USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=22 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 391 LYS NZ :NH3+ -120:sc= 0.407 (180deg=0.0296) USER MOD Set 1.2: B 399 ASN :FLIP amide:sc= -0.903 F(o=-2!,f=-0.5) USER MOD Single : B 365 SER OG : rot 180:sc= 0 USER MOD Single : B 368 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 369 ASN :FLIP amide:sc= -0.417 F(o=-1.2,f=-0.42) USER MOD Single : B 371 LYS NZ :NH3+ 139:sc= -2.75! (180deg=-3.98!) USER MOD Single : B 373 GLN : amide:sc= -17.1! C(o=-17!,f=-19!) USER MOD Single : B 375 TYR OH : rot -13:sc= 0.0414 USER MOD Single : B 376 SER OG : rot 64:sc= -1.41! USER MOD Single : B 380 TYR OH : rot 180:sc= 0 USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS : no HE2:sc= -2.24 X(o=-2.2,f=-2.4!) USER MOD Single : B 387 TYR OH : rot -49:sc= -6.78! USER MOD Single : B 389 THR OG1 : rot 34:sc= 0.373 USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot 85:sc= 0.352 USER MOD Single : B 400 SER OG : rot 180:sc= -0.616 USER MOD Single : B 404 CYS SG : rot 121:sc= -0.0118 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 180:sc= 0 USER MOD Single : B 419 ASN : amide:sc= -11.3! C(o=-11!,f=-17!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -0.877 X(o=-0.88,f=-0.48) USER MOD Single : B 435 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.27) USER MOD Single : B 436 LYS NZ :NH3+ 158:sc= -0.206 (180deg=-0.753) USER MOD Single : B 437 MET CE :methyl -151:sc= -9.59! (180deg=-10.7!) USER MOD Single : B 441 TYR OH : rot 180:sc= 0 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN :FLIP amide:sc= -2.56! C(o=-3.7!,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 1036 N SER B 365 -3.053 3.615 12.853 1.00 0.00 N ATOM 1037 CA SER B 365 -2.021 2.712 12.355 1.00 0.00 C ATOM 1038 C SER B 365 -2.593 1.760 11.307 1.00 0.00 C ATOM 1039 O SER B 365 -3.094 0.687 11.641 1.00 0.00 O ATOM 1040 CB SER B 365 -1.416 1.913 13.512 1.00 0.00 C ATOM 1041 OG SER B 365 -0.126 2.393 13.847 1.00 0.00 O ATOM 0 HA SER B 365 -1.240 3.311 11.887 1.00 0.00 H new ATOM 0 HB2 SER B 365 -2.069 1.978 14.383 1.00 0.00 H new ATOM 0 HB3 SER B 365 -1.355 0.860 13.237 1.00 0.00 H new ATOM 0 HG SER B 365 0.236 1.866 14.590 1.00 0.00 H new ATOM 1047 N LEU B 366 -2.519 2.160 10.040 1.00 0.00 N ATOM 1048 CA LEU B 366 -3.036 1.335 8.951 1.00 0.00 C ATOM 1049 C LEU B 366 -2.656 1.910 7.589 1.00 0.00 C ATOM 1050 O LEU B 366 -2.046 2.974 7.500 1.00 0.00 O ATOM 1051 CB LEU B 366 -4.556 1.213 9.059 1.00 0.00 C ATOM 1052 CG LEU B 366 -5.314 2.541 9.035 1.00 0.00 C ATOM 1053 CD1 LEU B 366 -6.782 2.313 8.711 1.00 0.00 C ATOM 1054 CD2 LEU B 366 -5.165 3.262 10.368 1.00 0.00 C ATOM 0 H LEU B 366 -2.109 3.045 9.743 1.00 0.00 H new ATOM 0 HA LEU B 366 -2.587 0.346 9.038 1.00 0.00 H new ATOM 0 HB2 LEU B 366 -4.915 0.592 8.238 1.00 0.00 H new ATOM 0 HB3 LEU B 366 -4.799 0.690 9.984 1.00 0.00 H new ATOM 0 HG LEU B 366 -4.885 3.169 8.254 1.00 0.00 H new ATOM 0 HD11 LEU B 366 -7.305 3.269 8.699 1.00 0.00 H new ATOM 0 HD12 LEU B 366 -6.869 1.839 7.733 1.00 0.00 H new ATOM 0 HD13 LEU B 366 -7.226 1.667 9.469 1.00 0.00 H new ATOM 0 HD21 LEU B 366 -5.710 4.205 10.334 1.00 0.00 H new ATOM 0 HD22 LEU B 366 -5.568 2.638 11.166 1.00 0.00 H new ATOM 0 HD23 LEU B 366 -4.110 3.459 10.559 1.00 0.00 H new ATOM 1066 N ASP B 367 -3.027 1.197 6.529 1.00 0.00 N ATOM 1067 CA ASP B 367 -2.728 1.631 5.167 1.00 0.00 C ATOM 1068 C ASP B 367 -3.224 3.051 4.918 1.00 0.00 C ATOM 1069 O ASP B 367 -2.439 4.001 4.918 1.00 0.00 O ATOM 1070 CB ASP B 367 -3.361 0.676 4.151 1.00 0.00 C ATOM 1071 CG ASP B 367 -4.657 0.068 4.654 1.00 0.00 C ATOM 1072 OD1 ASP B 367 -5.484 0.816 5.217 1.00 0.00 O ATOM 1073 OD2 ASP B 367 -4.845 -1.154 4.483 1.00 0.00 O ATOM 0 H ASP B 367 -3.536 0.315 6.587 1.00 0.00 H new ATOM 0 HA ASP B 367 -1.645 1.619 5.046 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -3.552 1.213 3.222 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -2.655 -0.122 3.918 1.00 0.00 H new ATOM 1078 N MET B 368 -4.532 3.180 4.693 1.00 0.00 N ATOM 1079 CA MET B 368 -5.152 4.477 4.432 1.00 0.00 C ATOM 1080 C MET B 368 -4.393 5.600 5.130 1.00 0.00 C ATOM 1081 O MET B 368 -4.063 6.613 4.520 1.00 0.00 O ATOM 1082 CB MET B 368 -6.610 4.466 4.893 1.00 0.00 C ATOM 1083 CG MET B 368 -7.197 5.853 5.093 1.00 0.00 C ATOM 1084 SD MET B 368 -7.364 6.292 6.833 1.00 0.00 S ATOM 1085 CE MET B 368 -7.020 8.047 6.778 1.00 0.00 C ATOM 0 H MET B 368 -5.185 2.396 4.687 1.00 0.00 H new ATOM 0 HA MET B 368 -5.116 4.658 3.358 1.00 0.00 H new ATOM 0 HB2 MET B 368 -7.210 3.929 4.158 1.00 0.00 H new ATOM 0 HB3 MET B 368 -6.682 3.912 5.829 1.00 0.00 H new ATOM 0 HG2 MET B 368 -6.562 6.587 4.596 1.00 0.00 H new ATOM 0 HG3 MET B 368 -8.175 5.902 4.614 1.00 0.00 H new ATOM 0 HE1 MET B 368 -7.086 8.462 7.784 1.00 0.00 H new ATOM 0 HE2 MET B 368 -6.017 8.209 6.383 1.00 0.00 H new ATOM 0 HE3 MET B 368 -7.748 8.540 6.134 1.00 0.00 H new ATOM 1095 N ASN B 369 -4.124 5.417 6.413 1.00 0.00 N ATOM 1096 CA ASN B 369 -3.408 6.420 7.189 1.00 0.00 C ATOM 1097 C ASN B 369 -2.073 6.779 6.537 1.00 0.00 C ATOM 1098 O ASN B 369 -1.857 7.924 6.139 1.00 0.00 O ATOM 1099 CB ASN B 369 -3.173 5.913 8.611 1.00 0.00 C ATOM 1100 CG ASN B 369 -3.957 6.696 9.646 1.00 0.00 C ATOM 1101 OD1 ASN B 369 -5.256 6.434 9.726 1.00 0.00 O flip ATOM 1102 ND2 ASN B 369 -3.401 7.526 10.367 1.00 0.00 N flip ATOM 0 H ASN B 369 -4.390 4.585 6.939 1.00 0.00 H new ATOM 0 HA ASN B 369 -4.022 7.320 7.222 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -3.452 4.861 8.668 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -2.110 5.974 8.843 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -2.400 7.695 10.271 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -3.942 8.044 11.060 1.00 0.00 H new ATOM 1109 N ALA B 370 -1.172 5.802 6.448 1.00 0.00 N ATOM 1110 CA ALA B 370 0.148 6.035 5.863 1.00 0.00 C ATOM 1111 C ALA B 370 0.045 6.690 4.489 1.00 0.00 C ATOM 1112 O ALA B 370 0.535 7.801 4.290 1.00 0.00 O ATOM 1113 CB ALA B 370 0.933 4.737 5.764 1.00 0.00 C ATOM 0 H ALA B 370 -1.330 4.847 6.771 1.00 0.00 H new ATOM 0 HA ALA B 370 0.679 6.719 6.525 1.00 0.00 H new ATOM 0 HB1 ALA B 370 1.911 4.936 5.326 1.00 0.00 H new ATOM 0 HB2 ALA B 370 1.061 4.312 6.760 1.00 0.00 H new ATOM 0 HB3 ALA B 370 0.391 4.031 5.135 1.00 0.00 H new ATOM 1119 N LYS B 371 -0.569 5.996 3.533 1.00 0.00 N ATOM 1120 CA LYS B 371 -0.694 6.528 2.180 1.00 0.00 C ATOM 1121 C LYS B 371 -1.171 7.974 2.213 1.00 0.00 C ATOM 1122 O LYS B 371 -0.727 8.801 1.416 1.00 0.00 O ATOM 1123 CB LYS B 371 -1.651 5.673 1.345 1.00 0.00 C ATOM 1124 CG LYS B 371 -3.082 5.676 1.855 1.00 0.00 C ATOM 1125 CD LYS B 371 -3.894 6.807 1.239 1.00 0.00 C ATOM 1126 CE LYS B 371 -5.314 6.848 1.789 1.00 0.00 C ATOM 1127 NZ LYS B 371 -6.051 5.580 1.530 1.00 0.00 N ATOM 0 H LYS B 371 -0.983 5.074 3.669 1.00 0.00 H new ATOM 0 HA LYS B 371 0.291 6.497 1.714 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -1.641 6.033 0.316 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -1.284 4.647 1.327 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -3.553 4.721 1.623 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -3.082 5.777 2.940 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -3.400 7.758 1.436 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -3.927 6.683 0.157 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -5.281 7.035 2.862 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -5.854 7.680 1.336 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -6.609 5.325 2.370 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -6.688 5.708 0.718 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -5.372 4.820 1.321 1.00 0.00 H new ATOM 1141 N ARG B 372 -2.055 8.285 3.154 1.00 0.00 N ATOM 1142 CA ARG B 372 -2.558 9.644 3.298 1.00 0.00 C ATOM 1143 C ARG B 372 -1.459 10.542 3.852 1.00 0.00 C ATOM 1144 O ARG B 372 -1.218 11.634 3.351 1.00 0.00 O ATOM 1145 CB ARG B 372 -3.774 9.672 4.231 1.00 0.00 C ATOM 1146 CG ARG B 372 -4.885 10.604 3.764 1.00 0.00 C ATOM 1147 CD ARG B 372 -4.688 12.032 4.257 1.00 0.00 C ATOM 1148 NE ARG B 372 -3.528 12.167 5.136 1.00 0.00 N ATOM 1149 CZ ARG B 372 -3.585 12.030 6.459 1.00 0.00 C ATOM 1150 NH1 ARG B 372 -4.732 11.723 7.049 1.00 0.00 N ATOM 1151 NH2 ARG B 372 -2.492 12.197 7.191 1.00 0.00 N ATOM 0 H ARG B 372 -2.436 7.618 3.825 1.00 0.00 H new ATOM 0 HA ARG B 372 -2.865 10.009 2.318 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -4.174 8.662 4.322 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -3.450 9.978 5.226 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -4.925 10.600 2.675 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -5.845 10.228 4.120 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -4.569 12.695 3.400 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -5.582 12.356 4.789 1.00 0.00 H new ATOM 0 HE ARG B 372 -2.625 12.378 4.712 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -5.574 11.591 6.489 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -4.772 11.619 8.063 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -1.607 12.431 6.740 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -2.536 12.092 8.205 1.00 0.00 H new ATOM 1165 N GLN B 373 -0.795 10.059 4.891 1.00 0.00 N ATOM 1166 CA GLN B 373 0.281 10.792 5.539 1.00 0.00 C ATOM 1167 C GLN B 373 1.430 11.102 4.584 1.00 0.00 C ATOM 1168 O GLN B 373 1.946 12.217 4.563 1.00 0.00 O ATOM 1169 CB GLN B 373 0.815 9.968 6.711 1.00 0.00 C ATOM 1170 CG GLN B 373 1.290 10.796 7.889 1.00 0.00 C ATOM 1171 CD GLN B 373 1.679 12.208 7.501 1.00 0.00 C ATOM 1172 OE1 GLN B 373 0.966 13.164 7.807 1.00 0.00 O ATOM 1173 NE2 GLN B 373 2.812 12.344 6.821 1.00 0.00 N ATOM 0 H GLN B 373 -0.987 9.148 5.308 1.00 0.00 H new ATOM 0 HA GLN B 373 -0.129 11.741 5.884 1.00 0.00 H new ATOM 0 HB2 GLN B 373 0.032 9.290 7.050 1.00 0.00 H new ATOM 0 HB3 GLN B 373 1.641 9.350 6.359 1.00 0.00 H new ATOM 0 HG2 GLN B 373 0.501 10.836 8.640 1.00 0.00 H new ATOM 0 HG3 GLN B 373 2.145 10.303 8.351 1.00 0.00 H new ATOM 0 HE21 GLN B 373 3.370 11.522 6.590 1.00 0.00 H new ATOM 0 HE22 GLN B 373 3.124 13.270 6.530 1.00 0.00 H new ATOM 1182 N LEU B 374 1.843 10.104 3.815 1.00 0.00 N ATOM 1183 CA LEU B 374 2.962 10.281 2.893 1.00 0.00 C ATOM 1184 C LEU B 374 2.611 11.180 1.715 1.00 0.00 C ATOM 1185 O LEU B 374 3.290 12.173 1.468 1.00 0.00 O ATOM 1186 CB LEU B 374 3.432 8.922 2.378 1.00 0.00 C ATOM 1187 CG LEU B 374 3.815 7.924 3.469 1.00 0.00 C ATOM 1188 CD1 LEU B 374 4.757 6.865 2.922 1.00 0.00 C ATOM 1189 CD2 LEU B 374 4.450 8.650 4.641 1.00 0.00 C ATOM 0 H LEU B 374 1.427 9.173 3.809 1.00 0.00 H new ATOM 0 HA LEU B 374 3.762 10.769 3.450 1.00 0.00 H new ATOM 0 HB2 LEU B 374 2.641 8.487 1.768 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.292 9.074 1.725 1.00 0.00 H new ATOM 0 HG LEU B 374 2.910 7.425 3.816 1.00 0.00 H new ATOM 0 HD11 LEU B 374 5.017 6.165 3.716 1.00 0.00 H new ATOM 0 HD12 LEU B 374 4.268 6.328 2.110 1.00 0.00 H new ATOM 0 HD13 LEU B 374 5.663 7.342 2.548 1.00 0.00 H new ATOM 0 HD21 LEU B 374 4.719 7.929 5.413 1.00 0.00 H new ATOM 0 HD22 LEU B 374 5.346 9.172 4.304 1.00 0.00 H new ATOM 0 HD23 LEU B 374 3.742 9.371 5.049 1.00 0.00 H new ATOM 1201 N TYR B 375 1.581 10.811 0.968 1.00 0.00 N ATOM 1202 CA TYR B 375 1.187 11.574 -0.212 1.00 0.00 C ATOM 1203 C TYR B 375 0.539 12.913 0.136 1.00 0.00 C ATOM 1204 O TYR B 375 0.697 13.887 -0.600 1.00 0.00 O ATOM 1205 CB TYR B 375 0.253 10.742 -1.088 1.00 0.00 C ATOM 1206 CG TYR B 375 0.989 9.828 -2.044 1.00 0.00 C ATOM 1207 CD1 TYR B 375 2.363 9.637 -1.939 1.00 0.00 C ATOM 1208 CD2 TYR B 375 0.310 9.157 -3.053 1.00 0.00 C ATOM 1209 CE1 TYR B 375 3.036 8.805 -2.814 1.00 0.00 C ATOM 1210 CE2 TYR B 375 0.976 8.323 -3.929 1.00 0.00 C ATOM 1211 CZ TYR B 375 2.338 8.151 -3.805 1.00 0.00 C ATOM 1212 OH TYR B 375 3.003 7.321 -4.677 1.00 0.00 O ATOM 0 H TYR B 375 1.003 9.991 1.155 1.00 0.00 H new ATOM 0 HA TYR B 375 2.099 11.802 -0.763 1.00 0.00 H new ATOM 0 HB2 TYR B 375 -0.396 10.143 -0.449 1.00 0.00 H new ATOM 0 HB3 TYR B 375 -0.391 11.411 -1.659 1.00 0.00 H new ATOM 0 HD1 TYR B 375 2.913 10.147 -1.162 1.00 0.00 H new ATOM 0 HD2 TYR B 375 -0.757 9.290 -3.154 1.00 0.00 H new ATOM 0 HE1 TYR B 375 4.103 8.669 -2.721 1.00 0.00 H new ATOM 0 HE2 TYR B 375 0.433 7.808 -4.707 1.00 0.00 H new ATOM 0 HH TYR B 375 3.968 7.470 -4.599 1.00 0.00 H new ATOM 1222 N SER B 376 -0.182 12.973 1.250 1.00 0.00 N ATOM 1223 CA SER B 376 -0.822 14.226 1.640 1.00 0.00 C ATOM 1224 C SER B 376 0.219 15.221 2.140 1.00 0.00 C ATOM 1225 O SER B 376 0.297 16.346 1.648 1.00 0.00 O ATOM 1226 CB SER B 376 -1.887 13.994 2.710 1.00 0.00 C ATOM 1227 OG SER B 376 -2.794 12.981 2.313 1.00 0.00 O ATOM 0 H SER B 376 -0.337 12.191 1.886 1.00 0.00 H new ATOM 0 HA SER B 376 -1.313 14.640 0.759 1.00 0.00 H new ATOM 0 HB2 SER B 376 -1.409 13.712 3.648 1.00 0.00 H new ATOM 0 HB3 SER B 376 -2.430 14.921 2.895 1.00 0.00 H new ATOM 0 HG SER B 376 -2.316 12.130 2.225 1.00 0.00 H new ATOM 1233 N LEU B 377 1.010 14.808 3.126 1.00 0.00 N ATOM 1234 CA LEU B 377 2.030 15.686 3.683 1.00 0.00 C ATOM 1235 C LEU B 377 3.149 15.945 2.683 1.00 0.00 C ATOM 1236 O LEU B 377 3.402 17.093 2.319 1.00 0.00 O ATOM 1237 CB LEU B 377 2.602 15.111 4.977 1.00 0.00 C ATOM 1238 CG LEU B 377 1.711 15.298 6.206 1.00 0.00 C ATOM 1239 CD1 LEU B 377 1.705 16.753 6.635 1.00 0.00 C ATOM 1240 CD2 LEU B 377 0.297 14.818 5.918 1.00 0.00 C ATOM 0 H LEU B 377 0.965 13.882 3.551 1.00 0.00 H new ATOM 0 HA LEU B 377 1.549 16.638 3.908 1.00 0.00 H new ATOM 0 HB2 LEU B 377 2.785 14.046 4.836 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.568 15.577 5.171 1.00 0.00 H new ATOM 0 HG LEU B 377 2.115 14.699 7.022 1.00 0.00 H new ATOM 0 HD11 LEU B 377 1.067 16.872 7.511 1.00 0.00 H new ATOM 0 HD12 LEU B 377 2.720 17.064 6.881 1.00 0.00 H new ATOM 0 HD13 LEU B 377 1.323 17.371 5.822 1.00 0.00 H new ATOM 0 HD21 LEU B 377 -0.323 14.959 6.804 1.00 0.00 H new ATOM 0 HD22 LEU B 377 -0.120 15.390 5.089 1.00 0.00 H new ATOM 0 HD23 LEU B 377 0.318 13.761 5.655 1.00 0.00 H new ATOM 1252 N ILE B 378 3.836 14.890 2.245 1.00 0.00 N ATOM 1253 CA ILE B 378 4.937 15.040 1.304 1.00 0.00 C ATOM 1254 C ILE B 378 4.575 14.512 -0.084 1.00 0.00 C ATOM 1255 O ILE B 378 3.707 13.654 -0.229 1.00 0.00 O ATOM 1256 CB ILE B 378 6.181 14.292 1.814 1.00 0.00 C ATOM 1257 CG1 ILE B 378 6.225 14.331 3.342 1.00 0.00 C ATOM 1258 CG2 ILE B 378 7.447 14.895 1.227 1.00 0.00 C ATOM 1259 CD1 ILE B 378 6.300 15.733 3.906 1.00 0.00 C ATOM 0 H ILE B 378 3.648 13.928 2.527 1.00 0.00 H new ATOM 0 HA ILE B 378 5.147 16.107 1.225 1.00 0.00 H new ATOM 0 HB ILE B 378 6.120 13.253 1.492 1.00 0.00 H new ATOM 0 HG12 ILE B 378 5.338 13.836 3.736 1.00 0.00 H new ATOM 0 HG13 ILE B 378 7.088 13.762 3.688 1.00 0.00 H new ATOM 0 HG21 ILE B 378 8.315 14.352 1.600 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.414 14.824 0.140 1.00 0.00 H new ATOM 0 HG23 ILE B 378 7.521 15.942 1.520 1.00 0.00 H new ATOM 0 HD11 ILE B 378 6.328 15.686 4.995 1.00 0.00 H new ATOM 0 HD12 ILE B 378 7.202 16.224 3.540 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.424 16.300 3.590 1.00 0.00 H new ATOM 1271 N GLY B 379 5.252 15.032 -1.101 1.00 0.00 N ATOM 1272 CA GLY B 379 4.994 14.601 -2.462 1.00 0.00 C ATOM 1273 C GLY B 379 4.456 15.714 -3.338 1.00 0.00 C ATOM 1274 O GLY B 379 3.283 16.076 -3.241 1.00 0.00 O ATOM 0 H GLY B 379 5.975 15.745 -1.007 1.00 0.00 H new ATOM 0 HA2 GLY B 379 5.916 14.216 -2.897 1.00 0.00 H new ATOM 0 HA3 GLY B 379 4.280 13.778 -2.448 1.00 0.00 H new ATOM 1278 N TYR B 380 5.313 16.259 -4.196 1.00 0.00 N ATOM 1279 CA TYR B 380 4.913 17.336 -5.091 1.00 0.00 C ATOM 1280 C TYR B 380 4.847 16.847 -6.534 1.00 0.00 C ATOM 1281 O TYR B 380 5.055 15.665 -6.810 1.00 0.00 O ATOM 1282 CB TYR B 380 5.888 18.512 -4.981 1.00 0.00 C ATOM 1283 CG TYR B 380 7.326 18.096 -4.752 1.00 0.00 C ATOM 1284 CD1 TYR B 380 7.733 17.572 -3.531 1.00 0.00 C ATOM 1285 CD2 TYR B 380 8.275 18.229 -5.758 1.00 0.00 C ATOM 1286 CE1 TYR B 380 9.045 17.193 -3.320 1.00 0.00 C ATOM 1287 CE2 TYR B 380 9.590 17.851 -5.553 1.00 0.00 C ATOM 1288 CZ TYR B 380 9.968 17.334 -4.333 1.00 0.00 C ATOM 1289 OH TYR B 380 11.275 16.957 -4.125 1.00 0.00 O ATOM 0 H TYR B 380 6.287 15.972 -4.289 1.00 0.00 H new ATOM 0 HA TYR B 380 3.919 17.671 -4.794 1.00 0.00 H new ATOM 0 HB2 TYR B 380 5.832 19.104 -5.894 1.00 0.00 H new ATOM 0 HB3 TYR B 380 5.572 19.158 -4.162 1.00 0.00 H new ATOM 0 HD1 TYR B 380 7.013 17.459 -2.734 1.00 0.00 H new ATOM 0 HD2 TYR B 380 7.982 18.634 -6.715 1.00 0.00 H new ATOM 0 HE1 TYR B 380 9.346 16.788 -2.365 1.00 0.00 H new ATOM 0 HE2 TYR B 380 10.316 17.961 -6.345 1.00 0.00 H new ATOM 0 HH TYR B 380 11.796 17.120 -4.939 1.00 0.00 H new ATOM 1299 N ALA B 381 4.556 17.763 -7.452 1.00 0.00 N ATOM 1300 CA ALA B 381 4.461 17.424 -8.868 1.00 0.00 C ATOM 1301 C ALA B 381 5.823 17.026 -9.426 1.00 0.00 C ATOM 1302 O ALA B 381 5.917 16.464 -10.517 1.00 0.00 O ATOM 1303 CB ALA B 381 3.883 18.584 -9.665 1.00 0.00 C ATOM 0 H ALA B 381 4.382 18.746 -7.241 1.00 0.00 H new ATOM 0 HA ALA B 381 3.789 16.571 -8.962 1.00 0.00 H new ATOM 0 HB1 ALA B 381 3.822 18.308 -10.718 1.00 0.00 H new ATOM 0 HB2 ALA B 381 2.886 18.820 -9.293 1.00 0.00 H new ATOM 0 HB3 ALA B 381 4.527 19.457 -9.556 1.00 0.00 H new ATOM 1309 N SER B 382 6.877 17.327 -8.673 1.00 0.00 N ATOM 1310 CA SER B 382 8.236 17.005 -9.094 1.00 0.00 C ATOM 1311 C SER B 382 8.795 15.830 -8.296 1.00 0.00 C ATOM 1312 O SER B 382 9.986 15.786 -7.991 1.00 0.00 O ATOM 1313 CB SER B 382 9.142 18.225 -8.927 1.00 0.00 C ATOM 1314 OG SER B 382 9.600 18.695 -10.182 1.00 0.00 O ATOM 0 H SER B 382 6.816 17.794 -7.768 1.00 0.00 H new ATOM 0 HA SER B 382 8.205 16.721 -10.146 1.00 0.00 H new ATOM 0 HB2 SER B 382 8.598 19.018 -8.414 1.00 0.00 H new ATOM 0 HB3 SER B 382 9.994 17.966 -8.299 1.00 0.00 H new ATOM 0 HG SER B 382 10.176 19.477 -10.048 1.00 0.00 H new ATOM 1320 N LEU B 383 7.928 14.880 -7.964 1.00 0.00 N ATOM 1321 CA LEU B 383 8.333 13.703 -7.205 1.00 0.00 C ATOM 1322 C LEU B 383 7.580 12.470 -7.691 1.00 0.00 C ATOM 1323 O LEU B 383 6.488 12.584 -8.251 1.00 0.00 O ATOM 1324 CB LEU B 383 8.075 13.918 -5.712 1.00 0.00 C ATOM 1325 CG LEU B 383 8.930 13.061 -4.778 1.00 0.00 C ATOM 1326 CD1 LEU B 383 10.349 12.946 -5.312 1.00 0.00 C ATOM 1327 CD2 LEU B 383 8.933 13.643 -3.372 1.00 0.00 C ATOM 0 H LEU B 383 6.938 14.902 -8.209 1.00 0.00 H new ATOM 0 HA LEU B 383 9.400 13.545 -7.360 1.00 0.00 H new ATOM 0 HB2 LEU B 383 8.248 14.968 -5.476 1.00 0.00 H new ATOM 0 HB3 LEU B 383 7.024 13.714 -5.507 1.00 0.00 H new ATOM 0 HG LEU B 383 8.497 12.062 -4.734 1.00 0.00 H new ATOM 0 HD11 LEU B 383 10.944 12.333 -4.635 1.00 0.00 H new ATOM 0 HD12 LEU B 383 10.330 12.483 -6.299 1.00 0.00 H new ATOM 0 HD13 LEU B 383 10.792 13.939 -5.385 1.00 0.00 H new ATOM 0 HD21 LEU B 383 9.547 13.020 -2.722 1.00 0.00 H new ATOM 0 HD22 LEU B 383 9.341 14.653 -3.397 1.00 0.00 H new ATOM 0 HD23 LEU B 383 7.913 13.674 -2.989 1.00 0.00 H new ATOM 1339 N ARG B 384 8.161 11.294 -7.482 1.00 0.00 N ATOM 1340 CA ARG B 384 7.529 10.052 -7.911 1.00 0.00 C ATOM 1341 C ARG B 384 7.516 9.004 -6.796 1.00 0.00 C ATOM 1342 O ARG B 384 6.923 7.938 -6.953 1.00 0.00 O ATOM 1343 CB ARG B 384 8.241 9.492 -9.146 1.00 0.00 C ATOM 1344 CG ARG B 384 9.587 8.857 -8.838 1.00 0.00 C ATOM 1345 CD ARG B 384 9.513 7.340 -8.903 1.00 0.00 C ATOM 1346 NE ARG B 384 10.143 6.813 -10.111 1.00 0.00 N ATOM 1347 CZ ARG B 384 10.257 5.516 -10.376 1.00 0.00 C ATOM 1348 NH1 ARG B 384 9.782 4.618 -9.522 1.00 0.00 N ATOM 1349 NH2 ARG B 384 10.845 5.115 -11.494 1.00 0.00 N ATOM 0 H ARG B 384 9.063 11.175 -7.021 1.00 0.00 H new ATOM 0 HA ARG B 384 6.494 10.283 -8.163 1.00 0.00 H new ATOM 0 HB2 ARG B 384 7.599 8.750 -9.620 1.00 0.00 H new ATOM 0 HB3 ARG B 384 8.385 10.296 -9.868 1.00 0.00 H new ATOM 0 HG2 ARG B 384 10.332 9.217 -9.548 1.00 0.00 H new ATOM 0 HG3 ARG B 384 9.917 9.164 -7.846 1.00 0.00 H new ATOM 0 HD2 ARG B 384 10.000 6.915 -8.025 1.00 0.00 H new ATOM 0 HD3 ARG B 384 8.470 7.026 -8.872 1.00 0.00 H new ATOM 0 HE ARG B 384 10.516 7.478 -10.789 1.00 0.00 H new ATOM 0 HH11 ARG B 384 9.329 4.923 -8.661 1.00 0.00 H new ATOM 0 HH12 ARG B 384 9.870 3.623 -9.727 1.00 0.00 H new ATOM 0 HH21 ARG B 384 11.211 5.802 -12.153 1.00 0.00 H new ATOM 0 HH22 ARG B 384 10.932 4.119 -11.696 1.00 0.00 H new ATOM 1363 N LEU B 385 8.246 9.263 -5.711 1.00 0.00 N ATOM 1364 CA LEU B 385 8.381 8.278 -4.641 1.00 0.00 C ATOM 1365 C LEU B 385 7.082 7.534 -4.390 1.00 0.00 C ATOM 1366 O LEU B 385 6.075 8.099 -3.963 1.00 0.00 O ATOM 1367 CB LEU B 385 8.847 8.954 -3.339 1.00 0.00 C ATOM 1368 CG LEU B 385 7.743 9.267 -2.316 1.00 0.00 C ATOM 1369 CD1 LEU B 385 8.327 9.524 -0.934 1.00 0.00 C ATOM 1370 CD2 LEU B 385 6.920 10.460 -2.772 1.00 0.00 C ATOM 0 H LEU B 385 8.747 10.137 -5.552 1.00 0.00 H new ATOM 0 HA LEU B 385 9.130 7.555 -4.964 1.00 0.00 H new ATOM 0 HB2 LEU B 385 9.586 8.311 -2.862 1.00 0.00 H new ATOM 0 HB3 LEU B 385 9.353 9.885 -3.596 1.00 0.00 H new ATOM 0 HG LEU B 385 7.092 8.395 -2.249 1.00 0.00 H new ATOM 0 HD11 LEU B 385 7.521 9.742 -0.233 1.00 0.00 H new ATOM 0 HD12 LEU B 385 8.870 8.641 -0.598 1.00 0.00 H new ATOM 0 HD13 LEU B 385 9.009 10.373 -0.979 1.00 0.00 H new ATOM 0 HD21 LEU B 385 6.143 10.668 -2.037 1.00 0.00 H new ATOM 0 HD22 LEU B 385 7.567 11.331 -2.873 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.459 10.237 -3.734 1.00 0.00 H new ATOM 1382 N HIS B 386 7.147 6.231 -4.661 1.00 0.00 N ATOM 1383 CA HIS B 386 6.024 5.323 -4.470 1.00 0.00 C ATOM 1384 C HIS B 386 6.465 4.127 -3.626 1.00 0.00 C ATOM 1385 O HIS B 386 7.471 4.193 -2.909 1.00 0.00 O ATOM 1386 CB HIS B 386 5.486 4.849 -5.821 1.00 0.00 C ATOM 1387 CG HIS B 386 6.449 3.993 -6.582 1.00 0.00 C ATOM 1388 ND1 HIS B 386 6.099 3.282 -7.711 1.00 0.00 N ATOM 1389 CD2 HIS B 386 7.761 3.735 -6.370 1.00 0.00 C ATOM 1390 CE1 HIS B 386 7.153 2.624 -8.158 1.00 0.00 C ATOM 1391 NE2 HIS B 386 8.174 2.882 -7.363 1.00 0.00 N ATOM 0 H HIS B 386 7.986 5.776 -5.021 1.00 0.00 H new ATOM 0 HA HIS B 386 5.226 5.852 -3.949 1.00 0.00 H new ATOM 0 HB2 HIS B 386 4.564 4.290 -5.660 1.00 0.00 H new ATOM 0 HB3 HIS B 386 5.229 5.719 -6.426 1.00 0.00 H new ATOM 0 HD1 HIS B 386 5.171 3.267 -8.134 1.00 0.00 H new ATOM 0 HD2 HIS B 386 8.370 4.127 -5.569 1.00 0.00 H new ATOM 0 HE1 HIS B 386 7.176 1.983 -9.027 1.00 0.00 H new ATOM 1400 N TYR B 387 5.725 3.022 -3.734 1.00 0.00 N ATOM 1401 CA TYR B 387 6.053 1.806 -3.000 1.00 0.00 C ATOM 1402 C TYR B 387 6.436 0.672 -3.951 1.00 0.00 C ATOM 1403 O TYR B 387 5.626 0.218 -4.760 1.00 0.00 O ATOM 1404 CB TYR B 387 4.873 1.380 -2.128 1.00 0.00 C ATOM 1405 CG TYR B 387 4.425 2.458 -1.173 1.00 0.00 C ATOM 1406 CD1 TYR B 387 3.541 3.445 -1.583 1.00 0.00 C ATOM 1407 CD2 TYR B 387 4.894 2.498 0.133 1.00 0.00 C ATOM 1408 CE1 TYR B 387 3.134 4.440 -0.718 1.00 0.00 C ATOM 1409 CE2 TYR B 387 4.491 3.493 1.003 1.00 0.00 C ATOM 1410 CZ TYR B 387 3.611 4.461 0.572 1.00 0.00 C ATOM 1411 OH TYR B 387 3.208 5.453 1.435 1.00 0.00 O ATOM 0 H TYR B 387 4.896 2.948 -4.323 1.00 0.00 H new ATOM 0 HA TYR B 387 6.911 2.020 -2.363 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.037 1.100 -2.769 1.00 0.00 H new ATOM 0 HB3 TYR B 387 5.150 0.492 -1.560 1.00 0.00 H new ATOM 0 HD1 TYR B 387 3.165 3.435 -2.595 1.00 0.00 H new ATOM 0 HD2 TYR B 387 5.584 1.740 0.474 1.00 0.00 H new ATOM 0 HE1 TYR B 387 2.443 5.200 -1.053 1.00 0.00 H new ATOM 0 HE2 TYR B 387 4.864 3.512 2.016 1.00 0.00 H new ATOM 0 HH TYR B 387 3.305 6.325 0.999 1.00 0.00 H new ATOM 1421 N VAL B 388 7.679 0.216 -3.833 1.00 0.00 N ATOM 1422 CA VAL B 388 8.182 -0.874 -4.667 1.00 0.00 C ATOM 1423 C VAL B 388 8.060 -2.205 -3.936 1.00 0.00 C ATOM 1424 O VAL B 388 8.450 -2.324 -2.778 1.00 0.00 O ATOM 1425 CB VAL B 388 9.649 -0.651 -5.077 1.00 0.00 C ATOM 1426 CG1 VAL B 388 9.740 0.368 -6.203 1.00 0.00 C ATOM 1427 CG2 VAL B 388 10.474 -0.212 -3.880 1.00 0.00 C ATOM 0 H VAL B 388 8.359 0.584 -3.167 1.00 0.00 H new ATOM 0 HA VAL B 388 7.573 -0.893 -5.571 1.00 0.00 H new ATOM 0 HB VAL B 388 10.055 -1.595 -5.442 1.00 0.00 H new ATOM 0 HG11 VAL B 388 10.784 0.513 -6.479 1.00 0.00 H new ATOM 0 HG12 VAL B 388 9.183 0.006 -7.067 1.00 0.00 H new ATOM 0 HG13 VAL B 388 9.318 1.316 -5.870 1.00 0.00 H new ATOM 0 HG21 VAL B 388 11.508 -0.059 -4.188 1.00 0.00 H new ATOM 0 HG22 VAL B 388 10.072 0.720 -3.483 1.00 0.00 H new ATOM 0 HG23 VAL B 388 10.435 -0.982 -3.109 1.00 0.00 H new ATOM 1437 N THR B 389 7.505 -3.206 -4.609 1.00 0.00 N ATOM 1438 CA THR B 389 7.327 -4.517 -3.998 1.00 0.00 C ATOM 1439 C THR B 389 8.450 -5.477 -4.371 1.00 0.00 C ATOM 1440 O THR B 389 8.643 -5.801 -5.543 1.00 0.00 O ATOM 1441 CB THR B 389 5.982 -5.146 -4.401 1.00 0.00 C ATOM 1442 OG1 THR B 389 5.874 -5.283 -5.824 1.00 0.00 O ATOM 1443 CG2 THR B 389 4.819 -4.298 -3.910 1.00 0.00 C ATOM 0 H THR B 389 7.173 -3.136 -5.571 1.00 0.00 H new ATOM 0 HA THR B 389 7.345 -4.355 -2.920 1.00 0.00 H new ATOM 0 HB THR B 389 5.943 -6.133 -3.939 1.00 0.00 H new ATOM 0 HG1 THR B 389 6.756 -5.482 -6.201 1.00 0.00 H new ATOM 0 HG21 THR B 389 3.879 -4.763 -4.207 1.00 0.00 H new ATOM 0 HG22 THR B 389 4.858 -4.221 -2.823 1.00 0.00 H new ATOM 0 HG23 THR B 389 4.885 -3.302 -4.347 1.00 0.00 H new ATOM 1451 N VAL B 390 9.182 -5.937 -3.361 1.00 0.00 N ATOM 1452 CA VAL B 390 10.279 -6.872 -3.572 1.00 0.00 C ATOM 1453 C VAL B 390 10.097 -8.121 -2.715 1.00 0.00 C ATOM 1454 O VAL B 390 10.072 -8.049 -1.484 1.00 0.00 O ATOM 1455 CB VAL B 390 11.643 -6.233 -3.247 1.00 0.00 C ATOM 1456 CG1 VAL B 390 12.275 -5.651 -4.502 1.00 0.00 C ATOM 1457 CG2 VAL B 390 11.492 -5.168 -2.173 1.00 0.00 C ATOM 0 H VAL B 390 9.034 -5.676 -2.386 1.00 0.00 H new ATOM 0 HA VAL B 390 10.264 -7.146 -4.627 1.00 0.00 H new ATOM 0 HB VAL B 390 12.304 -7.010 -2.864 1.00 0.00 H new ATOM 0 HG11 VAL B 390 13.237 -5.205 -4.251 1.00 0.00 H new ATOM 0 HG12 VAL B 390 12.423 -6.443 -5.236 1.00 0.00 H new ATOM 0 HG13 VAL B 390 11.619 -4.888 -4.919 1.00 0.00 H new ATOM 0 HG21 VAL B 390 12.466 -4.728 -1.957 1.00 0.00 H new ATOM 0 HG22 VAL B 390 10.813 -4.391 -2.524 1.00 0.00 H new ATOM 0 HG23 VAL B 390 11.089 -5.620 -1.267 1.00 0.00 H new ATOM 1467 N LYS B 391 9.938 -9.264 -3.369 1.00 0.00 N ATOM 1468 CA LYS B 391 9.738 -10.519 -2.661 1.00 0.00 C ATOM 1469 C LYS B 391 9.657 -11.688 -3.631 1.00 0.00 C ATOM 1470 O LYS B 391 9.403 -11.506 -4.822 1.00 0.00 O ATOM 1471 CB LYS B 391 8.468 -10.462 -1.811 1.00 0.00 C ATOM 1472 CG LYS B 391 8.163 -11.769 -1.093 1.00 0.00 C ATOM 1473 CD LYS B 391 9.256 -12.129 -0.100 1.00 0.00 C ATOM 1474 CE LYS B 391 9.294 -13.624 0.168 1.00 0.00 C ATOM 1475 NZ LYS B 391 9.940 -13.939 1.471 1.00 0.00 N ATOM 0 H LYS B 391 9.944 -9.347 -4.386 1.00 0.00 H new ATOM 0 HA LYS B 391 10.597 -10.670 -2.007 1.00 0.00 H new ATOM 0 HB2 LYS B 391 8.569 -9.666 -1.074 1.00 0.00 H new ATOM 0 HB3 LYS B 391 7.624 -10.201 -2.449 1.00 0.00 H new ATOM 0 HG2 LYS B 391 7.210 -11.684 -0.571 1.00 0.00 H new ATOM 0 HG3 LYS B 391 8.056 -12.570 -1.824 1.00 0.00 H new ATOM 0 HD2 LYS B 391 10.222 -11.803 -0.486 1.00 0.00 H new ATOM 0 HD3 LYS B 391 9.090 -11.595 0.835 1.00 0.00 H new ATOM 0 HE2 LYS B 391 8.278 -14.020 0.162 1.00 0.00 H new ATOM 0 HE3 LYS B 391 9.836 -14.123 -0.636 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 10.773 -14.541 1.309 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 10.236 -13.056 1.934 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 9.264 -14.441 2.081 1.00 0.00 H new ATOM 1489 N LYS B 392 9.820 -12.892 -3.103 1.00 0.00 N ATOM 1490 CA LYS B 392 9.706 -14.098 -3.902 1.00 0.00 C ATOM 1491 C LYS B 392 8.464 -14.852 -3.450 1.00 0.00 C ATOM 1492 O LYS B 392 8.544 -15.795 -2.662 1.00 0.00 O ATOM 1493 CB LYS B 392 10.952 -14.974 -3.744 1.00 0.00 C ATOM 1494 CG LYS B 392 12.236 -14.180 -3.563 1.00 0.00 C ATOM 1495 CD LYS B 392 13.184 -14.380 -4.736 1.00 0.00 C ATOM 1496 CE LYS B 392 12.569 -13.899 -6.040 1.00 0.00 C ATOM 1497 NZ LYS B 392 12.760 -14.883 -7.140 1.00 0.00 N ATOM 0 H LYS B 392 10.033 -13.058 -2.119 1.00 0.00 H new ATOM 0 HA LYS B 392 9.622 -13.836 -4.957 1.00 0.00 H new ATOM 0 HB2 LYS B 392 10.817 -15.631 -2.885 1.00 0.00 H new ATOM 0 HB3 LYS B 392 11.050 -15.613 -4.622 1.00 0.00 H new ATOM 0 HG2 LYS B 392 11.999 -13.121 -3.462 1.00 0.00 H new ATOM 0 HG3 LYS B 392 12.728 -14.487 -2.640 1.00 0.00 H new ATOM 0 HD2 LYS B 392 14.113 -13.841 -4.550 1.00 0.00 H new ATOM 0 HD3 LYS B 392 13.440 -15.436 -4.822 1.00 0.00 H new ATOM 0 HE2 LYS B 392 11.504 -13.719 -5.894 1.00 0.00 H new ATOM 0 HE3 LYS B 392 13.017 -12.947 -6.323 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 12.326 -14.518 -8.012 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 13.777 -15.036 -7.297 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 12.310 -15.784 -6.881 1.00 0.00 H new ATOM 1511 N PRO B 393 7.290 -14.416 -3.930 1.00 0.00 N ATOM 1512 CA PRO B 393 6.002 -15.013 -3.563 1.00 0.00 C ATOM 1513 C PRO B 393 5.916 -16.492 -3.902 1.00 0.00 C ATOM 1514 O PRO B 393 6.121 -16.894 -5.048 1.00 0.00 O ATOM 1515 CB PRO B 393 4.978 -14.217 -4.379 1.00 0.00 C ATOM 1516 CG PRO B 393 5.770 -13.532 -5.443 1.00 0.00 C ATOM 1517 CD PRO B 393 7.124 -13.281 -4.848 1.00 0.00 C ATOM 0 HA PRO B 393 5.838 -14.963 -2.487 1.00 0.00 H new ATOM 0 HB2 PRO B 393 4.223 -14.874 -4.812 1.00 0.00 H new ATOM 0 HB3 PRO B 393 4.452 -13.495 -3.754 1.00 0.00 H new ATOM 0 HG2 PRO B 393 5.844 -14.153 -6.336 1.00 0.00 H new ATOM 0 HG3 PRO B 393 5.296 -12.598 -5.743 1.00 0.00 H new ATOM 0 HD2 PRO B 393 7.903 -13.259 -5.610 1.00 0.00 H new ATOM 0 HD3 PRO B 393 7.165 -12.327 -4.323 1.00 0.00 H new ATOM 1525 N THR B 394 5.597 -17.295 -2.896 1.00 0.00 N ATOM 1526 CA THR B 394 5.465 -18.729 -3.075 1.00 0.00 C ATOM 1527 C THR B 394 4.203 -19.239 -2.389 1.00 0.00 C ATOM 1528 O THR B 394 3.682 -18.604 -1.473 1.00 0.00 O ATOM 1529 CB THR B 394 6.686 -19.478 -2.515 1.00 0.00 C ATOM 1530 OG1 THR B 394 7.843 -18.632 -2.475 1.00 0.00 O ATOM 1531 CG2 THR B 394 7.009 -20.696 -3.366 1.00 0.00 C ATOM 0 H THR B 394 5.425 -16.973 -1.944 1.00 0.00 H new ATOM 0 HA THR B 394 5.400 -18.919 -4.146 1.00 0.00 H new ATOM 0 HB THR B 394 6.431 -19.790 -1.502 1.00 0.00 H new ATOM 0 HG1 THR B 394 7.834 -18.104 -1.649 1.00 0.00 H new ATOM 0 HG21 THR B 394 7.876 -21.210 -2.951 1.00 0.00 H new ATOM 0 HG22 THR B 394 6.154 -21.373 -3.372 1.00 0.00 H new ATOM 0 HG23 THR B 394 7.228 -20.380 -4.386 1.00 0.00 H new ATOM 1539 N ALA B 395 3.698 -20.368 -2.862 1.00 0.00 N ATOM 1540 CA ALA B 395 2.474 -20.919 -2.300 1.00 0.00 C ATOM 1541 C ALA B 395 2.585 -20.985 -0.781 1.00 0.00 C ATOM 1542 O ALA B 395 1.719 -20.481 -0.066 1.00 0.00 O ATOM 1543 CB ALA B 395 2.189 -22.301 -2.865 1.00 0.00 C ATOM 0 H ALA B 395 4.108 -20.913 -3.621 1.00 0.00 H new ATOM 0 HA ALA B 395 1.646 -20.265 -2.572 1.00 0.00 H new ATOM 0 HB1 ALA B 395 1.269 -22.690 -2.429 1.00 0.00 H new ATOM 0 HB2 ALA B 395 2.078 -22.236 -3.947 1.00 0.00 H new ATOM 0 HB3 ALA B 395 3.016 -22.970 -2.625 1.00 0.00 H new ATOM 1549 N VAL B 396 3.647 -21.610 -0.292 1.00 0.00 N ATOM 1550 CA VAL B 396 3.863 -21.742 1.144 1.00 0.00 C ATOM 1551 C VAL B 396 4.464 -20.469 1.744 1.00 0.00 C ATOM 1552 O VAL B 396 4.198 -20.132 2.898 1.00 0.00 O ATOM 1553 CB VAL B 396 4.785 -22.938 1.455 1.00 0.00 C ATOM 1554 CG1 VAL B 396 5.886 -23.033 0.419 1.00 0.00 C ATOM 1555 CG2 VAL B 396 5.366 -22.841 2.860 1.00 0.00 C ATOM 0 H VAL B 396 4.374 -22.034 -0.868 1.00 0.00 H new ATOM 0 HA VAL B 396 2.886 -21.912 1.597 1.00 0.00 H new ATOM 0 HB VAL B 396 4.187 -23.848 1.412 1.00 0.00 H new ATOM 0 HG11 VAL B 396 6.530 -23.881 0.650 1.00 0.00 H new ATOM 0 HG12 VAL B 396 5.445 -23.170 -0.569 1.00 0.00 H new ATOM 0 HG13 VAL B 396 6.476 -22.116 0.429 1.00 0.00 H new ATOM 0 HG21 VAL B 396 6.011 -23.699 3.047 1.00 0.00 H new ATOM 0 HG22 VAL B 396 5.947 -21.924 2.951 1.00 0.00 H new ATOM 0 HG23 VAL B 396 4.556 -22.831 3.589 1.00 0.00 H new ATOM 1565 N ASP B 397 5.285 -19.776 0.962 1.00 0.00 N ATOM 1566 CA ASP B 397 5.933 -18.552 1.426 1.00 0.00 C ATOM 1567 C ASP B 397 5.383 -17.322 0.699 1.00 0.00 C ATOM 1568 O ASP B 397 5.836 -16.977 -0.393 1.00 0.00 O ATOM 1569 CB ASP B 397 7.447 -18.669 1.224 1.00 0.00 C ATOM 1570 CG ASP B 397 8.135 -17.324 1.073 1.00 0.00 C ATOM 1571 OD1 ASP B 397 8.211 -16.820 -0.068 1.00 0.00 O ATOM 1572 OD2 ASP B 397 8.597 -16.775 2.095 1.00 0.00 O ATOM 0 H ASP B 397 5.518 -20.040 0.005 1.00 0.00 H new ATOM 0 HA ASP B 397 5.720 -18.425 2.487 1.00 0.00 H new ATOM 0 HB2 ASP B 397 7.881 -19.199 2.072 1.00 0.00 H new ATOM 0 HB3 ASP B 397 7.643 -19.272 0.338 1.00 0.00 H new ATOM 1577 N PRO B 398 4.389 -16.651 1.305 1.00 0.00 N ATOM 1578 CA PRO B 398 3.756 -15.463 0.734 1.00 0.00 C ATOM 1579 C PRO B 398 4.430 -14.157 1.159 1.00 0.00 C ATOM 1580 O PRO B 398 4.599 -13.245 0.351 1.00 0.00 O ATOM 1581 CB PRO B 398 2.352 -15.543 1.324 1.00 0.00 C ATOM 1582 CG PRO B 398 2.545 -16.154 2.675 1.00 0.00 C ATOM 1583 CD PRO B 398 3.788 -17.011 2.600 1.00 0.00 C ATOM 0 HA PRO B 398 3.805 -15.451 -0.355 1.00 0.00 H new ATOM 0 HB2 PRO B 398 1.896 -14.556 1.397 1.00 0.00 H new ATOM 0 HB3 PRO B 398 1.695 -16.153 0.703 1.00 0.00 H new ATOM 0 HG2 PRO B 398 2.655 -15.381 3.436 1.00 0.00 H new ATOM 0 HG3 PRO B 398 1.679 -16.754 2.954 1.00 0.00 H new ATOM 0 HD2 PRO B 398 4.467 -16.803 3.427 1.00 0.00 H new ATOM 0 HD3 PRO B 398 3.545 -18.073 2.646 1.00 0.00 H new ATOM 1591 N ASN B 399 4.755 -14.054 2.446 1.00 0.00 N ATOM 1592 CA ASN B 399 5.344 -12.836 3.004 1.00 0.00 C ATOM 1593 C ASN B 399 6.215 -12.092 1.998 1.00 0.00 C ATOM 1594 O ASN B 399 6.985 -12.690 1.248 1.00 0.00 O ATOM 1595 CB ASN B 399 6.169 -13.178 4.246 1.00 0.00 C ATOM 1596 CG ASN B 399 7.536 -13.734 3.898 1.00 0.00 C ATOM 1597 OD1 ASN B 399 7.559 -14.812 3.124 1.00 0.00 O flip ATOM 1598 ND2 ASN B 399 8.561 -13.200 4.323 1.00 0.00 N flip ATOM 0 H ASN B 399 4.620 -14.802 3.126 1.00 0.00 H new ATOM 0 HA ASN B 399 4.519 -12.175 3.271 1.00 0.00 H new ATOM 0 HB2 ASN B 399 6.289 -12.283 4.857 1.00 0.00 H new ATOM 0 HB3 ASN B 399 5.627 -13.906 4.850 1.00 0.00 H new ATOM 0 HD21 ASN B 399 8.497 -12.372 4.915 1.00 0.00 H new ATOM 0 HD22 ASN B 399 9.474 -13.585 4.083 1.00 0.00 H new ATOM 1605 N SER B 400 6.052 -10.766 1.992 1.00 0.00 N ATOM 1606 CA SER B 400 6.785 -9.895 1.076 1.00 0.00 C ATOM 1607 C SER B 400 7.228 -8.592 1.743 1.00 0.00 C ATOM 1608 O SER B 400 6.653 -8.162 2.745 1.00 0.00 O ATOM 1609 CB SER B 400 5.915 -9.574 -0.144 1.00 0.00 C ATOM 1610 OG SER B 400 6.476 -8.523 -0.911 1.00 0.00 O ATOM 0 H SER B 400 5.414 -10.272 2.616 1.00 0.00 H new ATOM 0 HA SER B 400 7.683 -10.431 0.769 1.00 0.00 H new ATOM 0 HB2 SER B 400 5.811 -10.464 -0.764 1.00 0.00 H new ATOM 0 HB3 SER B 400 4.914 -9.294 0.184 1.00 0.00 H new ATOM 0 HG SER B 400 5.902 -8.340 -1.684 1.00 0.00 H new ATOM 1616 N ILE B 401 8.255 -7.968 1.159 1.00 0.00 N ATOM 1617 CA ILE B 401 8.788 -6.704 1.664 1.00 0.00 C ATOM 1618 C ILE B 401 8.522 -5.588 0.662 1.00 0.00 C ATOM 1619 O ILE B 401 8.592 -5.799 -0.549 1.00 0.00 O ATOM 1620 CB ILE B 401 10.305 -6.787 1.942 1.00 0.00 C ATOM 1621 CG1 ILE B 401 10.887 -5.385 2.147 1.00 0.00 C ATOM 1622 CG2 ILE B 401 11.022 -7.501 0.809 1.00 0.00 C ATOM 1623 CD1 ILE B 401 12.197 -5.378 2.903 1.00 0.00 C ATOM 0 H ILE B 401 8.735 -8.322 0.331 1.00 0.00 H new ATOM 0 HA ILE B 401 8.281 -6.492 2.605 1.00 0.00 H new ATOM 0 HB ILE B 401 10.455 -7.362 2.855 1.00 0.00 H new ATOM 0 HG12 ILE B 401 11.036 -4.917 1.174 1.00 0.00 H new ATOM 0 HG13 ILE B 401 10.162 -4.775 2.687 1.00 0.00 H new ATOM 0 HG21 ILE B 401 12.089 -7.548 1.026 1.00 0.00 H new ATOM 0 HG22 ILE B 401 10.627 -8.512 0.709 1.00 0.00 H new ATOM 0 HG23 ILE B 401 10.865 -6.956 -0.122 1.00 0.00 H new ATOM 0 HD11 ILE B 401 12.550 -4.352 3.011 1.00 0.00 H new ATOM 0 HD12 ILE B 401 12.050 -5.817 3.890 1.00 0.00 H new ATOM 0 HD13 ILE B 401 12.937 -5.960 2.354 1.00 0.00 H new ATOM 1635 N VAL B 402 8.224 -4.399 1.168 1.00 0.00 N ATOM 1636 CA VAL B 402 7.959 -3.253 0.310 1.00 0.00 C ATOM 1637 C VAL B 402 8.944 -2.137 0.594 1.00 0.00 C ATOM 1638 O VAL B 402 9.331 -1.915 1.740 1.00 0.00 O ATOM 1639 CB VAL B 402 6.531 -2.702 0.485 1.00 0.00 C ATOM 1640 CG1 VAL B 402 5.834 -2.592 -0.862 1.00 0.00 C ATOM 1641 CG2 VAL B 402 5.723 -3.565 1.438 1.00 0.00 C ATOM 0 H VAL B 402 8.160 -4.203 2.167 1.00 0.00 H new ATOM 0 HA VAL B 402 8.068 -3.607 -0.715 1.00 0.00 H new ATOM 0 HB VAL B 402 6.605 -1.705 0.919 1.00 0.00 H new ATOM 0 HG11 VAL B 402 4.827 -2.201 -0.720 1.00 0.00 H new ATOM 0 HG12 VAL B 402 6.396 -1.919 -1.509 1.00 0.00 H new ATOM 0 HG13 VAL B 402 5.779 -3.577 -1.325 1.00 0.00 H new ATOM 0 HG21 VAL B 402 4.720 -3.151 1.542 1.00 0.00 H new ATOM 0 HG22 VAL B 402 5.658 -4.579 1.044 1.00 0.00 H new ATOM 0 HG23 VAL B 402 6.210 -3.584 2.413 1.00 0.00 H new ATOM 1651 N GLU B 403 9.344 -1.437 -0.453 1.00 0.00 N ATOM 1652 CA GLU B 403 10.283 -0.342 -0.317 1.00 0.00 C ATOM 1653 C GLU B 403 9.655 0.973 -0.765 1.00 0.00 C ATOM 1654 O GLU B 403 9.421 1.197 -1.952 1.00 0.00 O ATOM 1655 CB GLU B 403 11.553 -0.629 -1.122 1.00 0.00 C ATOM 1656 CG GLU B 403 12.646 -1.306 -0.312 1.00 0.00 C ATOM 1657 CD GLU B 403 14.016 -1.157 -0.944 1.00 0.00 C ATOM 1658 OE1 GLU B 403 14.164 -0.299 -1.840 1.00 0.00 O ATOM 1659 OE2 GLU B 403 14.938 -1.897 -0.545 1.00 0.00 O ATOM 0 H GLU B 403 9.031 -1.609 -1.408 1.00 0.00 H new ATOM 0 HA GLU B 403 10.549 -0.249 0.736 1.00 0.00 H new ATOM 0 HB2 GLU B 403 11.299 -1.261 -1.973 1.00 0.00 H new ATOM 0 HB3 GLU B 403 11.938 0.308 -1.524 1.00 0.00 H new ATOM 0 HG2 GLU B 403 12.665 -0.882 0.692 1.00 0.00 H new ATOM 0 HG3 GLU B 403 12.412 -2.365 -0.206 1.00 0.00 H new ATOM 1666 N CYS B 404 9.419 1.851 0.199 1.00 0.00 N ATOM 1667 CA CYS B 404 8.860 3.162 -0.081 1.00 0.00 C ATOM 1668 C CYS B 404 10.006 4.119 -0.345 1.00 0.00 C ATOM 1669 O CYS B 404 10.672 4.570 0.589 1.00 0.00 O ATOM 1670 CB CYS B 404 8.015 3.655 1.096 1.00 0.00 C ATOM 1671 SG CYS B 404 7.728 5.441 1.102 1.00 0.00 S ATOM 0 H CYS B 404 9.608 1.676 1.186 1.00 0.00 H new ATOM 0 HA CYS B 404 8.208 3.106 -0.953 1.00 0.00 H new ATOM 0 HB2 CYS B 404 7.053 3.143 1.078 1.00 0.00 H new ATOM 0 HB3 CYS B 404 8.508 3.374 2.026 1.00 0.00 H new ATOM 0 HG CYS B 404 6.450 5.675 1.068 1.00 0.00 H new ATOM 1677 N ARG B 405 10.268 4.396 -1.617 1.00 0.00 N ATOM 1678 CA ARG B 405 11.381 5.267 -1.966 1.00 0.00 C ATOM 1679 C ARG B 405 10.999 6.324 -2.990 1.00 0.00 C ATOM 1680 O ARG B 405 9.901 6.297 -3.559 1.00 0.00 O ATOM 1681 CB ARG B 405 12.553 4.438 -2.494 1.00 0.00 C ATOM 1682 CG ARG B 405 12.256 3.726 -3.805 1.00 0.00 C ATOM 1683 CD ARG B 405 13.277 4.084 -4.874 1.00 0.00 C ATOM 1684 NE ARG B 405 12.731 3.944 -6.220 1.00 0.00 N ATOM 1685 CZ ARG B 405 12.665 2.786 -6.871 1.00 0.00 C ATOM 1686 NH1 ARG B 405 13.113 1.676 -6.300 1.00 0.00 N ATOM 1687 NH2 ARG B 405 12.151 2.739 -8.092 1.00 0.00 N ATOM 0 H ARG B 405 9.736 4.037 -2.410 1.00 0.00 H new ATOM 0 HA ARG B 405 11.673 5.788 -1.054 1.00 0.00 H new ATOM 0 HB2 ARG B 405 13.415 5.091 -2.632 1.00 0.00 H new ATOM 0 HB3 ARG B 405 12.830 3.698 -1.743 1.00 0.00 H new ATOM 0 HG2 ARG B 405 12.258 2.648 -3.644 1.00 0.00 H new ATOM 0 HG3 ARG B 405 11.257 3.995 -4.149 1.00 0.00 H new ATOM 0 HD2 ARG B 405 13.614 5.110 -4.724 1.00 0.00 H new ATOM 0 HD3 ARG B 405 14.152 3.442 -4.769 1.00 0.00 H new ATOM 0 HE ARG B 405 12.381 4.780 -6.687 1.00 0.00 H new ATOM 0 HH11 ARG B 405 13.509 1.710 -5.361 1.00 0.00 H new ATOM 0 HH12 ARG B 405 13.062 0.789 -6.800 1.00 0.00 H new ATOM 0 HH21 ARG B 405 11.806 3.591 -8.533 1.00 0.00 H new ATOM 0 HH22 ARG B 405 12.101 1.850 -8.590 1.00 0.00 H new ATOM 1701 N VAL B 406 11.932 7.256 -3.217 1.00 0.00 N ATOM 1702 CA VAL B 406 11.734 8.342 -4.162 1.00 0.00 C ATOM 1703 C VAL B 406 12.661 8.209 -5.369 1.00 0.00 C ATOM 1704 O VAL B 406 13.822 7.812 -5.235 1.00 0.00 O ATOM 1705 CB VAL B 406 11.972 9.715 -3.487 1.00 0.00 C ATOM 1706 CG1 VAL B 406 11.423 9.723 -2.067 1.00 0.00 C ATOM 1707 CG2 VAL B 406 13.452 10.074 -3.481 1.00 0.00 C ATOM 0 H VAL B 406 12.838 7.272 -2.749 1.00 0.00 H new ATOM 0 HA VAL B 406 10.701 8.282 -4.503 1.00 0.00 H new ATOM 0 HB VAL B 406 11.440 10.467 -4.070 1.00 0.00 H new ATOM 0 HG11 VAL B 406 11.602 10.698 -1.613 1.00 0.00 H new ATOM 0 HG12 VAL B 406 10.351 9.525 -2.090 1.00 0.00 H new ATOM 0 HG13 VAL B 406 11.922 8.952 -1.480 1.00 0.00 H new ATOM 0 HG21 VAL B 406 13.589 11.043 -3.001 1.00 0.00 H new ATOM 0 HG22 VAL B 406 14.008 9.315 -2.931 1.00 0.00 H new ATOM 0 HG23 VAL B 406 13.819 10.122 -4.506 1.00 0.00 H new ATOM 1717 N GLY B 407 12.120 8.531 -6.541 1.00 0.00 N ATOM 1718 CA GLY B 407 12.871 8.448 -7.783 1.00 0.00 C ATOM 1719 C GLY B 407 14.362 8.675 -7.603 1.00 0.00 C ATOM 1720 O GLY B 407 15.172 8.099 -8.330 1.00 0.00 O ATOM 0 H GLY B 407 11.159 8.853 -6.653 1.00 0.00 H new ATOM 0 HA2 GLY B 407 12.712 7.467 -8.230 1.00 0.00 H new ATOM 0 HA3 GLY B 407 12.481 9.185 -8.485 1.00 0.00 H new ATOM 1724 N ASP B 408 14.731 9.518 -6.641 1.00 0.00 N ATOM 1725 CA ASP B 408 16.138 9.822 -6.375 1.00 0.00 C ATOM 1726 C ASP B 408 16.866 8.667 -5.675 1.00 0.00 C ATOM 1727 O ASP B 408 17.956 8.854 -5.133 1.00 0.00 O ATOM 1728 CB ASP B 408 16.251 11.091 -5.528 1.00 0.00 C ATOM 1729 CG ASP B 408 15.954 12.346 -6.324 1.00 0.00 C ATOM 1730 OD1 ASP B 408 16.851 12.807 -7.061 1.00 0.00 O ATOM 1731 OD2 ASP B 408 14.824 12.867 -6.213 1.00 0.00 O ATOM 0 H ASP B 408 14.074 10.005 -6.031 1.00 0.00 H new ATOM 0 HA ASP B 408 16.619 9.975 -7.341 1.00 0.00 H new ATOM 0 HB2 ASP B 408 15.561 11.026 -4.687 1.00 0.00 H new ATOM 0 HB3 ASP B 408 17.256 11.158 -5.111 1.00 0.00 H new ATOM 1736 N GLY B 409 16.276 7.474 -5.700 1.00 0.00 N ATOM 1737 CA GLY B 409 16.901 6.321 -5.080 1.00 0.00 C ATOM 1738 C GLY B 409 16.971 6.420 -3.568 1.00 0.00 C ATOM 1739 O GLY B 409 17.977 6.044 -2.966 1.00 0.00 O ATOM 0 H GLY B 409 15.375 7.287 -6.140 1.00 0.00 H new ATOM 0 HA2 GLY B 409 16.346 5.424 -5.354 1.00 0.00 H new ATOM 0 HA3 GLY B 409 17.909 6.205 -5.477 1.00 0.00 H new ATOM 1743 N THR B 410 15.904 6.912 -2.949 1.00 0.00 N ATOM 1744 CA THR B 410 15.867 7.034 -1.494 1.00 0.00 C ATOM 1745 C THR B 410 14.731 6.201 -0.915 1.00 0.00 C ATOM 1746 O THR B 410 13.565 6.501 -1.142 1.00 0.00 O ATOM 1747 CB THR B 410 15.689 8.506 -1.060 1.00 0.00 C ATOM 1748 OG1 THR B 410 16.904 9.247 -1.221 1.00 0.00 O ATOM 1749 CG2 THR B 410 15.257 8.603 0.396 1.00 0.00 C ATOM 0 H THR B 410 15.060 7.230 -3.425 1.00 0.00 H new ATOM 0 HA THR B 410 16.820 6.667 -1.112 1.00 0.00 H new ATOM 0 HB THR B 410 14.916 8.929 -1.701 1.00 0.00 H new ATOM 0 HG1 THR B 410 16.761 10.175 -0.940 1.00 0.00 H new ATOM 0 HG21 THR B 410 15.140 9.651 0.672 1.00 0.00 H new ATOM 0 HG22 THR B 410 14.307 8.085 0.529 1.00 0.00 H new ATOM 0 HG23 THR B 410 16.014 8.143 1.031 1.00 0.00 H new ATOM 1757 N VAL B 411 15.081 5.161 -0.160 1.00 0.00 N ATOM 1758 CA VAL B 411 14.087 4.284 0.455 1.00 0.00 C ATOM 1759 C VAL B 411 13.963 4.563 1.945 1.00 0.00 C ATOM 1760 O VAL B 411 14.928 4.420 2.698 1.00 0.00 O ATOM 1761 CB VAL B 411 14.449 2.800 0.252 1.00 0.00 C ATOM 1762 CG1 VAL B 411 13.319 1.901 0.729 1.00 0.00 C ATOM 1763 CG2 VAL B 411 14.778 2.526 -1.207 1.00 0.00 C ATOM 0 H VAL B 411 16.048 4.905 0.041 1.00 0.00 H new ATOM 0 HA VAL B 411 13.134 4.489 -0.033 1.00 0.00 H new ATOM 0 HB VAL B 411 15.333 2.577 0.849 1.00 0.00 H new ATOM 0 HG11 VAL B 411 13.595 0.858 0.577 1.00 0.00 H new ATOM 0 HG12 VAL B 411 13.137 2.077 1.789 1.00 0.00 H new ATOM 0 HG13 VAL B 411 12.414 2.123 0.164 1.00 0.00 H new ATOM 0 HG21 VAL B 411 15.031 1.473 -1.331 1.00 0.00 H new ATOM 0 HG22 VAL B 411 13.914 2.767 -1.826 1.00 0.00 H new ATOM 0 HG23 VAL B 411 15.625 3.141 -1.511 1.00 0.00 H new ATOM 1773 N LEU B 412 12.775 4.971 2.363 1.00 0.00 N ATOM 1774 CA LEU B 412 12.527 5.282 3.763 1.00 0.00 C ATOM 1775 C LEU B 412 11.653 4.224 4.424 1.00 0.00 C ATOM 1776 O LEU B 412 11.835 3.904 5.599 1.00 0.00 O ATOM 1777 CB LEU B 412 11.856 6.650 3.882 1.00 0.00 C ATOM 1778 CG LEU B 412 12.720 7.835 3.455 1.00 0.00 C ATOM 1779 CD1 LEU B 412 11.954 8.736 2.500 1.00 0.00 C ATOM 1780 CD2 LEU B 412 13.182 8.619 4.673 1.00 0.00 C ATOM 0 H LEU B 412 11.967 5.095 1.753 1.00 0.00 H new ATOM 0 HA LEU B 412 13.488 5.297 4.277 1.00 0.00 H new ATOM 0 HB2 LEU B 412 10.948 6.646 3.278 1.00 0.00 H new ATOM 0 HB3 LEU B 412 11.550 6.798 4.917 1.00 0.00 H new ATOM 0 HG LEU B 412 13.599 7.453 2.936 1.00 0.00 H new ATOM 0 HD11 LEU B 412 12.585 9.575 2.206 1.00 0.00 H new ATOM 0 HD12 LEU B 412 11.669 8.169 1.614 1.00 0.00 H new ATOM 0 HD13 LEU B 412 11.058 9.112 2.994 1.00 0.00 H new ATOM 0 HD21 LEU B 412 13.797 9.460 4.353 1.00 0.00 H new ATOM 0 HD22 LEU B 412 12.314 8.991 5.217 1.00 0.00 H new ATOM 0 HD23 LEU B 412 13.767 7.969 5.324 1.00 0.00 H new ATOM 1792 N GLY B 413 10.678 3.710 3.683 1.00 0.00 N ATOM 1793 CA GLY B 413 9.772 2.727 4.246 1.00 0.00 C ATOM 1794 C GLY B 413 10.038 1.297 3.806 1.00 0.00 C ATOM 1795 O GLY B 413 10.087 1.002 2.615 1.00 0.00 O ATOM 0 H GLY B 413 10.499 3.954 2.709 1.00 0.00 H new ATOM 0 HA2 GLY B 413 9.833 2.776 5.333 1.00 0.00 H new ATOM 0 HA3 GLY B 413 8.751 2.994 3.972 1.00 0.00 H new ATOM 1799 N THR B 414 10.186 0.404 4.780 1.00 0.00 N ATOM 1800 CA THR B 414 10.417 -1.009 4.498 1.00 0.00 C ATOM 1801 C THR B 414 9.450 -1.882 5.284 1.00 0.00 C ATOM 1802 O THR B 414 9.668 -2.155 6.464 1.00 0.00 O ATOM 1803 CB THR B 414 11.849 -1.454 4.840 1.00 0.00 C ATOM 1804 OG1 THR B 414 12.562 -0.437 5.555 1.00 0.00 O ATOM 1805 CG2 THR B 414 12.625 -1.797 3.579 1.00 0.00 C ATOM 0 H THR B 414 10.150 0.634 5.773 1.00 0.00 H new ATOM 0 HA THR B 414 10.259 -1.130 3.426 1.00 0.00 H new ATOM 0 HB THR B 414 11.761 -2.338 5.472 1.00 0.00 H new ATOM 0 HG1 THR B 414 13.467 -0.753 5.758 1.00 0.00 H new ATOM 0 HG21 THR B 414 13.635 -2.109 3.847 1.00 0.00 H new ATOM 0 HG22 THR B 414 12.122 -2.608 3.052 1.00 0.00 H new ATOM 0 HG23 THR B 414 12.675 -0.921 2.933 1.00 0.00 H new ATOM 1813 N GLY B 415 8.381 -2.319 4.629 1.00 0.00 N ATOM 1814 CA GLY B 415 7.405 -3.156 5.299 1.00 0.00 C ATOM 1815 C GLY B 415 7.434 -4.585 4.803 1.00 0.00 C ATOM 1816 O GLY B 415 7.247 -4.847 3.616 1.00 0.00 O ATOM 0 H GLY B 415 8.174 -2.110 3.652 1.00 0.00 H new ATOM 0 HA2 GLY B 415 7.595 -3.143 6.372 1.00 0.00 H new ATOM 0 HA3 GLY B 415 6.409 -2.741 5.146 1.00 0.00 H new ATOM 1820 N VAL B 416 7.667 -5.514 5.721 1.00 0.00 N ATOM 1821 CA VAL B 416 7.720 -6.928 5.389 1.00 0.00 C ATOM 1822 C VAL B 416 6.845 -7.732 6.341 1.00 0.00 C ATOM 1823 O VAL B 416 7.023 -7.677 7.558 1.00 0.00 O ATOM 1824 CB VAL B 416 9.163 -7.462 5.452 1.00 0.00 C ATOM 1825 CG1 VAL B 416 9.293 -8.751 4.655 1.00 0.00 C ATOM 1826 CG2 VAL B 416 10.140 -6.413 4.950 1.00 0.00 C ATOM 0 H VAL B 416 7.823 -5.309 6.708 1.00 0.00 H new ATOM 0 HA VAL B 416 7.349 -7.040 4.370 1.00 0.00 H new ATOM 0 HB VAL B 416 9.405 -7.683 6.492 1.00 0.00 H new ATOM 0 HG11 VAL B 416 10.320 -9.112 4.712 1.00 0.00 H new ATOM 0 HG12 VAL B 416 8.620 -9.503 5.067 1.00 0.00 H new ATOM 0 HG13 VAL B 416 9.032 -8.563 3.614 1.00 0.00 H new ATOM 0 HG21 VAL B 416 11.155 -6.807 5.001 1.00 0.00 H new ATOM 0 HG22 VAL B 416 9.902 -6.158 3.917 1.00 0.00 H new ATOM 0 HG23 VAL B 416 10.066 -5.520 5.570 1.00 0.00 H new ATOM 1836 N GLY B 417 5.893 -8.472 5.785 1.00 0.00 N ATOM 1837 CA GLY B 417 5.004 -9.264 6.615 1.00 0.00 C ATOM 1838 C GLY B 417 4.602 -10.573 5.967 1.00 0.00 C ATOM 1839 O GLY B 417 4.835 -10.782 4.775 1.00 0.00 O ATOM 0 H GLY B 417 5.721 -8.538 4.782 1.00 0.00 H new ATOM 0 HA2 GLY B 417 5.492 -9.471 7.567 1.00 0.00 H new ATOM 0 HA3 GLY B 417 4.108 -8.684 6.836 1.00 0.00 H new ATOM 1843 N ARG B 418 3.995 -11.454 6.761 1.00 0.00 N ATOM 1844 CA ARG B 418 3.555 -12.758 6.276 1.00 0.00 C ATOM 1845 C ARG B 418 2.806 -12.626 4.957 1.00 0.00 C ATOM 1846 O ARG B 418 3.024 -13.402 4.027 1.00 0.00 O ATOM 1847 CB ARG B 418 2.668 -13.442 7.318 1.00 0.00 C ATOM 1848 CG ARG B 418 1.707 -12.492 8.015 1.00 0.00 C ATOM 1849 CD ARG B 418 2.044 -12.342 9.490 1.00 0.00 C ATOM 1850 NE ARG B 418 0.944 -12.767 10.350 1.00 0.00 N ATOM 1851 CZ ARG B 418 0.615 -14.039 10.552 1.00 0.00 C ATOM 1852 NH1 ARG B 418 1.300 -15.004 9.954 1.00 0.00 N ATOM 1853 NH2 ARG B 418 -0.396 -14.346 11.352 1.00 0.00 N ATOM 0 H ARG B 418 3.797 -11.286 7.747 1.00 0.00 H new ATOM 0 HA ARG B 418 4.440 -13.371 6.107 1.00 0.00 H new ATOM 0 HB2 ARG B 418 2.096 -14.233 6.833 1.00 0.00 H new ATOM 0 HB3 ARG B 418 3.302 -13.919 8.066 1.00 0.00 H new ATOM 0 HG2 ARG B 418 1.744 -11.516 7.531 1.00 0.00 H new ATOM 0 HG3 ARG B 418 0.687 -12.862 7.909 1.00 0.00 H new ATOM 0 HD2 ARG B 418 2.932 -12.931 9.720 1.00 0.00 H new ATOM 0 HD3 ARG B 418 2.288 -11.301 9.702 1.00 0.00 H new ATOM 0 HE ARG B 418 0.397 -12.047 10.823 1.00 0.00 H new ATOM 0 HH11 ARG B 418 2.079 -14.770 9.339 1.00 0.00 H new ATOM 0 HH12 ARG B 418 1.048 -15.980 10.109 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -0.924 -13.605 11.814 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -0.647 -15.323 11.505 1.00 0.00 H new ATOM 1867 N ASN B 419 1.931 -11.635 4.880 1.00 0.00 N ATOM 1868 CA ASN B 419 1.161 -11.389 3.670 1.00 0.00 C ATOM 1869 C ASN B 419 1.659 -10.118 3.002 1.00 0.00 C ATOM 1870 O ASN B 419 2.283 -9.277 3.649 1.00 0.00 O ATOM 1871 CB ASN B 419 -0.334 -11.266 3.989 1.00 0.00 C ATOM 1872 CG ASN B 419 -0.680 -11.767 5.378 1.00 0.00 C ATOM 1873 OD1 ASN B 419 -0.015 -12.652 5.917 1.00 0.00 O ATOM 1874 ND2 ASN B 419 -1.730 -11.203 5.965 1.00 0.00 N ATOM 0 H ASN B 419 1.736 -10.987 5.643 1.00 0.00 H new ATOM 0 HA ASN B 419 1.294 -12.233 2.993 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -0.636 -10.223 3.898 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -0.906 -11.829 3.251 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -2.013 -11.500 6.899 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -2.253 -10.473 5.482 1.00 0.00 H new ATOM 1881 N ILE B 420 1.382 -9.965 1.714 1.00 0.00 N ATOM 1882 CA ILE B 420 1.816 -8.774 1.005 1.00 0.00 C ATOM 1883 C ILE B 420 1.090 -7.550 1.548 1.00 0.00 C ATOM 1884 O ILE B 420 1.571 -6.425 1.430 1.00 0.00 O ATOM 1885 CB ILE B 420 1.599 -8.890 -0.520 1.00 0.00 C ATOM 1886 CG1 ILE B 420 0.189 -8.448 -0.908 1.00 0.00 C ATOM 1887 CG2 ILE B 420 1.855 -10.316 -0.985 1.00 0.00 C ATOM 1888 CD1 ILE B 420 0.062 -6.955 -1.126 1.00 0.00 C ATOM 0 H ILE B 420 0.867 -10.640 1.148 1.00 0.00 H new ATOM 0 HA ILE B 420 2.888 -8.667 1.172 1.00 0.00 H new ATOM 0 HB ILE B 420 2.309 -8.228 -1.015 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -0.108 -8.967 -1.820 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -0.507 -8.753 -0.127 1.00 0.00 H new ATOM 0 HG21 ILE B 420 1.698 -10.381 -2.062 1.00 0.00 H new ATOM 0 HG22 ILE B 420 2.882 -10.596 -0.750 1.00 0.00 H new ATOM 0 HG23 ILE B 420 1.169 -10.993 -0.476 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -0.965 -6.713 -1.399 1.00 0.00 H new ATOM 0 HD12 ILE B 420 0.327 -6.429 -0.209 1.00 0.00 H new ATOM 0 HD13 ILE B 420 0.732 -6.646 -1.928 1.00 0.00 H new ATOM 1900 N LYS B 421 -0.065 -7.783 2.172 1.00 0.00 N ATOM 1901 CA LYS B 421 -0.830 -6.687 2.750 1.00 0.00 C ATOM 1902 C LYS B 421 -0.016 -6.059 3.869 1.00 0.00 C ATOM 1903 O LYS B 421 0.344 -4.885 3.796 1.00 0.00 O ATOM 1904 CB LYS B 421 -2.176 -7.182 3.284 1.00 0.00 C ATOM 1905 CG LYS B 421 -3.302 -7.114 2.265 1.00 0.00 C ATOM 1906 CD LYS B 421 -3.367 -8.375 1.420 1.00 0.00 C ATOM 1907 CE LYS B 421 -4.486 -9.296 1.880 1.00 0.00 C ATOM 1908 NZ LYS B 421 -4.536 -10.550 1.080 1.00 0.00 N ATOM 0 H LYS B 421 -0.483 -8.706 2.287 1.00 0.00 H new ATOM 0 HA LYS B 421 -1.033 -5.944 1.979 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -2.066 -8.212 3.622 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -2.451 -6.589 4.156 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -4.252 -6.971 2.780 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -3.157 -6.249 1.618 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -3.522 -8.107 0.375 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -2.414 -8.902 1.476 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -4.344 -9.542 2.932 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -5.441 -8.776 1.800 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -5.312 -11.151 1.424 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -4.697 -10.317 0.079 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -3.635 -11.060 1.177 1.00 0.00 H new ATOM 1922 N ILE B 422 0.294 -6.842 4.901 1.00 0.00 N ATOM 1923 CA ILE B 422 1.088 -6.311 6.000 1.00 0.00 C ATOM 1924 C ILE B 422 2.325 -5.674 5.415 1.00 0.00 C ATOM 1925 O ILE B 422 2.794 -4.643 5.879 1.00 0.00 O ATOM 1926 CB ILE B 422 1.529 -7.371 7.033 1.00 0.00 C ATOM 1927 CG1 ILE B 422 0.993 -8.756 6.685 1.00 0.00 C ATOM 1928 CG2 ILE B 422 1.083 -6.961 8.428 1.00 0.00 C ATOM 1929 CD1 ILE B 422 -0.496 -8.902 6.902 1.00 0.00 C ATOM 0 H ILE B 422 0.016 -7.819 4.997 1.00 0.00 H new ATOM 0 HA ILE B 422 0.456 -5.601 6.534 1.00 0.00 H new ATOM 0 HB ILE B 422 2.617 -7.427 7.009 1.00 0.00 H new ATOM 0 HG12 ILE B 422 1.223 -8.973 5.642 1.00 0.00 H new ATOM 0 HG13 ILE B 422 1.514 -9.500 7.288 1.00 0.00 H new ATOM 0 HG21 ILE B 422 1.399 -7.716 9.148 1.00 0.00 H new ATOM 0 HG22 ILE B 422 1.532 -6.002 8.687 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -0.003 -6.871 8.451 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -0.805 -9.912 6.634 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -0.731 -8.717 7.950 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -1.027 -8.182 6.279 1.00 0.00 H new ATOM 1941 N ALA B 423 2.828 -6.271 4.351 1.00 0.00 N ATOM 1942 CA ALA B 423 3.978 -5.722 3.678 1.00 0.00 C ATOM 1943 C ALA B 423 3.610 -4.340 3.159 1.00 0.00 C ATOM 1944 O ALA B 423 4.223 -3.339 3.521 1.00 0.00 O ATOM 1945 CB ALA B 423 4.431 -6.634 2.548 1.00 0.00 C ATOM 0 H ALA B 423 2.459 -7.129 3.941 1.00 0.00 H new ATOM 0 HA ALA B 423 4.814 -5.641 4.373 1.00 0.00 H new ATOM 0 HB1 ALA B 423 5.300 -6.198 2.055 1.00 0.00 H new ATOM 0 HB2 ALA B 423 4.695 -7.611 2.953 1.00 0.00 H new ATOM 0 HB3 ALA B 423 3.623 -6.747 1.825 1.00 0.00 H new ATOM 1951 N GLY B 424 2.588 -4.302 2.310 1.00 0.00 N ATOM 1952 CA GLY B 424 2.126 -3.049 1.745 1.00 0.00 C ATOM 1953 C GLY B 424 1.724 -2.021 2.794 1.00 0.00 C ATOM 1954 O GLY B 424 2.176 -0.874 2.749 1.00 0.00 O ATOM 0 H GLY B 424 2.069 -5.124 2.002 1.00 0.00 H new ATOM 0 HA2 GLY B 424 2.914 -2.629 1.120 1.00 0.00 H new ATOM 0 HA3 GLY B 424 1.274 -3.245 1.095 1.00 0.00 H new ATOM 1958 N ILE B 425 0.865 -2.419 3.732 1.00 0.00 N ATOM 1959 CA ILE B 425 0.403 -1.500 4.773 1.00 0.00 C ATOM 1960 C ILE B 425 1.502 -1.175 5.784 1.00 0.00 C ATOM 1961 O ILE B 425 1.828 -0.009 6.005 1.00 0.00 O ATOM 1962 CB ILE B 425 -0.804 -2.085 5.531 1.00 0.00 C ATOM 1963 CG1 ILE B 425 -1.985 -2.291 4.579 1.00 0.00 C ATOM 1964 CG2 ILE B 425 -1.199 -1.177 6.684 1.00 0.00 C ATOM 1965 CD1 ILE B 425 -2.436 -3.733 4.478 1.00 0.00 C ATOM 0 H ILE B 425 0.478 -3.361 3.793 1.00 0.00 H new ATOM 0 HA ILE B 425 0.113 -0.582 4.262 1.00 0.00 H new ATOM 0 HB ILE B 425 -0.519 -3.054 5.940 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -2.823 -1.679 4.914 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -1.708 -1.935 3.587 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -2.053 -1.605 7.208 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -0.361 -1.080 7.374 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -1.467 -0.194 6.297 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -3.276 -3.804 3.787 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -1.613 -4.347 4.113 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -2.745 -4.087 5.461 1.00 0.00 H new ATOM 1977 N ARG B 426 2.042 -2.207 6.426 1.00 0.00 N ATOM 1978 CA ARG B 426 3.068 -1.999 7.445 1.00 0.00 C ATOM 1979 C ARG B 426 4.216 -1.154 6.892 1.00 0.00 C ATOM 1980 O ARG B 426 4.782 -0.334 7.614 1.00 0.00 O ATOM 1981 CB ARG B 426 3.575 -3.335 8.019 1.00 0.00 C ATOM 1982 CG ARG B 426 4.931 -3.771 7.488 1.00 0.00 C ATOM 1983 CD ARG B 426 6.042 -3.387 8.453 1.00 0.00 C ATOM 1984 NE ARG B 426 6.953 -4.496 8.719 1.00 0.00 N ATOM 1985 CZ ARG B 426 6.638 -5.544 9.474 1.00 0.00 C ATOM 1986 NH1 ARG B 426 5.441 -5.620 10.038 1.00 0.00 N ATOM 1987 NH2 ARG B 426 7.520 -6.513 9.670 1.00 0.00 N ATOM 0 H ARG B 426 1.792 -3.182 6.263 1.00 0.00 H new ATOM 0 HA ARG B 426 2.614 -1.450 8.270 1.00 0.00 H new ATOM 0 HB2 ARG B 426 3.633 -3.252 9.104 1.00 0.00 H new ATOM 0 HB3 ARG B 426 2.844 -4.113 7.797 1.00 0.00 H new ATOM 0 HG2 ARG B 426 4.935 -4.850 7.333 1.00 0.00 H new ATOM 0 HG3 ARG B 426 5.111 -3.309 6.517 1.00 0.00 H new ATOM 0 HD2 ARG B 426 6.604 -2.549 8.041 1.00 0.00 H new ATOM 0 HD3 ARG B 426 5.604 -3.047 9.391 1.00 0.00 H new ATOM 0 HE ARG B 426 7.883 -4.465 8.302 1.00 0.00 H new ATOM 0 HH11 ARG B 426 4.761 -4.874 9.893 1.00 0.00 H new ATOM 0 HH12 ARG B 426 5.200 -6.424 10.617 1.00 0.00 H new ATOM 0 HH21 ARG B 426 8.444 -6.456 9.241 1.00 0.00 H new ATOM 0 HH22 ARG B 426 7.275 -7.316 10.250 1.00 0.00 H new ATOM 2001 N ALA B 427 4.537 -1.317 5.608 1.00 0.00 N ATOM 2002 CA ALA B 427 5.593 -0.511 4.998 1.00 0.00 C ATOM 2003 C ALA B 427 5.147 0.944 4.980 1.00 0.00 C ATOM 2004 O ALA B 427 5.850 1.840 5.449 1.00 0.00 O ATOM 2005 CB ALA B 427 5.914 -0.980 3.586 1.00 0.00 C ATOM 0 H ALA B 427 4.091 -1.986 4.981 1.00 0.00 H new ATOM 0 HA ALA B 427 6.503 -0.620 5.588 1.00 0.00 H new ATOM 0 HB1 ALA B 427 6.703 -0.356 3.166 1.00 0.00 H new ATOM 0 HB2 ALA B 427 6.247 -2.017 3.614 1.00 0.00 H new ATOM 0 HB3 ALA B 427 5.021 -0.902 2.965 1.00 0.00 H new ATOM 2011 N ALA B 428 3.956 1.163 4.441 1.00 0.00 N ATOM 2012 CA ALA B 428 3.402 2.504 4.377 1.00 0.00 C ATOM 2013 C ALA B 428 3.463 3.114 5.771 1.00 0.00 C ATOM 2014 O ALA B 428 3.901 4.252 5.952 1.00 0.00 O ATOM 2015 CB ALA B 428 1.972 2.490 3.857 1.00 0.00 C ATOM 0 H ALA B 428 3.361 0.435 4.045 1.00 0.00 H new ATOM 0 HA ALA B 428 3.987 3.104 3.680 1.00 0.00 H new ATOM 0 HB1 ALA B 428 1.588 3.509 3.822 1.00 0.00 H new ATOM 0 HB2 ALA B 428 1.953 2.060 2.855 1.00 0.00 H new ATOM 0 HB3 ALA B 428 1.349 1.890 4.521 1.00 0.00 H new ATOM 2021 N GLU B 429 3.045 2.327 6.758 1.00 0.00 N ATOM 2022 CA GLU B 429 3.073 2.761 8.146 1.00 0.00 C ATOM 2023 C GLU B 429 4.508 2.988 8.602 1.00 0.00 C ATOM 2024 O GLU B 429 4.769 3.825 9.467 1.00 0.00 O ATOM 2025 CB GLU B 429 2.412 1.715 9.042 1.00 0.00 C ATOM 2026 CG GLU B 429 0.906 1.635 8.868 1.00 0.00 C ATOM 2027 CD GLU B 429 0.243 2.992 8.986 1.00 0.00 C ATOM 2028 OE1 GLU B 429 0.124 3.686 7.956 1.00 0.00 O ATOM 2029 OE2 GLU B 429 -0.152 3.362 10.111 1.00 0.00 O ATOM 0 H GLU B 429 2.683 1.384 6.619 1.00 0.00 H new ATOM 0 HA GLU B 429 2.522 3.698 8.223 1.00 0.00 H new ATOM 0 HB2 GLU B 429 2.847 0.738 8.829 1.00 0.00 H new ATOM 0 HB3 GLU B 429 2.638 1.945 10.083 1.00 0.00 H new ATOM 0 HG2 GLU B 429 0.677 1.204 7.893 1.00 0.00 H new ATOM 0 HG3 GLU B 429 0.490 0.963 9.619 1.00 0.00 H new ATOM 2036 N ASN B 430 5.441 2.243 8.009 1.00 0.00 N ATOM 2037 CA ASN B 430 6.847 2.380 8.361 1.00 0.00 C ATOM 2038 C ASN B 430 7.292 3.819 8.136 1.00 0.00 C ATOM 2039 O ASN B 430 7.867 4.445 9.025 1.00 0.00 O ATOM 2040 CB ASN B 430 7.707 1.413 7.546 1.00 0.00 C ATOM 2041 CG ASN B 430 8.340 0.338 8.408 1.00 0.00 C ATOM 2042 OD1 ASN B 430 9.552 0.325 8.617 1.00 0.00 O ATOM 2043 ND2 ASN B 430 7.516 -0.574 8.910 1.00 0.00 N ATOM 0 H ASN B 430 5.248 1.546 7.290 1.00 0.00 H new ATOM 0 HA ASN B 430 6.974 2.130 9.414 1.00 0.00 H new ATOM 0 HB2 ASN B 430 7.093 0.944 6.777 1.00 0.00 H new ATOM 0 HB3 ASN B 430 8.490 1.971 7.032 1.00 0.00 H new ATOM 0 HD21 ASN B 430 7.882 -1.325 9.496 1.00 0.00 H new ATOM 0 HD22 ASN B 430 6.517 -0.524 8.710 1.00 0.00 H new ATOM 2050 N ALA B 431 6.991 4.355 6.954 1.00 0.00 N ATOM 2051 CA ALA B 431 7.337 5.738 6.655 1.00 0.00 C ATOM 2052 C ALA B 431 6.621 6.641 7.648 1.00 0.00 C ATOM 2053 O ALA B 431 7.196 7.596 8.170 1.00 0.00 O ATOM 2054 CB ALA B 431 6.980 6.118 5.226 1.00 0.00 C ATOM 0 H ALA B 431 6.516 3.859 6.200 1.00 0.00 H new ATOM 0 HA ALA B 431 8.416 5.859 6.748 1.00 0.00 H new ATOM 0 HB1 ALA B 431 7.255 7.157 5.046 1.00 0.00 H new ATOM 0 HB2 ALA B 431 7.521 5.474 4.532 1.00 0.00 H new ATOM 0 HB3 ALA B 431 5.908 5.995 5.074 1.00 0.00 H new ATOM 2060 N LEU B 432 5.360 6.303 7.923 1.00 0.00 N ATOM 2061 CA LEU B 432 4.540 7.043 8.877 1.00 0.00 C ATOM 2062 C LEU B 432 5.203 7.089 10.255 1.00 0.00 C ATOM 2063 O LEU B 432 4.799 7.863 11.122 1.00 0.00 O ATOM 2064 CB LEU B 432 3.160 6.394 8.987 1.00 0.00 C ATOM 2065 CG LEU B 432 2.011 7.350 9.305 1.00 0.00 C ATOM 2066 CD1 LEU B 432 0.692 6.596 9.358 1.00 0.00 C ATOM 2067 CD2 LEU B 432 2.268 8.074 10.618 1.00 0.00 C ATOM 0 H LEU B 432 4.882 5.512 7.492 1.00 0.00 H new ATOM 0 HA LEU B 432 4.435 8.066 8.515 1.00 0.00 H new ATOM 0 HB2 LEU B 432 2.939 5.887 8.048 1.00 0.00 H new ATOM 0 HB3 LEU B 432 3.198 5.628 9.761 1.00 0.00 H new ATOM 0 HG LEU B 432 1.950 8.094 8.510 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -0.116 7.292 9.586 1.00 0.00 H new ATOM 0 HD12 LEU B 432 0.504 6.124 8.394 1.00 0.00 H new ATOM 0 HD13 LEU B 432 0.741 5.831 10.133 1.00 0.00 H new ATOM 0 HD21 LEU B 432 1.440 8.751 10.829 1.00 0.00 H new ATOM 0 HD22 LEU B 432 2.356 7.346 11.424 1.00 0.00 H new ATOM 0 HD23 LEU B 432 3.193 8.645 10.543 1.00 0.00 H new ATOM 2079 N ARG B 433 6.244 6.276 10.438 1.00 0.00 N ATOM 2080 CA ARG B 433 6.981 6.249 11.695 1.00 0.00 C ATOM 2081 C ARG B 433 8.043 7.340 11.683 1.00 0.00 C ATOM 2082 O ARG B 433 8.545 7.751 12.728 1.00 0.00 O ATOM 2083 CB ARG B 433 7.640 4.884 11.909 1.00 0.00 C ATOM 2084 CG ARG B 433 6.647 3.739 12.035 1.00 0.00 C ATOM 2085 CD ARG B 433 7.347 2.386 12.082 1.00 0.00 C ATOM 2086 NE ARG B 433 8.799 2.506 11.965 1.00 0.00 N ATOM 2087 CZ ARG B 433 9.608 2.701 13.002 1.00 0.00 C ATOM 2088 NH1 ARG B 433 9.109 2.798 14.226 1.00 0.00 N ATOM 2089 NH2 ARG B 433 10.917 2.800 12.815 1.00 0.00 N ATOM 0 H ARG B 433 6.593 5.629 9.731 1.00 0.00 H new ATOM 0 HA ARG B 433 6.283 6.425 12.514 1.00 0.00 H new ATOM 0 HB2 ARG B 433 8.312 4.680 11.075 1.00 0.00 H new ATOM 0 HB3 ARG B 433 8.252 4.923 12.810 1.00 0.00 H new ATOM 0 HG2 ARG B 433 6.052 3.872 12.938 1.00 0.00 H new ATOM 0 HG3 ARG B 433 5.957 3.762 11.192 1.00 0.00 H new ATOM 0 HD2 ARG B 433 7.101 1.885 13.018 1.00 0.00 H new ATOM 0 HD3 ARG B 433 6.971 1.757 11.275 1.00 0.00 H new ATOM 0 HE ARG B 433 9.215 2.436 11.036 1.00 0.00 H new ATOM 0 HH11 ARG B 433 8.103 2.723 14.374 1.00 0.00 H new ATOM 0 HH12 ARG B 433 9.731 2.948 15.020 1.00 0.00 H new ATOM 0 HH21 ARG B 433 11.305 2.727 11.874 1.00 0.00 H new ATOM 0 HH22 ARG B 433 11.536 2.950 13.612 1.00 0.00 H new ATOM 2103 N ASP B 434 8.364 7.814 10.482 1.00 0.00 N ATOM 2104 CA ASP B 434 9.347 8.871 10.312 1.00 0.00 C ATOM 2105 C ASP B 434 8.644 10.217 10.206 1.00 0.00 C ATOM 2106 O ASP B 434 8.980 11.049 9.365 1.00 0.00 O ATOM 2107 CB ASP B 434 10.192 8.613 9.065 1.00 0.00 C ATOM 2108 CG ASP B 434 10.798 7.223 9.058 1.00 0.00 C ATOM 2109 OD1 ASP B 434 10.073 6.260 8.731 1.00 0.00 O ATOM 2110 OD2 ASP B 434 11.998 7.097 9.382 1.00 0.00 O ATOM 0 H ASP B 434 7.953 7.478 9.611 1.00 0.00 H new ATOM 0 HA ASP B 434 10.007 8.884 11.179 1.00 0.00 H new ATOM 0 HB2 ASP B 434 9.574 8.742 8.177 1.00 0.00 H new ATOM 0 HB3 ASP B 434 10.989 9.355 9.009 1.00 0.00 H new ATOM 2115 N LYS B 435 7.664 10.416 11.079 1.00 0.00 N ATOM 2116 CA LYS B 435 6.910 11.658 11.095 1.00 0.00 C ATOM 2117 C LYS B 435 7.877 12.831 11.018 1.00 0.00 C ATOM 2118 O LYS B 435 7.789 13.667 10.119 1.00 0.00 O ATOM 2119 CB LYS B 435 6.028 11.748 12.347 1.00 0.00 C ATOM 2120 CG LYS B 435 6.628 12.564 13.481 1.00 0.00 C ATOM 2121 CD LYS B 435 5.668 12.670 14.650 1.00 0.00 C ATOM 2122 CE LYS B 435 5.818 11.482 15.584 1.00 0.00 C ATOM 2123 NZ LYS B 435 6.331 11.884 16.923 1.00 0.00 N ATOM 0 H LYS B 435 7.376 9.735 11.781 1.00 0.00 H new ATOM 0 HA LYS B 435 6.246 11.687 10.231 1.00 0.00 H new ATOM 0 HB2 LYS B 435 5.068 12.184 12.070 1.00 0.00 H new ATOM 0 HB3 LYS B 435 5.827 10.739 12.708 1.00 0.00 H new ATOM 0 HG2 LYS B 435 7.558 12.102 13.812 1.00 0.00 H new ATOM 0 HG3 LYS B 435 6.878 13.562 13.121 1.00 0.00 H new ATOM 0 HD2 LYS B 435 5.856 13.594 15.197 1.00 0.00 H new ATOM 0 HD3 LYS B 435 4.644 12.721 14.281 1.00 0.00 H new ATOM 0 HE2 LYS B 435 4.853 10.988 15.699 1.00 0.00 H new ATOM 0 HE3 LYS B 435 6.497 10.755 15.139 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 6.642 11.039 17.444 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 7.135 12.534 16.806 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 5.575 12.360 17.456 1.00 0.00 H new ATOM 2137 N LYS B 436 8.805 12.881 11.967 1.00 0.00 N ATOM 2138 CA LYS B 436 9.790 13.937 12.010 1.00 0.00 C ATOM 2139 C LYS B 436 10.456 14.078 10.649 1.00 0.00 C ATOM 2140 O LYS B 436 10.774 15.186 10.215 1.00 0.00 O ATOM 2141 CB LYS B 436 10.822 13.633 13.092 1.00 0.00 C ATOM 2142 CG LYS B 436 10.530 14.321 14.418 1.00 0.00 C ATOM 2143 CD LYS B 436 9.431 13.607 15.191 1.00 0.00 C ATOM 2144 CE LYS B 436 9.923 12.292 15.770 1.00 0.00 C ATOM 2145 NZ LYS B 436 11.160 12.472 16.579 1.00 0.00 N ATOM 0 H LYS B 436 8.890 12.195 12.717 1.00 0.00 H new ATOM 0 HA LYS B 436 9.303 14.881 12.252 1.00 0.00 H new ATOM 0 HB2 LYS B 436 10.863 12.556 13.252 1.00 0.00 H new ATOM 0 HB3 LYS B 436 11.807 13.941 12.741 1.00 0.00 H new ATOM 0 HG2 LYS B 436 11.438 14.351 15.020 1.00 0.00 H new ATOM 0 HG3 LYS B 436 10.234 15.354 14.235 1.00 0.00 H new ATOM 0 HD2 LYS B 436 9.074 14.250 15.996 1.00 0.00 H new ATOM 0 HD3 LYS B 436 8.583 13.421 14.532 1.00 0.00 H new ATOM 0 HE2 LYS B 436 9.142 11.854 16.392 1.00 0.00 H new ATOM 0 HE3 LYS B 436 10.117 11.589 14.960 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 11.259 11.678 17.243 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 11.986 12.501 15.948 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 11.100 13.363 17.112 1.00 0.00 H new ATOM 2159 N MET B 437 10.643 12.951 9.964 1.00 0.00 N ATOM 2160 CA MET B 437 11.245 12.965 8.639 1.00 0.00 C ATOM 2161 C MET B 437 10.285 13.606 7.646 1.00 0.00 C ATOM 2162 O MET B 437 10.648 14.531 6.920 1.00 0.00 O ATOM 2163 CB MET B 437 11.594 11.545 8.185 1.00 0.00 C ATOM 2164 CG MET B 437 12.229 11.488 6.805 1.00 0.00 C ATOM 2165 SD MET B 437 11.012 11.523 5.475 1.00 0.00 S ATOM 2166 CE MET B 437 10.443 9.825 5.488 1.00 0.00 C ATOM 0 H MET B 437 10.387 12.024 10.305 1.00 0.00 H new ATOM 0 HA MET B 437 12.166 13.547 8.682 1.00 0.00 H new ATOM 0 HB2 MET B 437 12.276 11.098 8.909 1.00 0.00 H new ATOM 0 HB3 MET B 437 10.688 10.939 8.184 1.00 0.00 H new ATOM 0 HG2 MET B 437 12.912 12.330 6.689 1.00 0.00 H new ATOM 0 HG3 MET B 437 12.826 10.580 6.722 1.00 0.00 H new ATOM 0 HE1 MET B 437 10.120 9.542 4.486 1.00 0.00 H new ATOM 0 HE2 MET B 437 11.255 9.171 5.806 1.00 0.00 H new ATOM 0 HE3 MET B 437 9.607 9.727 6.180 1.00 0.00 H new ATOM 2176 N LEU B 438 9.056 13.102 7.623 1.00 0.00 N ATOM 2177 CA LEU B 438 8.043 13.627 6.717 1.00 0.00 C ATOM 2178 C LEU B 438 8.011 15.146 6.807 1.00 0.00 C ATOM 2179 O LEU B 438 8.026 15.836 5.790 1.00 0.00 O ATOM 2180 CB LEU B 438 6.664 13.054 7.053 1.00 0.00 C ATOM 2181 CG LEU B 438 6.618 11.537 7.249 1.00 0.00 C ATOM 2182 CD1 LEU B 438 5.273 11.113 7.816 1.00 0.00 C ATOM 2183 CD2 LEU B 438 6.892 10.824 5.934 1.00 0.00 C ATOM 0 H LEU B 438 8.739 12.336 8.217 1.00 0.00 H new ATOM 0 HA LEU B 438 8.299 13.330 5.700 1.00 0.00 H new ATOM 0 HB2 LEU B 438 6.301 13.533 7.963 1.00 0.00 H new ATOM 0 HB3 LEU B 438 5.973 13.322 6.254 1.00 0.00 H new ATOM 0 HG LEU B 438 7.394 11.257 7.962 1.00 0.00 H new ATOM 0 HD11 LEU B 438 5.259 10.031 7.949 1.00 0.00 H new ATOM 0 HD12 LEU B 438 5.115 11.599 8.779 1.00 0.00 H new ATOM 0 HD13 LEU B 438 4.480 11.405 7.128 1.00 0.00 H new ATOM 0 HD21 LEU B 438 6.856 9.746 6.090 1.00 0.00 H new ATOM 0 HD22 LEU B 438 6.138 11.110 5.201 1.00 0.00 H new ATOM 0 HD23 LEU B 438 7.879 11.104 5.567 1.00 0.00 H new ATOM 2195 N ASP B 439 7.984 15.664 8.030 1.00 0.00 N ATOM 2196 CA ASP B 439 7.968 17.104 8.236 1.00 0.00 C ATOM 2197 C ASP B 439 9.189 17.734 7.568 1.00 0.00 C ATOM 2198 O ASP B 439 9.063 18.657 6.763 1.00 0.00 O ATOM 2199 CB ASP B 439 7.960 17.411 9.735 1.00 0.00 C ATOM 2200 CG ASP B 439 8.254 18.868 10.032 1.00 0.00 C ATOM 2201 OD1 ASP B 439 7.636 19.741 9.386 1.00 0.00 O ATOM 2202 OD2 ASP B 439 9.101 19.137 10.910 1.00 0.00 O ATOM 0 H ASP B 439 7.973 15.111 8.887 1.00 0.00 H new ATOM 0 HA ASP B 439 7.068 17.525 7.788 1.00 0.00 H new ATOM 0 HB2 ASP B 439 6.987 17.148 10.151 1.00 0.00 H new ATOM 0 HB3 ASP B 439 8.700 16.786 10.234 1.00 0.00 H new ATOM 2207 N PHE B 440 10.368 17.224 7.913 1.00 0.00 N ATOM 2208 CA PHE B 440 11.609 17.740 7.343 1.00 0.00 C ATOM 2209 C PHE B 440 11.459 17.861 5.830 1.00 0.00 C ATOM 2210 O PHE B 440 11.789 18.890 5.243 1.00 0.00 O ATOM 2211 CB PHE B 440 12.808 16.844 7.724 1.00 0.00 C ATOM 2212 CG PHE B 440 13.490 16.142 6.569 1.00 0.00 C ATOM 2213 CD1 PHE B 440 13.984 16.855 5.485 1.00 0.00 C ATOM 2214 CD2 PHE B 440 13.639 14.764 6.576 1.00 0.00 C ATOM 2215 CE1 PHE B 440 14.608 16.206 4.435 1.00 0.00 C ATOM 2216 CE2 PHE B 440 14.262 14.112 5.530 1.00 0.00 C ATOM 2217 CZ PHE B 440 14.746 14.833 4.457 1.00 0.00 C ATOM 0 H PHE B 440 10.490 16.461 8.578 1.00 0.00 H new ATOM 0 HA PHE B 440 11.808 18.730 7.754 1.00 0.00 H new ATOM 0 HB2 PHE B 440 13.547 17.456 8.242 1.00 0.00 H new ATOM 0 HB3 PHE B 440 12.465 16.090 8.433 1.00 0.00 H new ATOM 0 HD1 PHE B 440 13.880 17.930 5.461 1.00 0.00 H new ATOM 0 HD2 PHE B 440 13.263 14.192 7.411 1.00 0.00 H new ATOM 0 HE1 PHE B 440 14.987 16.774 3.598 1.00 0.00 H new ATOM 0 HE2 PHE B 440 14.371 13.038 5.552 1.00 0.00 H new ATOM 0 HZ PHE B 440 15.231 14.324 3.637 1.00 0.00 H new ATOM 2227 N TYR B 441 10.948 16.804 5.209 1.00 0.00 N ATOM 2228 CA TYR B 441 10.739 16.797 3.769 1.00 0.00 C ATOM 2229 C TYR B 441 9.688 17.829 3.386 1.00 0.00 C ATOM 2230 O TYR B 441 9.811 18.519 2.377 1.00 0.00 O ATOM 2231 CB TYR B 441 10.299 15.411 3.304 1.00 0.00 C ATOM 2232 CG TYR B 441 11.376 14.662 2.560 1.00 0.00 C ATOM 2233 CD1 TYR B 441 11.622 14.919 1.220 1.00 0.00 C ATOM 2234 CD2 TYR B 441 12.151 13.705 3.200 1.00 0.00 C ATOM 2235 CE1 TYR B 441 12.610 14.242 0.535 1.00 0.00 C ATOM 2236 CE2 TYR B 441 13.142 13.021 2.522 1.00 0.00 C ATOM 2237 CZ TYR B 441 13.368 13.294 1.189 1.00 0.00 C ATOM 2238 OH TYR B 441 14.355 12.616 0.509 1.00 0.00 O ATOM 0 H TYR B 441 10.672 15.943 5.681 1.00 0.00 H new ATOM 0 HA TYR B 441 11.680 17.050 3.281 1.00 0.00 H new ATOM 0 HB2 TYR B 441 9.991 14.825 4.170 1.00 0.00 H new ATOM 0 HB3 TYR B 441 9.425 15.512 2.660 1.00 0.00 H new ATOM 0 HD1 TYR B 441 11.031 15.661 0.704 1.00 0.00 H new ATOM 0 HD2 TYR B 441 11.977 13.492 4.244 1.00 0.00 H new ATOM 0 HE1 TYR B 441 12.789 14.454 -0.509 1.00 0.00 H new ATOM 0 HE2 TYR B 441 13.736 12.277 3.033 1.00 0.00 H new ATOM 0 HH TYR B 441 14.795 11.985 1.115 1.00 0.00 H new ATOM 2248 N ALA B 442 8.651 17.919 4.208 1.00 0.00 N ATOM 2249 CA ALA B 442 7.573 18.865 3.956 1.00 0.00 C ATOM 2250 C ALA B 442 8.141 20.275 3.833 1.00 0.00 C ATOM 2251 O ALA B 442 7.964 20.943 2.812 1.00 0.00 O ATOM 2252 CB ALA B 442 6.527 18.811 5.061 1.00 0.00 C ATOM 0 H ALA B 442 8.534 17.353 5.049 1.00 0.00 H new ATOM 0 HA ALA B 442 7.086 18.591 3.020 1.00 0.00 H new ATOM 0 HB1 ALA B 442 5.734 19.528 4.847 1.00 0.00 H new ATOM 0 HB2 ALA B 442 6.105 17.808 5.114 1.00 0.00 H new ATOM 0 HB3 ALA B 442 6.992 19.059 6.015 1.00 0.00 H new ATOM 2258 N LYS B 443 8.824 20.724 4.880 1.00 0.00 N ATOM 2259 CA LYS B 443 9.417 22.055 4.901 1.00 0.00 C ATOM 2260 C LYS B 443 10.446 22.209 3.785 1.00 0.00 C ATOM 2261 O LYS B 443 10.680 23.310 3.293 1.00 0.00 O ATOM 2262 CB LYS B 443 10.066 22.320 6.264 1.00 0.00 C ATOM 2263 CG LYS B 443 11.199 23.333 6.224 1.00 0.00 C ATOM 2264 CD LYS B 443 12.529 22.666 5.915 1.00 0.00 C ATOM 2265 CE LYS B 443 13.058 21.894 7.112 1.00 0.00 C ATOM 2266 NZ LYS B 443 14.263 22.540 7.702 1.00 0.00 N ATOM 0 H LYS B 443 8.981 20.182 5.730 1.00 0.00 H new ATOM 0 HA LYS B 443 8.626 22.787 4.737 1.00 0.00 H new ATOM 0 HB2 LYS B 443 9.302 22.673 6.956 1.00 0.00 H new ATOM 0 HB3 LYS B 443 10.447 21.380 6.662 1.00 0.00 H new ATOM 0 HG2 LYS B 443 10.986 24.090 5.469 1.00 0.00 H new ATOM 0 HG3 LYS B 443 11.263 23.848 7.183 1.00 0.00 H new ATOM 0 HD2 LYS B 443 12.410 21.990 5.069 1.00 0.00 H new ATOM 0 HD3 LYS B 443 13.256 23.422 5.619 1.00 0.00 H new ATOM 0 HE2 LYS B 443 12.278 21.820 7.870 1.00 0.00 H new ATOM 0 HE3 LYS B 443 13.304 20.877 6.808 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 14.592 21.982 8.516 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 15.017 22.588 6.987 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 14.023 23.502 8.016 1.00 0.00 H new ATOM 2280 N GLN B 444 11.059 21.098 3.392 1.00 0.00 N ATOM 2281 CA GLN B 444 12.060 21.112 2.333 1.00 0.00 C ATOM 2282 C GLN B 444 11.396 21.317 0.972 1.00 0.00 C ATOM 2283 O GLN B 444 11.722 22.258 0.248 1.00 0.00 O ATOM 2284 CB GLN B 444 12.877 19.810 2.371 1.00 0.00 C ATOM 2285 CG GLN B 444 12.828 18.969 1.098 1.00 0.00 C ATOM 2286 CD GLN B 444 13.382 19.689 -0.121 1.00 0.00 C ATOM 2287 OE1 GLN B 444 14.237 20.681 0.106 1.00 0.00 O flip ATOM 2288 NE2 GLN B 444 13.045 19.354 -1.257 1.00 0.00 N flip ATOM 0 H GLN B 444 10.880 20.177 3.791 1.00 0.00 H new ATOM 0 HA GLN B 444 12.742 21.947 2.494 1.00 0.00 H new ATOM 0 HB2 GLN B 444 13.917 20.060 2.582 1.00 0.00 H new ATOM 0 HB3 GLN B 444 12.521 19.202 3.202 1.00 0.00 H new ATOM 0 HG2 GLN B 444 13.393 18.050 1.256 1.00 0.00 H new ATOM 0 HG3 GLN B 444 11.796 18.679 0.902 1.00 0.00 H new ATOM 0 HE21 GLN B 444 12.386 18.587 -1.388 1.00 0.00 H new ATOM 0 HE22 GLN B 444 13.425 19.844 -2.067 1.00 0.00 H new ATOM 2297 N ARG B 445 10.479 20.421 0.624 1.00 0.00 N ATOM 2298 CA ARG B 445 9.788 20.499 -0.656 1.00 0.00 C ATOM 2299 C ARG B 445 9.139 21.866 -0.835 1.00 0.00 C ATOM 2300 O ARG B 445 8.979 22.344 -1.956 1.00 0.00 O ATOM 2301 CB ARG B 445 8.743 19.375 -0.764 1.00 0.00 C ATOM 2302 CG ARG B 445 7.296 19.845 -0.679 1.00 0.00 C ATOM 2303 CD ARG B 445 6.880 20.596 -1.935 1.00 0.00 C ATOM 2304 NE ARG B 445 5.485 20.349 -2.285 1.00 0.00 N ATOM 2305 CZ ARG B 445 4.781 21.129 -3.100 1.00 0.00 C ATOM 2306 NH1 ARG B 445 5.343 22.197 -3.650 1.00 0.00 N ATOM 2307 NH2 ARG B 445 3.513 20.841 -3.366 1.00 0.00 N ATOM 0 H ARG B 445 10.198 19.634 1.209 1.00 0.00 H new ATOM 0 HA ARG B 445 10.518 20.368 -1.455 1.00 0.00 H new ATOM 0 HB2 ARG B 445 8.887 18.853 -1.710 1.00 0.00 H new ATOM 0 HB3 ARG B 445 8.924 18.651 0.031 1.00 0.00 H new ATOM 0 HG2 ARG B 445 6.641 18.986 -0.534 1.00 0.00 H new ATOM 0 HG3 ARG B 445 7.172 20.491 0.190 1.00 0.00 H new ATOM 0 HD2 ARG B 445 7.032 21.665 -1.785 1.00 0.00 H new ATOM 0 HD3 ARG B 445 7.520 20.296 -2.765 1.00 0.00 H new ATOM 0 HE ARG B 445 5.024 19.533 -1.882 1.00 0.00 H new ATOM 0 HH11 ARG B 445 6.317 22.422 -3.448 1.00 0.00 H new ATOM 0 HH12 ARG B 445 4.801 22.794 -4.275 1.00 0.00 H new ATOM 0 HH21 ARG B 445 3.077 20.020 -2.945 1.00 0.00 H new ATOM 0 HH22 ARG B 445 2.974 21.440 -3.991 1.00 0.00 H new ATOM 2321 N ALA B 446 8.774 22.495 0.276 1.00 0.00 N ATOM 2322 CA ALA B 446 8.153 23.810 0.231 1.00 0.00 C ATOM 2323 C ALA B 446 9.215 24.904 0.235 1.00 0.00 C ATOM 2324 O ALA B 446 9.172 25.832 -0.573 1.00 0.00 O ATOM 2325 CB ALA B 446 7.196 24.001 1.398 1.00 0.00 C ATOM 0 H ALA B 446 8.897 22.116 1.215 1.00 0.00 H new ATOM 0 HA ALA B 446 7.582 23.880 -0.695 1.00 0.00 H new ATOM 0 HB1 ALA B 446 6.745 24.992 1.341 1.00 0.00 H new ATOM 0 HB2 ALA B 446 6.413 23.243 1.355 1.00 0.00 H new ATOM 0 HB3 ALA B 446 7.742 23.905 2.336 1.00 0.00 H new ATOM 2331 N ALA B 447 10.165 24.789 1.158 1.00 0.00 N ATOM 2332 CA ALA B 447 11.239 25.768 1.284 1.00 0.00 C ATOM 2333 C ALA B 447 11.890 26.059 -0.065 1.00 0.00 C ATOM 2334 O ALA B 447 12.389 27.159 -0.298 1.00 0.00 O ATOM 2335 CB ALA B 447 12.289 25.296 2.279 1.00 0.00 C ATOM 0 H ALA B 447 10.213 24.025 1.832 1.00 0.00 H new ATOM 0 HA ALA B 447 10.794 26.692 1.654 1.00 0.00 H new ATOM 0 HB1 ALA B 447 13.079 26.043 2.356 1.00 0.00 H new ATOM 0 HB2 ALA B 447 11.827 25.155 3.256 1.00 0.00 H new ATOM 0 HB3 ALA B 447 12.714 24.352 1.939 1.00 0.00 H new ATOM 2341 N ILE B 448 11.889 25.067 -0.947 1.00 0.00 N ATOM 2342 CA ILE B 448 12.485 25.214 -2.268 1.00 0.00 C ATOM 2343 C ILE B 448 11.990 26.479 -2.960 1.00 0.00 C ATOM 2344 O ILE B 448 10.897 26.969 -2.677 1.00 0.00 O ATOM 2345 CB ILE B 448 12.160 24.000 -3.152 1.00 0.00 C ATOM 2346 CG1 ILE B 448 10.663 23.951 -3.437 1.00 0.00 C ATOM 2347 CG2 ILE B 448 12.615 22.715 -2.478 1.00 0.00 C ATOM 2348 CD1 ILE B 448 10.228 22.699 -4.166 1.00 0.00 C ATOM 0 H ILE B 448 11.480 24.149 -0.770 1.00 0.00 H new ATOM 0 HA ILE B 448 13.564 25.284 -2.128 1.00 0.00 H new ATOM 0 HB ILE B 448 12.695 24.099 -4.096 1.00 0.00 H new ATOM 0 HG12 ILE B 448 10.119 24.021 -2.495 1.00 0.00 H new ATOM 0 HG13 ILE B 448 10.385 24.822 -4.030 1.00 0.00 H new ATOM 0 HG21 ILE B 448 12.377 21.865 -3.117 1.00 0.00 H new ATOM 0 HG22 ILE B 448 13.691 22.753 -2.311 1.00 0.00 H new ATOM 0 HG23 ILE B 448 12.103 22.604 -1.522 1.00 0.00 H new ATOM 0 HD11 ILE B 448 9.152 22.732 -4.335 1.00 0.00 H new ATOM 0 HD12 ILE B 448 10.744 22.638 -5.124 1.00 0.00 H new ATOM 0 HD13 ILE B 448 10.474 21.824 -3.565 1.00 0.00 H new