 0.00 H new ATOM 0 HG1 THR B 394 8.094 -19.304 -1.378 1.00 0.00 H new ATOM 0 HG21 THR B 394 7.327 -21.405 -2.190 1.00 0.00 H new ATOM 0 HG22 THR B 394 5.680 -21.467 -2.863 1.00 0.00 H new ATOM 0 HG23 THR B 394 6.984 -20.669 -3.774 1.00 0.00 H new ATOM 1539 N ALA B 395 3.387 -20.324 -2.941 1.00 0.00 N ATOM 1540 CA ALA B 395 2.061 -20.830 -2.624 1.00 0.00 C ATOM 1541 C ALA B 395 1.821 -20.818 -1.118 1.00 0.00 C ATOM 1542 O ALA B 395 0.807 -20.301 -0.653 1.00 0.00 O ATOM 1543 CB ALA B 395 1.882 -22.239 -3.160 1.00 0.00 C ATOM 0 H ALA B 395 3.931 -20.921 -3.565 1.00 0.00 H new ATOM 0 HA ALA B 395 1.332 -20.175 -3.101 1.00 0.00 H new ATOM 0 HB1 ALA B 395 0.883 -22.599 -2.912 1.00 0.00 H new ATOM 0 HB2 ALA B 395 2.008 -22.235 -4.243 1.00 0.00 H new ATOM 0 HB3 ALA B 395 2.626 -22.896 -2.711 1.00 0.00 H new ATOM 1549 N VAL B 396 2.741 -21.398 -0.358 1.00 0.00 N ATOM 1550 CA VAL B 396 2.595 -21.454 1.091 1.00 0.00 C ATOM 1551 C VAL B 396 3.163 -20.205 1.761 1.00 0.00 C ATOM 1552 O VAL B 396 2.625 -19.730 2.760 1.00 0.00 O ATOM 1553 CB VAL B 396 3.277 -22.711 1.670 1.00 0.00 C ATOM 1554 CG1 VAL B 396 4.562 -23.005 0.920 1.00 0.00 C ATOM 1555 CG2 VAL B 396 3.537 -22.559 3.164 1.00 0.00 C ATOM 0 H VAL B 396 3.591 -21.833 -0.717 1.00 0.00 H new ATOM 0 HA VAL B 396 1.527 -21.503 1.302 1.00 0.00 H new ATOM 0 HB VAL B 396 2.601 -23.556 1.540 1.00 0.00 H new ATOM 0 HG11 VAL B 396 5.033 -23.894 1.339 1.00 0.00 H new ATOM 0 HG12 VAL B 396 4.338 -23.175 -0.133 1.00 0.00 H new ATOM 0 HG13 VAL B 396 5.240 -22.157 1.014 1.00 0.00 H new ATOM 0 HG21 VAL B 396 4.018 -23.461 3.543 1.00 0.00 H new ATOM 0 HG22 VAL B 396 4.188 -21.701 3.335 1.00 0.00 H new ATOM 0 HG23 VAL B 396 2.591 -22.406 3.684 1.00 0.00 H new ATOM 1565 N ASP B 397 4.255 -19.681 1.214 1.00 0.00 N ATOM 1566 CA ASP B 397 4.887 -18.494 1.777 1.00 0.00 C ATOM 1567 C ASP B 397 4.692 -17.277 0.873 1.00 0.00 C ATOM 1568 O ASP B 397 5.397 -17.104 -0.121 1.00 0.00 O ATOM 1569 CB ASP B 397 6.376 -18.756 2.020 1.00 0.00 C ATOM 1570 CG ASP B 397 7.206 -18.710 0.751 1.00 0.00 C ATOM 1571 OD1 ASP B 397 7.607 -17.600 0.341 1.00 0.00 O ATOM 1572 OD2 ASP B 397 7.466 -19.787 0.175 1.00 0.00 O ATOM 0 H ASP B 397 4.718 -20.057 0.387 1.00 0.00 H new ATOM 0 HA ASP B 397 4.408 -18.274 2.731 1.00 0.00 H new ATOM 0 HB2 ASP B 397 6.758 -18.016 2.723 1.00 0.00 H new ATOM 0 HB3 ASP B 397 6.495 -19.733 2.489 1.00 0.00 H new ATOM 1577 N PRO B 398 3.709 -16.426 1.205 1.00 0.00 N ATOM 1578 CA PRO B 398 3.389 -15.230 0.434 1.00 0.00 C ATOM 1579 C PRO B 398 4.100 -13.973 0.942 1.00 0.00 C ATOM 1580 O PRO B 398 4.336 -13.038 0.176 1.00 0.00 O ATOM 1581 CB PRO B 398 1.887 -15.113 0.658 1.00 0.00 C ATOM 1582 CG PRO B 398 1.677 -15.607 2.056 1.00 0.00 C ATOM 1583 CD PRO B 398 2.803 -16.575 2.356 1.00 0.00 C ATOM 0 HA PRO B 398 3.701 -15.310 -0.607 1.00 0.00 H new ATOM 0 HB2 PRO B 398 1.548 -14.083 0.546 1.00 0.00 H new ATOM 0 HB3 PRO B 398 1.330 -15.712 -0.063 1.00 0.00 H new ATOM 0 HG2 PRO B 398 1.682 -14.778 2.763 1.00 0.00 H new ATOM 0 HG3 PRO B 398 0.709 -16.100 2.150 1.00 0.00 H new ATOM 0 HD2 PRO B 398 3.303 -16.330 3.293 1.00 0.00 H new ATOM 0 HD3 PRO B 398 2.438 -17.598 2.448 1.00 0.00 H new ATOM 1591 N ASN B 399 4.383 -13.930 2.244 1.00 0.00 N ATOM 1592 CA ASN B 399 5.002 -12.756 2.862 1.00 0.00 C ATOM 1593 C ASN B 399 5.928 -12.023 1.904 1.00 0.00 C ATOM 1594 O ASN B 399 6.579 -12.628 1.052 1.00 0.00 O ATOM 1595 CB ASN B 399 5.779 -13.168 4.115 1.00 0.00 C ATOM 1596 CG ASN B 399 6.953 -14.074 3.794 1.00 0.00 C ATOM 1597 OD1 ASN B 399 6.659 -15.314 3.419 1.00 0.00 O flip ATOM 1598 ND2 ASN B 399 8.110 -13.665 3.884 1.00 0.00 N flip ATOM 0 H ASN B 399 4.194 -14.695 2.892 1.00 0.00 H new ATOM 0 HA ASN B 399 4.197 -12.073 3.133 1.00 0.00 H new ATOM 0 HB2 ASN B 399 6.141 -12.275 4.625 1.00 0.00 H new ATOM 0 HB3 ASN B 399 5.107 -13.679 4.805 1.00 0.00 H new ATOM 0 HD21 ASN B 399 8.290 -12.704 4.176 1.00 0.00 H new ATOM 0 HD22 ASN B 399 8.889 -14.287 3.667 1.00 0.00 H new ATOM 1605 N SER B 400 5.942 -10.698 2.041 1.00 0.00 N ATOM 1606 CA SER B 400 6.746 -9.847 1.175 1.00 0.00 C ATOM 1607 C SER B 400 7.271 -8.608 1.896 1.00 0.00 C ATOM 1608 O SER B 400 6.672 -8.128 2.861 1.00 0.00 O ATOM 1609 CB SER B 400 5.902 -9.399 -0.022 1.00 0.00 C ATOM 1610 OG SER B 400 6.676 -8.657 -0.947 1.00 0.00 O ATOM 0 H SER B 400 5.404 -10.193 2.745 1.00 0.00 H new ATOM 0 HA SER B 400 7.605 -10.435 0.852 1.00 0.00 H new ATOM 0 HB2 SER B 400 5.477 -10.272 -0.517 1.00 0.00 H new ATOM 0 HB3 SER B 400 5.066 -8.792 0.326 1.00 0.00 H new ATOM 0 HG SER B 400 6.100 -8.021 -1.420 1.00 0.00 H new ATOM 1616 N ILE B 401 8.387 -8.084 1.387 1.00 0.00 N ATOM 1617 CA ILE B 401 8.994 -6.876 1.933 1.00 0.00 C ATOM 1618 C ILE B 401 8.842 -5.743 0.928 1.00 0.00 C ATOM 1619 O ILE B 401 8.875 -5.971 -0.282 1.00 0.00 O ATOM 1620 CB ILE B 401 10.488 -7.067 2.275 1.00 0.00 C ATOM 1621 CG1 ILE B 401 11.061 -5.778 2.867 1.00 0.00 C ATOM 1622 CG2 ILE B 401 11.276 -7.481 1.043 1.00 0.00 C ATOM 1623 CD1 ILE B 401 12.297 -5.995 3.714 1.00 0.00 C ATOM 0 H ILE B 401 8.889 -8.482 0.593 1.00 0.00 H new ATOM 0 HA ILE B 401 8.478 -6.638 2.863 1.00 0.00 H new ATOM 0 HB ILE B 401 10.573 -7.863 3.015 1.00 0.00 H new ATOM 0 HG12 ILE B 401 11.303 -5.092 2.055 1.00 0.00 H new ATOM 0 HG13 ILE B 401 10.295 -5.296 3.474 1.00 0.00 H new ATOM 0 HG21 ILE B 401 12.325 -7.610 1.308 1.00 0.00 H new ATOM 0 HG22 ILE B 401 10.881 -8.421 0.658 1.00 0.00 H new ATOM 0 HG23 ILE B 401 11.187 -6.710 0.278 1.00 0.00 H new ATOM 0 HD11 ILE B 401 12.647 -5.037 4.100 1.00 0.00 H new ATOM 0 HD12 ILE B 401 12.056 -6.655 4.547 1.00 0.00 H new ATOM 0 HD13 ILE B 401 13.080 -6.449 3.106 1.00 0.00 H new ATOM 1635 N VAL B 402 8.673 -4.527 1.423 1.00 0.00 N ATOM 1636 CA VAL B 402 8.515 -3.369 0.551 1.00 0.00 C ATOM 1637 C VAL B 402 9.458 -2.259 0.973 1.00 0.00 C ATOM 1638 O VAL B 402 10.088 -2.344 2.022 1.00 0.00 O ATOM 1639 CB VAL B 402 7.067 -2.831 0.560 1.00 0.00 C ATOM 1640 CG1 VAL B 402 6.479 -2.864 -0.842 1.00 0.00 C ATOM 1641 CG2 VAL B 402 6.197 -3.624 1.527 1.00 0.00 C ATOM 0 H VAL B 402 8.641 -4.314 2.420 1.00 0.00 H new ATOM 0 HA VAL B 402 8.753 -3.697 -0.461 1.00 0.00 H new ATOM 0 HB VAL B 402 7.091 -1.796 0.901 1.00 0.00 H new ATOM 0 HG11 VAL B 402 5.459 -2.482 -0.818 1.00 0.00 H new ATOM 0 HG12 VAL B 402 7.083 -2.244 -1.505 1.00 0.00 H new ATOM 0 HG13 VAL B 402 6.473 -3.890 -1.210 1.00 0.00 H new ATOM 0 HG21 VAL B 402 5.183 -3.225 1.515 1.00 0.00 H new ATOM 0 HG22 VAL B 402 6.179 -4.671 1.225 1.00 0.00 H new ATOM 0 HG23 VAL B 402 6.606 -3.544 2.534 1.00 0.00 H new ATOM 1651 N GLU B 403 9.561 -1.224 0.152 1.00 0.00 N ATOM 1652 CA GLU B 403 10.441 -0.106 0.457 1.00 0.00 C ATOM 1653 C GLU B 403 9.846 1.212 -0.020 1.00 0.00 C ATOM 1654 O GLU B 403 9.522 1.371 -1.197 1.00 0.00 O ATOM 1655 CB GLU B 403 11.814 -0.315 -0.185 1.00 0.00 C ATOM 1656 CG GLU B 403 12.026 -1.716 -0.735 1.00 0.00 C ATOM 1657 CD GLU B 403 12.359 -2.723 0.347 1.00 0.00 C ATOM 1658 OE1 GLU B 403 13.246 -2.431 1.178 1.00 0.00 O ATOM 1659 OE2 GLU B 403 11.734 -3.804 0.366 1.00 0.00 O ATOM 0 H GLU B 403 9.049 -1.135 -0.726 1.00 0.00 H new ATOM 0 HA GLU B 403 10.554 -0.061 1.540 1.00 0.00 H new ATOM 0 HB2 GLU B 403 11.941 0.406 -0.993 1.00 0.00 H new ATOM 0 HB3 GLU B 403 12.587 -0.104 0.554 1.00 0.00 H new ATOM 0 HG2 GLU B 403 11.126 -2.036 -1.260 1.00 0.00 H new ATOM 0 HG3 GLU B 403 12.832 -1.696 -1.468 1.00 0.00 H new ATOM 1666 N CYS B 404 9.728 2.162 0.899 1.00 0.00 N ATOM 1667 CA CYS B 404 9.201 3.478 0.572 1.00 0.00 C ATOM 1668 C CYS B 404 10.340 4.391 0.149 1.00 0.00 C ATOM 1669 O CYS B 404 10.979 5.024 0.998 1.00 0.00 O ATOM 1670 CB CYS B 404 8.463 4.071 1.774 1.00 0.00 C ATOM 1671 SG CYS B 404 7.107 5.185 1.337 1.00 0.00 S ATOM 0 H CYS B 404 9.991 2.044 1.877 1.00 0.00 H new ATOM 0 HA CYS B 404 8.493 3.384 -0.251 1.00 0.00 H new ATOM 0 HB2 CYS B 404 8.068 3.257 2.381 1.00 0.00 H new ATOM 0 HB3 CYS B 404 9.178 4.613 2.394 1.00 0.00 H new ATOM 0 HG CYS B 404 6.111 4.493 0.868 1.00 0.00 H new ATOM 1677 N ARG B 405 10.587 4.432 -1.170 1.00 0.00 N ATOM 1678 CA ARG B 405 11.652 5.246 -1.761 1.00 0.00 C ATOM 1679 C ARG B 405 11.097 6.520 -2.389 1.00 0.00 C ATOM 1680 O ARG B 405 9.961 6.544 -2.858 1.00 0.00 O ATOM 1681 CB ARG B 405 12.400 4.445 -2.828 1.00 0.00 C ATOM 1682 CG ARG B 405 13.863 4.831 -2.960 1.00 0.00 C ATOM 1683 CD ARG B 405 14.667 3.742 -3.653 1.00 0.00 C ATOM 1684 NE ARG B 405 16.067 3.748 -3.234 1.00 0.00 N ATOM 1685 CZ ARG B 405 17.039 3.145 -3.909 1.00 0.00 C ATOM 1686 NH1 ARG B 405 16.765 2.492 -5.030 1.00 0.00 N ATOM 1687 NH2 ARG B 405 18.287 3.195 -3.463 1.00 0.00 N ATOM 0 H ARG B 405 10.051 3.899 -1.855 1.00 0.00 H new ATOM 0 HA ARG B 405 12.336 5.523 -0.959 1.00 0.00 H new ATOM 0 HB2 ARG B 405 12.333 3.384 -2.588 1.00 0.00 H new ATOM 0 HB3 ARG B 405 11.907 4.587 -3.790 1.00 0.00 H new ATOM 0 HG2 ARG B 405 13.946 5.760 -3.524 1.00 0.00 H new ATOM 0 HG3 ARG B 405 14.281 5.020 -1.971 1.00 0.00 H new ATOM 0 HD2 ARG B 405 14.226 2.770 -3.433 1.00 0.00 H new ATOM 0 HD3 ARG B 405 14.611 3.880 -4.733 1.00 0.00 H new ATOM 0 HE ARG B 405 16.311 4.242 -2.376 1.00 0.00 H new ATOM 0 HH11 ARG B 405 15.806 2.452 -5.376 1.00 0.00 H new ATOM 0 HH12 ARG B 405 17.513 2.030 -5.547 1.00 0.00 H new ATOM 0 HH21 ARG B 405 18.501 3.697 -2.601 1.00 0.00 H new ATOM 0 HH22 ARG B 405 19.033 2.732 -3.982 1.00 0.00 H new ATOM 1701 N VAL B 406 11.914 7.572 -2.400 1.00 0.00 N ATOM 1702 CA VAL B 406 11.516 8.853 -2.969 1.00 0.00 C ATOM 1703 C VAL B 406 12.265 9.146 -4.267 1.00 0.00 C ATOM 1704 O VAL B 406 13.345 8.603 -4.514 1.00 0.00 O ATOM 1705 CB VAL B 406 11.754 10.009 -1.979 1.00 0.00 C ATOM 1706 CG1 VAL B 406 11.262 9.632 -0.592 1.00 0.00 C ATOM 1707 CG2 VAL B 406 13.225 10.393 -1.944 1.00 0.00 C ATOM 0 H VAL B 406 12.860 7.559 -2.019 1.00 0.00 H new ATOM 0 HA VAL B 406 10.449 8.780 -3.182 1.00 0.00 H new ATOM 0 HB VAL B 406 11.186 10.875 -2.320 1.00 0.00 H new ATOM 0 HG11 VAL B 406 11.438 10.460 0.094 1.00 0.00 H new ATOM 0 HG12 VAL B 406 10.195 9.414 -0.631 1.00 0.00 H new ATOM 0 HG13 VAL B 406 11.800 8.751 -0.242 1.00 0.00 H new ATOM 0 HG21 VAL B 406 13.371 11.211 -1.239 1.00 0.00 H new ATOM 0 HG22 VAL B 406 13.818 9.534 -1.631 1.00 0.00 H new ATOM 0 HG23 VAL B 406 13.542 10.710 -2.938 1.00 0.00 H new ATOM 1717 N GLY B 407 11.661 10.003 -5.092 1.00 0.00 N ATOM 1718 CA GLY B 407 12.230 10.379 -6.377 1.00 0.00 C ATOM 1719 C GLY B 407 13.744 10.325 -6.423 1.00 0.00 C ATOM 1720 O GLY B 407 14.319 9.746 -7.345 1.00 0.00 O ATOM 0 H GLY B 407 10.768 10.451 -4.885 1.00 0.00 H new ATOM 0 HA2 GLY B 407 11.830 9.719 -7.147 1.00 0.00 H new ATOM 0 HA3 GLY B 407 11.906 11.390 -6.624 1.00 0.00 H new ATOM 1724 N ASP B 408 14.396 10.942 -5.444 1.00 0.00 N ATOM 1725 CA ASP B 408 15.858 10.978 -5.395 1.00 0.00 C ATOM 1726 C ASP B 408 16.471 9.619 -5.037 1.00 0.00 C ATOM 1727 O ASP B 408 17.644 9.546 -4.673 1.00 0.00 O ATOM 1728 CB ASP B 408 16.324 12.030 -4.388 1.00 0.00 C ATOM 1729 CG ASP B 408 17.305 13.016 -4.993 1.00 0.00 C ATOM 1730 OD1 ASP B 408 17.343 13.128 -6.236 1.00 0.00 O ATOM 1731 OD2 ASP B 408 18.035 13.675 -4.223 1.00 0.00 O ATOM 0 H ASP B 408 13.937 11.425 -4.672 1.00 0.00 H new ATOM 0 HA ASP B 408 16.202 11.238 -6.396 1.00 0.00 H new ATOM 0 HB2 ASP B 408 15.459 12.571 -4.006 1.00 0.00 H new ATOM 0 HB3 ASP B 408 16.791 11.533 -3.537 1.00 0.00 H new ATOM 1736 N GLY B 409 15.688 8.548 -5.136 1.00 0.00 N ATOM 1737 CA GLY B 409 16.202 7.236 -4.812 1.00 0.00 C ATOM 1738 C GLY B 409 16.545 7.113 -3.346 1.00 0.00 C ATOM 1739 O GLY B 409 17.608 6.608 -2.987 1.00 0.00 O ATOM 0 H GLY B 409 14.713 8.568 -5.433 1.00 0.00 H new ATOM 0 HA2 GLY B 409 15.462 6.481 -5.077 1.00 0.00 H new ATOM 0 HA3 GLY B 409 17.090 7.036 -5.411 1.00 0.00 H new ATOM 1743 N THR B 410 15.627 7.552 -2.493 1.00 0.00 N ATOM 1744 CA THR B 410 15.823 7.462 -1.052 1.00 0.00 C ATOM 1745 C THR B 410 14.670 6.702 -0.416 1.00 0.00 C ATOM 1746 O THR B 410 13.535 7.169 -0.421 1.00 0.00 O ATOM 1747 CB THR B 410 15.939 8.856 -0.403 1.00 0.00 C ATOM 1748 OG1 THR B 410 17.211 9.454 -0.679 1.00 0.00 O ATOM 1749 CG2 THR B 410 15.765 8.775 1.108 1.00 0.00 C ATOM 0 H THR B 410 14.741 7.973 -2.774 1.00 0.00 H new ATOM 0 HA THR B 410 16.758 6.929 -0.881 1.00 0.00 H new ATOM 0 HB THR B 410 15.146 9.468 -0.833 1.00 0.00 H new ATOM 0 HG1 THR B 410 17.256 10.337 -0.257 1.00 0.00 H new ATOM 0 HG21 THR B 410 15.852 9.773 1.538 1.00 0.00 H new ATOM 0 HG22 THR B 410 14.782 8.364 1.340 1.00 0.00 H new ATOM 0 HG23 THR B 410 16.536 8.130 1.529 1.00 0.00 H new ATOM 1757 N VAL B 411 14.956 5.532 0.134 1.00 0.00 N ATOM 1758 CA VAL B 411 13.906 4.744 0.757 1.00 0.00 C ATOM 1759 C VAL B 411 14.152 4.500 2.228 1.00 0.00 C ATOM 1760 O VAL B 411 15.255 4.166 2.658 1.00 0.00 O ATOM 1761 CB VAL B 411 13.677 3.397 0.049 1.00 0.00 C ATOM 1762 CG1 VAL B 411 14.889 2.514 0.166 1.00 0.00 C ATOM 1763 CG2 VAL B 411 12.466 2.685 0.622 1.00 0.00 C ATOM 0 H VAL B 411 15.886 5.114 0.162 1.00 0.00 H new ATOM 0 HA VAL B 411 13.005 5.349 0.654 1.00 0.00 H new ATOM 0 HB VAL B 411 13.497 3.606 -1.006 1.00 0.00 H new ATOM 0 HG11 VAL B 411 14.701 1.569 -0.343 1.00 0.00 H new ATOM 0 HG12 VAL B 411 15.745 3.009 -0.293 1.00 0.00 H new ATOM 0 HG13 VAL B 411 15.101 2.324 1.218 1.00 0.00 H new ATOM 0 HG21 VAL B 411 12.324 1.735 0.106 1.00 0.00 H new ATOM 0 HG22 VAL B 411 12.622 2.501 1.685 1.00 0.00 H new ATOM 0 HG23 VAL B 411 11.581 3.307 0.487 1.00 0.00 H new ATOM 1773 N LEU B 412 13.081 4.660 2.983 1.00 0.00 N ATOM 1774 CA LEU B 412 13.101 4.457 4.417 1.00 0.00 C ATOM 1775 C LEU B 412 11.850 3.709 4.876 1.00 0.00 C ATOM 1776 O LEU B 412 11.842 3.112 5.952 1.00 0.00 O ATOM 1777 CB LEU B 412 13.190 5.797 5.155 1.00 0.00 C ATOM 1778 CG LEU B 412 13.446 7.026 4.277 1.00 0.00 C ATOM 1779 CD1 LEU B 412 12.254 7.310 3.372 1.00 0.00 C ATOM 1780 CD2 LEU B 412 13.747 8.235 5.148 1.00 0.00 C ATOM 0 H LEU B 412 12.170 4.935 2.616 1.00 0.00 H new ATOM 0 HA LEU B 412 13.982 3.860 4.654 1.00 0.00 H new ATOM 0 HB2 LEU B 412 12.260 5.952 5.702 1.00 0.00 H new ATOM 0 HB3 LEU B 412 13.987 5.730 5.895 1.00 0.00 H new ATOM 0 HG LEU B 412 14.309 6.820 3.643 1.00 0.00 H new ATOM 0 HD11 LEU B 412 12.463 8.187 2.760 1.00 0.00 H new ATOM 0 HD12 LEU B 412 12.075 6.451 2.726 1.00 0.00 H new ATOM 0 HD13 LEU B 412 11.370 7.495 3.982 1.00 0.00 H new ATOM 0 HD21 LEU B 412 13.928 9.104 4.515 1.00 0.00 H new ATOM 0 HD22 LEU B 412 12.898 8.433 5.802 1.00 0.00 H new ATOM 0 HD23 LEU B 412 14.632 8.037 5.753 1.00 0.00 H new ATOM 1792 N GLY B 413 10.774 3.771 4.083 1.00 0.00 N ATOM 1793 CA GLY B 413 9.539 3.119 4.487 1.00 0.00 C ATOM 1794 C GLY B 413 9.433 1.663 4.071 1.00 0.00 C ATOM 1795 O GLY B 413 8.605 1.316 3.228 1.00 0.00 O ATOM 0 H GLY B 413 10.738 4.253 3.185 1.00 0.00 H new ATOM 0 HA2 GLY B 413 9.447 3.182 5.571 1.00 0.00 H new ATOM 0 HA3 GLY B 413 8.698 3.667 4.063 1.00 0.00 H new ATOM 1799 N THR B 414 10.254 0.804 4.669 1.00 0.00 N ATOM 1800 CA THR B 414 10.221 -0.621 4.355 1.00 0.00 C ATOM 1801 C THR B 414 9.068 -1.286 5.087 1.00 0.00 C ATOM 1802 O THR B 414 8.574 -0.755 6.078 1.00 0.00 O ATOM 1803 CB THR B 414 11.528 -1.331 4.758 1.00 0.00 C ATOM 1804 OG1 THR B 414 12.539 -0.391 5.143 1.00 0.00 O ATOM 1805 CG2 THR B 414 12.067 -2.178 3.615 1.00 0.00 C ATOM 0 H THR B 414 10.947 1.068 5.370 1.00 0.00 H new ATOM 0 HA THR B 414 10.095 -0.709 3.276 1.00 0.00 H new ATOM 0 HB THR B 414 11.286 -1.970 5.607 1.00 0.00 H new ATOM 0 HG1 THR B 414 13.355 -0.873 5.394 1.00 0.00 H new ATOM 0 HG21 THR B 414 12.989 -2.667 3.928 1.00 0.00 H new ATOM 0 HG22 THR B 414 11.330 -2.934 3.343 1.00 0.00 H new ATOM 0 HG23 THR B 414 12.268 -1.541 2.754 1.00 0.00 H new ATOM 1813 N GLY B 415 8.642 -2.450 4.616 1.00 0.00 N ATOM 1814 CA GLY B 415 7.553 -3.141 5.274 1.00 0.00 C ATOM 1815 C GLY B 415 7.473 -4.602 4.892 1.00 0.00 C ATOM 1816 O GLY B 415 7.339 -4.940 3.717 1.00 0.00 O ATOM 0 H GLY B 415 9.027 -2.924 3.799 1.00 0.00 H new ATOM 0 HA2 GLY B 415 7.675 -3.058 6.354 1.00 0.00 H new ATOM 0 HA3 GLY B 415 6.612 -2.652 5.021 1.00 0.00 H new ATOM 1820 N VAL B 416 7.533 -5.468 5.892 1.00 0.00 N ATOM 1821 CA VAL B 416 7.446 -6.900 5.671 1.00 0.00 C ATOM 1822 C VAL B 416 6.201 -7.446 6.357 1.00 0.00 C ATOM 1823 O VAL B 416 5.811 -6.957 7.418 1.00 0.00 O ATOM 1824 CB VAL B 416 8.693 -7.629 6.208 1.00 0.00 C ATOM 1825 CG1 VAL B 416 8.751 -9.053 5.682 1.00 0.00 C ATOM 1826 CG2 VAL B 416 9.957 -6.866 5.841 1.00 0.00 C ATOM 0 H VAL B 416 7.642 -5.200 6.870 1.00 0.00 H new ATOM 0 HA VAL B 416 7.388 -7.075 4.597 1.00 0.00 H new ATOM 0 HB VAL B 416 8.624 -7.672 7.295 1.00 0.00 H new ATOM 0 HG11 VAL B 416 9.639 -9.550 6.073 1.00 0.00 H new ATOM 0 HG12 VAL B 416 7.861 -9.595 6.002 1.00 0.00 H new ATOM 0 HG13 VAL B 416 8.794 -9.037 4.593 1.00 0.00 H new ATOM 0 HG21 VAL B 416 10.827 -7.396 6.229 1.00 0.00 H new ATOM 0 HG22 VAL B 416 10.033 -6.788 4.756 1.00 0.00 H new ATOM 0 HG23 VAL B 416 9.918 -5.867 6.275 1.00 0.00 H new ATOM 1836 N GLY B 417 5.567 -8.442 5.755 1.00 0.00 N ATOM 1837 CA GLY B 417 4.364 -8.998 6.349 1.00 0.00 C ATOM 1838 C GLY B 417 4.025 -10.377 5.822 1.00 0.00 C ATOM 1839 O GLY B 417 4.446 -10.749 4.727 1.00 0.00 O ATOM 0 H GLY B 417 5.858 -8.872 4.877 1.00 0.00 H new ATOM 0 HA2 GLY B 417 4.490 -9.050 7.430 1.00 0.00 H new ATOM 0 HA3 GLY B 417 3.527 -8.326 6.157 1.00 0.00 H new ATOM 1843 N ARG B 418 3.251 -11.133 6.602 1.00 0.00 N ATOM 1844 CA ARG B 418 2.842 -12.477 6.205 1.00 0.00 C ATOM 1845 C ARG B 418 2.383 -12.478 4.754 1.00 0.00 C ATOM 1846 O ARG B 418 2.776 -13.333 3.963 1.00 0.00 O ATOM 1847 CB ARG B 418 1.714 -12.979 7.110 1.00 0.00 C ATOM 1848 CG ARG B 418 2.157 -13.266 8.535 1.00 0.00 C ATOM 1849 CD ARG B 418 1.082 -12.887 9.540 1.00 0.00 C ATOM 1850 NE ARG B 418 0.527 -14.058 10.213 1.00 0.00 N ATOM 1851 CZ ARG B 418 -0.393 -13.989 11.171 1.00 0.00 C ATOM 1852 NH1 ARG B 418 -0.857 -12.810 11.564 1.00 0.00 N ATOM 1853 NH2 ARG B 418 -0.850 -15.099 11.735 1.00 0.00 N ATOM 0 H ARG B 418 2.896 -10.836 7.511 1.00 0.00 H new ATOM 0 HA ARG B 418 3.697 -13.145 6.307 1.00 0.00 H new ATOM 0 HB2 ARG B 418 0.917 -12.235 7.129 1.00 0.00 H new ATOM 0 HB3 ARG B 418 1.292 -13.887 6.680 1.00 0.00 H new ATOM 0 HG2 ARG B 418 2.395 -14.325 8.637 1.00 0.00 H new ATOM 0 HG3 ARG B 418 3.070 -12.712 8.752 1.00 0.00 H new ATOM 0 HD2 ARG B 418 1.502 -12.207 10.282 1.00 0.00 H new ATOM 0 HD3 ARG B 418 0.283 -12.349 9.031 1.00 0.00 H new ATOM 0 HE ARG B 418 0.863 -14.979 9.933 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -0.508 -11.955 11.131 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -1.563 -12.759 12.299 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -0.496 -16.007 11.434 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -1.556 -15.045 12.470 1.00 0.00 H new ATOM 1867 N ASN B 419 1.536 -11.512 4.421 1.00 0.00 N ATOM 1868 CA ASN B 419 1.010 -11.381 3.070 1.00 0.00 C ATOM 1869 C ASN B 419 1.518 -10.100 2.421 1.00 0.00 C ATOM 1870 O ASN B 419 2.178 -9.285 3.066 1.00 0.00 O ATOM 1871 CB ASN B 419 -0.513 -11.390 3.089 1.00 0.00 C ATOM 1872 CG ASN B 419 -1.081 -10.235 3.876 1.00 0.00 C ATOM 1873 OD1 ASN B 419 -0.365 -9.554 4.610 1.00 0.00 O ATOM 1874 ND2 ASN B 419 -2.372 -10.004 3.724 1.00 0.00 N ATOM 0 H ASN B 419 1.198 -10.804 5.073 1.00 0.00 H new ATOM 0 HA ASN B 419 1.358 -12.231 2.483 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -0.887 -11.349 2.066 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -0.864 -12.328 3.520 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -2.815 -9.235 4.226 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -2.926 -10.595 3.104 1.00 0.00 H new ATOM 1881 N ILE B 420 1.210 -9.927 1.142 1.00 0.00 N ATOM 1882 CA ILE B 420 1.639 -8.744 0.407 1.00 0.00 C ATOM 1883 C ILE B 420 1.018 -7.482 0.997 1.00 0.00 C ATOM 1884 O ILE B 420 1.540 -6.381 0.824 1.00 0.00 O ATOM 1885 CB ILE B 420 1.255 -8.848 -1.083 1.00 0.00 C ATOM 1886 CG1 ILE B 420 1.519 -7.526 -1.808 1.00 0.00 C ATOM 1887 CG2 ILE B 420 -0.205 -9.256 -1.227 1.00 0.00 C ATOM 1888 CD1 ILE B 420 0.480 -6.462 -1.531 1.00 0.00 C ATOM 0 H ILE B 420 0.665 -10.591 0.592 1.00 0.00 H new ATOM 0 HA ILE B 420 2.724 -8.685 0.493 1.00 0.00 H new ATOM 0 HB ILE B 420 1.877 -9.616 -1.544 1.00 0.00 H new ATOM 0 HG12 ILE B 420 2.499 -7.150 -1.514 1.00 0.00 H new ATOM 0 HG13 ILE B 420 1.558 -7.712 -2.881 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -0.461 -9.325 -2.284 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -0.361 -10.225 -0.752 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -0.840 -8.511 -0.748 1.00 0.00 H new ATOM 0 HD11 ILE B 420 0.734 -5.554 -2.079 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -0.499 -6.817 -1.852 1.00 0.00 H new ATOM 0 HD13 ILE B 420 0.456 -6.246 -0.463 1.00 0.00 H new ATOM 1900 N LYS B 421 -0.093 -7.654 1.700 1.00 0.00 N ATOM 1901 CA LYS B 421 -0.774 -6.518 2.311 1.00 0.00 C ATOM 1902 C LYS B 421 0.011 -6.015 3.516 1.00 0.00 C ATOM 1903 O LYS B 421 0.439 -4.862 3.541 1.00 0.00 O ATOM 1904 CB LYS B 421 -2.196 -6.901 2.716 1.00 0.00 C ATOM 1905 CG LYS B 421 -3.180 -6.860 1.560 1.00 0.00 C ATOM 1906 CD LYS B 421 -2.753 -7.787 0.431 1.00 0.00 C ATOM 1907 CE LYS B 421 -3.883 -8.008 -0.563 1.00 0.00 C ATOM 1908 NZ LYS B 421 -3.493 -8.948 -1.649 1.00 0.00 N ATOM 0 H LYS B 421 -0.539 -8.557 1.861 1.00 0.00 H new ATOM 0 HA LYS B 421 -0.833 -5.713 1.578 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -2.188 -7.904 3.142 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -2.538 -6.225 3.500 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -4.170 -7.147 1.913 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -3.259 -5.840 1.184 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -1.891 -7.363 -0.084 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -2.437 -8.745 0.844 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -4.755 -8.400 -0.040 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -4.175 -7.052 -0.998 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -4.291 -9.071 -2.305 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -2.677 -8.562 -2.165 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -3.238 -9.868 -1.237 1.00 0.00 H new ATOM 1922 N ILE B 422 0.202 -6.872 4.513 1.00 0.00 N ATOM 1923 CA ILE B 422 0.942 -6.462 5.698 1.00 0.00 C ATOM 1924 C ILE B 422 2.246 -5.823 5.263 1.00 0.00 C ATOM 1925 O ILE B 422 2.735 -4.886 5.887 1.00 0.00 O ATOM 1926 CB ILE B 422 1.253 -7.650 6.630 1.00 0.00 C ATOM 1927 CG1 ILE B 422 -0.031 -8.202 7.239 1.00 0.00 C ATOM 1928 CG2 ILE B 422 2.225 -7.234 7.727 1.00 0.00 C ATOM 1929 CD1 ILE B 422 0.002 -9.698 7.440 1.00 0.00 C ATOM 0 H ILE B 422 -0.137 -7.834 4.525 1.00 0.00 H new ATOM 0 HA ILE B 422 0.323 -5.757 6.253 1.00 0.00 H new ATOM 0 HB ILE B 422 1.721 -8.435 6.037 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -0.208 -7.717 8.199 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -0.871 -7.947 6.593 1.00 0.00 H new ATOM 0 HG21 ILE B 422 2.431 -8.087 8.373 1.00 0.00 H new ATOM 0 HG22 ILE B 422 3.155 -6.887 7.277 1.00 0.00 H new ATOM 0 HG23 ILE B 422 1.785 -6.430 8.317 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -0.941 -10.027 7.876 1.00 0.00 H new ATOM 0 HD12 ILE B 422 0.149 -10.191 6.479 1.00 0.00 H new ATOM 0 HD13 ILE B 422 0.822 -9.957 8.110 1.00 0.00 H new ATOM 1941 N ALA B 423 2.790 -6.318 4.164 1.00 0.00 N ATOM 1942 CA ALA B 423 4.019 -5.775 3.622 1.00 0.00 C ATOM 1943 C ALA B 423 3.760 -4.380 3.065 1.00 0.00 C ATOM 1944 O ALA B 423 4.397 -3.407 3.468 1.00 0.00 O ATOM 1945 CB ALA B 423 4.578 -6.690 2.546 1.00 0.00 C ATOM 0 H ALA B 423 2.398 -7.095 3.631 1.00 0.00 H new ATOM 0 HA ALA B 423 4.759 -5.704 4.419 1.00 0.00 H new ATOM 0 HB1 ALA B 423 5.501 -6.266 2.151 1.00 0.00 H new ATOM 0 HB2 ALA B 423 4.784 -7.671 2.974 1.00 0.00 H new ATOM 0 HB3 ALA B 423 3.851 -6.791 1.740 1.00 0.00 H new ATOM 1951 N GLY B 424 2.817 -4.297 2.130 1.00 0.00 N ATOM 1952 CA GLY B 424 2.479 -3.026 1.521 1.00 0.00 C ATOM 1953 C GLY B 424 2.042 -1.965 2.522 1.00 0.00 C ATOM 1954 O GLY B 424 2.553 -0.840 2.510 1.00 0.00 O ATOM 0 H GLY B 424 2.280 -5.092 1.783 1.00 0.00 H new ATOM 0 HA2 GLY B 424 3.343 -2.657 0.968 1.00 0.00 H new ATOM 0 HA3 GLY B 424 1.679 -3.181 0.797 1.00 0.00 H new ATOM 1958 N ILE B 425 1.088 -2.314 3.383 1.00 0.00 N ATOM 1959 CA ILE B 425 0.583 -1.362 4.368 1.00 0.00 C ATOM 1960 C ILE B 425 1.618 -1.058 5.450 1.00 0.00 C ATOM 1961 O ILE B 425 1.975 0.099 5.664 1.00 0.00 O ATOM 1962 CB ILE B 425 -0.704 -1.892 5.030 1.00 0.00 C ATOM 1963 CG1 ILE B 425 -1.800 -2.081 3.980 1.00 0.00 C ATOM 1964 CG2 ILE B 425 -1.171 -0.946 6.125 1.00 0.00 C ATOM 1965 CD1 ILE B 425 -1.984 -3.520 3.546 1.00 0.00 C ATOM 0 H ILE B 425 0.654 -3.237 3.419 1.00 0.00 H new ATOM 0 HA ILE B 425 0.365 -0.439 3.832 1.00 0.00 H new ATOM 0 HB ILE B 425 -0.487 -2.859 5.484 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -2.743 -1.708 4.380 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -1.562 -1.475 3.106 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -2.081 -1.337 6.580 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -0.394 -0.857 6.885 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -1.373 0.035 5.696 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -2.777 -3.577 2.801 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -1.054 -3.892 3.115 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -2.253 -4.129 4.409 1.00 0.00 H new ATOM 1977 N ARG B 426 2.070 -2.089 6.156 1.00 0.00 N ATOM 1978 CA ARG B 426 3.030 -1.878 7.236 1.00 0.00 C ATOM 1979 C ARG B 426 4.237 -1.088 6.734 1.00 0.00 C ATOM 1980 O ARG B 426 4.807 -0.285 7.474 1.00 0.00 O ATOM 1981 CB ARG B 426 3.457 -3.204 7.878 1.00 0.00 C ATOM 1982 CG ARG B 426 4.799 -3.728 7.397 1.00 0.00 C ATOM 1983 CD ARG B 426 5.940 -3.112 8.188 1.00 0.00 C ATOM 1984 NE ARG B 426 6.883 -4.119 8.667 1.00 0.00 N ATOM 1985 CZ ARG B 426 6.559 -5.082 9.523 1.00 0.00 C ATOM 1986 NH1 ARG B 426 5.321 -5.168 9.994 1.00 0.00 N ATOM 1987 NH2 ARG B 426 7.473 -5.960 9.911 1.00 0.00 N ATOM 0 H ARG B 426 1.795 -3.060 6.006 1.00 0.00 H new ATOM 0 HA ARG B 426 2.539 -1.291 8.012 1.00 0.00 H new ATOM 0 HB2 ARG B 426 3.497 -3.074 8.959 1.00 0.00 H new ATOM 0 HB3 ARG B 426 2.693 -3.955 7.675 1.00 0.00 H new ATOM 0 HG2 ARG B 426 4.827 -4.813 7.497 1.00 0.00 H new ATOM 0 HG3 ARG B 426 4.923 -3.502 6.338 1.00 0.00 H new ATOM 0 HD2 ARG B 426 6.467 -2.391 7.562 1.00 0.00 H new ATOM 0 HD3 ARG B 426 5.536 -2.561 9.037 1.00 0.00 H new ATOM 0 HE ARG B 426 7.843 -4.081 8.326 1.00 0.00 H new ATOM 0 HH11 ARG B 426 4.615 -4.494 9.699 1.00 0.00 H new ATOM 0 HH12 ARG B 426 5.076 -5.909 10.651 1.00 0.00 H new ATOM 0 HH21 ARG B 426 8.426 -5.897 9.552 1.00 0.00 H new ATOM 0 HH22 ARG B 426 7.224 -6.699 10.568 1.00 0.00 H new ATOM 2001 N ALA B 427 4.604 -1.275 5.465 1.00 0.00 N ATOM 2002 CA ALA B 427 5.716 -0.520 4.895 1.00 0.00 C ATOM 2003 C ALA B 427 5.357 0.956 4.924 1.00 0.00 C ATOM 2004 O ALA B 427 6.100 1.796 5.445 1.00 0.00 O ATOM 2005 CB ALA B 427 6.017 -0.965 3.470 1.00 0.00 C ATOM 0 H ALA B 427 4.156 -1.930 4.824 1.00 0.00 H new ATOM 0 HA ALA B 427 6.614 -0.702 5.485 1.00 0.00 H new ATOM 0 HB1 ALA B 427 6.850 -0.383 3.075 1.00 0.00 H new ATOM 0 HB2 ALA B 427 6.280 -2.023 3.467 1.00 0.00 H new ATOM 0 HB3 ALA B 427 5.137 -0.808 2.846 1.00 0.00 H new ATOM 2011 N ALA B 428 4.187 1.255 4.372 1.00 0.00 N ATOM 2012 CA ALA B 428 3.703 2.621 4.348 1.00 0.00 C ATOM 2013 C ALA B 428 3.803 3.176 5.761 1.00 0.00 C ATOM 2014 O ALA B 428 4.253 4.303 5.976 1.00 0.00 O ATOM 2015 CB ALA B 428 2.270 2.695 3.838 1.00 0.00 C ATOM 0 H ALA B 428 3.564 0.573 3.940 1.00 0.00 H new ATOM 0 HA ALA B 428 4.310 3.214 3.664 1.00 0.00 H new ATOM 0 HB1 ALA B 428 1.939 3.733 3.833 1.00 0.00 H new ATOM 0 HB2 ALA B 428 2.223 2.294 2.825 1.00 0.00 H new ATOM 0 HB3 ALA B 428 1.621 2.110 4.490 1.00 0.00 H new ATOM 2021 N GLU B 429 3.396 2.357 6.726 1.00 0.00 N ATOM 2022 CA GLU B 429 3.450 2.732 8.131 1.00 0.00 C ATOM 2023 C GLU B 429 4.891 2.950 8.581 1.00 0.00 C ATOM 2024 O GLU B 429 5.155 3.797 9.433 1.00 0.00 O ATOM 2025 CB GLU B 429 2.813 1.645 8.996 1.00 0.00 C ATOM 2026 CG GLU B 429 1.294 1.681 8.999 1.00 0.00 C ATOM 2027 CD GLU B 429 0.693 1.001 7.787 1.00 0.00 C ATOM 2028 OE1 GLU B 429 0.687 -0.247 7.748 1.00 0.00 O ATOM 2029 OE2 GLU B 429 0.228 1.717 6.876 1.00 0.00 O ATOM 0 H GLU B 429 3.023 1.423 6.556 1.00 0.00 H new ATOM 0 HA GLU B 429 2.896 3.664 8.249 1.00 0.00 H new ATOM 0 HB2 GLU B 429 3.144 0.669 8.640 1.00 0.00 H new ATOM 0 HB3 GLU B 429 3.172 1.750 10.020 1.00 0.00 H new ATOM 0 HG2 GLU B 429 0.925 1.197 9.903 1.00 0.00 H new ATOM 0 HG3 GLU B 429 0.959 2.718 9.033 1.00 0.00 H new ATOM 2036 N ASN B 430 5.825 2.189 8.004 1.00 0.00 N ATOM 2037 CA ASN B 430 7.225 2.327 8.364 1.00 0.00 C ATOM 2038 C ASN B 430 7.662 3.769 8.168 1.00 0.00 C ATOM 2039 O ASN B 430 8.247 4.379 9.062 1.00 0.00 O ATOM 2040 CB ASN B 430 8.088 1.386 7.528 1.00 0.00 C ATOM 2041 CG ASN B 430 8.770 0.331 8.376 1.00 0.00 C ATOM 2042 OD1 ASN B 430 9.988 0.354 8.556 1.00 0.00 O ATOM 2043 ND2 ASN B 430 7.984 -0.600 8.902 1.00 0.00 N ATOM 0 H ASN B 430 5.634 1.481 7.295 1.00 0.00 H new ATOM 0 HA ASN B 430 7.351 2.058 9.413 1.00 0.00 H new ATOM 0 HB2 ASN B 430 7.468 0.900 6.775 1.00 0.00 H new ATOM 0 HB3 ASN B 430 8.842 1.965 6.995 1.00 0.00 H new ATOM 0 HD21 ASN B 430 8.384 -1.337 9.483 1.00 0.00 H new ATOM 0 HD22 ASN B 430 6.980 -0.579 8.725 1.00 0.00 H new ATOM 2050 N ALA B 431 7.352 4.321 6.998 1.00 0.00 N ATOM 2051 CA ALA B 431 7.698 5.706 6.711 1.00 0.00 C ATOM 2052 C ALA B 431 6.984 6.625 7.696 1.00 0.00 C ATOM 2053 O ALA B 431 7.575 7.564 8.229 1.00 0.00 O ATOM 2054 CB ALA B 431 7.357 6.087 5.278 1.00 0.00 C ATOM 0 H ALA B 431 6.868 3.836 6.243 1.00 0.00 H new ATOM 0 HA ALA B 431 8.776 5.820 6.825 1.00 0.00 H new ATOM 0 HB1 ALA B 431 7.630 7.128 5.103 1.00 0.00 H new ATOM 0 HB2 ALA B 431 7.909 5.447 4.590 1.00 0.00 H new ATOM 0 HB3 ALA B 431 6.287 5.960 5.113 1.00 0.00 H new ATOM 2060 N LEU B 432 5.707 6.333 7.944 1.00 0.00 N ATOM 2061 CA LEU B 432 4.903 7.114 8.881 1.00 0.00 C ATOM 2062 C LEU B 432 5.512 7.081 10.283 1.00 0.00 C ATOM 2063 O LEU B 432 5.145 7.876 11.147 1.00 0.00 O ATOM 2064 CB LEU B 432 3.458 6.594 8.906 1.00 0.00 C ATOM 2065 CG LEU B 432 3.051 5.824 10.167 1.00 0.00 C ATOM 2066 CD1 LEU B 432 2.825 6.783 11.327 1.00 0.00 C ATOM 2067 CD2 LEU B 432 1.800 4.999 9.907 1.00 0.00 C ATOM 0 H LEU B 432 5.207 5.559 7.507 1.00 0.00 H new ATOM 0 HA LEU B 432 4.894 8.150 8.543 1.00 0.00 H new ATOM 0 HB2 LEU B 432 2.784 7.442 8.787 1.00 0.00 H new ATOM 0 HB3 LEU B 432 3.310 5.945 8.043 1.00 0.00 H new ATOM 0 HG LEU B 432 3.862 5.146 10.433 1.00 0.00 H new ATOM 0 HD11 LEU B 432 2.537 6.219 12.214 1.00 0.00 H new ATOM 0 HD12 LEU B 432 3.744 7.333 11.529 1.00 0.00 H new ATOM 0 HD13 LEU B 432 2.032 7.485 11.070 1.00 0.00 H new ATOM 0 HD21 LEU B 432 1.526 4.459 10.813 1.00 0.00 H new ATOM 0 HD22 LEU B 432 0.983 5.659 9.616 1.00 0.00 H new ATOM 0 HD23 LEU B 432 1.994 4.287 9.105 1.00 0.00 H new ATOM 2079 N ARG B 433 6.465 6.176 10.490 1.00 0.00 N ATOM 2080 CA ARG B 433 7.143 6.070 11.775 1.00 0.00 C ATOM 2081 C ARG B 433 8.204 7.154 11.865 1.00 0.00 C ATOM 2082 O ARG B 433 8.627 7.546 12.953 1.00 0.00 O ATOM 2083 CB ARG B 433 7.781 4.690 11.942 1.00 0.00 C ATOM 2084 CG ARG B 433 6.818 3.542 11.689 1.00 0.00 C ATOM 2085 CD ARG B 433 7.244 2.282 12.425 1.00 0.00 C ATOM 2086 NE ARG B 433 8.694 2.201 12.579 1.00 0.00 N ATOM 2087 CZ ARG B 433 9.306 1.285 13.325 1.00 0.00 C ATOM 2088 NH1 ARG B 433 8.596 0.377 13.981 1.00 0.00 N ATOM 2089 NH2 ARG B 433 10.628 1.278 13.415 1.00 0.00 N ATOM 0 H ARG B 433 6.783 5.509 9.787 1.00 0.00 H new ATOM 0 HA ARG B 433 6.414 6.200 12.575 1.00 0.00 H new ATOM 0 HB2 ARG B 433 8.625 4.603 11.257 1.00 0.00 H new ATOM 0 HB3 ARG B 433 8.180 4.603 12.953 1.00 0.00 H new ATOM 0 HG2 ARG B 433 5.816 3.830 12.008 1.00 0.00 H new ATOM 0 HG3 ARG B 433 6.766 3.339 10.619 1.00 0.00 H new ATOM 0 HD2 ARG B 433 6.773 2.260 13.408 1.00 0.00 H new ATOM 0 HD3 ARG B 433 6.888 1.407 11.881 1.00 0.00 H new ATOM 0 HE ARG B 433 9.270 2.885 12.087 1.00 0.00 H new ATOM 0 HH11 ARG B 433 7.578 0.380 13.914 1.00 0.00 H new ATOM 0 HH12 ARG B 433 9.068 -0.324 14.552 1.00 0.00 H new ATOM 0 HH21 ARG B 433 11.177 1.975 12.912 1.00 0.00 H new ATOM 0 HH22 ARG B 433 11.097 0.575 13.987 1.00 0.00 H new ATOM 2103 N ASP B 434 8.611 7.643 10.699 1.00 0.00 N ATOM 2104 CA ASP B 434 9.603 8.697 10.608 1.00 0.00 C ATOM 2105 C ASP B 434 8.913 10.052 10.527 1.00 0.00 C ATOM 2106 O ASP B 434 9.272 10.901 9.715 1.00 0.00 O ATOM 2107 CB ASP B 434 10.484 8.480 9.377 1.00 0.00 C ATOM 2108 CG ASP B 434 10.777 7.013 9.131 1.00 0.00 C ATOM 2109 OD1 ASP B 434 10.842 6.247 10.116 1.00 0.00 O ATOM 2110 OD2 ASP B 434 10.944 6.630 7.955 1.00 0.00 O ATOM 0 H ASP B 434 8.262 7.319 9.797 1.00 0.00 H new ATOM 0 HA ASP B 434 10.231 8.673 11.499 1.00 0.00 H new ATOM 0 HB2 ASP B 434 9.991 8.902 8.501 1.00 0.00 H new ATOM 0 HB3 ASP B 434 11.423 9.019 9.505 1.00 0.00 H new ATOM 2115 N LYS B 435 7.912 10.248 11.375 1.00 0.00 N ATOM 2116 CA LYS B 435 7.182 11.503 11.384 1.00 0.00 C ATOM 2117 C LYS B 435 8.170 12.657 11.247 1.00 0.00 C ATOM 2118 O LYS B 435 8.058 13.474 10.333 1.00 0.00 O ATOM 2119 CB LYS B 435 6.322 11.623 12.646 1.00 0.00 C ATOM 2120 CG LYS B 435 6.923 12.478 13.747 1.00 0.00 C ATOM 2121 CD LYS B 435 6.025 12.495 14.968 1.00 0.00 C ATOM 2122 CE LYS B 435 5.868 11.102 15.559 1.00 0.00 C ATOM 2123 NZ LYS B 435 5.816 11.130 17.047 1.00 0.00 N ATOM 0 H LYS B 435 7.592 9.561 12.057 1.00 0.00 H new ATOM 0 HA LYS B 435 6.497 11.537 10.537 1.00 0.00 H new ATOM 0 HB2 LYS B 435 5.353 12.039 12.370 1.00 0.00 H new ATOM 0 HB3 LYS B 435 6.139 10.623 13.040 1.00 0.00 H new ATOM 0 HG2 LYS B 435 7.905 12.091 14.018 1.00 0.00 H new ATOM 0 HG3 LYS B 435 7.070 13.495 13.384 1.00 0.00 H new ATOM 0 HD2 LYS B 435 6.442 13.166 15.719 1.00 0.00 H new ATOM 0 HD3 LYS B 435 5.046 12.889 14.696 1.00 0.00 H new ATOM 0 HE2 LYS B 435 4.957 10.645 15.173 1.00 0.00 H new ATOM 0 HE3 LYS B 435 6.700 10.476 15.237 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 5.709 10.161 17.409 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 6.696 11.542 17.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 5.007 11.706 17.355 1.00 0.00 H new ATOM 2137 N LYS B 436 9.142 12.717 12.153 1.00 0.00 N ATOM 2138 CA LYS B 436 10.144 13.762 12.120 1.00 0.00 C ATOM 2139 C LYS B 436 10.722 13.880 10.715 1.00 0.00 C ATOM 2140 O LYS B 436 11.058 14.975 10.261 1.00 0.00 O ATOM 2141 CB LYS B 436 11.258 13.462 13.123 1.00 0.00 C ATOM 2142 CG LYS B 436 10.787 12.731 14.372 1.00 0.00 C ATOM 2143 CD LYS B 436 9.572 13.408 14.989 1.00 0.00 C ATOM 2144 CE LYS B 436 9.977 14.431 16.036 1.00 0.00 C ATOM 2145 NZ LYS B 436 9.548 14.026 17.404 1.00 0.00 N ATOM 0 H LYS B 436 9.252 12.051 12.917 1.00 0.00 H new ATOM 0 HA LYS B 436 9.676 14.708 12.394 1.00 0.00 H new ATOM 0 HB2 LYS B 436 12.024 12.863 12.631 1.00 0.00 H new ATOM 0 HB3 LYS B 436 11.728 14.400 13.419 1.00 0.00 H new ATOM 0 HG2 LYS B 436 10.541 11.699 14.120 1.00 0.00 H new ATOM 0 HG3 LYS B 436 11.596 12.697 15.102 1.00 0.00 H new ATOM 0 HD2 LYS B 436 8.990 13.897 14.207 1.00 0.00 H new ATOM 0 HD3 LYS B 436 8.927 12.656 15.444 1.00 0.00 H new ATOM 0 HE2 LYS B 436 11.059 14.560 16.018 1.00 0.00 H new ATOM 0 HE3 LYS B 436 9.537 15.397 15.789 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 9.843 14.751 18.089 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 8.513 13.928 17.428 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 9.988 13.116 17.651 1.00 0.00 H new ATOM 2159 N MET B 437 10.811 12.748 10.019 1.00 0.00 N ATOM 2160 CA MET B 437 11.319 12.738 8.655 1.00 0.00 C ATOM 2161 C MET B 437 10.279 13.346 7.722 1.00 0.00 C ATOM 2162 O MET B 437 10.589 14.235 6.933 1.00 0.00 O ATOM 2163 CB MET B 437 11.680 11.314 8.211 1.00 0.00 C ATOM 2164 CG MET B 437 11.929 11.180 6.719 1.00 0.00 C ATOM 2165 SD MET B 437 11.281 9.636 6.050 1.00 0.00 S ATOM 2166 CE MET B 437 10.136 10.253 4.822 1.00 0.00 C ATOM 0 H MET B 437 10.539 11.833 10.377 1.00 0.00 H new ATOM 0 HA MET B 437 12.230 13.335 8.614 1.00 0.00 H new ATOM 0 HB2 MET B 437 12.571 10.991 8.749 1.00 0.00 H new ATOM 0 HB3 MET B 437 10.873 10.639 8.497 1.00 0.00 H new ATOM 0 HG2 MET B 437 11.468 12.020 6.200 1.00 0.00 H new ATOM 0 HG3 MET B 437 13.000 11.235 6.526 1.00 0.00 H new ATOM 0 HE1 MET B 437 9.253 9.614 4.794 1.00 0.00 H new ATOM 0 HE2 MET B 437 9.840 11.270 5.079 1.00 0.00 H new ATOM 0 HE3 MET B 437 10.616 10.251 3.843 1.00 0.00 H new ATOM 2176 N LEU B 438 9.038 12.867 7.822 1.00 0.00 N ATOM 2177 CA LEU B 438 7.969 13.391 6.980 1.00 0.00 C ATOM 2178 C LEU B 438 7.967 14.910 7.037 1.00 0.00 C ATOM 2179 O LEU B 438 7.940 15.574 6.005 1.00 0.00 O ATOM 2180 CB LEU B 438 6.607 12.854 7.428 1.00 0.00 C ATOM 2181 CG LEU B 438 6.521 11.332 7.552 1.00 0.00 C ATOM 2182 CD1 LEU B 438 5.162 10.917 8.093 1.00 0.00 C ATOM 2183 CD2 LEU B 438 6.786 10.673 6.208 1.00 0.00 C ATOM 0 H LEU B 438 8.754 12.130 8.467 1.00 0.00 H new ATOM 0 HA LEU B 438 8.147 13.064 5.955 1.00 0.00 H new ATOM 0 HB2 LEU B 438 6.358 13.297 8.393 1.00 0.00 H new ATOM 0 HB3 LEU B 438 5.850 13.189 6.719 1.00 0.00 H new ATOM 0 HG LEU B 438 7.285 10.999 8.254 1.00 0.00 H new ATOM 0 HD11 LEU B 438 5.119 9.831 8.174 1.00 0.00 H new ATOM 0 HD12 LEU B 438 5.011 11.361 9.077 1.00 0.00 H new ATOM 0 HD13 LEU B 438 4.380 11.261 7.416 1.00 0.00 H new ATOM 0 HD21 LEU B 438 6.721 9.590 6.315 1.00 0.00 H new ATOM 0 HD22 LEU B 438 6.045 11.012 5.484 1.00 0.00 H new ATOM 0 HD23 LEU B 438 7.783 10.944 5.860 1.00 0.00 H new ATOM 2195 N ASP B 439 8.006 15.464 8.247 1.00 0.00 N ATOM 2196 CA ASP B 439 8.023 16.910 8.410 1.00 0.00 C ATOM 2197 C ASP B 439 9.240 17.489 7.697 1.00 0.00 C ATOM 2198 O ASP B 439 9.122 18.381 6.858 1.00 0.00 O ATOM 2199 CB ASP B 439 8.051 17.269 9.899 1.00 0.00 C ATOM 2200 CG ASP B 439 8.354 18.735 10.139 1.00 0.00 C ATOM 2201 OD1 ASP B 439 9.549 19.095 10.175 1.00 0.00 O ATOM 2202 OD2 ASP B 439 7.396 19.522 10.293 1.00 0.00 O ATOM 0 H ASP B 439 8.026 14.936 9.120 1.00 0.00 H new ATOM 0 HA ASP B 439 7.121 17.335 7.970 1.00 0.00 H new ATOM 0 HB2 ASP B 439 7.088 17.023 10.347 1.00 0.00 H new ATOM 0 HB3 ASP B 439 8.802 16.659 10.402 1.00 0.00 H new ATOM 2207 N PHE B 440 10.412 16.959 8.035 1.00 0.00 N ATOM 2208 CA PHE B 440 11.654 17.412 7.418 1.00 0.00 C ATOM 2209 C PHE B 440 11.475 17.455 5.904 1.00 0.00 C ATOM 2210 O PHE B 440 11.760 18.464 5.258 1.00 0.00 O ATOM 2211 CB PHE B 440 12.818 16.484 7.792 1.00 0.00 C ATOM 2212 CG PHE B 440 13.898 16.413 6.746 1.00 0.00 C ATOM 2213 CD1 PHE B 440 13.732 15.631 5.615 1.00 0.00 C ATOM 2214 CD2 PHE B 440 15.074 17.133 6.892 1.00 0.00 C ATOM 2215 CE1 PHE B 440 14.717 15.567 4.647 1.00 0.00 C ATOM 2216 CE2 PHE B 440 16.063 17.072 5.928 1.00 0.00 C ATOM 2217 CZ PHE B 440 15.885 16.287 4.806 1.00 0.00 C ATOM 0 H PHE B 440 10.527 16.220 8.728 1.00 0.00 H new ATOM 0 HA PHE B 440 11.891 18.411 7.785 1.00 0.00 H new ATOM 0 HB2 PHE B 440 13.256 16.825 8.730 1.00 0.00 H new ATOM 0 HB3 PHE B 440 12.429 15.481 7.968 1.00 0.00 H new ATOM 0 HD1 PHE B 440 12.822 15.064 5.488 1.00 0.00 H new ATOM 0 HD2 PHE B 440 15.219 17.748 7.768 1.00 0.00 H new ATOM 0 HE1 PHE B 440 14.574 14.955 3.768 1.00 0.00 H new ATOM 0 HE2 PHE B 440 16.974 17.638 6.052 1.00 0.00 H new ATOM 0 HZ PHE B 440 16.658 16.236 4.054 1.00 0.00 H new ATOM 2227 N TYR B 441 10.976 16.355 5.354 1.00 0.00 N ATOM 2228 CA TYR B 441 10.725 16.258 3.925 1.00 0.00 C ATOM 2229 C TYR B 441 9.699 17.303 3.514 1.00 0.00 C ATOM 2230 O TYR B 441 9.803 17.921 2.457 1.00 0.00 O ATOM 2231 CB TYR B 441 10.221 14.859 3.579 1.00 0.00 C ATOM 2232 CG TYR B 441 11.233 14.027 2.835 1.00 0.00 C ATOM 2233 CD1 TYR B 441 12.281 13.411 3.503 1.00 0.00 C ATOM 2234 CD2 TYR B 441 11.147 13.873 1.463 1.00 0.00 C ATOM 2235 CE1 TYR B 441 13.216 12.657 2.819 1.00 0.00 C ATOM 2236 CE2 TYR B 441 12.074 13.127 0.770 1.00 0.00 C ATOM 2237 CZ TYR B 441 13.107 12.519 1.451 1.00 0.00 C ATOM 2238 OH TYR B 441 14.035 11.772 0.763 1.00 0.00 O ATOM 0 H TYR B 441 10.737 15.515 5.880 1.00 0.00 H new ATOM 0 HA TYR B 441 11.653 16.439 3.383 1.00 0.00 H new ATOM 0 HB2 TYR B 441 9.942 14.343 4.498 1.00 0.00 H new ATOM 0 HB3 TYR B 441 9.318 14.945 2.975 1.00 0.00 H new ATOM 0 HD1 TYR B 441 12.368 13.522 4.574 1.00 0.00 H new ATOM 0 HD2 TYR B 441 10.338 14.346 0.926 1.00 0.00 H new ATOM 0 HE1 TYR B 441 14.025 12.180 3.351 1.00 0.00 H new ATOM 0 HE2 TYR B 441 11.992 13.019 -0.301 1.00 0.00 H new ATOM 0 HH TYR B 441 14.898 11.816 1.225 1.00 0.00 H new ATOM 2248 N ALA B 442 8.715 17.490 4.380 1.00 0.00 N ATOM 2249 CA ALA B 442 7.663 18.466 4.135 1.00 0.00 C ATOM 2250 C ALA B 442 8.297 19.828 3.893 1.00 0.00 C ATOM 2251 O ALA B 442 8.070 20.459 2.861 1.00 0.00 O ATOM 2252 CB ALA B 442 6.688 18.530 5.301 1.00 0.00 C ATOM 0 H ALA B 442 8.622 16.980 5.258 1.00 0.00 H new ATOM 0 HA ALA B 442 7.097 18.163 3.254 1.00 0.00 H new ATOM 0 HB1 ALA B 442 5.914 19.268 5.088 1.00 0.00 H new ATOM 0 HB2 ALA B 442 6.228 17.552 5.445 1.00 0.00 H new ATOM 0 HB3 ALA B 442 7.222 18.816 6.207 1.00 0.00 H new ATOM 2258 N LYS B 443 9.089 20.276 4.860 1.00 0.00 N ATOM 2259 CA LYS B 443 9.757 21.567 4.767 1.00 0.00 C ATOM 2260 C LYS B 443 10.634 21.607 3.525 1.00 0.00 C ATOM 2261 O LYS B 443 10.865 22.668 2.950 1.00 0.00 O ATOM 2262 CB LYS B 443 10.591 21.823 6.028 1.00 0.00 C ATOM 2263 CG LYS B 443 11.817 22.694 5.797 1.00 0.00 C ATOM 2264 CD LYS B 443 13.054 21.851 5.536 1.00 0.00 C ATOM 2265 CE LYS B 443 13.462 21.067 6.774 1.00 0.00 C ATOM 2266 NZ LYS B 443 14.929 21.130 7.014 1.00 0.00 N ATOM 0 H LYS B 443 9.284 19.762 5.719 1.00 0.00 H new ATOM 0 HA LYS B 443 9.006 22.353 4.688 1.00 0.00 H new ATOM 0 HB2 LYS B 443 9.958 22.297 6.779 1.00 0.00 H new ATOM 0 HB3 LYS B 443 10.911 20.866 6.439 1.00 0.00 H new ATOM 0 HG2 LYS B 443 11.640 23.356 4.949 1.00 0.00 H new ATOM 0 HG3 LYS B 443 11.984 23.328 6.668 1.00 0.00 H new ATOM 0 HD2 LYS B 443 12.860 21.162 4.714 1.00 0.00 H new ATOM 0 HD3 LYS B 443 13.876 22.495 5.224 1.00 0.00 H new ATOM 0 HE2 LYS B 443 12.935 21.461 7.643 1.00 0.00 H new ATOM 0 HE3 LYS B 443 13.157 20.027 6.661 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 15.165 20.583 7.867 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 15.432 20.731 6.196 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 15.217 22.120 7.147 1.00 0.00 H new ATOM 2280 N GLN B 444 11.100 20.439 3.102 1.00 0.00 N ATOM 2281 CA GLN B 444 11.924 20.337 1.907 1.00 0.00 C ATOM 2282 C GLN B 444 11.054 20.581 0.674 1.00 0.00 C ATOM 2283 O GLN B 444 11.348 21.440 -0.158 1.00 0.00 O ATOM 2284 CB GLN B 444 12.593 18.952 1.851 1.00 0.00 C ATOM 2285 CG GLN B 444 12.315 18.157 0.584 1.00 0.00 C ATOM 2286 CD GLN B 444 12.787 18.859 -0.676 1.00 0.00 C ATOM 2287 OE1 GLN B 444 12.236 18.650 -1.757 1.00 0.00 O ATOM 2288 NE2 GLN B 444 13.812 19.695 -0.547 1.00 0.00 N ATOM 0 H GLN B 444 10.921 19.550 3.569 1.00 0.00 H new ATOM 0 HA GLN B 444 12.712 21.090 1.931 1.00 0.00 H new ATOM 0 HB2 GLN B 444 13.671 19.081 1.953 1.00 0.00 H new ATOM 0 HB3 GLN B 444 12.259 18.369 2.709 1.00 0.00 H new ATOM 0 HG2 GLN B 444 12.805 17.186 0.657 1.00 0.00 H new ATOM 0 HG3 GLN B 444 11.244 17.969 0.508 1.00 0.00 H new ATOM 0 HE21 GLN B 444 14.240 19.840 0.367 1.00 0.00 H new ATOM 0 HE22 GLN B 444 14.171 20.192 -1.362 1.00 0.00 H new ATOM 2297 N ARG B 445 9.986 19.794 0.569 1.00 0.00 N ATOM 2298 CA ARG B 445 9.066 19.882 -0.557 1.00 0.00 C ATOM 2299 C ARG B 445 8.578 21.315 -0.742 1.00 0.00 C ATOM 2300 O ARG B 445 8.396 21.772 -1.867 1.00 0.00 O ATOM 2301 CB ARG B 445 7.883 18.920 -0.334 1.00 0.00 C ATOM 2302 CG ARG B 445 6.509 19.581 -0.320 1.00 0.00 C ATOM 2303 CD ARG B 445 6.149 20.148 -1.684 1.00 0.00 C ATOM 2304 NE ARG B 445 4.726 20.007 -1.979 1.00 0.00 N ATOM 2305 CZ ARG B 445 4.068 20.797 -2.822 1.00 0.00 C ATOM 2306 NH1 ARG B 445 4.703 21.778 -3.449 1.00 0.00 N ATOM 2307 NH2 ARG B 445 2.774 20.607 -3.039 1.00 0.00 N ATOM 0 H ARG B 445 9.737 19.083 1.257 1.00 0.00 H new ATOM 0 HA ARG B 445 9.588 19.590 -1.468 1.00 0.00 H new ATOM 0 HB2 ARG B 445 7.897 18.163 -1.118 1.00 0.00 H new ATOM 0 HB3 ARG B 445 8.030 18.401 0.613 1.00 0.00 H new ATOM 0 HG2 ARG B 445 5.757 18.852 -0.018 1.00 0.00 H new ATOM 0 HG3 ARG B 445 6.496 20.379 0.422 1.00 0.00 H new ATOM 0 HD2 ARG B 445 6.424 21.202 -1.722 1.00 0.00 H new ATOM 0 HD3 ARG B 445 6.730 19.639 -2.453 1.00 0.00 H new ATOM 0 HE ARG B 445 4.208 19.262 -1.513 1.00 0.00 H new ATOM 0 HH11 ARG B 445 5.699 21.928 -3.285 1.00 0.00 H new ATOM 0 HH12 ARG B 445 4.196 22.383 -4.095 1.00 0.00 H new ATOM 0 HH21 ARG B 445 2.282 19.854 -2.559 1.00 0.00 H new ATOM 0 HH22 ARG B 445 2.271 21.214 -3.686 1.00 0.00 H new ATOM 2321 N ALA B 446 8.375 22.022 0.361 1.00 0.00 N ATOM 2322 CA ALA B 446 7.919 23.404 0.300 1.00 0.00 C ATOM 2323 C ALA B 446 9.099 24.352 0.102 1.00 0.00 C ATOM 2324 O ALA B 446 9.045 25.266 -0.719 1.00 0.00 O ATOM 2325 CB ALA B 446 7.148 23.779 1.556 1.00 0.00 C ATOM 0 H ALA B 446 8.518 21.664 1.305 1.00 0.00 H new ATOM 0 HA ALA B 446 7.249 23.498 -0.554 1.00 0.00 H new ATOM 0 HB1 ALA B 446 6.819 24.816 1.485 1.00 0.00 H new ATOM 0 HB2 ALA B 446 6.279 23.129 1.657 1.00 0.00 H new ATOM 0 HB3 ALA B 446 7.793 23.662 2.427 1.00 0.00 H new ATOM 2331 N ALA B 447 10.160 24.128 0.872 1.00 0.00 N ATOM 2332 CA ALA B 447 11.354 24.963 0.796 1.00 0.00 C ATOM 2333 C ALA B 447 11.756 25.232 -0.650 1.00 0.00 C ATOM 2334 O ALA B 447 12.255 26.310 -0.975 1.00 0.00 O ATOM 2335 CB ALA B 447 12.511 24.326 1.552 1.00 0.00 C ATOM 0 H ALA B 447 10.217 23.374 1.557 1.00 0.00 H new ATOM 0 HA ALA B 447 11.113 25.917 1.264 1.00 0.00 H new ATOM 0 HB1 ALA B 447 13.389 24.967 1.481 1.00 0.00 H new ATOM 0 HB2 ALA B 447 12.237 24.202 2.600 1.00 0.00 H new ATOM 0 HB3 ALA B 447 12.737 23.352 1.118 1.00 0.00 H new ATOM 2341 N ILE B 448 11.543 24.247 -1.515 1.00 0.00 N ATOM 2342 CA ILE B 448 11.890 24.378 -2.922 1.00 0.00 C ATOM 2343 C ILE B 448 11.316 25.658 -3.518 1.00 0.00 C ATOM 2344 O ILE B 448 10.215 26.081 -3.165 1.00 0.00 O ATOM 2345 CB ILE B 448 11.366 23.178 -3.726 1.00 0.00 C ATOM 2346 CG1 ILE B 448 9.842 23.184 -3.722 1.00 0.00 C ATOM 2347 CG2 ILE B 448 11.897 21.877 -3.143 1.00 0.00 C ATOM 2348 CD1 ILE B 448 9.232 21.919 -4.285 1.00 0.00 C ATOM 0 H ILE B 448 11.131 23.348 -1.264 1.00 0.00 H new ATOM 0 HA ILE B 448 12.978 24.413 -2.982 1.00 0.00 H new ATOM 0 HB ILE B 448 11.717 23.258 -4.755 1.00 0.00 H new ATOM 0 HG12 ILE B 448 9.490 23.324 -2.700 1.00 0.00 H new ATOM 0 HG13 ILE B 448 9.488 24.037 -4.301 1.00 0.00 H new ATOM 0 HG21 ILE B 448 11.517 21.036 -3.723 1.00 0.00 H new ATOM 0 HG22 ILE B 448 12.986 21.880 -3.179 1.00 0.00 H new ATOM 0 HG23 ILE B 448 11.569 21.781 -2.108 1.00 0.00 H new ATOM 0 HD11 ILE B 448 8.145 21.993 -4.251 1.00 0.00 H new ATOM 0 HD12 ILE B 448 9.555 21.788 -5.318 1.00 0.00 H new ATOM 0 HD13 ILE B 448 9.556 21.064 -3.692 1.00 0.00 H new