USER MOD reduce.3.24.130724 H: found=0, std=0, add=663, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 664 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 380 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: B 444 GLN : amide:sc= -1.16 K(o=-1.2,f=-0.31) USER MOD Set 2.1: B 368 MET CE :methyl -131:sc= -0.0411 (180deg=0) USER MOD Set 2.2: B 369 ASN : amide:sc= -0.0386 X(o=-0.08,f=-0.031) USER MOD Single : B 371 LYS NZ :NH3+ 161:sc= -0.978 (180deg=-1.98!) USER MOD Single : B 373 GLN : amide:sc= -22.3! C(o=-22!,f=-18!) USER MOD Single : B 375 TYR OH : rot -68:sc= 0.0872 USER MOD Single : B 376 SER OG : rot 130:sc= 0.279 USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS : no HD1:sc=-0.00985 X(o=-0.0098,f=0) USER MOD Single : B 387 TYR OH : rot 60:sc= -5.08! USER MOD Single : B 389 THR OG1 : rot 180:sc= 0 USER MOD Single : B 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot 180:sc= -0.236 USER MOD Single : B 399 ASN : amide:sc= -2.45! C(o=-2.4!,f=-8.6!) USER MOD Single : B 400 SER OG : rot 180:sc= -0.0443 USER MOD Single : B 404 CYS SG : rot -113:sc= -2.8! USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 68:sc= -1.73! USER MOD Single : B 419 ASN : amide:sc= -4.12! C(o=-4.1!,f=-16!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -11.3! C(o=-11!,f=-17!) 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 -157:sc= -6.06 (180deg=-10.7!) USER MOD Single : B 441 TYR OH : rot 30:sc= -0.0542 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1050 N LEU B 366 2.226 3.851 11.034 1.00 0.00 N ATOM 1051 CA LEU B 366 1.622 2.708 10.367 1.00 0.00 C ATOM 1052 C LEU B 366 1.363 3.027 8.900 1.00 0.00 C ATOM 1053 O LEU B 366 1.530 4.165 8.466 1.00 0.00 O ATOM 1054 CB LEU B 366 0.327 2.304 11.090 1.00 0.00 C ATOM 1055 CG LEU B 366 -0.973 2.466 10.293 1.00 0.00 C ATOM 1056 CD1 LEU B 366 -1.311 1.182 9.550 1.00 0.00 C ATOM 1057 CD2 LEU B 366 -2.118 2.862 11.216 1.00 0.00 C ATOM 0 HA LEU B 366 2.310 1.864 10.406 1.00 0.00 H new ATOM 0 HB2 LEU B 366 0.415 1.261 11.393 1.00 0.00 H new ATOM 0 HB3 LEU B 366 0.245 2.895 12.002 1.00 0.00 H new ATOM 0 HG LEU B 366 -0.828 3.259 9.560 1.00 0.00 H new ATOM 0 HD11 LEU B 366 -2.237 1.318 8.991 1.00 0.00 H new ATOM 0 HD12 LEU B 366 -0.503 0.937 8.860 1.00 0.00 H new ATOM 0 HD13 LEU B 366 -1.436 0.369 10.266 1.00 0.00 H new ATOM 0 HD21 LEU B 366 -3.033 2.973 10.634 1.00 0.00 H new ATOM 0 HD22 LEU B 366 -2.260 2.089 11.972 1.00 0.00 H new ATOM 0 HD23 LEU B 366 -1.882 3.808 11.704 1.00 0.00 H new ATOM 1069 N ASP B 367 0.945 2.023 8.143 1.00 0.00 N ATOM 1070 CA ASP B 367 0.656 2.222 6.730 1.00 0.00 C ATOM 1071 C ASP B 367 -0.089 3.539 6.548 1.00 0.00 C ATOM 1072 O ASP B 367 0.493 4.545 6.140 1.00 0.00 O ATOM 1073 CB ASP B 367 -0.170 1.060 6.177 1.00 0.00 C ATOM 1074 CG ASP B 367 -0.495 1.229 4.706 1.00 0.00 C ATOM 1075 OD1 ASP B 367 0.401 0.993 3.870 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -1.647 1.595 4.392 1.00 0.00 O ATOM 0 H ASP B 367 0.799 1.071 8.479 1.00 0.00 H new ATOM 0 HA ASP B 367 1.595 2.259 6.177 1.00 0.00 H new ATOM 0 HB2 ASP B 367 0.377 0.128 6.320 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -1.097 0.975 6.744 1.00 0.00 H new ATOM 1081 N MET B 368 -1.378 3.521 6.865 1.00 0.00 N ATOM 1082 CA MET B 368 -2.209 4.712 6.752 1.00 0.00 C ATOM 1083 C MET B 368 -1.410 5.960 7.125 1.00 0.00 C ATOM 1084 O MET B 368 -1.516 6.998 6.468 1.00 0.00 O ATOM 1085 CB MET B 368 -3.451 4.577 7.646 1.00 0.00 C ATOM 1086 CG MET B 368 -3.322 5.255 9.003 1.00 0.00 C ATOM 1087 SD MET B 368 -3.712 7.015 8.936 1.00 0.00 S ATOM 1088 CE MET B 368 -3.269 7.520 10.595 1.00 0.00 C ATOM 0 H MET B 368 -1.870 2.694 7.203 1.00 0.00 H new ATOM 0 HA MET B 368 -2.535 4.814 5.717 1.00 0.00 H new ATOM 0 HB2 MET B 368 -4.309 4.999 7.122 1.00 0.00 H new ATOM 0 HB3 MET B 368 -3.660 3.518 7.800 1.00 0.00 H new ATOM 0 HG2 MET B 368 -3.987 4.766 9.715 1.00 0.00 H new ATOM 0 HG3 MET B 368 -2.306 5.125 9.375 1.00 0.00 H new ATOM 0 HE1 MET B 368 -4.081 8.105 11.026 1.00 0.00 H new ATOM 0 HE2 MET B 368 -3.092 6.637 11.209 1.00 0.00 H new ATOM 0 HE3 MET B 368 -2.364 8.126 10.561 1.00 0.00 H new ATOM 1098 N ASN B 369 -0.607 5.852 8.183 1.00 0.00 N ATOM 1099 CA ASN B 369 0.204 6.974 8.642 1.00 0.00 C ATOM 1100 C ASN B 369 1.233 7.371 7.591 1.00 0.00 C ATOM 1101 O ASN B 369 1.398 8.553 7.291 1.00 0.00 O ATOM 1102 CB ASN B 369 0.907 6.629 9.953 1.00 0.00 C ATOM 1103 CG ASN B 369 0.268 7.306 11.151 1.00 0.00 C ATOM 1104 OD1 ASN B 369 0.460 8.502 11.377 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -0.498 6.546 11.924 1.00 0.00 N ATOM 0 H ASN B 369 -0.502 5.001 8.735 1.00 0.00 H new ATOM 0 HA ASN B 369 -0.463 7.819 8.810 1.00 0.00 H new ATOM 0 HB2 ASN B 369 0.889 5.549 10.098 1.00 0.00 H new ATOM 0 HB3 ASN B 369 1.954 6.924 9.889 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -0.955 6.948 12.742 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -0.630 5.560 11.700 1.00 0.00 H new ATOM 1112 N ALA B 370 1.917 6.381 7.023 1.00 0.00 N ATOM 1113 CA ALA B 370 2.915 6.647 5.999 1.00 0.00 C ATOM 1114 C ALA B 370 2.260 7.299 4.793 1.00 0.00 C ATOM 1115 O ALA B 370 2.513 8.460 4.504 1.00 0.00 O ATOM 1116 CB ALA B 370 3.633 5.378 5.591 1.00 0.00 C ATOM 0 H ALA B 370 1.797 5.395 7.255 1.00 0.00 H new ATOM 0 HA ALA B 370 3.657 7.330 6.413 1.00 0.00 H new ATOM 0 HB1 ALA B 370 4.373 5.609 4.824 1.00 0.00 H new ATOM 0 HB2 ALA B 370 4.132 4.947 6.459 1.00 0.00 H new ATOM 0 HB3 ALA B 370 2.912 4.663 5.195 1.00 0.00 H new ATOM 1122 N LYS B 371 1.430 6.543 4.076 1.00 0.00 N ATOM 1123 CA LYS B 371 0.749 7.073 2.900 1.00 0.00 C ATOM 1124 C LYS B 371 0.380 8.540 3.110 1.00 0.00 C ATOM 1125 O LYS B 371 0.595 9.376 2.232 1.00 0.00 O ATOM 1126 CB LYS B 371 -0.509 6.252 2.600 1.00 0.00 C ATOM 1127 CG LYS B 371 -1.204 5.727 3.846 1.00 0.00 C ATOM 1128 CD LYS B 371 -1.579 4.263 3.696 1.00 0.00 C ATOM 1129 CE LYS B 371 -3.042 4.101 3.322 1.00 0.00 C ATOM 1130 NZ LYS B 371 -3.609 5.346 2.732 1.00 0.00 N ATOM 0 H LYS B 371 1.215 5.569 4.288 1.00 0.00 H new ATOM 0 HA LYS B 371 1.427 7.003 2.049 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -1.209 6.868 2.036 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -0.240 5.410 1.962 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -0.549 5.850 4.709 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -2.101 6.316 4.040 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -0.953 3.802 2.932 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -1.380 3.737 4.630 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -3.145 3.283 2.610 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -3.614 3.827 4.208 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -4.476 5.117 2.206 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -3.833 6.020 3.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -2.914 5.772 2.086 1.00 0.00 H new ATOM 1144 N ARG B 372 -0.160 8.851 4.289 1.00 0.00 N ATOM 1145 CA ARG B 372 -0.540 10.224 4.617 1.00 0.00 C ATOM 1146 C ARG B 372 0.698 11.117 4.669 1.00 0.00 C ATOM 1147 O ARG B 372 0.664 12.279 4.274 1.00 0.00 O ATOM 1148 CB ARG B 372 -1.270 10.268 5.961 1.00 0.00 C ATOM 1149 CG ARG B 372 -2.374 11.313 6.020 1.00 0.00 C ATOM 1150 CD ARG B 372 -1.895 12.596 6.680 1.00 0.00 C ATOM 1151 NE ARG B 372 -2.702 13.747 6.281 1.00 0.00 N ATOM 1152 CZ ARG B 372 -2.954 14.787 7.073 1.00 0.00 C ATOM 1153 NH1 ARG B 372 -2.459 14.832 8.303 1.00 0.00 N ATOM 1154 NH2 ARG B 372 -3.703 15.789 6.630 1.00 0.00 N ATOM 0 H ARG B 372 -0.343 8.174 5.029 1.00 0.00 H new ATOM 0 HA ARG B 372 -1.210 10.592 3.840 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -1.699 9.287 6.165 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -0.547 10.470 6.751 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -2.724 11.531 5.011 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -3.224 10.914 6.573 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -1.934 12.483 7.763 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -0.853 12.774 6.415 1.00 0.00 H new ATOM 0 HE ARG B 372 -3.096 13.754 5.340 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -1.881 14.066 8.648 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -2.657 15.632 8.903 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -4.084 15.761 5.684 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -3.897 16.587 7.235 1.00 0.00 H new ATOM 1168 N GLN B 373 1.791 10.550 5.153 1.00 0.00 N ATOM 1169 CA GLN B 373 3.056 11.263 5.258 1.00 0.00 C ATOM 1170 C GLN B 373 3.564 11.682 3.879 1.00 0.00 C ATOM 1171 O GLN B 373 4.012 12.812 3.677 1.00 0.00 O ATOM 1172 CB GLN B 373 4.105 10.365 5.943 1.00 0.00 C ATOM 1173 CG GLN B 373 4.677 10.961 7.221 1.00 0.00 C ATOM 1174 CD GLN B 373 5.786 11.979 6.982 1.00 0.00 C ATOM 1175 OE1 GLN B 373 6.380 12.488 7.934 1.00 0.00 O ATOM 1176 NE2 GLN B 373 6.076 12.289 5.721 1.00 0.00 N ATOM 0 H GLN B 373 1.828 9.586 5.483 1.00 0.00 H new ATOM 0 HA GLN B 373 2.894 12.161 5.854 1.00 0.00 H new ATOM 0 HB2 GLN B 373 3.651 9.401 6.173 1.00 0.00 H new ATOM 0 HB3 GLN B 373 4.920 10.175 5.244 1.00 0.00 H new ATOM 0 HG2 GLN B 373 3.872 11.439 7.780 1.00 0.00 H new ATOM 0 HG3 GLN B 373 5.064 10.156 7.845 1.00 0.00 H new ATOM 0 HE21 GLN B 373 5.564 11.848 4.957 1.00 0.00 H new ATOM 0 HE22 GLN B 373 6.810 12.967 5.519 1.00 0.00 H new ATOM 1185 N LEU B 374 3.516 10.751 2.943 1.00 0.00 N ATOM 1186 CA LEU B 374 4.003 10.991 1.590 1.00 0.00 C ATOM 1187 C LEU B 374 3.099 11.929 0.785 1.00 0.00 C ATOM 1188 O LEU B 374 3.505 13.031 0.412 1.00 0.00 O ATOM 1189 CB LEU B 374 4.144 9.658 0.844 1.00 0.00 C ATOM 1190 CG LEU B 374 5.153 8.664 1.433 1.00 0.00 C ATOM 1191 CD1 LEU B 374 6.402 8.613 0.574 1.00 0.00 C ATOM 1192 CD2 LEU B 374 5.511 9.025 2.867 1.00 0.00 C ATOM 0 H LEU B 374 3.142 9.814 3.094 1.00 0.00 H new ATOM 0 HA LEU B 374 4.972 11.481 1.688 1.00 0.00 H new ATOM 0 HB2 LEU B 374 3.166 9.177 0.811 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.430 9.869 -0.186 1.00 0.00 H new ATOM 0 HG LEU B 374 4.689 7.678 1.442 1.00 0.00 H new ATOM 0 HD11 LEU B 374 7.110 7.904 1.003 1.00 0.00 H new ATOM 0 HD12 LEU B 374 6.137 8.296 -0.435 1.00 0.00 H new ATOM 0 HD13 LEU B 374 6.858 9.602 0.536 1.00 0.00 H new ATOM 0 HD21 LEU B 374 6.228 8.302 3.256 1.00 0.00 H new ATOM 0 HD22 LEU B 374 5.951 10.022 2.892 1.00 0.00 H new ATOM 0 HD23 LEU B 374 4.611 9.010 3.481 1.00 0.00 H new ATOM 1204 N TYR B 375 1.884 11.481 0.502 1.00 0.00 N ATOM 1205 CA TYR B 375 0.945 12.272 -0.291 1.00 0.00 C ATOM 1206 C TYR B 375 0.265 13.371 0.521 1.00 0.00 C ATOM 1207 O TYR B 375 -0.462 14.193 -0.038 1.00 0.00 O ATOM 1208 CB TYR B 375 -0.115 11.361 -0.912 1.00 0.00 C ATOM 1209 CG TYR B 375 0.435 10.434 -1.971 1.00 0.00 C ATOM 1210 CD1 TYR B 375 1.505 9.590 -1.697 1.00 0.00 C ATOM 1211 CD2 TYR B 375 -0.113 10.404 -3.248 1.00 0.00 C ATOM 1212 CE1 TYR B 375 2.012 8.744 -2.664 1.00 0.00 C ATOM 1213 CE2 TYR B 375 0.390 9.561 -4.221 1.00 0.00 C ATOM 1214 CZ TYR B 375 1.452 8.733 -3.924 1.00 0.00 C ATOM 1215 OH TYR B 375 1.957 7.893 -4.890 1.00 0.00 O ATOM 0 H TYR B 375 1.523 10.577 0.807 1.00 0.00 H new ATOM 0 HA TYR B 375 1.526 12.760 -1.074 1.00 0.00 H new ATOM 0 HB2 TYR B 375 -0.579 10.767 -0.125 1.00 0.00 H new ATOM 0 HB3 TYR B 375 -0.900 11.977 -1.351 1.00 0.00 H new ATOM 0 HD1 TYR B 375 1.947 9.596 -0.712 1.00 0.00 H new ATOM 0 HD2 TYR B 375 -0.946 11.050 -3.484 1.00 0.00 H new ATOM 0 HE1 TYR B 375 2.843 8.094 -2.434 1.00 0.00 H new ATOM 0 HE2 TYR B 375 -0.046 9.551 -5.209 1.00 0.00 H new ATOM 0 HH TYR B 375 2.860 8.184 -5.137 1.00 0.00 H new ATOM 1225 N SER B 376 0.479 13.384 1.829 1.00 0.00 N ATOM 1226 CA SER B 376 -0.155 14.395 2.669 1.00 0.00 C ATOM 1227 C SER B 376 0.839 15.131 3.563 1.00 0.00 C ATOM 1228 O SER B 376 0.431 15.957 4.381 1.00 0.00 O ATOM 1229 CB SER B 376 -1.256 13.763 3.525 1.00 0.00 C ATOM 1230 OG SER B 376 -2.427 14.559 3.518 1.00 0.00 O ATOM 0 H SER B 376 1.074 12.721 2.326 1.00 0.00 H new ATOM 0 HA SER B 376 -0.589 15.133 1.995 1.00 0.00 H new ATOM 0 HB2 SER B 376 -1.487 12.767 3.148 1.00 0.00 H new ATOM 0 HB3 SER B 376 -0.901 13.642 4.548 1.00 0.00 H new ATOM 0 HG SER B 376 -3.202 13.998 3.306 1.00 0.00 H new ATOM 1236 N LEU B 377 2.135 14.850 3.429 1.00 0.00 N ATOM 1237 CA LEU B 377 3.114 15.528 4.266 1.00 0.00 C ATOM 1238 C LEU B 377 4.501 15.647 3.619 1.00 0.00 C ATOM 1239 O LEU B 377 5.393 16.256 4.207 1.00 0.00 O ATOM 1240 CB LEU B 377 3.221 14.805 5.604 1.00 0.00 C ATOM 1241 CG LEU B 377 4.182 15.427 6.613 1.00 0.00 C ATOM 1242 CD1 LEU B 377 3.673 16.780 7.083 1.00 0.00 C ATOM 1243 CD2 LEU B 377 4.368 14.482 7.785 1.00 0.00 C ATOM 0 H LEU B 377 2.520 14.176 2.767 1.00 0.00 H new ATOM 0 HA LEU B 377 2.758 16.548 4.407 1.00 0.00 H new ATOM 0 HB2 LEU B 377 2.229 14.761 6.053 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.533 13.777 5.418 1.00 0.00 H new ATOM 0 HG LEU B 377 5.146 15.588 6.131 1.00 0.00 H new ATOM 0 HD11 LEU B 377 4.375 17.203 7.801 1.00 0.00 H new ATOM 0 HD12 LEU B 377 3.580 17.450 6.229 1.00 0.00 H new ATOM 0 HD13 LEU B 377 2.699 16.658 7.556 1.00 0.00 H new ATOM 0 HD21 LEU B 377 5.055 14.927 8.505 1.00 0.00 H new ATOM 0 HD22 LEU B 377 3.405 14.302 8.264 1.00 0.00 H new ATOM 0 HD23 LEU B 377 4.778 13.537 7.429 1.00 0.00 H new ATOM 1255 N ILE B 378 4.708 15.095 2.420 1.00 0.00 N ATOM 1256 CA ILE B 378 6.021 15.211 1.794 1.00 0.00 C ATOM 1257 C ILE B 378 5.932 15.671 0.340 1.00 0.00 C ATOM 1258 O ILE B 378 6.609 16.623 -0.048 1.00 0.00 O ATOM 1259 CB ILE B 378 6.858 13.906 1.916 1.00 0.00 C ATOM 1260 CG1 ILE B 378 6.578 12.915 0.786 1.00 0.00 C ATOM 1261 CG2 ILE B 378 6.610 13.239 3.253 1.00 0.00 C ATOM 1262 CD1 ILE B 378 7.356 13.198 -0.475 1.00 0.00 C ATOM 0 H ILE B 378 4.009 14.582 1.882 1.00 0.00 H new ATOM 0 HA ILE B 378 6.548 15.986 2.351 1.00 0.00 H new ATOM 0 HB ILE B 378 7.905 14.201 1.839 1.00 0.00 H new ATOM 0 HG12 ILE B 378 6.815 11.908 1.130 1.00 0.00 H new ATOM 0 HG13 ILE B 378 5.513 12.931 0.556 1.00 0.00 H new ATOM 0 HG21 ILE B 378 7.204 12.328 3.321 1.00 0.00 H new ATOM 0 HG22 ILE B 378 6.895 13.918 4.057 1.00 0.00 H new ATOM 0 HG23 ILE B 378 5.553 12.991 3.345 1.00 0.00 H new ATOM 0 HD11 ILE B 378 7.106 12.454 -1.232 1.00 0.00 H new ATOM 0 HD12 ILE B 378 7.101 14.191 -0.844 1.00 0.00 H new ATOM 0 HD13 ILE B 378 8.424 13.153 -0.261 1.00 0.00 H new ATOM 1274 N GLY B 379 5.123 15.008 -0.476 1.00 0.00 N ATOM 1275 CA GLY B 379 5.029 15.404 -1.862 1.00 0.00 C ATOM 1276 C GLY B 379 3.669 15.944 -2.247 1.00 0.00 C ATOM 1277 O GLY B 379 2.952 16.512 -1.423 1.00 0.00 O ATOM 0 H GLY B 379 4.540 14.216 -0.206 1.00 0.00 H new ATOM 0 HA2 GLY B 379 5.783 16.164 -2.066 1.00 0.00 H new ATOM 0 HA3 GLY B 379 5.262 14.546 -2.493 1.00 0.00 H new ATOM 1281 N TYR B 380 3.331 15.767 -3.515 1.00 0.00 N ATOM 1282 CA TYR B 380 2.063 16.236 -4.060 1.00 0.00 C ATOM 1283 C TYR B 380 1.677 15.406 -5.279 1.00 0.00 C ATOM 1284 O TYR B 380 0.925 14.438 -5.171 1.00 0.00 O ATOM 1285 CB TYR B 380 2.174 17.713 -4.450 1.00 0.00 C ATOM 1286 CG TYR B 380 3.604 18.199 -4.546 1.00 0.00 C ATOM 1287 CD1 TYR B 380 4.334 18.483 -3.401 1.00 0.00 C ATOM 1288 CD2 TYR B 380 4.225 18.363 -5.778 1.00 0.00 C ATOM 1289 CE1 TYR B 380 5.644 18.916 -3.478 1.00 0.00 C ATOM 1290 CE2 TYR B 380 5.533 18.796 -5.865 1.00 0.00 C ATOM 1291 CZ TYR B 380 6.240 19.071 -4.713 1.00 0.00 C ATOM 1292 OH TYR B 380 7.544 19.503 -4.793 1.00 0.00 O ATOM 0 H TYR B 380 3.926 15.295 -4.196 1.00 0.00 H new ATOM 0 HA TYR B 380 1.291 16.126 -3.298 1.00 0.00 H new ATOM 0 HB2 TYR B 380 1.680 17.867 -5.409 1.00 0.00 H new ATOM 0 HB3 TYR B 380 1.640 18.317 -3.716 1.00 0.00 H new ATOM 0 HD1 TYR B 380 3.871 18.364 -2.433 1.00 0.00 H new ATOM 0 HD2 TYR B 380 3.675 18.148 -6.683 1.00 0.00 H new ATOM 0 HE1 TYR B 380 6.198 19.132 -2.577 1.00 0.00 H new ATOM 0 HE2 TYR B 380 6.001 18.919 -6.831 1.00 0.00 H new ATOM 0 HH TYR B 380 7.813 19.558 -5.734 1.00 0.00 H new ATOM 1302 N ALA B 381 2.208 15.786 -6.436 1.00 0.00 N ATOM 1303 CA ALA B 381 1.927 15.071 -7.672 1.00 0.00 C ATOM 1304 C ALA B 381 2.822 15.546 -8.815 1.00 0.00 C ATOM 1305 O ALA B 381 2.458 15.423 -9.984 1.00 0.00 O ATOM 1306 CB ALA B 381 0.462 15.206 -8.057 1.00 0.00 C ATOM 0 H ALA B 381 2.834 16.584 -6.542 1.00 0.00 H new ATOM 0 HA ALA B 381 2.145 14.018 -7.492 1.00 0.00 H new ATOM 0 HB1 ALA B 381 0.278 14.663 -8.984 1.00 0.00 H new ATOM 0 HB2 ALA B 381 -0.162 14.793 -7.264 1.00 0.00 H new ATOM 0 HB3 ALA B 381 0.219 16.259 -8.199 1.00 0.00 H new ATOM 1312 N SER B 382 3.990 16.087 -8.479 1.00 0.00 N ATOM 1313 CA SER B 382 4.920 16.570 -9.492 1.00 0.00 C ATOM 1314 C SER B 382 6.332 16.052 -9.231 1.00 0.00 C ATOM 1315 O SER B 382 7.023 15.623 -10.153 1.00 0.00 O ATOM 1316 CB SER B 382 4.924 18.100 -9.524 1.00 0.00 C ATOM 1317 OG SER B 382 6.242 18.602 -9.663 1.00 0.00 O ATOM 0 H SER B 382 4.313 16.201 -7.518 1.00 0.00 H new ATOM 0 HA SER B 382 4.588 16.193 -10.460 1.00 0.00 H new ATOM 0 HB2 SER B 382 4.308 18.452 -10.352 1.00 0.00 H new ATOM 0 HB3 SER B 382 4.478 18.488 -8.608 1.00 0.00 H new ATOM 0 HG SER B 382 6.219 19.582 -9.683 1.00 0.00 H new ATOM 1323 N LEU B 383 6.756 16.096 -7.970 1.00 0.00 N ATOM 1324 CA LEU B 383 8.087 15.630 -7.592 1.00 0.00 C ATOM 1325 C LEU B 383 8.252 14.146 -7.911 1.00 0.00 C ATOM 1326 O LEU B 383 9.367 13.624 -7.937 1.00 0.00 O ATOM 1327 CB LEU B 383 8.329 15.870 -6.102 1.00 0.00 C ATOM 1328 CG LEU B 383 7.206 15.397 -5.179 1.00 0.00 C ATOM 1329 CD1 LEU B 383 7.011 13.895 -5.300 1.00 0.00 C ATOM 1330 CD2 LEU B 383 7.505 15.778 -3.738 1.00 0.00 C ATOM 0 H LEU B 383 6.197 16.449 -7.193 1.00 0.00 H new ATOM 0 HA LEU B 383 8.821 16.194 -8.168 1.00 0.00 H new ATOM 0 HB2 LEU B 383 9.252 15.366 -5.814 1.00 0.00 H new ATOM 0 HB3 LEU B 383 8.485 16.937 -5.942 1.00 0.00 H new ATOM 0 HG LEU B 383 6.283 15.890 -5.483 1.00 0.00 H new ATOM 0 HD11 LEU B 383 6.207 13.578 -4.635 1.00 0.00 H new ATOM 0 HD12 LEU B 383 6.752 13.643 -6.328 1.00 0.00 H new ATOM 0 HD13 LEU B 383 7.934 13.385 -5.023 1.00 0.00 H new ATOM 0 HD21 LEU B 383 6.695 15.433 -3.095 1.00 0.00 H new ATOM 0 HD22 LEU B 383 8.440 15.313 -3.425 1.00 0.00 H new ATOM 0 HD23 LEU B 383 7.595 16.861 -3.659 1.00 0.00 H new ATOM 1342 N ARG B 384 7.131 13.480 -8.161 1.00 0.00 N ATOM 1343 CA ARG B 384 7.138 12.060 -8.491 1.00 0.00 C ATOM 1344 C ARG B 384 7.512 11.203 -7.286 1.00 0.00 C ATOM 1345 O ARG B 384 8.559 10.556 -7.276 1.00 0.00 O ATOM 1346 CB ARG B 384 8.111 11.786 -9.637 1.00 0.00 C ATOM 1347 CG ARG B 384 7.925 12.715 -10.826 1.00 0.00 C ATOM 1348 CD ARG B 384 7.104 12.061 -11.924 1.00 0.00 C ATOM 1349 NE ARG B 384 6.826 12.983 -13.020 1.00 0.00 N ATOM 1350 CZ ARG B 384 5.858 12.798 -13.911 1.00 0.00 C ATOM 1351 NH1 ARG B 384 5.081 11.727 -13.837 1.00 0.00 N ATOM 1352 NH2 ARG B 384 5.667 13.685 -14.877 1.00 0.00 N ATOM 0 H ARG B 384 6.203 13.902 -8.141 1.00 0.00 H new ATOM 0 HA ARG B 384 6.127 11.792 -8.798 1.00 0.00 H new ATOM 0 HB2 ARG B 384 9.132 11.882 -9.267 1.00 0.00 H new ATOM 0 HB3 ARG B 384 7.988 10.755 -9.969 1.00 0.00 H new ATOM 0 HG2 ARG B 384 7.433 13.631 -10.499 1.00 0.00 H new ATOM 0 HG3 ARG B 384 8.900 13.001 -11.221 1.00 0.00 H new ATOM 0 HD2 ARG B 384 7.638 11.192 -12.308 1.00 0.00 H new ATOM 0 HD3 ARG B 384 6.164 11.699 -11.507 1.00 0.00 H new ATOM 0 HE ARG B 384 7.407 13.816 -13.107 1.00 0.00 H new ATOM 0 HH11 ARG B 384 5.225 11.042 -13.095 1.00 0.00 H new ATOM 0 HH12 ARG B 384 4.339 11.587 -14.522 1.00 0.00 H new ATOM 0 HH21 ARG B 384 6.263 14.510 -14.937 1.00 0.00 H new ATOM 0 HH22 ARG B 384 4.924 13.542 -15.561 1.00 0.00 H new ATOM 1366 N LEU B 385 6.644 11.185 -6.280 1.00 0.00 N ATOM 1367 CA LEU B 385 6.875 10.388 -5.087 1.00 0.00 C ATOM 1368 C LEU B 385 6.029 9.125 -5.149 1.00 0.00 C ATOM 1369 O LEU B 385 4.837 9.190 -5.447 1.00 0.00 O ATOM 1370 CB LEU B 385 6.529 11.199 -3.836 1.00 0.00 C ATOM 1371 CG LEU B 385 5.953 10.397 -2.667 1.00 0.00 C ATOM 1372 CD1 LEU B 385 4.519 9.988 -2.956 1.00 0.00 C ATOM 1373 CD2 LEU B 385 6.815 9.176 -2.371 1.00 0.00 C ATOM 0 H LEU B 385 5.773 11.716 -6.270 1.00 0.00 H new ATOM 0 HA LEU B 385 7.928 10.110 -5.037 1.00 0.00 H new ATOM 0 HB2 LEU B 385 7.430 11.709 -3.495 1.00 0.00 H new ATOM 0 HB3 LEU B 385 5.811 11.971 -4.112 1.00 0.00 H new ATOM 0 HG LEU B 385 5.955 11.033 -1.782 1.00 0.00 H new ATOM 0 HD11 LEU B 385 4.126 9.419 -2.114 1.00 0.00 H new ATOM 0 HD12 LEU B 385 3.910 10.879 -3.107 1.00 0.00 H new ATOM 0 HD13 LEU B 385 4.490 9.372 -3.855 1.00 0.00 H new ATOM 0 HD21 LEU B 385 6.386 8.621 -1.536 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.852 8.535 -3.252 1.00 0.00 H new ATOM 0 HD23 LEU B 385 7.824 9.497 -2.113 1.00 0.00 H new ATOM 1385 N HIS B 386 6.633 7.979 -4.865 1.00 0.00 N ATOM 1386 CA HIS B 386 5.885 6.726 -4.900 1.00 0.00 C ATOM 1387 C HIS B 386 6.718 5.534 -4.461 1.00 0.00 C ATOM 1388 O HIS B 386 7.887 5.662 -4.099 1.00 0.00 O ATOM 1389 CB HIS B 386 5.335 6.486 -6.307 1.00 0.00 C ATOM 1390 CG HIS B 386 6.393 6.397 -7.359 1.00 0.00 C ATOM 1391 ND1 HIS B 386 6.797 7.476 -8.114 1.00 0.00 N ATOM 1392 CD2 HIS B 386 7.129 5.344 -7.784 1.00 0.00 C ATOM 1393 CE1 HIS B 386 7.735 7.090 -8.961 1.00 0.00 C ATOM 1394 NE2 HIS B 386 7.955 5.801 -8.781 1.00 0.00 N ATOM 0 H HIS B 386 7.617 7.888 -4.613 1.00 0.00 H new ATOM 0 HA HIS B 386 5.064 6.823 -4.190 1.00 0.00 H new ATOM 0 HB2 HIS B 386 4.755 5.563 -6.308 1.00 0.00 H new ATOM 0 HB3 HIS B 386 4.649 7.294 -6.562 1.00 0.00 H new ATOM 0 HD2 HIS B 386 7.076 4.333 -7.409 1.00 0.00 H new ATOM 0 HE1 HIS B 386 8.237 7.722 -9.679 1.00 0.00 H new ATOM 0 HE2 HIS B 386 8.629 5.236 -9.298 1.00 0.00 H new ATOM 1403 N TYR B 387 6.094 4.365 -4.529 1.00 0.00 N ATOM 1404 CA TYR B 387 6.738 3.111 -4.179 1.00 0.00 C ATOM 1405 C TYR B 387 6.768 2.190 -5.375 1.00 0.00 C ATOM 1406 O TYR B 387 6.059 2.407 -6.357 1.00 0.00 O ATOM 1407 CB TYR B 387 5.986 2.408 -3.061 1.00 0.00 C ATOM 1408 CG TYR B 387 6.117 3.096 -1.743 1.00 0.00 C ATOM 1409 CD1 TYR B 387 5.847 4.445 -1.630 1.00 0.00 C ATOM 1410 CD2 TYR B 387 6.512 2.399 -0.616 1.00 0.00 C ATOM 1411 CE1 TYR B 387 5.963 5.088 -0.427 1.00 0.00 C ATOM 1412 CE2 TYR B 387 6.634 3.031 0.597 1.00 0.00 C ATOM 1413 CZ TYR B 387 6.358 4.380 0.692 1.00 0.00 C ATOM 1414 OH TYR B 387 6.469 5.016 1.903 1.00 0.00 O ATOM 0 H TYR B 387 5.125 4.262 -4.829 1.00 0.00 H new ATOM 0 HA TYR B 387 7.751 3.342 -3.851 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.931 2.343 -3.326 1.00 0.00 H new ATOM 0 HB3 TYR B 387 6.356 1.387 -2.969 1.00 0.00 H new ATOM 0 HD1 TYR B 387 5.540 5.001 -2.503 1.00 0.00 H new ATOM 0 HD2 TYR B 387 6.727 1.343 -0.691 1.00 0.00 H new ATOM 0 HE1 TYR B 387 5.747 6.144 -0.353 1.00 0.00 H new ATOM 0 HE2 TYR B 387 6.944 2.476 1.470 1.00 0.00 H new ATOM 0 HH TYR B 387 5.600 5.393 2.155 1.00 0.00 H new ATOM 1424 N VAL B 388 7.581 1.155 -5.287 1.00 0.00 N ATOM 1425 CA VAL B 388 7.677 0.205 -6.368 1.00 0.00 C ATOM 1426 C VAL B 388 8.012 -1.183 -5.875 1.00 0.00 C ATOM 1427 O VAL B 388 9.109 -1.442 -5.379 1.00 0.00 O ATOM 1428 CB VAL B 388 8.703 0.641 -7.413 1.00 0.00 C ATOM 1429 CG1 VAL B 388 7.967 1.271 -8.577 1.00 0.00 C ATOM 1430 CG2 VAL B 388 9.712 1.605 -6.810 1.00 0.00 C ATOM 0 H VAL B 388 8.178 0.955 -4.484 1.00 0.00 H new ATOM 0 HA VAL B 388 6.692 0.175 -6.835 1.00 0.00 H new ATOM 0 HB VAL B 388 9.262 -0.225 -7.766 1.00 0.00 H new ATOM 0 HG11 VAL B 388 8.685 1.588 -9.333 1.00 0.00 H new ATOM 0 HG12 VAL B 388 7.281 0.543 -9.011 1.00 0.00 H new ATOM 0 HG13 VAL B 388 7.404 2.136 -8.226 1.00 0.00 H new ATOM 0 HG21 VAL B 388 10.432 1.902 -7.572 1.00 0.00 H new ATOM 0 HG22 VAL B 388 9.193 2.488 -6.437 1.00 0.00 H new ATOM 0 HG23 VAL B 388 10.235 1.117 -5.987 1.00 0.00 H new ATOM 1440 N THR B 389 7.046 -2.072 -6.020 1.00 0.00 N ATOM 1441 CA THR B 389 7.216 -3.451 -5.599 1.00 0.00 C ATOM 1442 C THR B 389 8.148 -4.174 -6.555 1.00 0.00 C ATOM 1443 O THR B 389 7.972 -4.116 -7.773 1.00 0.00 O ATOM 1444 CB THR B 389 5.873 -4.205 -5.531 1.00 0.00 C ATOM 1445 OG1 THR B 389 5.091 -3.781 -4.407 1.00 0.00 O ATOM 1446 CG2 THR B 389 6.102 -5.706 -5.419 1.00 0.00 C ATOM 0 H THR B 389 6.134 -1.863 -6.427 1.00 0.00 H new ATOM 0 HA THR B 389 7.645 -3.433 -4.597 1.00 0.00 H new ATOM 0 HB THR B 389 5.335 -3.978 -6.451 1.00 0.00 H new ATOM 0 HG1 THR B 389 4.245 -4.275 -4.392 1.00 0.00 H new ATOM 0 HG21 THR B 389 5.141 -6.218 -5.372 1.00 0.00 H new ATOM 0 HG22 THR B 389 6.658 -6.055 -6.289 1.00 0.00 H new ATOM 0 HG23 THR B 389 6.672 -5.921 -4.515 1.00 0.00 H new ATOM 1454 N VAL B 390 9.141 -4.846 -6.001 1.00 0.00 N ATOM 1455 CA VAL B 390 10.101 -5.571 -6.810 1.00 0.00 C ATOM 1456 C VAL B 390 10.398 -6.936 -6.210 1.00 0.00 C ATOM 1457 O VAL B 390 10.267 -7.138 -5.004 1.00 0.00 O ATOM 1458 CB VAL B 390 11.409 -4.777 -6.960 1.00 0.00 C ATOM 1459 CG1 VAL B 390 11.162 -3.492 -7.736 1.00 0.00 C ATOM 1460 CG2 VAL B 390 12.004 -4.473 -5.598 1.00 0.00 C ATOM 0 H VAL B 390 9.303 -4.904 -4.996 1.00 0.00 H new ATOM 0 HA VAL B 390 9.658 -5.708 -7.797 1.00 0.00 H new ATOM 0 HB VAL B 390 12.122 -5.384 -7.517 1.00 0.00 H new ATOM 0 HG11 VAL B 390 12.097 -2.941 -7.834 1.00 0.00 H new ATOM 0 HG12 VAL B 390 10.778 -3.734 -8.727 1.00 0.00 H new ATOM 0 HG13 VAL B 390 10.434 -2.880 -7.204 1.00 0.00 H new ATOM 0 HG21 VAL B 390 12.929 -3.911 -5.723 1.00 0.00 H new ATOM 0 HG22 VAL B 390 11.296 -3.883 -5.015 1.00 0.00 H new ATOM 0 HG23 VAL B 390 12.214 -5.407 -5.076 1.00 0.00 H new ATOM 1470 N LYS B 391 10.784 -7.870 -7.067 1.00 0.00 N ATOM 1471 CA LYS B 391 11.090 -9.226 -6.640 1.00 0.00 C ATOM 1472 C LYS B 391 9.820 -10.069 -6.601 1.00 0.00 C ATOM 1473 O LYS B 391 9.717 -11.011 -5.817 1.00 0.00 O ATOM 1474 CB LYS B 391 11.760 -9.211 -5.265 1.00 0.00 C ATOM 1475 CG LYS B 391 12.489 -10.502 -4.906 1.00 0.00 C ATOM 1476 CD LYS B 391 12.773 -11.364 -6.130 1.00 0.00 C ATOM 1477 CE LYS B 391 13.852 -10.748 -7.007 1.00 0.00 C ATOM 1478 NZ LYS B 391 13.834 -11.308 -8.386 1.00 0.00 N ATOM 0 H LYS B 391 10.893 -7.711 -8.069 1.00 0.00 H new ATOM 0 HA LYS B 391 11.779 -9.670 -7.358 1.00 0.00 H new ATOM 0 HB2 LYS B 391 12.470 -8.385 -5.229 1.00 0.00 H new ATOM 0 HB3 LYS B 391 11.002 -9.013 -4.507 1.00 0.00 H new ATOM 0 HG2 LYS B 391 13.428 -10.260 -4.409 1.00 0.00 H new ATOM 0 HG3 LYS B 391 11.889 -11.070 -4.195 1.00 0.00 H new ATOM 0 HD2 LYS B 391 13.085 -12.359 -5.811 1.00 0.00 H new ATOM 0 HD3 LYS B 391 11.858 -11.488 -6.710 1.00 0.00 H new ATOM 0 HE2 LYS B 391 13.710 -9.668 -7.052 1.00 0.00 H new ATOM 0 HE3 LYS B 391 14.829 -10.923 -6.557 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 14.584 -10.862 -8.952 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 13.994 -12.335 -8.346 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 12.911 -11.119 -8.825 1.00 0.00 H new ATOM 1492 N LYS B 392 8.863 -9.698 -7.459 1.00 0.00 N ATOM 1493 CA LYS B 392 7.568 -10.379 -7.568 1.00 0.00 C ATOM 1494 C LYS B 392 7.514 -11.669 -6.755 1.00 0.00 C ATOM 1495 O LYS B 392 8.287 -12.597 -6.993 1.00 0.00 O ATOM 1496 CB LYS B 392 7.257 -10.684 -9.033 1.00 0.00 C ATOM 1497 CG LYS B 392 7.439 -9.490 -9.956 1.00 0.00 C ATOM 1498 CD LYS B 392 6.385 -9.468 -11.051 1.00 0.00 C ATOM 1499 CE LYS B 392 5.292 -8.455 -10.752 1.00 0.00 C ATOM 1500 NZ LYS B 392 3.941 -8.980 -11.090 1.00 0.00 N ATOM 0 H LYS B 392 8.966 -8.912 -8.101 1.00 0.00 H new ATOM 0 HA LYS B 392 6.818 -9.702 -7.159 1.00 0.00 H new ATOM 0 HB2 LYS B 392 7.902 -11.495 -9.371 1.00 0.00 H new ATOM 0 HB3 LYS B 392 6.230 -11.040 -9.111 1.00 0.00 H new ATOM 0 HG2 LYS B 392 7.383 -8.569 -9.376 1.00 0.00 H new ATOM 0 HG3 LYS B 392 8.432 -9.524 -10.405 1.00 0.00 H new ATOM 0 HD2 LYS B 392 6.855 -9.227 -12.005 1.00 0.00 H new ATOM 0 HD3 LYS B 392 5.945 -10.460 -11.154 1.00 0.00 H new ATOM 0 HE2 LYS B 392 5.324 -8.188 -9.696 1.00 0.00 H new ATOM 0 HE3 LYS B 392 5.479 -7.542 -11.317 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 3.224 -8.259 -10.871 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 3.902 -9.211 -12.103 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 3.752 -9.837 -10.532 1.00 0.00 H new ATOM 1514 N PRO B 393 6.596 -11.740 -5.779 1.00 0.00 N ATOM 1515 CA PRO B 393 6.440 -12.916 -4.926 1.00 0.00 C ATOM 1516 C PRO B 393 6.363 -14.207 -5.721 1.00 0.00 C ATOM 1517 O PRO B 393 6.204 -14.194 -6.941 1.00 0.00 O ATOM 1518 CB PRO B 393 5.117 -12.684 -4.189 1.00 0.00 C ATOM 1519 CG PRO B 393 4.524 -11.436 -4.766 1.00 0.00 C ATOM 1520 CD PRO B 393 5.643 -10.683 -5.426 1.00 0.00 C ATOM 0 HA PRO B 393 7.297 -13.028 -4.261 1.00 0.00 H new ATOM 0 HB2 PRO B 393 4.444 -13.531 -4.323 1.00 0.00 H new ATOM 0 HB3 PRO B 393 5.283 -12.575 -3.117 1.00 0.00 H new ATOM 0 HG2 PRO B 393 3.744 -11.678 -5.488 1.00 0.00 H new ATOM 0 HG3 PRO B 393 4.061 -10.833 -3.985 1.00 0.00 H new ATOM 0 HD2 PRO B 393 5.299 -10.141 -6.307 1.00 0.00 H new ATOM 0 HD3 PRO B 393 6.087 -9.949 -4.753 1.00 0.00 H new ATOM 1528 N THR B 394 6.477 -15.323 -5.015 1.00 0.00 N ATOM 1529 CA THR B 394 6.418 -16.633 -5.655 1.00 0.00 C ATOM 1530 C THR B 394 5.853 -17.689 -4.710 1.00 0.00 C ATOM 1531 O THR B 394 5.878 -17.521 -3.491 1.00 0.00 O ATOM 1532 CB THR B 394 7.811 -17.086 -6.133 1.00 0.00 C ATOM 1533 OG1 THR B 394 8.697 -17.306 -5.028 1.00 0.00 O ATOM 1534 CG2 THR B 394 8.436 -16.044 -7.048 1.00 0.00 C ATOM 0 H THR B 394 6.610 -15.350 -4.004 1.00 0.00 H new ATOM 0 HA THR B 394 5.757 -16.531 -6.516 1.00 0.00 H new ATOM 0 HB THR B 394 7.670 -18.021 -6.676 1.00 0.00 H new ATOM 0 HG1 THR B 394 9.572 -17.594 -5.363 1.00 0.00 H new ATOM 0 HG21 THR B 394 9.419 -16.387 -7.372 1.00 0.00 H new ATOM 0 HG22 THR B 394 7.798 -15.895 -7.919 1.00 0.00 H new ATOM 0 HG23 THR B 394 8.540 -15.102 -6.509 1.00 0.00 H new ATOM 1542 N ALA B 395 5.349 -18.785 -5.281 1.00 0.00 N ATOM 1543 CA ALA B 395 4.786 -19.874 -4.489 1.00 0.00 C ATOM 1544 C ALA B 395 5.888 -20.737 -3.877 1.00 0.00 C ATOM 1545 O ALA B 395 5.615 -21.750 -3.233 1.00 0.00 O ATOM 1546 CB ALA B 395 3.856 -20.730 -5.331 1.00 0.00 C ATOM 0 H ALA B 395 5.320 -18.939 -6.289 1.00 0.00 H new ATOM 0 HA ALA B 395 4.210 -19.429 -3.678 1.00 0.00 H new ATOM 0 HB1 ALA B 395 3.449 -21.535 -4.719 1.00 0.00 H new ATOM 0 HB2 ALA B 395 3.040 -20.115 -5.712 1.00 0.00 H new ATOM 0 HB3 ALA B 395 4.411 -21.155 -6.168 1.00 0.00 H new ATOM 1552 N VAL B 396 7.130 -20.304 -4.056 1.00 0.00 N ATOM 1553 CA VAL B 396 8.282 -20.996 -3.504 1.00 0.00 C ATOM 1554 C VAL B 396 9.204 -19.987 -2.833 1.00 0.00 C ATOM 1555 O VAL B 396 10.351 -20.285 -2.500 1.00 0.00 O ATOM 1556 CB VAL B 396 9.060 -21.768 -4.586 1.00 0.00 C ATOM 1557 CG1 VAL B 396 8.260 -22.971 -5.062 1.00 0.00 C ATOM 1558 CG2 VAL B 396 9.406 -20.852 -5.750 1.00 0.00 C ATOM 0 H VAL B 396 7.364 -19.465 -4.587 1.00 0.00 H new ATOM 0 HA VAL B 396 7.921 -21.721 -2.774 1.00 0.00 H new ATOM 0 HB VAL B 396 9.991 -22.130 -4.151 1.00 0.00 H new ATOM 0 HG11 VAL B 396 8.825 -23.504 -5.826 1.00 0.00 H new ATOM 0 HG12 VAL B 396 8.069 -23.637 -4.221 1.00 0.00 H new ATOM 0 HG13 VAL B 396 7.312 -22.635 -5.481 1.00 0.00 H new ATOM 0 HG21 VAL B 396 9.956 -21.415 -6.505 1.00 0.00 H new ATOM 0 HG22 VAL B 396 8.489 -20.457 -6.188 1.00 0.00 H new ATOM 0 HG23 VAL B 396 10.022 -20.027 -5.393 1.00 0.00 H new ATOM 1568 N ASP B 397 8.672 -18.783 -2.644 1.00 0.00 N ATOM 1569 CA ASP B 397 9.403 -17.692 -2.018 1.00 0.00 C ATOM 1570 C ASP B 397 8.576 -16.408 -2.075 1.00 0.00 C ATOM 1571 O ASP B 397 9.020 -15.394 -2.611 1.00 0.00 O ATOM 1572 CB ASP B 397 10.749 -17.479 -2.714 1.00 0.00 C ATOM 1573 CG ASP B 397 11.916 -17.544 -1.749 1.00 0.00 C ATOM 1574 OD1 ASP B 397 12.181 -16.531 -1.068 1.00 0.00 O ATOM 1575 OD2 ASP B 397 12.566 -18.608 -1.673 1.00 0.00 O ATOM 0 H ASP B 397 7.721 -18.539 -2.922 1.00 0.00 H new ATOM 0 HA ASP B 397 9.588 -17.951 -0.976 1.00 0.00 H new ATOM 0 HB2 ASP B 397 10.878 -18.236 -3.488 1.00 0.00 H new ATOM 0 HB3 ASP B 397 10.747 -16.510 -3.213 1.00 0.00 H new ATOM 1580 N PRO B 398 7.350 -16.445 -1.521 1.00 0.00 N ATOM 1581 CA PRO B 398 6.449 -15.297 -1.503 1.00 0.00 C ATOM 1582 C PRO B 398 7.184 -13.976 -1.329 1.00 0.00 C ATOM 1583 O PRO B 398 7.056 -13.073 -2.150 1.00 0.00 O ATOM 1584 CB PRO B 398 5.578 -15.589 -0.286 1.00 0.00 C ATOM 1585 CG PRO B 398 5.476 -17.077 -0.247 1.00 0.00 C ATOM 1586 CD PRO B 398 6.748 -17.618 -0.860 1.00 0.00 C ATOM 0 HA PRO B 398 5.900 -15.183 -2.438 1.00 0.00 H new ATOM 0 HB2 PRO B 398 6.028 -15.198 0.627 1.00 0.00 H new ATOM 0 HB3 PRO B 398 4.596 -15.126 -0.381 1.00 0.00 H new ATOM 0 HG2 PRO B 398 5.360 -17.430 0.778 1.00 0.00 H new ATOM 0 HG3 PRO B 398 4.603 -17.419 -0.803 1.00 0.00 H new ATOM 0 HD2 PRO B 398 7.412 -18.034 -0.102 1.00 0.00 H new ATOM 0 HD3 PRO B 398 6.540 -18.416 -1.573 1.00 0.00 H new ATOM 1594 N ASN B 399 7.941 -13.883 -0.241 1.00 0.00 N ATOM 1595 CA ASN B 399 8.709 -12.690 0.100 1.00 0.00 C ATOM 1596 C ASN B 399 8.819 -11.703 -1.058 1.00 0.00 C ATOM 1597 O ASN B 399 9.269 -12.051 -2.150 1.00 0.00 O ATOM 1598 CB ASN B 399 10.101 -13.094 0.575 1.00 0.00 C ATOM 1599 CG ASN B 399 10.045 -13.946 1.824 1.00 0.00 C ATOM 1600 OD1 ASN B 399 9.140 -14.764 1.994 1.00 0.00 O ATOM 1601 ND2 ASN B 399 11.013 -13.758 2.708 1.00 0.00 N ATOM 0 H ASN B 399 8.040 -14.640 0.435 1.00 0.00 H new ATOM 0 HA ASN B 399 8.171 -12.179 0.899 1.00 0.00 H new ATOM 0 HB2 ASN B 399 10.610 -13.644 -0.217 1.00 0.00 H new ATOM 0 HB3 ASN B 399 10.691 -12.199 0.772 1.00 0.00 H new ATOM 0 HD21 ASN B 399 11.029 -14.302 3.571 1.00 0.00 H new ATOM 0 HD22 ASN B 399 11.743 -13.069 2.526 1.00 0.00 H new ATOM 1608 N SER B 400 8.417 -10.463 -0.797 1.00 0.00 N ATOM 1609 CA SER B 400 8.475 -9.400 -1.793 1.00 0.00 C ATOM 1610 C SER B 400 9.105 -8.153 -1.181 1.00 0.00 C ATOM 1611 O SER B 400 8.877 -7.852 -0.007 1.00 0.00 O ATOM 1612 CB SER B 400 7.072 -9.077 -2.311 1.00 0.00 C ATOM 1613 OG SER B 400 7.114 -8.073 -3.311 1.00 0.00 O ATOM 0 H SER B 400 8.044 -10.168 0.106 1.00 0.00 H new ATOM 0 HA SER B 400 9.086 -9.736 -2.631 1.00 0.00 H new ATOM 0 HB2 SER B 400 6.614 -9.979 -2.717 1.00 0.00 H new ATOM 0 HB3 SER B 400 6.444 -8.745 -1.485 1.00 0.00 H new ATOM 0 HG SER B 400 6.205 -7.887 -3.626 1.00 0.00 H new ATOM 1619 N ILE B 401 9.910 -7.436 -1.962 1.00 0.00 N ATOM 1620 CA ILE B 401 10.573 -6.238 -1.477 1.00 0.00 C ATOM 1621 C ILE B 401 9.988 -4.984 -2.115 1.00 0.00 C ATOM 1622 O ILE B 401 9.785 -4.923 -3.327 1.00 0.00 O ATOM 1623 CB ILE B 401 12.086 -6.301 -1.779 1.00 0.00 C ATOM 1624 CG1 ILE B 401 12.748 -4.915 -1.678 1.00 0.00 C ATOM 1625 CG2 ILE B 401 12.316 -6.894 -3.160 1.00 0.00 C ATOM 1626 CD1 ILE B 401 13.705 -4.777 -0.518 1.00 0.00 C ATOM 0 H ILE B 401 10.116 -7.668 -2.934 1.00 0.00 H new ATOM 0 HA ILE B 401 10.415 -6.190 -0.400 1.00 0.00 H new ATOM 0 HB ILE B 401 12.549 -6.941 -1.028 1.00 0.00 H new ATOM 0 HG12 ILE B 401 13.284 -4.711 -2.605 1.00 0.00 H new ATOM 0 HG13 ILE B 401 11.970 -4.157 -1.586 1.00 0.00 H new ATOM 0 HG21 ILE B 401 13.386 -6.935 -3.365 1.00 0.00 H new ATOM 0 HG22 ILE B 401 11.901 -7.901 -3.197 1.00 0.00 H new ATOM 0 HG23 ILE B 401 11.827 -6.272 -3.909 1.00 0.00 H new ATOM 0 HD11 ILE B 401 14.130 -3.773 -0.515 1.00 0.00 H new ATOM 0 HD12 ILE B 401 13.171 -4.948 0.417 1.00 0.00 H new ATOM 0 HD13 ILE B 401 14.506 -5.510 -0.618 1.00 0.00 H new ATOM 1638 N VAL B 402 9.730 -3.986 -1.282 1.00 0.00 N ATOM 1639 CA VAL B 402 9.178 -2.720 -1.746 1.00 0.00 C ATOM 1640 C VAL B 402 10.279 -1.683 -1.921 1.00 0.00 C ATOM 1641 O VAL B 402 11.324 -1.759 -1.277 1.00 0.00 O ATOM 1642 CB VAL B 402 8.119 -2.183 -0.764 1.00 0.00 C ATOM 1643 CG1 VAL B 402 7.143 -1.259 -1.475 1.00 0.00 C ATOM 1644 CG2 VAL B 402 7.385 -3.341 -0.105 1.00 0.00 C ATOM 0 H VAL B 402 9.895 -4.029 -0.276 1.00 0.00 H new ATOM 0 HA VAL B 402 8.703 -2.904 -2.710 1.00 0.00 H new ATOM 0 HB VAL B 402 8.623 -1.604 0.010 1.00 0.00 H new ATOM 0 HG11 VAL B 402 6.404 -0.892 -0.762 1.00 0.00 H new ATOM 0 HG12 VAL B 402 7.686 -0.416 -1.902 1.00 0.00 H new ATOM 0 HG13 VAL B 402 6.638 -1.806 -2.271 1.00 0.00 H new ATOM 0 HG21 VAL B 402 6.639 -2.952 0.587 1.00 0.00 H new ATOM 0 HG22 VAL B 402 6.892 -3.942 -0.870 1.00 0.00 H new ATOM 0 HG23 VAL B 402 8.097 -3.960 0.440 1.00 0.00 H new ATOM 1654 N GLU B 403 10.037 -0.710 -2.789 1.00 0.00 N ATOM 1655 CA GLU B 403 11.008 0.348 -3.037 1.00 0.00 C ATOM 1656 C GLU B 403 10.337 1.713 -2.956 1.00 0.00 C ATOM 1657 O GLU B 403 9.642 2.130 -3.881 1.00 0.00 O ATOM 1658 CB GLU B 403 11.658 0.164 -4.410 1.00 0.00 C ATOM 1659 CG GLU B 403 13.015 -0.518 -4.353 1.00 0.00 C ATOM 1660 CD GLU B 403 14.037 0.283 -3.569 1.00 0.00 C ATOM 1661 OE1 GLU B 403 14.561 1.276 -4.117 1.00 0.00 O ATOM 1662 OE2 GLU B 403 14.314 -0.083 -2.408 1.00 0.00 O ATOM 0 H GLU B 403 9.178 -0.631 -3.333 1.00 0.00 H new ATOM 0 HA GLU B 403 11.782 0.291 -2.272 1.00 0.00 H new ATOM 0 HB2 GLU B 403 10.992 -0.423 -5.043 1.00 0.00 H new ATOM 0 HB3 GLU B 403 11.770 1.139 -4.883 1.00 0.00 H new ATOM 0 HG2 GLU B 403 12.904 -1.503 -3.899 1.00 0.00 H new ATOM 0 HG3 GLU B 403 13.382 -0.675 -5.367 1.00 0.00 H new ATOM 1669 N CYS B 404 10.571 2.417 -1.855 1.00 0.00 N ATOM 1670 CA CYS B 404 10.007 3.748 -1.678 1.00 0.00 C ATOM 1671 C CYS B 404 11.006 4.774 -2.176 1.00 0.00 C ATOM 1672 O CYS B 404 12.038 5.017 -1.543 1.00 0.00 O ATOM 1673 CB CYS B 404 9.636 4.023 -0.212 1.00 0.00 C ATOM 1674 SG CYS B 404 10.137 2.735 0.958 1.00 0.00 S ATOM 0 H CYS B 404 11.144 2.091 -1.077 1.00 0.00 H new ATOM 0 HA CYS B 404 9.085 3.815 -2.255 1.00 0.00 H new ATOM 0 HB2 CYS B 404 10.091 4.966 0.092 1.00 0.00 H new ATOM 0 HB3 CYS B 404 8.556 4.154 -0.145 1.00 0.00 H new ATOM 0 HG CYS B 404 9.080 2.159 1.448 1.00 0.00 H new ATOM 1680 N ARG B 405 10.696 5.364 -3.322 1.00 0.00 N ATOM 1681 CA ARG B 405 11.566 6.357 -3.923 1.00 0.00 C ATOM 1682 C ARG B 405 10.757 7.406 -4.670 1.00 0.00 C ATOM 1683 O ARG B 405 9.571 7.217 -4.940 1.00 0.00 O ATOM 1684 CB ARG B 405 12.561 5.687 -4.874 1.00 0.00 C ATOM 1685 CG ARG B 405 11.933 5.200 -6.170 1.00 0.00 C ATOM 1686 CD ARG B 405 12.782 4.122 -6.824 1.00 0.00 C ATOM 1687 NE ARG B 405 14.120 4.605 -7.156 1.00 0.00 N ATOM 1688 CZ ARG B 405 15.160 3.806 -7.375 1.00 0.00 C ATOM 1689 NH1 ARG B 405 15.021 2.491 -7.290 1.00 0.00 N ATOM 1690 NH2 ARG B 405 16.344 4.323 -7.676 1.00 0.00 N ATOM 0 H ARG B 405 9.847 5.170 -3.852 1.00 0.00 H new ATOM 0 HA ARG B 405 12.118 6.852 -3.124 1.00 0.00 H new ATOM 0 HB2 ARG B 405 13.357 6.393 -5.109 1.00 0.00 H new ATOM 0 HB3 ARG B 405 13.024 4.842 -4.365 1.00 0.00 H new ATOM 0 HG2 ARG B 405 10.936 4.808 -5.969 1.00 0.00 H new ATOM 0 HG3 ARG B 405 11.814 6.038 -6.856 1.00 0.00 H new ATOM 0 HD2 ARG B 405 12.862 3.267 -6.153 1.00 0.00 H new ATOM 0 HD3 ARG B 405 12.288 3.772 -7.730 1.00 0.00 H new ATOM 0 HE ARG B 405 14.265 5.612 -7.224 1.00 0.00 H new ATOM 0 HH11 ARG B 405 14.114 2.088 -7.056 1.00 0.00 H new ATOM 0 HH12 ARG B 405 15.821 1.882 -7.459 1.00 0.00 H new ATOM 0 HH21 ARG B 405 16.457 5.335 -7.740 1.00 0.00 H new ATOM 0 HH22 ARG B 405 17.141 3.709 -7.844 1.00 0.00 H new ATOM 1704 N VAL B 406 11.406 8.514 -4.990 1.00 0.00 N ATOM 1705 CA VAL B 406 10.759 9.605 -5.695 1.00 0.00 C ATOM 1706 C VAL B 406 11.720 10.273 -6.665 1.00 0.00 C ATOM 1707 O VAL B 406 12.918 10.388 -6.391 1.00 0.00 O ATOM 1708 CB VAL B 406 10.216 10.648 -4.703 1.00 0.00 C ATOM 1709 CG1 VAL B 406 9.637 9.953 -3.491 1.00 0.00 C ATOM 1710 CG2 VAL B 406 11.306 11.614 -4.277 1.00 0.00 C ATOM 0 H VAL B 406 12.388 8.680 -4.770 1.00 0.00 H new ATOM 0 HA VAL B 406 9.927 9.185 -6.260 1.00 0.00 H new ATOM 0 HB VAL B 406 9.432 11.218 -5.201 1.00 0.00 H new ATOM 0 HG11 VAL B 406 9.254 10.698 -2.793 1.00 0.00 H new ATOM 0 HG12 VAL B 406 8.825 9.296 -3.802 1.00 0.00 H new ATOM 0 HG13 VAL B 406 10.414 9.364 -3.004 1.00 0.00 H new ATOM 0 HG21 VAL B 406 10.895 12.340 -3.576 1.00 0.00 H new ATOM 0 HG22 VAL B 406 12.114 11.062 -3.796 1.00 0.00 H new ATOM 0 HG23 VAL B 406 11.694 12.134 -5.153 1.00 0.00 H new ATOM 1720 N GLY B 407 11.193 10.706 -7.800 1.00 0.00 N ATOM 1721 CA GLY B 407 12.020 11.353 -8.793 1.00 0.00 C ATOM 1722 C GLY B 407 13.001 10.396 -9.441 1.00 0.00 C ATOM 1723 O GLY B 407 13.830 10.801 -10.256 1.00 0.00 O ATOM 0 H GLY B 407 10.208 10.620 -8.050 1.00 0.00 H new ATOM 0 HA2 GLY B 407 11.384 11.792 -9.561 1.00 0.00 H new ATOM 0 HA3 GLY B 407 12.569 12.172 -8.327 1.00 0.00 H new ATOM 1727 N ASP B 408 12.908 9.121 -9.074 1.00 0.00 N ATOM 1728 CA ASP B 408 13.790 8.098 -9.617 1.00 0.00 C ATOM 1729 C ASP B 408 15.224 8.319 -9.154 1.00 0.00 C ATOM 1730 O ASP B 408 16.156 7.710 -9.681 1.00 0.00 O ATOM 1731 CB ASP B 408 13.723 8.096 -11.143 1.00 0.00 C ATOM 1732 CG ASP B 408 13.477 6.709 -11.704 1.00 0.00 C ATOM 1733 OD1 ASP B 408 12.634 5.982 -11.138 1.00 0.00 O ATOM 1734 OD2 ASP B 408 14.128 6.349 -12.706 1.00 0.00 O ATOM 0 H ASP B 408 12.227 8.773 -8.400 1.00 0.00 H new ATOM 0 HA ASP B 408 13.456 7.128 -9.248 1.00 0.00 H new ATOM 0 HB2 ASP B 408 12.927 8.765 -11.471 1.00 0.00 H new ATOM 0 HB3 ASP B 408 14.656 8.489 -11.546 1.00 0.00 H new ATOM 1739 N GLY B 409 15.395 9.198 -8.173 1.00 0.00 N ATOM 1740 CA GLY B 409 16.721 9.485 -7.667 1.00 0.00 C ATOM 1741 C GLY B 409 16.795 9.492 -6.150 1.00 0.00 C ATOM 1742 O GLY B 409 17.878 9.633 -5.581 1.00 0.00 O ATOM 0 H GLY B 409 14.641 9.715 -7.721 1.00 0.00 H new ATOM 0 HA2 GLY B 409 17.419 8.743 -8.055 1.00 0.00 H new ATOM 0 HA3 GLY B 409 17.045 10.455 -8.044 1.00 0.00 H new ATOM 1746 N THR B 410 15.648 9.347 -5.488 1.00 0.00 N ATOM 1747 CA THR B 410 15.613 9.349 -4.028 1.00 0.00 C ATOM 1748 C THR B 410 14.835 8.159 -3.475 1.00 0.00 C ATOM 1749 O THR B 410 13.668 7.975 -3.794 1.00 0.00 O ATOM 1750 CB THR B 410 14.983 10.645 -3.490 1.00 0.00 C ATOM 1751 OG1 THR B 410 15.677 11.801 -3.975 1.00 0.00 O ATOM 1752 CG2 THR B 410 15.009 10.669 -1.970 1.00 0.00 C ATOM 0 H THR B 410 14.739 9.228 -5.935 1.00 0.00 H new ATOM 0 HA THR B 410 16.649 9.278 -3.696 1.00 0.00 H new ATOM 0 HB THR B 410 13.952 10.668 -3.843 1.00 0.00 H new ATOM 0 HG1 THR B 410 15.254 12.610 -3.619 1.00 0.00 H new ATOM 0 HG21 THR B 410 14.558 11.595 -1.613 1.00 0.00 H new ATOM 0 HG22 THR B 410 14.447 9.819 -1.583 1.00 0.00 H new ATOM 0 HG23 THR B 410 16.041 10.610 -1.623 1.00 0.00 H new ATOM 1760 N VAL B 411 15.490 7.360 -2.634 1.00 0.00 N ATOM 1761 CA VAL B 411 14.854 6.193 -2.026 1.00 0.00 C ATOM 1762 C VAL B 411 14.569 6.439 -0.548 1.00 0.00 C ATOM 1763 O VAL B 411 15.442 6.248 0.299 1.00 0.00 O ATOM 1764 CB VAL B 411 15.736 4.937 -2.152 1.00 0.00 C ATOM 1765 CG1 VAL B 411 14.940 3.689 -1.803 1.00 0.00 C ATOM 1766 CG2 VAL B 411 16.319 4.832 -3.551 1.00 0.00 C ATOM 0 H VAL B 411 16.462 7.500 -2.358 1.00 0.00 H new ATOM 0 HA VAL B 411 13.919 6.029 -2.562 1.00 0.00 H new ATOM 0 HB VAL B 411 16.562 5.023 -1.446 1.00 0.00 H new ATOM 0 HG11 VAL B 411 15.579 2.811 -1.898 1.00 0.00 H new ATOM 0 HG12 VAL B 411 14.576 3.764 -0.778 1.00 0.00 H new ATOM 0 HG13 VAL B 411 14.093 3.596 -2.483 1.00 0.00 H new ATOM 0 HG21 VAL B 411 16.939 3.938 -3.621 1.00 0.00 H new ATOM 0 HG22 VAL B 411 15.510 4.770 -4.279 1.00 0.00 H new ATOM 0 HG23 VAL B 411 16.927 5.713 -3.759 1.00 0.00 H new ATOM 1776 N LEU B 412 13.345 6.855 -0.237 1.00 0.00 N ATOM 1777 CA LEU B 412 12.964 7.113 1.147 1.00 0.00 C ATOM 1778 C LEU B 412 13.239 5.889 2.007 1.00 0.00 C ATOM 1779 O LEU B 412 13.373 5.988 3.227 1.00 0.00 O ATOM 1780 CB LEU B 412 11.482 7.491 1.241 1.00 0.00 C ATOM 1781 CG LEU B 412 11.075 8.777 0.509 1.00 0.00 C ATOM 1782 CD1 LEU B 412 12.295 9.618 0.160 1.00 0.00 C ATOM 1783 CD2 LEU B 412 10.281 8.447 -0.746 1.00 0.00 C ATOM 0 H LEU B 412 12.605 7.020 -0.919 1.00 0.00 H new ATOM 0 HA LEU B 412 13.561 7.948 1.513 1.00 0.00 H new ATOM 0 HB2 LEU B 412 10.890 6.666 0.844 1.00 0.00 H new ATOM 0 HB3 LEU B 412 11.219 7.595 2.294 1.00 0.00 H new ATOM 0 HG LEU B 412 10.443 9.360 1.179 1.00 0.00 H new ATOM 0 HD11 LEU B 412 11.977 10.523 -0.358 1.00 0.00 H new ATOM 0 HD12 LEU B 412 12.823 9.890 1.074 1.00 0.00 H new ATOM 0 HD13 LEU B 412 12.959 9.045 -0.486 1.00 0.00 H new ATOM 0 HD21 LEU B 412 10.001 9.371 -1.253 1.00 0.00 H new ATOM 0 HD22 LEU B 412 10.891 7.838 -1.413 1.00 0.00 H new ATOM 0 HD23 LEU B 412 9.381 7.896 -0.473 1.00 0.00 H new ATOM 1795 N GLY B 413 13.317 4.732 1.359 1.00 0.00 N ATOM 1796 CA GLY B 413 13.573 3.498 2.076 1.00 0.00 C ATOM 1797 C GLY B 413 13.158 2.277 1.284 1.00 0.00 C ATOM 1798 O GLY B 413 12.983 2.349 0.068 1.00 0.00 O ATOM 0 H GLY B 413 13.207 4.627 0.350 1.00 0.00 H new ATOM 0 HA2 GLY B 413 14.635 3.431 2.312 1.00 0.00 H new ATOM 0 HA3 GLY B 413 13.036 3.513 3.024 1.00 0.00 H new ATOM 1802 N THR B 414 12.994 1.155 1.972 1.00 0.00 N ATOM 1803 CA THR B 414 12.591 -0.079 1.315 1.00 0.00 C ATOM 1804 C THR B 414 12.007 -1.075 2.309 1.00 0.00 C ATOM 1805 O THR B 414 12.114 -0.900 3.521 1.00 0.00 O ATOM 1806 CB THR B 414 13.765 -0.734 0.560 1.00 0.00 C ATOM 1807 OG1 THR B 414 13.347 -1.913 -0.137 1.00 0.00 O ATOM 1808 CG2 THR B 414 14.885 -1.112 1.512 1.00 0.00 C ATOM 0 H THR B 414 13.133 1.075 2.979 1.00 0.00 H new ATOM 0 HA THR B 414 11.821 0.192 0.593 1.00 0.00 H new ATOM 0 HB THR B 414 14.124 0.004 -0.158 1.00 0.00 H new ATOM 0 HG1 THR B 414 12.749 -1.664 -0.872 1.00 0.00 H new ATOM 0 HG21 THR B 414 15.699 -1.572 0.952 1.00 0.00 H new ATOM 0 HG22 THR B 414 15.251 -0.218 2.016 1.00 0.00 H new ATOM 0 HG23 THR B 414 14.510 -1.818 2.253 1.00 0.00 H new ATOM 1816 N GLY B 415 11.383 -2.117 1.775 1.00 0.00 N ATOM 1817 CA GLY B 415 10.775 -3.128 2.620 1.00 0.00 C ATOM 1818 C GLY B 415 10.942 -4.537 2.094 1.00 0.00 C ATOM 1819 O GLY B 415 11.104 -4.747 0.896 1.00 0.00 O ATOM 0 H GLY B 415 11.287 -2.281 0.773 1.00 0.00 H new ATOM 0 HA2 GLY B 415 11.212 -3.067 3.617 1.00 0.00 H new ATOM 0 HA3 GLY B 415 9.712 -2.911 2.724 1.00 0.00 H new ATOM 1823 N VAL B 416 10.898 -5.502 3.010 1.00 0.00 N ATOM 1824 CA VAL B 416 11.038 -6.910 2.658 1.00 0.00 C ATOM 1825 C VAL B 416 10.226 -7.786 3.602 1.00 0.00 C ATOM 1826 O VAL B 416 10.651 -8.066 4.724 1.00 0.00 O ATOM 1827 CB VAL B 416 12.505 -7.371 2.704 1.00 0.00 C ATOM 1828 CG1 VAL B 416 12.608 -8.856 2.389 1.00 0.00 C ATOM 1829 CG2 VAL B 416 13.345 -6.558 1.741 1.00 0.00 C ATOM 0 H VAL B 416 10.766 -5.331 4.007 1.00 0.00 H new ATOM 0 HA VAL B 416 10.667 -7.014 1.638 1.00 0.00 H new ATOM 0 HB VAL B 416 12.888 -7.210 3.712 1.00 0.00 H new ATOM 0 HG11 VAL B 416 13.653 -9.164 2.426 1.00 0.00 H new ATOM 0 HG12 VAL B 416 12.036 -9.424 3.122 1.00 0.00 H new ATOM 0 HG13 VAL B 416 12.209 -9.045 1.392 1.00 0.00 H new ATOM 0 HG21 VAL B 416 14.380 -6.897 1.786 1.00 0.00 H new ATOM 0 HG22 VAL B 416 12.964 -6.687 0.728 1.00 0.00 H new ATOM 0 HG23 VAL B 416 13.296 -5.504 2.015 1.00 0.00 H new ATOM 1839 N GLY B 417 9.060 -8.220 3.144 1.00 0.00 N ATOM 1840 CA GLY B 417 8.214 -9.064 3.962 1.00 0.00 C ATOM 1841 C GLY B 417 8.077 -10.453 3.380 1.00 0.00 C ATOM 1842 O GLY B 417 8.367 -10.655 2.205 1.00 0.00 O ATOM 0 H GLY B 417 8.685 -8.002 2.221 1.00 0.00 H new ATOM 0 HA2 GLY B 417 8.630 -9.130 4.967 1.00 0.00 H new ATOM 0 HA3 GLY B 417 7.228 -8.610 4.054 1.00 0.00 H new ATOM 1846 N ARG B 418 7.637 -11.410 4.192 1.00 0.00 N ATOM 1847 CA ARG B 418 7.469 -12.785 3.729 1.00 0.00 C ATOM 1848 C ARG B 418 6.127 -12.966 3.027 1.00 0.00 C ATOM 1849 O ARG B 418 6.068 -13.489 1.914 1.00 0.00 O ATOM 1850 CB ARG B 418 7.573 -13.755 4.908 1.00 0.00 C ATOM 1851 CG ARG B 418 6.541 -13.503 5.996 1.00 0.00 C ATOM 1852 CD ARG B 418 7.041 -13.957 7.358 1.00 0.00 C ATOM 1853 NE ARG B 418 6.239 -15.051 7.903 1.00 0.00 N ATOM 1854 CZ ARG B 418 5.003 -14.900 8.372 1.00 0.00 C ATOM 1855 NH1 ARG B 418 4.430 -13.703 8.370 1.00 0.00 N ATOM 1856 NH2 ARG B 418 4.338 -15.946 8.845 1.00 0.00 N ATOM 0 H ARG B 418 7.391 -11.260 5.170 1.00 0.00 H new ATOM 0 HA ARG B 418 8.263 -13.000 3.014 1.00 0.00 H new ATOM 0 HB2 ARG B 418 7.459 -14.775 4.540 1.00 0.00 H new ATOM 0 HB3 ARG B 418 8.571 -13.682 5.341 1.00 0.00 H new ATOM 0 HG2 ARG B 418 6.301 -12.440 6.032 1.00 0.00 H new ATOM 0 HG3 ARG B 418 5.619 -14.030 5.752 1.00 0.00 H new ATOM 0 HD2 ARG B 418 8.080 -14.277 7.274 1.00 0.00 H new ATOM 0 HD3 ARG B 418 7.022 -13.115 8.050 1.00 0.00 H new ATOM 0 HE ARG B 418 6.651 -15.984 7.925 1.00 0.00 H new ATOM 0 HH11 ARG B 418 4.937 -12.895 8.008 1.00 0.00 H new ATOM 0 HH12 ARG B 418 3.482 -13.591 8.730 1.00 0.00 H new ATOM 0 HH21 ARG B 418 4.774 -16.868 8.850 1.00 0.00 H new ATOM 0 HH22 ARG B 418 3.391 -15.828 9.204 1.00 0.00 H new ATOM 1870 N ASN B 419 5.048 -12.534 3.677 1.00 0.00 N ATOM 1871 CA ASN B 419 3.718 -12.660 3.091 1.00 0.00 C ATOM 1872 C ASN B 419 3.468 -11.552 2.075 1.00 0.00 C ATOM 1873 O ASN B 419 2.631 -11.706 1.191 1.00 0.00 O ATOM 1874 CB ASN B 419 2.625 -12.646 4.165 1.00 0.00 C ATOM 1875 CG ASN B 419 2.985 -11.798 5.367 1.00 0.00 C ATOM 1876 OD1 ASN B 419 4.075 -11.921 5.926 1.00 0.00 O ATOM 1877 ND2 ASN B 419 2.064 -10.930 5.774 1.00 0.00 N ATOM 0 H ASN B 419 5.069 -12.099 4.599 1.00 0.00 H new ATOM 0 HA ASN B 419 3.678 -13.622 2.581 1.00 0.00 H new ATOM 0 HB2 ASN B 419 1.699 -12.272 3.728 1.00 0.00 H new ATOM 0 HB3 ASN B 419 2.433 -13.668 4.493 1.00 0.00 H new ATOM 0 HD21 ASN B 419 2.247 -10.332 6.580 1.00 0.00 H new ATOM 0 HD22 ASN B 419 1.174 -10.862 5.280 1.00 0.00 H new ATOM 1884 N ILE B 420 4.195 -10.438 2.234 1.00 0.00 N ATOM 1885 CA ILE B 420 4.102 -9.253 1.371 1.00 0.00 C ATOM 1886 C ILE B 420 3.473 -8.085 2.120 1.00 0.00 C ATOM 1887 O ILE B 420 3.912 -6.948 1.977 1.00 0.00 O ATOM 1888 CB ILE B 420 3.351 -9.454 0.040 1.00 0.00 C ATOM 1889 CG1 ILE B 420 1.840 -9.451 0.268 1.00 0.00 C ATOM 1890 CG2 ILE B 420 3.820 -10.706 -0.687 1.00 0.00 C ATOM 1891 CD1 ILE B 420 1.255 -8.056 0.299 1.00 0.00 C ATOM 0 H ILE B 420 4.879 -10.333 2.983 1.00 0.00 H new ATOM 0 HA ILE B 420 5.138 -9.042 1.104 1.00 0.00 H new ATOM 0 HB ILE B 420 3.587 -8.613 -0.612 1.00 0.00 H new ATOM 0 HG12 ILE B 420 1.357 -10.025 -0.522 1.00 0.00 H new ATOM 0 HG13 ILE B 420 1.618 -9.954 1.209 1.00 0.00 H new ATOM 0 HG21 ILE B 420 3.267 -10.813 -1.620 1.00 0.00 H new ATOM 0 HG22 ILE B 420 4.885 -10.624 -0.903 1.00 0.00 H new ATOM 0 HG23 ILE B 420 3.644 -11.579 -0.059 1.00 0.00 H new ATOM 0 HD11 ILE B 420 0.179 -8.116 0.464 1.00 0.00 H new ATOM 0 HD12 ILE B 420 1.715 -7.487 1.107 1.00 0.00 H new ATOM 0 HD13 ILE B 420 1.449 -7.559 -0.651 1.00 0.00 H new ATOM 1903 N LYS B 421 2.456 -8.350 2.931 1.00 0.00 N ATOM 1904 CA LYS B 421 1.832 -7.274 3.688 1.00 0.00 C ATOM 1905 C LYS B 421 2.918 -6.417 4.313 1.00 0.00 C ATOM 1906 O LYS B 421 3.087 -5.247 3.971 1.00 0.00 O ATOM 1907 CB LYS B 421 0.915 -7.812 4.772 1.00 0.00 C ATOM 1908 CG LYS B 421 -0.297 -6.935 4.968 1.00 0.00 C ATOM 1909 CD LYS B 421 -1.182 -6.970 3.738 1.00 0.00 C ATOM 1910 CE LYS B 421 -2.649 -7.104 4.110 1.00 0.00 C ATOM 1911 NZ LYS B 421 -3.243 -5.795 4.501 1.00 0.00 N ATOM 0 H LYS B 421 2.054 -9.276 3.079 1.00 0.00 H new ATOM 0 HA LYS B 421 1.224 -6.679 3.006 1.00 0.00 H new ATOM 0 HB2 LYS B 421 0.595 -8.820 4.510 1.00 0.00 H new ATOM 0 HB3 LYS B 421 1.465 -7.886 5.710 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -0.860 -7.272 5.838 1.00 0.00 H new ATOM 0 HG3 LYS B 421 0.017 -5.911 5.169 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -1.035 -6.060 3.157 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -0.889 -7.805 3.102 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -3.202 -7.516 3.266 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -2.752 -7.810 4.934 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -4.245 -5.928 4.748 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -2.732 -5.413 5.322 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -3.168 -5.128 3.706 1.00 0.00 H new ATOM 1925 N ILE B 422 3.690 -7.041 5.197 1.00 0.00 N ATOM 1926 CA ILE B 422 4.819 -6.366 5.844 1.00 0.00 C ATOM 1927 C ILE B 422 5.614 -5.597 4.795 1.00 0.00 C ATOM 1928 O ILE B 422 6.248 -4.591 5.086 1.00 0.00 O ATOM 1929 CB ILE B 422 5.792 -7.349 6.547 1.00 0.00 C ATOM 1930 CG1 ILE B 422 5.281 -8.791 6.484 1.00 0.00 C ATOM 1931 CG2 ILE B 422 6.025 -6.934 7.990 1.00 0.00 C ATOM 1932 CD1 ILE B 422 5.285 -9.368 5.083 1.00 0.00 C ATOM 0 H ILE B 422 3.558 -8.011 5.484 1.00 0.00 H new ATOM 0 HA ILE B 422 4.395 -5.706 6.601 1.00 0.00 H new ATOM 0 HB ILE B 422 6.741 -7.308 6.012 1.00 0.00 H new ATOM 0 HG12 ILE B 422 5.899 -9.416 7.129 1.00 0.00 H new ATOM 0 HG13 ILE B 422 4.267 -8.827 6.881 1.00 0.00 H new ATOM 0 HG21 ILE B 422 6.710 -7.637 8.465 1.00 0.00 H new ATOM 0 HG22 ILE B 422 6.456 -5.933 8.016 1.00 0.00 H new ATOM 0 HG23 ILE B 422 5.076 -6.934 8.526 1.00 0.00 H new ATOM 0 HD11 ILE B 422 4.911 -10.392 5.110 1.00 0.00 H new ATOM 0 HD12 ILE B 422 4.645 -8.765 4.439 1.00 0.00 H new ATOM 0 HD13 ILE B 422 6.302 -9.363 4.690 1.00 0.00 H new ATOM 1944 N ALA B 423 5.502 -6.050 3.555 1.00 0.00 N ATOM 1945 CA ALA B 423 6.152 -5.379 2.449 1.00 0.00 C ATOM 1946 C ALA B 423 5.406 -4.082 2.167 1.00 0.00 C ATOM 1947 O ALA B 423 6.002 -3.003 2.118 1.00 0.00 O ATOM 1948 CB ALA B 423 6.211 -6.256 1.206 1.00 0.00 C ATOM 0 H ALA B 423 4.967 -6.878 3.294 1.00 0.00 H new ATOM 0 HA ALA B 423 7.185 -5.164 2.722 1.00 0.00 H new ATOM 0 HB1 ALA B 423 6.706 -5.713 0.401 1.00 0.00 H new ATOM 0 HB2 ALA B 423 6.770 -7.165 1.428 1.00 0.00 H new ATOM 0 HB3 ALA B 423 5.199 -6.518 0.897 1.00 0.00 H new ATOM 1954 N GLY B 424 4.087 -4.194 2.006 1.00 0.00 N ATOM 1955 CA GLY B 424 3.282 -3.020 1.748 1.00 0.00 C ATOM 1956 C GLY B 424 3.317 -2.064 2.914 1.00 0.00 C ATOM 1957 O GLY B 424 3.658 -0.888 2.764 1.00 0.00 O ATOM 0 H GLY B 424 3.570 -5.072 2.050 1.00 0.00 H new ATOM 0 HA2 GLY B 424 3.645 -2.517 0.852 1.00 0.00 H new ATOM 0 HA3 GLY B 424 2.252 -3.319 1.551 1.00 0.00 H new ATOM 1961 N ILE B 425 2.976 -2.577 4.087 1.00 0.00 N ATOM 1962 CA ILE B 425 2.976 -1.775 5.292 1.00 0.00 C ATOM 1963 C ILE B 425 4.379 -1.268 5.615 1.00 0.00 C ATOM 1964 O ILE B 425 4.656 -0.075 5.501 1.00 0.00 O ATOM 1965 CB ILE B 425 2.436 -2.571 6.494 1.00 0.00 C ATOM 1966 CG1 ILE B 425 1.225 -3.410 6.078 1.00 0.00 C ATOM 1967 CG2 ILE B 425 2.072 -1.631 7.632 1.00 0.00 C ATOM 1968 CD1 ILE B 425 0.352 -2.743 5.036 1.00 0.00 C ATOM 0 H ILE B 425 2.696 -3.548 4.226 1.00 0.00 H new ATOM 0 HA ILE B 425 2.321 -0.923 5.108 1.00 0.00 H new ATOM 0 HB ILE B 425 3.217 -3.246 6.843 1.00 0.00 H new ATOM 0 HG12 ILE B 425 1.573 -4.367 5.689 1.00 0.00 H new ATOM 0 HG13 ILE B 425 0.622 -3.625 6.961 1.00 0.00 H new ATOM 0 HG21 ILE B 425 1.692 -2.209 8.474 1.00 0.00 H new ATOM 0 HG22 ILE B 425 2.957 -1.076 7.943 1.00 0.00 H new ATOM 0 HG23 ILE B 425 1.306 -0.933 7.296 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -0.485 -3.396 4.791 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -0.027 -1.799 5.429 1.00 0.00 H new ATOM 0 HD13 ILE B 425 0.939 -2.553 4.137 1.00 0.00 H new ATOM 1980 N ARG B 426 5.256 -2.174 6.043 1.00 0.00 N ATOM 1981 CA ARG B 426 6.618 -1.783 6.409 1.00 0.00 C ATOM 1982 C ARG B 426 7.222 -0.862 5.350 1.00 0.00 C ATOM 1983 O ARG B 426 8.064 -0.011 5.654 1.00 0.00 O ATOM 1984 CB ARG B 426 7.503 -3.014 6.676 1.00 0.00 C ATOM 1985 CG ARG B 426 8.452 -3.397 5.547 1.00 0.00 C ATOM 1986 CD ARG B 426 9.899 -3.237 5.975 1.00 0.00 C ATOM 1987 NE ARG B 426 10.160 -3.872 7.265 1.00 0.00 N ATOM 1988 CZ ARG B 426 11.378 -4.087 7.747 1.00 0.00 C ATOM 1989 NH1 ARG B 426 12.444 -3.707 7.057 1.00 0.00 N ATOM 1990 NH2 ARG B 426 11.532 -4.681 8.923 1.00 0.00 N ATOM 0 H ARG B 426 5.054 -3.169 6.144 1.00 0.00 H new ATOM 0 HA ARG B 426 6.570 -1.221 7.342 1.00 0.00 H new ATOM 0 HB2 ARG B 426 8.091 -2.829 7.575 1.00 0.00 H new ATOM 0 HB3 ARG B 426 6.856 -3.865 6.888 1.00 0.00 H new ATOM 0 HG2 ARG B 426 8.269 -4.429 5.248 1.00 0.00 H new ATOM 0 HG3 ARG B 426 8.256 -2.773 4.675 1.00 0.00 H new ATOM 0 HD2 ARG B 426 10.552 -3.672 5.218 1.00 0.00 H new ATOM 0 HD3 ARG B 426 10.144 -2.177 6.036 1.00 0.00 H new ATOM 0 HE ARG B 426 9.361 -4.167 7.827 1.00 0.00 H new ATOM 0 HH11 ARG B 426 12.330 -3.248 6.153 1.00 0.00 H new ATOM 0 HH12 ARG B 426 13.379 -3.873 7.430 1.00 0.00 H new ATOM 0 HH21 ARG B 426 10.714 -4.973 9.458 1.00 0.00 H new ATOM 0 HH22 ARG B 426 12.468 -4.846 9.292 1.00 0.00 H new ATOM 2004 N ALA B 427 6.728 -0.975 4.120 1.00 0.00 N ATOM 2005 CA ALA B 427 7.185 -0.092 3.062 1.00 0.00 C ATOM 2006 C ALA B 427 6.813 1.330 3.448 1.00 0.00 C ATOM 2007 O ALA B 427 7.664 2.221 3.541 1.00 0.00 O ATOM 2008 CB ALA B 427 6.573 -0.470 1.720 1.00 0.00 C ATOM 0 H ALA B 427 6.024 -1.658 3.839 1.00 0.00 H new ATOM 0 HA ALA B 427 8.265 -0.181 2.948 1.00 0.00 H new ATOM 0 HB1 ALA B 427 6.936 0.211 0.950 1.00 0.00 H new ATOM 0 HB2 ALA B 427 6.857 -1.491 1.465 1.00 0.00 H new ATOM 0 HB3 ALA B 427 5.487 -0.401 1.783 1.00 0.00 H new ATOM 2014 N ALA B 428 5.535 1.525 3.725 1.00 0.00 N ATOM 2015 CA ALA B 428 5.053 2.819 4.156 1.00 0.00 C ATOM 2016 C ALA B 428 5.882 3.274 5.354 1.00 0.00 C ATOM 2017 O ALA B 428 6.423 4.393 5.385 1.00 0.00 O ATOM 2018 CB ALA B 428 3.578 2.736 4.512 1.00 0.00 C ATOM 0 H ALA B 428 4.817 0.804 3.658 1.00 0.00 H new ATOM 0 HA ALA B 428 5.158 3.546 3.351 1.00 0.00 H new ATOM 0 HB1 ALA B 428 3.226 3.716 4.835 1.00 0.00 H new ATOM 0 HB2 ALA B 428 3.010 2.416 3.638 1.00 0.00 H new ATOM 0 HB3 ALA B 428 3.438 2.016 5.319 1.00 0.00 H new ATOM 2024 N GLU B 429 5.991 2.380 6.339 1.00 0.00 N ATOM 2025 CA GLU B 429 6.761 2.647 7.545 1.00 0.00 C ATOM 2026 C GLU B 429 8.235 2.891 7.223 1.00 0.00 C ATOM 2027 O GLU B 429 9.004 3.310 8.088 1.00 0.00 O ATOM 2028 CB GLU B 429 6.639 1.481 8.531 1.00 0.00 C ATOM 2029 CG GLU B 429 5.231 0.922 8.658 1.00 0.00 C ATOM 2030 CD GLU B 429 5.129 -0.149 9.726 1.00 0.00 C ATOM 2031 OE1 GLU B 429 6.145 -0.410 10.404 1.00 0.00 O ATOM 2032 OE2 GLU B 429 4.033 -0.725 9.886 1.00 0.00 O ATOM 0 H GLU B 429 5.551 1.460 6.320 1.00 0.00 H new ATOM 0 HA GLU B 429 6.352 3.549 8.000 1.00 0.00 H new ATOM 0 HB2 GLU B 429 7.309 0.681 8.216 1.00 0.00 H new ATOM 0 HB3 GLU B 429 6.977 1.812 9.513 1.00 0.00 H new ATOM 0 HG2 GLU B 429 4.541 1.732 8.893 1.00 0.00 H new ATOM 0 HG3 GLU B 429 4.920 0.506 7.700 1.00 0.00 H new ATOM 2039 N ASN B 430 8.620 2.655 5.969 1.00 0.00 N ATOM 2040 CA ASN B 430 9.997 2.888 5.547 1.00 0.00 C ATOM 2041 C ASN B 430 10.187 4.340 5.118 1.00 0.00 C ATOM 2042 O ASN B 430 11.222 4.946 5.400 1.00 0.00 O ATOM 2043 CB ASN B 430 10.396 1.945 4.408 1.00 0.00 C ATOM 2044 CG ASN B 430 10.441 0.499 4.853 1.00 0.00 C ATOM 2045 OD1 ASN B 430 9.939 -0.394 4.173 1.00 0.00 O ATOM 2046 ND2 ASN B 430 11.046 0.265 6.005 1.00 0.00 N ATOM 0 H ASN B 430 8.003 2.306 5.235 1.00 0.00 H new ATOM 0 HA ASN B 430 10.645 2.684 6.400 1.00 0.00 H new ATOM 0 HB2 ASN B 430 9.687 2.049 3.587 1.00 0.00 H new ATOM 0 HB3 ASN B 430 11.374 2.236 4.023 1.00 0.00 H new ATOM 0 HD21 ASN B 430 11.110 -0.688 6.363 1.00 0.00 H new ATOM 0 HD22 ASN B 430 11.448 1.037 6.536 1.00 0.00 H new ATOM 2053 N ALA B 431 9.191 4.896 4.423 1.00 0.00 N ATOM 2054 CA ALA B 431 9.276 6.272 3.953 1.00 0.00 C ATOM 2055 C ALA B 431 9.171 7.266 5.102 1.00 0.00 C ATOM 2056 O ALA B 431 9.801 8.324 5.074 1.00 0.00 O ATOM 2057 CB ALA B 431 8.205 6.565 2.918 1.00 0.00 C ATOM 0 H ALA B 431 8.325 4.416 4.177 1.00 0.00 H new ATOM 0 HA ALA B 431 10.255 6.388 3.488 1.00 0.00 H new ATOM 0 HB1 ALA B 431 8.293 7.599 2.586 1.00 0.00 H new ATOM 0 HB2 ALA B 431 8.331 5.898 2.065 1.00 0.00 H new ATOM 0 HB3 ALA B 431 7.220 6.408 3.359 1.00 0.00 H new ATOM 2063 N LEU B 432 8.376 6.933 6.114 1.00 0.00 N ATOM 2064 CA LEU B 432 8.217 7.831 7.255 1.00 0.00 C ATOM 2065 C LEU B 432 9.310 7.609 8.292 1.00 0.00 C ATOM 2066 O LEU B 432 9.201 8.060 9.433 1.00 0.00 O ATOM 2067 CB LEU B 432 6.821 7.692 7.888 1.00 0.00 C ATOM 2068 CG LEU B 432 6.518 6.406 8.683 1.00 0.00 C ATOM 2069 CD1 LEU B 432 5.340 5.677 8.060 1.00 0.00 C ATOM 2070 CD2 LEU B 432 7.722 5.477 8.775 1.00 0.00 C ATOM 0 H LEU B 432 7.841 6.066 6.169 1.00 0.00 H new ATOM 0 HA LEU B 432 8.313 8.851 6.882 1.00 0.00 H new ATOM 0 HB2 LEU B 432 6.669 8.541 8.554 1.00 0.00 H new ATOM 0 HB3 LEU B 432 6.082 7.775 7.091 1.00 0.00 H new ATOM 0 HG LEU B 432 6.270 6.707 9.701 1.00 0.00 H new ATOM 0 HD11 LEU B 432 5.132 4.770 8.627 1.00 0.00 H new ATOM 0 HD12 LEU B 432 4.463 6.324 8.075 1.00 0.00 H new ATOM 0 HD13 LEU B 432 5.579 5.414 7.030 1.00 0.00 H new ATOM 0 HD21 LEU B 432 7.453 4.588 9.345 1.00 0.00 H new ATOM 0 HD22 LEU B 432 8.033 5.185 7.772 1.00 0.00 H new ATOM 0 HD23 LEU B 432 8.542 5.993 9.274 1.00 0.00 H new ATOM 2082 N ARG B 433 10.360 6.899 7.892 1.00 0.00 N ATOM 2083 CA ARG B 433 11.469 6.606 8.793 1.00 0.00 C ATOM 2084 C ARG B 433 12.590 7.623 8.634 1.00 0.00 C ATOM 2085 O ARG B 433 13.586 7.578 9.356 1.00 0.00 O ATOM 2086 CB ARG B 433 12.004 5.196 8.537 1.00 0.00 C ATOM 2087 CG ARG B 433 12.751 4.608 9.725 1.00 0.00 C ATOM 2088 CD ARG B 433 13.013 3.123 9.537 1.00 0.00 C ATOM 2089 NE ARG B 433 14.333 2.736 10.025 1.00 0.00 N ATOM 2090 CZ ARG B 433 14.746 1.475 10.105 1.00 0.00 C ATOM 2091 NH1 ARG B 433 13.944 0.488 9.728 1.00 0.00 N ATOM 2092 NH2 ARG B 433 15.960 1.202 10.561 1.00 0.00 N ATOM 0 H ARG B 433 10.466 6.517 6.952 1.00 0.00 H new ATOM 0 HA ARG B 433 11.094 6.666 9.815 1.00 0.00 H new ATOM 0 HB2 ARG B 433 11.172 4.541 8.280 1.00 0.00 H new ATOM 0 HB3 ARG B 433 12.670 5.219 7.674 1.00 0.00 H new ATOM 0 HG2 ARG B 433 13.698 5.132 9.857 1.00 0.00 H new ATOM 0 HG3 ARG B 433 12.171 4.764 10.635 1.00 0.00 H new ATOM 0 HD2 ARG B 433 12.249 2.550 10.063 1.00 0.00 H new ATOM 0 HD3 ARG B 433 12.929 2.871 8.480 1.00 0.00 H new ATOM 0 HE ARG B 433 14.973 3.473 10.321 1.00 0.00 H new ATOM 0 HH11 ARG B 433 13.009 0.696 9.376 1.00 0.00 H new ATOM 0 HH12 ARG B 433 14.262 -0.479 9.790 1.00 0.00 H new ATOM 0 HH21 ARG B 433 16.578 1.960 10.851 1.00 0.00 H new ATOM 0 HH22 ARG B 433 16.276 0.234 10.622 1.00 0.00 H new ATOM 2106 N ASP B 434 12.432 8.538 7.685 1.00 0.00 N ATOM 2107 CA ASP B 434 13.448 9.558 7.444 1.00 0.00 C ATOM 2108 C ASP B 434 12.930 10.949 7.790 1.00 0.00 C ATOM 2109 O ASP B 434 12.655 11.755 6.901 1.00 0.00 O ATOM 2110 CB ASP B 434 13.900 9.519 5.987 1.00 0.00 C ATOM 2111 CG ASP B 434 14.768 8.318 5.680 1.00 0.00 C ATOM 2112 OD1 ASP B 434 15.947 8.316 6.093 1.00 0.00 O ATOM 2113 OD2 ASP B 434 14.272 7.378 5.025 1.00 0.00 O ATOM 0 H ASP B 434 11.617 8.596 7.074 1.00 0.00 H new ATOM 0 HA ASP B 434 14.298 9.342 8.091 1.00 0.00 H new ATOM 0 HB2 ASP B 434 13.024 9.505 5.339 1.00 0.00 H new ATOM 0 HB3 ASP B 434 14.452 10.430 5.757 1.00 0.00 H new ATOM 2118 N LYS B 435 12.802 11.230 9.083 1.00 0.00 N ATOM 2119 CA LYS B 435 12.322 12.530 9.538 1.00 0.00 C ATOM 2120 C LYS B 435 12.946 13.649 8.715 1.00 0.00 C ATOM 2121 O LYS B 435 12.243 14.498 8.169 1.00 0.00 O ATOM 2122 CB LYS B 435 12.642 12.727 11.022 1.00 0.00 C ATOM 2123 CG LYS B 435 14.049 13.244 11.280 1.00 0.00 C ATOM 2124 CD LYS B 435 14.311 13.435 12.765 1.00 0.00 C ATOM 2125 CE LYS B 435 13.601 14.665 13.306 1.00 0.00 C ATOM 2126 NZ LYS B 435 14.408 15.352 14.352 1.00 0.00 N ATOM 0 H LYS B 435 13.024 10.576 9.833 1.00 0.00 H new ATOM 0 HA LYS B 435 11.241 12.562 9.405 1.00 0.00 H new ATOM 0 HB2 LYS B 435 11.923 13.426 11.450 1.00 0.00 H new ATOM 0 HB3 LYS B 435 12.512 11.778 11.542 1.00 0.00 H new ATOM 0 HG2 LYS B 435 14.776 12.543 10.869 1.00 0.00 H new ATOM 0 HG3 LYS B 435 14.190 14.192 10.760 1.00 0.00 H new ATOM 0 HD2 LYS B 435 13.977 12.552 13.310 1.00 0.00 H new ATOM 0 HD3 LYS B 435 15.383 13.529 12.937 1.00 0.00 H new ATOM 0 HE2 LYS B 435 13.399 15.358 12.489 1.00 0.00 H new ATOM 0 HE3 LYS B 435 12.637 14.375 13.723 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 13.891 16.186 14.697 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 14.579 14.699 15.143 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 15.318 15.652 13.947 1.00 0.00 H new ATOM 2140 N LYS B 436 14.270 13.640 8.626 1.00 0.00 N ATOM 2141 CA LYS B 436 14.988 14.652 7.865 1.00 0.00 C ATOM 2142 C LYS B 436 14.482 14.688 6.429 1.00 0.00 C ATOM 2143 O LYS B 436 14.228 15.757 5.874 1.00 0.00 O ATOM 2144 CB LYS B 436 16.487 14.365 7.890 1.00 0.00 C ATOM 2145 CG LYS B 436 17.059 14.303 9.296 1.00 0.00 C ATOM 2146 CD LYS B 436 18.298 13.428 9.353 1.00 0.00 C ATOM 2147 CE LYS B 436 19.529 14.242 9.712 1.00 0.00 C ATOM 2148 NZ LYS B 436 19.757 14.285 11.183 1.00 0.00 N ATOM 0 H LYS B 436 14.867 12.943 9.071 1.00 0.00 H new ATOM 0 HA LYS B 436 14.811 15.625 8.322 1.00 0.00 H new ATOM 0 HB2 LYS B 436 16.678 13.418 7.385 1.00 0.00 H new ATOM 0 HB3 LYS B 436 17.008 15.138 7.326 1.00 0.00 H new ATOM 0 HG2 LYS B 436 17.307 15.309 9.634 1.00 0.00 H new ATOM 0 HG3 LYS B 436 16.305 13.913 9.980 1.00 0.00 H new ATOM 0 HD2 LYS B 436 18.154 12.637 10.089 1.00 0.00 H new ATOM 0 HD3 LYS B 436 18.448 12.942 8.389 1.00 0.00 H new ATOM 0 HE2 LYS B 436 20.403 13.814 9.222 1.00 0.00 H new ATOM 0 HE3 LYS B 436 19.416 15.257 9.332 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 20.606 14.850 11.386 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 18.934 14.717 11.649 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 19.890 13.318 11.542 1.00 0.00 H new ATOM 2162 N MET B 437 14.324 13.508 5.839 1.00 0.00 N ATOM 2163 CA MET B 437 13.833 13.399 4.473 1.00 0.00 C ATOM 2164 C MET B 437 12.392 13.885 4.395 1.00 0.00 C ATOM 2165 O MET B 437 12.056 14.745 3.581 1.00 0.00 O ATOM 2166 CB MET B 437 13.920 11.949 3.995 1.00 0.00 C ATOM 2167 CG MET B 437 13.444 11.748 2.567 1.00 0.00 C ATOM 2168 SD MET B 437 11.665 11.481 2.460 1.00 0.00 S ATOM 2169 CE MET B 437 11.490 9.971 3.407 1.00 0.00 C ATOM 0 H MET B 437 14.529 12.615 6.286 1.00 0.00 H new ATOM 0 HA MET B 437 14.453 14.021 3.828 1.00 0.00 H new ATOM 0 HB2 MET B 437 14.953 11.610 4.075 1.00 0.00 H new ATOM 0 HB3 MET B 437 13.326 11.321 4.659 1.00 0.00 H new ATOM 0 HG2 MET B 437 13.713 12.621 1.972 1.00 0.00 H new ATOM 0 HG3 MET B 437 13.963 10.894 2.132 1.00 0.00 H new ATOM 0 HE1 MET B 437 10.574 9.460 3.111 1.00 0.00 H new ATOM 0 HE2 MET B 437 12.345 9.322 3.218 1.00 0.00 H new ATOM 0 HE3 MET B 437 11.444 10.211 4.469 1.00 0.00 H new ATOM 2179 N LEU B 438 11.549 13.337 5.261 1.00 0.00 N ATOM 2180 CA LEU B 438 10.144 13.714 5.314 1.00 0.00 C ATOM 2181 C LEU B 438 9.999 15.221 5.464 1.00 0.00 C ATOM 2182 O LEU B 438 9.496 15.906 4.574 1.00 0.00 O ATOM 2183 CB LEU B 438 9.468 13.029 6.499 1.00 0.00 C ATOM 2184 CG LEU B 438 9.514 11.500 6.491 1.00 0.00 C ATOM 2185 CD1 LEU B 438 9.240 10.962 7.885 1.00 0.00 C ATOM 2186 CD2 LEU B 438 8.513 10.939 5.493 1.00 0.00 C ATOM 0 H LEU B 438 11.817 12.625 5.940 1.00 0.00 H new ATOM 0 HA LEU B 438 9.670 13.400 4.384 1.00 0.00 H new ATOM 0 HB2 LEU B 438 9.936 13.384 7.417 1.00 0.00 H new ATOM 0 HB3 LEU B 438 8.425 13.343 6.531 1.00 0.00 H new ATOM 0 HG LEU B 438 10.511 11.183 6.185 1.00 0.00 H new ATOM 0 HD11 LEU B 438 9.275 9.873 7.868 1.00 0.00 H new ATOM 0 HD12 LEU B 438 9.995 11.339 8.575 1.00 0.00 H new ATOM 0 HD13 LEU B 438 8.253 11.288 8.213 1.00 0.00 H new ATOM 0 HD21 LEU B 438 8.561 9.850 5.502 1.00 0.00 H new ATOM 0 HD22 LEU B 438 7.508 11.260 5.766 1.00 0.00 H new ATOM 0 HD23 LEU B 438 8.752 11.304 4.494 1.00 0.00 H new ATOM 2198 N ASP B 439 10.455 15.722 6.604 1.00 0.00 N ATOM 2199 CA ASP B 439 10.393 17.145 6.897 1.00 0.00 C ATOM 2200 C ASP B 439 10.878 17.962 5.707 1.00 0.00 C ATOM 2201 O ASP B 439 10.218 18.910 5.284 1.00 0.00 O ATOM 2202 CB ASP B 439 11.236 17.474 8.130 1.00 0.00 C ATOM 2203 CG ASP B 439 11.132 18.935 8.524 1.00 0.00 C ATOM 2204 OD1 ASP B 439 10.061 19.340 9.020 1.00 0.00 O ATOM 2205 OD2 ASP B 439 12.123 19.673 8.335 1.00 0.00 O ATOM 0 H ASP B 439 10.874 15.159 7.344 1.00 0.00 H new ATOM 0 HA ASP B 439 9.353 17.404 7.098 1.00 0.00 H new ATOM 0 HB2 ASP B 439 10.914 16.851 8.964 1.00 0.00 H new ATOM 0 HB3 ASP B 439 12.279 17.227 7.931 1.00 0.00 H new ATOM 2210 N PHE B 440 12.036 17.591 5.169 1.00 0.00 N ATOM 2211 CA PHE B 440 12.594 18.300 4.029 1.00 0.00 C ATOM 2212 C PHE B 440 11.517 18.476 2.967 1.00 0.00 C ATOM 2213 O PHE B 440 11.378 19.541 2.359 1.00 0.00 O ATOM 2214 CB PHE B 440 13.808 17.536 3.474 1.00 0.00 C ATOM 2215 CG PHE B 440 13.850 17.419 1.973 1.00 0.00 C ATOM 2216 CD1 PHE B 440 13.784 18.548 1.173 1.00 0.00 C ATOM 2217 CD2 PHE B 440 13.957 16.178 1.369 1.00 0.00 C ATOM 2218 CE1 PHE B 440 13.823 18.440 -0.206 1.00 0.00 C ATOM 2219 CE2 PHE B 440 13.997 16.063 -0.007 1.00 0.00 C ATOM 2220 CZ PHE B 440 13.929 17.195 -0.795 1.00 0.00 C ATOM 0 H PHE B 440 12.600 16.810 5.503 1.00 0.00 H new ATOM 0 HA PHE B 440 12.937 19.287 4.340 1.00 0.00 H new ATOM 0 HB2 PHE B 440 14.717 18.034 3.811 1.00 0.00 H new ATOM 0 HB3 PHE B 440 13.816 16.534 3.903 1.00 0.00 H new ATOM 0 HD1 PHE B 440 13.701 19.523 1.630 1.00 0.00 H new ATOM 0 HD2 PHE B 440 14.010 15.289 1.981 1.00 0.00 H new ATOM 0 HE1 PHE B 440 13.771 19.327 -0.820 1.00 0.00 H new ATOM 0 HE2 PHE B 440 14.081 15.089 -0.466 1.00 0.00 H new ATOM 0 HZ PHE B 440 13.959 17.107 -1.871 1.00 0.00 H new ATOM 2230 N TYR B 441 10.750 17.416 2.762 1.00 0.00 N ATOM 2231 CA TYR B 441 9.678 17.432 1.788 1.00 0.00 C ATOM 2232 C TYR B 441 8.508 18.265 2.274 1.00 0.00 C ATOM 2233 O TYR B 441 7.898 18.983 1.490 1.00 0.00 O ATOM 2234 CB TYR B 441 9.243 16.010 1.473 1.00 0.00 C ATOM 2235 CG TYR B 441 10.217 15.323 0.560 1.00 0.00 C ATOM 2236 CD1 TYR B 441 10.367 15.739 -0.754 1.00 0.00 C ATOM 2237 CD2 TYR B 441 11.012 14.288 1.019 1.00 0.00 C ATOM 2238 CE1 TYR B 441 11.279 15.136 -1.590 1.00 0.00 C ATOM 2239 CE2 TYR B 441 11.931 13.682 0.195 1.00 0.00 C ATOM 2240 CZ TYR B 441 12.063 14.107 -1.113 1.00 0.00 C ATOM 2241 OH TYR B 441 12.981 13.503 -1.941 1.00 0.00 O ATOM 0 H TYR B 441 10.854 16.532 3.261 1.00 0.00 H new ATOM 0 HA TYR B 441 10.048 17.895 0.873 1.00 0.00 H new ATOM 0 HB2 TYR B 441 9.151 15.444 2.400 1.00 0.00 H new ATOM 0 HB3 TYR B 441 8.257 16.025 1.009 1.00 0.00 H new ATOM 0 HD1 TYR B 441 9.758 16.549 -1.128 1.00 0.00 H new ATOM 0 HD2 TYR B 441 10.909 13.951 2.040 1.00 0.00 H new ATOM 0 HE1 TYR B 441 11.380 15.467 -2.613 1.00 0.00 H new ATOM 0 HE2 TYR B 441 12.547 12.877 0.569 1.00 0.00 H new ATOM 0 HH TYR B 441 13.301 14.151 -2.603 1.00 0.00 H new ATOM 2251 N ALA B 442 8.202 18.205 3.566 1.00 0.00 N ATOM 2252 CA ALA B 442 7.113 19.006 4.102 1.00 0.00 C ATOM 2253 C ALA B 442 7.315 20.451 3.681 1.00 0.00 C ATOM 2254 O ALA B 442 6.480 21.029 2.985 1.00 0.00 O ATOM 2255 CB ALA B 442 7.037 18.897 5.618 1.00 0.00 C ATOM 0 H ALA B 442 8.684 17.621 4.249 1.00 0.00 H new ATOM 0 HA ALA B 442 6.169 18.633 3.705 1.00 0.00 H new ATOM 0 HB1 ALA B 442 6.212 19.508 5.986 1.00 0.00 H new ATOM 0 HB2 ALA B 442 6.872 17.857 5.900 1.00 0.00 H new ATOM 0 HB3 ALA B 442 7.972 19.248 6.055 1.00 0.00 H new ATOM 2261 N LYS B 443 8.448 21.020 4.081 1.00 0.00 N ATOM 2262 CA LYS B 443 8.771 22.386 3.710 1.00 0.00 C ATOM 2263 C LYS B 443 8.566 22.547 2.211 1.00 0.00 C ATOM 2264 O LYS B 443 7.955 23.512 1.754 1.00 0.00 O ATOM 2265 CB LYS B 443 10.215 22.720 4.090 1.00 0.00 C ATOM 2266 CG LYS B 443 10.808 23.860 3.282 1.00 0.00 C ATOM 2267 CD LYS B 443 12.041 24.441 3.958 1.00 0.00 C ATOM 2268 CE LYS B 443 11.670 25.502 4.982 1.00 0.00 C ATOM 2269 NZ LYS B 443 12.680 25.599 6.071 1.00 0.00 N ATOM 0 H LYS B 443 9.151 20.557 4.658 1.00 0.00 H new ATOM 0 HA LYS B 443 8.117 23.074 4.247 1.00 0.00 H new ATOM 0 HB2 LYS B 443 10.253 22.978 5.148 1.00 0.00 H new ATOM 0 HB3 LYS B 443 10.832 21.831 3.956 1.00 0.00 H new ATOM 0 HG2 LYS B 443 11.072 23.503 2.287 1.00 0.00 H new ATOM 0 HG3 LYS B 443 10.060 24.643 3.152 1.00 0.00 H new ATOM 0 HD2 LYS B 443 12.599 23.642 4.447 1.00 0.00 H new ATOM 0 HD3 LYS B 443 12.699 24.875 3.205 1.00 0.00 H new ATOM 0 HE2 LYS B 443 11.577 26.468 4.486 1.00 0.00 H new ATOM 0 HE3 LYS B 443 10.695 25.268 5.410 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 12.391 26.333 6.748 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 12.751 24.684 6.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 13.605 25.847 5.666 1.00 0.00 H new ATOM 2283 N GLN B 444 9.062 21.569 1.454 1.00 0.00 N ATOM 2284 CA GLN B 444 8.916 21.569 0.008 1.00 0.00 C ATOM 2285 C GLN B 444 7.442 21.711 -0.370 1.00 0.00 C ATOM 2286 O GLN B 444 7.076 22.541 -1.202 1.00 0.00 O ATOM 2287 CB GLN B 444 9.492 20.266 -0.558 1.00 0.00 C ATOM 2288 CG GLN B 444 10.925 20.392 -1.043 1.00 0.00 C ATOM 2289 CD GLN B 444 11.052 20.107 -2.521 1.00 0.00 C ATOM 2290 OE1 GLN B 444 12.052 19.558 -2.981 1.00 0.00 O ATOM 2291 NE2 GLN B 444 10.027 20.483 -3.271 1.00 0.00 N ATOM 0 H GLN B 444 9.570 20.766 1.825 1.00 0.00 H new ATOM 0 HA GLN B 444 9.461 22.414 -0.414 1.00 0.00 H new ATOM 0 HB2 GLN B 444 9.444 19.494 0.210 1.00 0.00 H new ATOM 0 HB3 GLN B 444 8.866 19.931 -1.385 1.00 0.00 H new ATOM 0 HG2 GLN B 444 11.290 21.398 -0.836 1.00 0.00 H new ATOM 0 HG3 GLN B 444 11.558 19.702 -0.485 1.00 0.00 H new ATOM 0 HE21 GLN B 444 9.220 20.935 -2.842 1.00 0.00 H new ATOM 0 HE22 GLN B 444 10.045 20.320 -4.278 1.00 0.00 H new ATOM 2300 N ARG B 445 6.604 20.890 0.258 1.00 0.00 N ATOM 2301 CA ARG B 445 5.167 20.902 0.014 1.00 0.00 C ATOM 2302 C ARG B 445 4.576 22.280 0.291 1.00 0.00 C ATOM 2303 O ARG B 445 3.564 22.662 -0.295 1.00 0.00 O ATOM 2304 CB ARG B 445 4.476 19.856 0.893 1.00 0.00 C ATOM 2305 CG ARG B 445 3.783 18.754 0.109 1.00 0.00 C ATOM 2306 CD ARG B 445 2.469 19.235 -0.490 1.00 0.00 C ATOM 2307 NE ARG B 445 1.366 19.127 0.462 1.00 0.00 N ATOM 2308 CZ ARG B 445 0.238 19.824 0.366 1.00 0.00 C ATOM 2309 NH1 ARG B 445 0.059 20.666 -0.641 1.00 0.00 N ATOM 2310 NH2 ARG B 445 -0.713 19.675 1.278 1.00 0.00 N ATOM 0 H ARG B 445 6.902 20.200 0.948 1.00 0.00 H new ATOM 0 HA ARG B 445 5.000 20.661 -1.036 1.00 0.00 H new ATOM 0 HB2 ARG B 445 5.216 19.407 1.556 1.00 0.00 H new ATOM 0 HB3 ARG B 445 3.742 20.355 1.526 1.00 0.00 H new ATOM 0 HG2 ARG B 445 4.440 18.404 -0.687 1.00 0.00 H new ATOM 0 HG3 ARG B 445 3.595 17.903 0.764 1.00 0.00 H new ATOM 0 HD2 ARG B 445 2.573 20.272 -0.809 1.00 0.00 H new ATOM 0 HD3 ARG B 445 2.239 18.649 -1.380 1.00 0.00 H new ATOM 0 HE ARG B 445 1.467 18.480 1.244 1.00 0.00 H new ATOM 0 HH11 ARG B 445 0.788 20.781 -1.345 1.00 0.00 H new ATOM 0 HH12 ARG B 445 -0.808 21.199 -0.712 1.00 0.00 H new ATOM 0 HH21 ARG B 445 -0.579 19.026 2.053 1.00 0.00 H new ATOM 0 HH22 ARG B 445 -1.578 20.210 1.204 1.00 0.00 H new ATOM 2324 N ALA B 446 5.212 23.026 1.187 1.00 0.00 N ATOM 2325 CA ALA B 446 4.744 24.362 1.528 1.00 0.00 C ATOM 2326 C ALA B 446 5.076 25.345 0.412 1.00 0.00 C ATOM 2327 O ALA B 446 4.263 26.201 0.058 1.00 0.00 O ATOM 2328 CB ALA B 446 5.346 24.831 2.844 1.00 0.00 C ATOM 0 H ALA B 446 6.049 22.729 1.688 1.00 0.00 H new ATOM 0 HA ALA B 446 3.661 24.320 1.646 1.00 0.00 H new ATOM 0 HB1 ALA B 446 4.980 25.831 3.075 1.00 0.00 H new ATOM 0 HB2 ALA B 446 5.057 24.146 3.641 1.00 0.00 H new ATOM 0 HB3 ALA B 446 6.433 24.852 2.760 1.00 0.00 H new ATOM 2334 N ALA B 447 6.279 25.216 -0.136 1.00 0.00 N ATOM 2335 CA ALA B 447 6.730 26.088 -1.211 1.00 0.00 C ATOM 2336 C ALA B 447 5.981 25.796 -2.506 1.00 0.00 C ATOM 2337 O ALA B 447 5.058 26.524 -2.871 1.00 0.00 O ATOM 2338 CB ALA B 447 8.229 25.945 -1.430 1.00 0.00 C ATOM 0 H ALA B 447 6.961 24.513 0.149 1.00 0.00 H new ATOM 0 HA ALA B 447 6.516 27.115 -0.915 1.00 0.00 H new ATOM 0 HB1 ALA B 447 8.543 26.606 -2.238 1.00 0.00 H new ATOM 0 HB2 ALA B 447 8.758 26.213 -0.515 1.00 0.00 H new ATOM 0 HB3 ALA B 447 8.461 24.913 -1.694 1.00 0.00 H new