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 Single : B 368 MET CE :methyl -146:sc= -10.5! (180deg=-14.8!) USER MOD Single : B 369 ASN : amide:sc= -3.9! K(o=-3.9!,f=-2.9) USER MOD Single : B 371 LYS NZ :NH3+ -120:sc= -0.0184 (180deg=-0.0749) USER MOD Single : B 373 GLN : amide:sc= -13.2! C(o=-13!,f=-14!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 180:sc= 0 USER MOD Single : B 380 TYR OH : rot 180:sc= -0.41 USER MOD Single : B 382 SER OG : rot 180:sc= -0.404 USER MOD Single : B 386 HIS : no HD1:sc= -0.0448 X(o=-0.045,f=0) USER MOD Single : B 387 TYR OH : rot -9:sc= -9.53! 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 -140:sc= -0.815 USER MOD Single : B 399 ASN : amide:sc= -2.41! K(o=-2.4!,f=-1.7) USER MOD Single : B 400 SER OG : rot 57:sc= -1.36! USER MOD Single : B 404 CYS SG : rot 179:sc= -2.43 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 53:sc= -0.87 USER MOD Single : B 419 ASN : amide:sc= -5.74! C(o=-5.7!,f=-11!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -5.71! C(o=-5.7!,f=-14!) 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 178:sc= -3.87! (180deg=-3.91!) USER MOD Single : B 441 TYR OH : rot 159:sc= -3.23! USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN : amide:sc= -0.846 K(o=-0.85,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1050 N LEU B 366 -1.645 0.276 10.689 1.00 0.00 N ATOM 1051 CA LEU B 366 -0.710 1.394 10.598 1.00 0.00 C ATOM 1052 C LEU B 366 -0.524 1.847 9.151 1.00 0.00 C ATOM 1053 O LEU B 366 -0.087 2.969 8.891 1.00 0.00 O ATOM 1054 CB LEU B 366 0.640 0.997 11.194 1.00 0.00 C ATOM 1055 CG LEU B 366 1.271 2.032 12.129 1.00 0.00 C ATOM 1056 CD1 LEU B 366 0.217 2.656 13.028 1.00 0.00 C ATOM 1057 CD2 LEU B 366 2.372 1.392 12.960 1.00 0.00 C ATOM 0 HA LEU B 366 -1.127 2.227 11.164 1.00 0.00 H new ATOM 0 HB2 LEU B 366 0.516 0.063 11.743 1.00 0.00 H new ATOM 0 HB3 LEU B 366 1.334 0.797 10.378 1.00 0.00 H new ATOM 0 HG LEU B 366 1.711 2.823 11.521 1.00 0.00 H new ATOM 0 HD11 LEU B 366 0.686 3.389 13.685 1.00 0.00 H new ATOM 0 HD12 LEU B 366 -0.538 3.149 12.416 1.00 0.00 H new ATOM 0 HD13 LEU B 366 -0.254 1.879 13.630 1.00 0.00 H new ATOM 0 HD21 LEU B 366 2.811 2.140 13.620 1.00 0.00 H new ATOM 0 HD22 LEU B 366 1.953 0.582 13.557 1.00 0.00 H new ATOM 0 HD23 LEU B 366 3.142 0.994 12.299 1.00 0.00 H new ATOM 1069 N ASP B 367 -0.867 0.969 8.215 1.00 0.00 N ATOM 1070 CA ASP B 367 -0.747 1.279 6.794 1.00 0.00 C ATOM 1071 C ASP B 367 -1.304 2.673 6.505 1.00 0.00 C ATOM 1072 O ASP B 367 -0.556 3.605 6.203 1.00 0.00 O ATOM 1073 CB ASP B 367 -1.485 0.235 5.945 1.00 0.00 C ATOM 1074 CG ASP B 367 -1.472 -1.151 6.565 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -1.706 -1.259 7.787 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -1.234 -2.129 5.826 1.00 0.00 O ATOM 0 H ASP B 367 -1.230 0.037 8.414 1.00 0.00 H new ATOM 0 HA ASP B 367 0.310 1.257 6.530 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -2.518 0.554 5.804 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -1.027 0.189 4.957 1.00 0.00 H new ATOM 1081 N MET B 368 -2.629 2.795 6.571 1.00 0.00 N ATOM 1082 CA MET B 368 -3.297 4.064 6.300 1.00 0.00 C ATOM 1083 C MET B 368 -2.500 5.237 6.864 1.00 0.00 C ATOM 1084 O MET B 368 -2.460 6.313 6.268 1.00 0.00 O ATOM 1085 CB MET B 368 -4.726 4.056 6.864 1.00 0.00 C ATOM 1086 CG MET B 368 -4.887 4.775 8.201 1.00 0.00 C ATOM 1087 SD MET B 368 -4.251 3.818 9.590 1.00 0.00 S ATOM 1088 CE MET B 368 -3.419 5.091 10.537 1.00 0.00 C ATOM 0 H MET B 368 -3.260 2.030 6.810 1.00 0.00 H new ATOM 0 HA MET B 368 -3.355 4.188 5.219 1.00 0.00 H new ATOM 0 HB2 MET B 368 -5.392 4.518 6.136 1.00 0.00 H new ATOM 0 HB3 MET B 368 -5.050 3.022 6.981 1.00 0.00 H new ATOM 0 HG2 MET B 368 -4.369 5.733 8.158 1.00 0.00 H new ATOM 0 HG3 MET B 368 -5.942 4.991 8.367 1.00 0.00 H new ATOM 0 HE1 MET B 368 -2.537 4.669 11.018 1.00 0.00 H new ATOM 0 HE2 MET B 368 -3.117 5.900 9.872 1.00 0.00 H new ATOM 0 HE3 MET B 368 -4.096 5.480 11.298 1.00 0.00 H new ATOM 1098 N ASN B 369 -1.863 5.024 8.011 1.00 0.00 N ATOM 1099 CA ASN B 369 -1.068 6.067 8.641 1.00 0.00 C ATOM 1100 C ASN B 369 0.162 6.369 7.789 1.00 0.00 C ATOM 1101 O ASN B 369 0.542 7.528 7.610 1.00 0.00 O ATOM 1102 CB ASN B 369 -0.702 5.651 10.073 1.00 0.00 C ATOM 1103 CG ASN B 369 0.776 5.668 10.328 1.00 0.00 C ATOM 1104 OD1 ASN B 369 1.288 6.478 11.101 1.00 0.00 O ATOM 1105 ND2 ASN B 369 1.464 4.765 9.669 1.00 0.00 N ATOM 0 H ASN B 369 -1.883 4.141 8.520 1.00 0.00 H new ATOM 0 HA ASN B 369 -1.648 6.987 8.709 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -1.194 6.321 10.777 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -1.087 4.649 10.264 1.00 0.00 H new ATOM 0 HD21 ASN B 369 2.476 4.710 9.785 1.00 0.00 H new ATOM 0 HD22 ASN B 369 0.987 4.118 9.041 1.00 0.00 H new ATOM 1112 N ALA B 370 0.757 5.323 7.230 1.00 0.00 N ATOM 1113 CA ALA B 370 1.910 5.491 6.367 1.00 0.00 C ATOM 1114 C ALA B 370 1.499 6.311 5.157 1.00 0.00 C ATOM 1115 O ALA B 370 1.898 7.465 5.010 1.00 0.00 O ATOM 1116 CB ALA B 370 2.475 4.147 5.935 1.00 0.00 C ATOM 0 H ALA B 370 0.459 4.356 7.360 1.00 0.00 H new ATOM 0 HA ALA B 370 2.695 6.011 6.916 1.00 0.00 H new ATOM 0 HB1 ALA B 370 3.338 4.306 5.289 1.00 0.00 H new ATOM 0 HB2 ALA B 370 2.780 3.581 6.815 1.00 0.00 H new ATOM 0 HB3 ALA B 370 1.712 3.590 5.391 1.00 0.00 H new ATOM 1122 N LYS B 371 0.688 5.706 4.293 1.00 0.00 N ATOM 1123 CA LYS B 371 0.210 6.392 3.094 1.00 0.00 C ATOM 1124 C LYS B 371 -0.062 7.862 3.403 1.00 0.00 C ATOM 1125 O LYS B 371 0.321 8.752 2.642 1.00 0.00 O ATOM 1126 CB LYS B 371 -1.069 5.738 2.544 1.00 0.00 C ATOM 1127 CG LYS B 371 -1.438 4.410 3.195 1.00 0.00 C ATOM 1128 CD LYS B 371 -2.825 3.945 2.773 1.00 0.00 C ATOM 1129 CE LYS B 371 -3.215 2.642 3.454 1.00 0.00 C ATOM 1130 NZ LYS B 371 -4.685 2.545 3.669 1.00 0.00 N ATOM 0 H LYS B 371 0.350 4.750 4.398 1.00 0.00 H new ATOM 0 HA LYS B 371 0.989 6.314 2.335 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -1.899 6.432 2.672 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -0.948 5.580 1.472 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -0.702 3.654 2.923 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -1.403 4.514 4.279 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -3.556 4.716 3.016 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -2.850 3.812 1.691 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -2.881 1.801 2.846 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -2.702 2.566 4.413 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -4.882 2.453 4.686 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -5.147 3.402 3.303 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -5.055 1.712 3.168 1.00 0.00 H new ATOM 1144 N ARG B 372 -0.723 8.105 4.533 1.00 0.00 N ATOM 1145 CA ARG B 372 -1.049 9.461 4.960 1.00 0.00 C ATOM 1146 C ARG B 372 0.209 10.317 5.060 1.00 0.00 C ATOM 1147 O ARG B 372 0.211 11.482 4.672 1.00 0.00 O ATOM 1148 CB ARG B 372 -1.764 9.429 6.314 1.00 0.00 C ATOM 1149 CG ARG B 372 -2.925 10.406 6.419 1.00 0.00 C ATOM 1150 CD ARG B 372 -2.449 11.807 6.771 1.00 0.00 C ATOM 1151 NE ARG B 372 -1.761 11.849 8.059 1.00 0.00 N ATOM 1152 CZ ARG B 372 -1.069 12.900 8.489 1.00 0.00 C ATOM 1153 NH1 ARG B 372 -0.983 13.991 7.739 1.00 0.00 N ATOM 1154 NH2 ARG B 372 -0.464 12.862 9.668 1.00 0.00 N ATOM 0 H ARG B 372 -1.044 7.376 5.171 1.00 0.00 H new ATOM 0 HA ARG B 372 -1.709 9.903 4.214 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -2.133 8.420 6.495 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -1.043 9.651 7.101 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -3.466 10.432 5.473 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -3.626 10.058 7.178 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -1.778 12.168 5.991 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -3.303 12.484 6.795 1.00 0.00 H new ATOM 0 HE ARG B 372 -1.814 11.028 8.661 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -1.448 14.024 6.832 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -0.452 14.797 8.070 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -0.529 12.025 10.248 1.00 0.00 H new ATOM 0 HH22 ARG B 372 0.066 13.670 9.995 1.00 0.00 H new ATOM 1168 N GLN B 373 1.278 9.729 5.579 1.00 0.00 N ATOM 1169 CA GLN B 373 2.540 10.443 5.724 1.00 0.00 C ATOM 1170 C GLN B 373 3.116 10.831 4.365 1.00 0.00 C ATOM 1171 O GLN B 373 3.538 11.968 4.155 1.00 0.00 O ATOM 1172 CB GLN B 373 3.558 9.585 6.483 1.00 0.00 C ATOM 1173 CG GLN B 373 4.507 10.396 7.353 1.00 0.00 C ATOM 1174 CD GLN B 373 5.292 11.427 6.562 1.00 0.00 C ATOM 1175 OE1 GLN B 373 5.624 12.496 7.073 1.00 0.00 O ATOM 1176 NE2 GLN B 373 5.592 11.111 5.308 1.00 0.00 N ATOM 0 H GLN B 373 1.297 8.763 5.906 1.00 0.00 H new ATOM 0 HA GLN B 373 2.339 11.353 6.290 1.00 0.00 H new ATOM 0 HB2 GLN B 373 3.024 8.871 7.110 1.00 0.00 H new ATOM 0 HB3 GLN B 373 4.140 9.006 5.766 1.00 0.00 H new ATOM 0 HG2 GLN B 373 3.937 10.900 8.133 1.00 0.00 H new ATOM 0 HG3 GLN B 373 5.202 9.721 7.852 1.00 0.00 H new ATOM 0 HE21 GLN B 373 5.297 10.213 4.924 1.00 0.00 H new ATOM 0 HE22 GLN B 373 6.117 11.766 4.729 1.00 0.00 H new ATOM 1185 N LEU B 374 3.156 9.860 3.461 1.00 0.00 N ATOM 1186 CA LEU B 374 3.715 10.055 2.123 1.00 0.00 C ATOM 1187 C LEU B 374 3.008 11.140 1.317 1.00 0.00 C ATOM 1188 O LEU B 374 3.590 12.186 1.030 1.00 0.00 O ATOM 1189 CB LEU B 374 3.665 8.742 1.340 1.00 0.00 C ATOM 1190 CG LEU B 374 3.689 7.480 2.197 1.00 0.00 C ATOM 1191 CD1 LEU B 374 3.964 6.258 1.340 1.00 0.00 C ATOM 1192 CD2 LEU B 374 4.730 7.621 3.296 1.00 0.00 C ATOM 0 H LEU B 374 2.804 8.918 3.631 1.00 0.00 H new ATOM 0 HA LEU B 374 4.744 10.383 2.270 1.00 0.00 H new ATOM 0 HB2 LEU B 374 2.760 8.733 0.732 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.511 8.713 0.653 1.00 0.00 H new ATOM 0 HG LEU B 374 2.712 7.348 2.661 1.00 0.00 H new ATOM 0 HD11 LEU B 374 3.977 5.368 1.969 1.00 0.00 H new ATOM 0 HD12 LEU B 374 3.182 6.158 0.587 1.00 0.00 H new ATOM 0 HD13 LEU B 374 4.930 6.369 0.848 1.00 0.00 H new ATOM 0 HD21 LEU B 374 4.742 6.717 3.904 1.00 0.00 H new ATOM 0 HD22 LEU B 374 5.713 7.771 2.849 1.00 0.00 H new ATOM 0 HD23 LEU B 374 4.483 8.477 3.924 1.00 0.00 H new ATOM 1204 N TYR B 375 1.776 10.867 0.905 1.00 0.00 N ATOM 1205 CA TYR B 375 1.028 11.807 0.076 1.00 0.00 C ATOM 1206 C TYR B 375 0.550 13.037 0.841 1.00 0.00 C ATOM 1207 O TYR B 375 0.485 14.130 0.279 1.00 0.00 O ATOM 1208 CB TYR B 375 -0.156 11.103 -0.584 1.00 0.00 C ATOM 1209 CG TYR B 375 0.205 10.452 -1.898 1.00 0.00 C ATOM 1210 CD1 TYR B 375 1.310 9.618 -1.996 1.00 0.00 C ATOM 1211 CD2 TYR B 375 -0.553 10.675 -3.041 1.00 0.00 C ATOM 1212 CE1 TYR B 375 1.651 9.022 -3.194 1.00 0.00 C ATOM 1213 CE2 TYR B 375 -0.220 10.081 -4.244 1.00 0.00 C ATOM 1214 CZ TYR B 375 0.883 9.257 -4.315 1.00 0.00 C ATOM 1215 OH TYR B 375 1.220 8.665 -5.510 1.00 0.00 O ATOM 0 H TYR B 375 1.275 10.007 1.129 1.00 0.00 H new ATOM 0 HA TYR B 375 1.718 12.165 -0.688 1.00 0.00 H new ATOM 0 HB2 TYR B 375 -0.547 10.346 0.096 1.00 0.00 H new ATOM 0 HB3 TYR B 375 -0.955 11.825 -0.750 1.00 0.00 H new ATOM 0 HD1 TYR B 375 1.914 9.432 -1.120 1.00 0.00 H new ATOM 0 HD2 TYR B 375 -1.416 11.323 -2.989 1.00 0.00 H new ATOM 0 HE1 TYR B 375 2.514 8.376 -3.253 1.00 0.00 H new ATOM 0 HE2 TYR B 375 -0.821 10.261 -5.123 1.00 0.00 H new ATOM 0 HH TYR B 375 0.577 8.932 -6.200 1.00 0.00 H new ATOM 1225 N SER B 376 0.203 12.868 2.109 1.00 0.00 N ATOM 1226 CA SER B 376 -0.279 13.992 2.906 1.00 0.00 C ATOM 1227 C SER B 376 0.876 14.804 3.487 1.00 0.00 C ATOM 1228 O SER B 376 0.943 16.019 3.306 1.00 0.00 O ATOM 1229 CB SER B 376 -1.194 13.500 4.028 1.00 0.00 C ATOM 1230 OG SER B 376 -2.284 14.384 4.224 1.00 0.00 O ATOM 0 H SER B 376 0.244 11.977 2.605 1.00 0.00 H new ATOM 0 HA SER B 376 -0.848 14.644 2.244 1.00 0.00 H new ATOM 0 HB2 SER B 376 -1.568 12.505 3.786 1.00 0.00 H new ATOM 0 HB3 SER B 376 -0.624 13.410 4.953 1.00 0.00 H new ATOM 0 HG SER B 376 -2.854 14.045 4.945 1.00 0.00 H new ATOM 1236 N LEU B 377 1.769 14.136 4.208 1.00 0.00 N ATOM 1237 CA LEU B 377 2.899 14.809 4.838 1.00 0.00 C ATOM 1238 C LEU B 377 3.963 15.242 3.830 1.00 0.00 C ATOM 1239 O LEU B 377 4.598 16.281 4.007 1.00 0.00 O ATOM 1240 CB LEU B 377 3.531 13.900 5.891 1.00 0.00 C ATOM 1241 CG LEU B 377 3.877 14.581 7.217 1.00 0.00 C ATOM 1242 CD1 LEU B 377 5.056 15.522 7.041 1.00 0.00 C ATOM 1243 CD2 LEU B 377 2.671 15.329 7.764 1.00 0.00 C ATOM 0 H LEU B 377 1.733 13.130 4.371 1.00 0.00 H new ATOM 0 HA LEU B 377 2.508 15.712 5.308 1.00 0.00 H new ATOM 0 HB2 LEU B 377 2.848 13.075 6.092 1.00 0.00 H new ATOM 0 HB3 LEU B 377 4.441 13.467 5.475 1.00 0.00 H new ATOM 0 HG LEU B 377 4.157 13.811 7.936 1.00 0.00 H new ATOM 0 HD11 LEU B 377 5.288 15.997 7.994 1.00 0.00 H new ATOM 0 HD12 LEU B 377 5.923 14.958 6.696 1.00 0.00 H new ATOM 0 HD13 LEU B 377 4.805 16.287 6.306 1.00 0.00 H new ATOM 0 HD21 LEU B 377 2.936 15.807 8.707 1.00 0.00 H new ATOM 0 HD22 LEU B 377 2.358 16.089 7.048 1.00 0.00 H new ATOM 0 HD23 LEU B 377 1.853 14.628 7.930 1.00 0.00 H new ATOM 1255 N ILE B 378 4.185 14.443 2.790 1.00 0.00 N ATOM 1256 CA ILE B 378 5.206 14.770 1.802 1.00 0.00 C ATOM 1257 C ILE B 378 4.732 14.528 0.376 1.00 0.00 C ATOM 1258 O ILE B 378 5.506 14.090 -0.474 1.00 0.00 O ATOM 1259 CB ILE B 378 6.478 13.941 2.046 1.00 0.00 C ATOM 1260 CG1 ILE B 378 6.737 13.813 3.542 1.00 0.00 C ATOM 1261 CG2 ILE B 378 7.674 14.573 1.350 1.00 0.00 C ATOM 1262 CD1 ILE B 378 7.291 15.076 4.167 1.00 0.00 C ATOM 0 H ILE B 378 3.679 13.576 2.611 1.00 0.00 H new ATOM 0 HA ILE B 378 5.419 15.833 1.918 1.00 0.00 H new ATOM 0 HB ILE B 378 6.330 12.945 1.628 1.00 0.00 H new ATOM 0 HG12 ILE B 378 5.806 13.547 4.043 1.00 0.00 H new ATOM 0 HG13 ILE B 378 7.436 12.995 3.713 1.00 0.00 H new ATOM 0 HG21 ILE B 378 8.563 13.971 1.536 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.487 14.622 0.277 1.00 0.00 H new ATOM 0 HG23 ILE B 378 7.830 15.580 1.738 1.00 0.00 H new ATOM 0 HD11 ILE B 378 7.452 14.914 5.233 1.00 0.00 H new ATOM 0 HD12 ILE B 378 8.238 15.332 3.692 1.00 0.00 H new ATOM 0 HD13 ILE B 378 6.583 15.892 4.027 1.00 0.00 H new ATOM 1274 N GLY B 379 3.462 14.806 0.114 1.00 0.00 N ATOM 1275 CA GLY B 379 2.930 14.600 -1.219 1.00 0.00 C ATOM 1276 C GLY B 379 2.248 15.830 -1.775 1.00 0.00 C ATOM 1277 O GLY B 379 1.047 16.021 -1.584 1.00 0.00 O ATOM 0 H GLY B 379 2.794 15.168 0.795 1.00 0.00 H new ATOM 0 HA2 GLY B 379 3.740 14.306 -1.887 1.00 0.00 H new ATOM 0 HA3 GLY B 379 2.219 13.774 -1.198 1.00 0.00 H new ATOM 1281 N TYR B 380 3.010 16.664 -2.472 1.00 0.00 N ATOM 1282 CA TYR B 380 2.470 17.877 -3.065 1.00 0.00 C ATOM 1283 C TYR B 380 2.190 17.664 -4.550 1.00 0.00 C ATOM 1284 O TYR B 380 2.060 16.528 -5.005 1.00 0.00 O ATOM 1285 CB TYR B 380 3.448 19.035 -2.863 1.00 0.00 C ATOM 1286 CG TYR B 380 4.809 18.790 -3.475 1.00 0.00 C ATOM 1287 CD1 TYR B 380 5.075 19.147 -4.791 1.00 0.00 C ATOM 1288 CD2 TYR B 380 5.829 18.204 -2.735 1.00 0.00 C ATOM 1289 CE1 TYR B 380 6.318 18.925 -5.352 1.00 0.00 C ATOM 1290 CE2 TYR B 380 7.074 17.979 -3.290 1.00 0.00 C ATOM 1291 CZ TYR B 380 7.313 18.342 -4.598 1.00 0.00 C ATOM 1292 OH TYR B 380 8.552 18.119 -5.154 1.00 0.00 O ATOM 0 H TYR B 380 4.006 16.520 -2.640 1.00 0.00 H new ATOM 0 HA TYR B 380 1.529 18.123 -2.573 1.00 0.00 H new ATOM 0 HB2 TYR B 380 3.021 19.940 -3.296 1.00 0.00 H new ATOM 0 HB3 TYR B 380 3.566 19.218 -1.795 1.00 0.00 H new ATOM 0 HD1 TYR B 380 4.298 19.605 -5.385 1.00 0.00 H new ATOM 0 HD2 TYR B 380 5.645 17.920 -1.709 1.00 0.00 H new ATOM 0 HE1 TYR B 380 6.509 19.207 -6.377 1.00 0.00 H new ATOM 0 HE2 TYR B 380 7.856 17.521 -2.702 1.00 0.00 H new ATOM 0 HH TYR B 380 9.139 17.702 -4.489 1.00 0.00 H new ATOM 1302 N ALA B 381 2.089 18.755 -5.302 1.00 0.00 N ATOM 1303 CA ALA B 381 1.815 18.669 -6.731 1.00 0.00 C ATOM 1304 C ALA B 381 3.101 18.672 -7.551 1.00 0.00 C ATOM 1305 O ALA B 381 3.902 19.603 -7.464 1.00 0.00 O ATOM 1306 CB ALA B 381 0.912 19.809 -7.176 1.00 0.00 C ATOM 0 H ALA B 381 2.192 19.706 -4.947 1.00 0.00 H new ATOM 0 HA ALA B 381 1.304 17.722 -6.906 1.00 0.00 H new ATOM 0 HB1 ALA B 381 0.721 19.725 -8.246 1.00 0.00 H new ATOM 0 HB2 ALA B 381 -0.032 19.758 -6.633 1.00 0.00 H new ATOM 0 HB3 ALA B 381 1.399 20.762 -6.968 1.00 0.00 H new ATOM 1312 N SER B 382 3.279 17.630 -8.360 1.00 0.00 N ATOM 1313 CA SER B 382 4.452 17.509 -9.219 1.00 0.00 C ATOM 1314 C SER B 382 5.615 16.826 -8.506 1.00 0.00 C ATOM 1315 O SER B 382 6.661 16.586 -9.108 1.00 0.00 O ATOM 1316 CB SER B 382 4.889 18.888 -9.715 1.00 0.00 C ATOM 1317 OG SER B 382 3.770 19.671 -10.095 1.00 0.00 O ATOM 0 H SER B 382 2.621 16.854 -8.438 1.00 0.00 H new ATOM 0 HA SER B 382 4.169 16.886 -10.068 1.00 0.00 H new ATOM 0 HB2 SER B 382 5.446 19.400 -8.931 1.00 0.00 H new ATOM 0 HB3 SER B 382 5.564 18.776 -10.564 1.00 0.00 H new ATOM 0 HG SER B 382 4.075 20.548 -10.407 1.00 0.00 H new ATOM 1323 N LEU B 383 5.439 16.515 -7.226 1.00 0.00 N ATOM 1324 CA LEU B 383 6.495 15.863 -6.459 1.00 0.00 C ATOM 1325 C LEU B 383 7.030 14.639 -7.191 1.00 0.00 C ATOM 1326 O LEU B 383 8.240 14.419 -7.251 1.00 0.00 O ATOM 1327 CB LEU B 383 5.989 15.455 -5.076 1.00 0.00 C ATOM 1328 CG LEU B 383 7.087 15.097 -4.074 1.00 0.00 C ATOM 1329 CD1 LEU B 383 6.529 15.052 -2.661 1.00 0.00 C ATOM 1330 CD2 LEU B 383 7.724 13.765 -4.439 1.00 0.00 C ATOM 0 H LEU B 383 4.584 16.701 -6.702 1.00 0.00 H new ATOM 0 HA LEU B 383 7.306 16.582 -6.342 1.00 0.00 H new ATOM 0 HB2 LEU B 383 5.394 16.271 -4.666 1.00 0.00 H new ATOM 0 HB3 LEU B 383 5.323 14.599 -5.186 1.00 0.00 H new ATOM 0 HG LEU B 383 7.854 15.870 -4.114 1.00 0.00 H new ATOM 0 HD11 LEU B 383 7.326 14.796 -1.963 1.00 0.00 H new ATOM 0 HD12 LEU B 383 6.119 16.028 -2.401 1.00 0.00 H new ATOM 0 HD13 LEU B 383 5.742 14.300 -2.605 1.00 0.00 H new ATOM 0 HD21 LEU B 383 8.504 13.524 -3.716 1.00 0.00 H new ATOM 0 HD22 LEU B 383 6.965 12.983 -4.427 1.00 0.00 H new ATOM 0 HD23 LEU B 383 8.161 13.832 -5.435 1.00 0.00 H new ATOM 1342 N ARG B 384 6.125 13.840 -7.746 1.00 0.00 N ATOM 1343 CA ARG B 384 6.515 12.636 -8.470 1.00 0.00 C ATOM 1344 C ARG B 384 7.059 11.584 -7.511 1.00 0.00 C ATOM 1345 O ARG B 384 8.264 11.341 -7.461 1.00 0.00 O ATOM 1346 CB ARG B 384 7.572 12.971 -9.526 1.00 0.00 C ATOM 1347 CG ARG B 384 7.745 11.887 -10.578 1.00 0.00 C ATOM 1348 CD ARG B 384 6.566 11.852 -11.536 1.00 0.00 C ATOM 1349 NE ARG B 384 5.877 10.562 -11.513 1.00 0.00 N ATOM 1350 CZ ARG B 384 5.953 9.648 -12.482 1.00 0.00 C ATOM 1351 NH1 ARG B 384 6.706 9.852 -13.556 1.00 0.00 N ATOM 1352 NH2 ARG B 384 5.273 8.515 -12.371 1.00 0.00 N ATOM 0 H ARG B 384 5.119 14.004 -7.709 1.00 0.00 H new ATOM 0 HA ARG B 384 5.631 12.234 -8.965 1.00 0.00 H new ATOM 0 HB2 ARG B 384 7.298 13.904 -10.019 1.00 0.00 H new ATOM 0 HB3 ARG B 384 8.528 13.141 -9.030 1.00 0.00 H new ATOM 0 HG2 ARG B 384 8.664 12.063 -11.136 1.00 0.00 H new ATOM 0 HG3 ARG B 384 7.849 10.918 -10.090 1.00 0.00 H new ATOM 0 HD2 ARG B 384 5.863 12.643 -11.274 1.00 0.00 H new ATOM 0 HD3 ARG B 384 6.915 12.058 -12.548 1.00 0.00 H new ATOM 0 HE ARG B 384 5.299 10.346 -10.701 1.00 0.00 H new ATOM 0 HH11 ARG B 384 7.237 10.718 -13.649 1.00 0.00 H new ATOM 0 HH12 ARG B 384 6.753 9.143 -14.288 1.00 0.00 H new ATOM 0 HH21 ARG B 384 4.695 8.346 -11.548 1.00 0.00 H new ATOM 0 HH22 ARG B 384 5.328 7.813 -13.109 1.00 0.00 H new ATOM 1366 N LEU B 385 6.163 10.958 -6.755 1.00 0.00 N ATOM 1367 CA LEU B 385 6.547 9.930 -5.801 1.00 0.00 C ATOM 1368 C LEU B 385 5.891 8.607 -6.165 1.00 0.00 C ATOM 1369 O LEU B 385 4.683 8.550 -6.391 1.00 0.00 O ATOM 1370 CB LEU B 385 6.137 10.353 -4.389 1.00 0.00 C ATOM 1371 CG LEU B 385 6.630 9.443 -3.269 1.00 0.00 C ATOM 1372 CD1 LEU B 385 6.882 10.249 -2.005 1.00 0.00 C ATOM 1373 CD2 LEU B 385 5.628 8.331 -3.004 1.00 0.00 C ATOM 0 H LEU B 385 5.161 11.148 -6.787 1.00 0.00 H new ATOM 0 HA LEU B 385 7.629 9.802 -5.832 1.00 0.00 H new ATOM 0 HB2 LEU B 385 6.509 11.361 -4.207 1.00 0.00 H new ATOM 0 HB3 LEU B 385 5.049 10.402 -4.343 1.00 0.00 H new ATOM 0 HG LEU B 385 7.570 8.988 -3.581 1.00 0.00 H new ATOM 0 HD11 LEU B 385 7.233 9.586 -1.215 1.00 0.00 H new ATOM 0 HD12 LEU B 385 7.637 11.010 -2.203 1.00 0.00 H new ATOM 0 HD13 LEU B 385 5.956 10.730 -1.690 1.00 0.00 H new ATOM 0 HD21 LEU B 385 5.997 7.692 -2.202 1.00 0.00 H new ATOM 0 HD22 LEU B 385 4.672 8.765 -2.711 1.00 0.00 H new ATOM 0 HD23 LEU B 385 5.495 7.738 -3.909 1.00 0.00 H new ATOM 1385 N HIS B 386 6.689 7.546 -6.247 1.00 0.00 N ATOM 1386 CA HIS B 386 6.141 6.243 -6.617 1.00 0.00 C ATOM 1387 C HIS B 386 6.901 5.081 -5.988 1.00 0.00 C ATOM 1388 O HIS B 386 8.118 5.130 -5.801 1.00 0.00 O ATOM 1389 CB HIS B 386 6.136 6.089 -8.139 1.00 0.00 C ATOM 1390 CG HIS B 386 7.500 5.916 -8.731 1.00 0.00 C ATOM 1391 ND1 HIS B 386 8.284 6.974 -9.140 1.00 0.00 N ATOM 1392 CD2 HIS B 386 8.222 4.797 -8.984 1.00 0.00 C ATOM 1393 CE1 HIS B 386 9.427 6.515 -9.620 1.00 0.00 C ATOM 1394 NE2 HIS B 386 9.414 5.198 -9.535 1.00 0.00 N ATOM 0 H HIS B 386 7.693 7.559 -6.067 1.00 0.00 H new ATOM 0 HA HIS B 386 5.122 6.209 -6.232 1.00 0.00 H new ATOM 0 HB2 HIS B 386 5.522 5.229 -8.406 1.00 0.00 H new ATOM 0 HB3 HIS B 386 5.666 6.967 -8.583 1.00 0.00 H new ATOM 0 HD2 HIS B 386 7.917 3.780 -8.789 1.00 0.00 H new ATOM 0 HE1 HIS B 386 10.234 7.115 -10.014 1.00 0.00 H new ATOM 0 HE2 HIS B 386 10.168 4.578 -9.831 1.00 0.00 H new ATOM 1403 N TYR B 387 6.152 4.024 -5.692 1.00 0.00 N ATOM 1404 CA TYR B 387 6.706 2.808 -5.114 1.00 0.00 C ATOM 1405 C TYR B 387 6.861 1.735 -6.178 1.00 0.00 C ATOM 1406 O TYR B 387 6.009 1.588 -7.054 1.00 0.00 O ATOM 1407 CB TYR B 387 5.805 2.283 -4.000 1.00 0.00 C ATOM 1408 CG TYR B 387 5.916 3.083 -2.738 1.00 0.00 C ATOM 1409 CD1 TYR B 387 5.904 4.465 -2.784 1.00 0.00 C ATOM 1410 CD2 TYR B 387 6.047 2.464 -1.506 1.00 0.00 C ATOM 1411 CE1 TYR B 387 6.020 5.214 -1.639 1.00 0.00 C ATOM 1412 CE2 TYR B 387 6.161 3.204 -0.349 1.00 0.00 C ATOM 1413 CZ TYR B 387 6.148 4.582 -0.419 1.00 0.00 C ATOM 1414 OH TYR B 387 6.270 5.328 0.729 1.00 0.00 O ATOM 0 H TYR B 387 5.144 3.988 -5.846 1.00 0.00 H new ATOM 0 HA TYR B 387 7.685 3.050 -4.700 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.770 2.293 -4.341 1.00 0.00 H new ATOM 0 HB3 TYR B 387 6.062 1.245 -3.790 1.00 0.00 H new ATOM 0 HD1 TYR B 387 5.802 4.964 -3.737 1.00 0.00 H new ATOM 0 HD2 TYR B 387 6.060 1.385 -1.451 1.00 0.00 H new ATOM 0 HE1 TYR B 387 6.011 6.293 -1.693 1.00 0.00 H new ATOM 0 HE2 TYR B 387 6.260 2.709 0.606 1.00 0.00 H new ATOM 0 HH TYR B 387 6.393 6.272 0.494 1.00 0.00 H new ATOM 1424 N VAL B 388 7.943 0.978 -6.092 1.00 0.00 N ATOM 1425 CA VAL B 388 8.187 -0.088 -7.046 1.00 0.00 C ATOM 1426 C VAL B 388 8.379 -1.412 -6.335 1.00 0.00 C ATOM 1427 O VAL B 388 9.289 -1.573 -5.521 1.00 0.00 O ATOM 1428 CB VAL B 388 9.405 0.197 -7.937 1.00 0.00 C ATOM 1429 CG1 VAL B 388 8.937 0.559 -9.334 1.00 0.00 C ATOM 1430 CG2 VAL B 388 10.266 1.300 -7.341 1.00 0.00 C ATOM 0 H VAL B 388 8.661 1.082 -5.375 1.00 0.00 H new ATOM 0 HA VAL B 388 7.306 -0.142 -7.686 1.00 0.00 H new ATOM 0 HB VAL B 388 10.022 -0.700 -7.996 1.00 0.00 H new ATOM 0 HG11 VAL B 388 9.801 0.761 -9.966 1.00 0.00 H new ATOM 0 HG12 VAL B 388 8.367 -0.270 -9.753 1.00 0.00 H new ATOM 0 HG13 VAL B 388 8.306 1.446 -9.288 1.00 0.00 H new ATOM 0 HG21 VAL B 388 11.122 1.484 -7.990 1.00 0.00 H new ATOM 0 HG22 VAL B 388 9.677 2.213 -7.250 1.00 0.00 H new ATOM 0 HG23 VAL B 388 10.617 0.995 -6.355 1.00 0.00 H new ATOM 1440 N THR B 389 7.508 -2.358 -6.645 1.00 0.00 N ATOM 1441 CA THR B 389 7.573 -3.674 -6.032 1.00 0.00 C ATOM 1442 C THR B 389 8.632 -4.530 -6.703 1.00 0.00 C ATOM 1443 O THR B 389 8.593 -4.756 -7.913 1.00 0.00 O ATOM 1444 CB THR B 389 6.217 -4.405 -6.094 1.00 0.00 C ATOM 1445 OG1 THR B 389 5.317 -3.916 -5.091 1.00 0.00 O ATOM 1446 CG2 THR B 389 6.391 -5.907 -5.893 1.00 0.00 C ATOM 0 H THR B 389 6.749 -2.240 -7.316 1.00 0.00 H new ATOM 0 HA THR B 389 7.835 -3.521 -4.985 1.00 0.00 H new ATOM 0 HB THR B 389 5.802 -4.213 -7.083 1.00 0.00 H new ATOM 0 HG1 THR B 389 4.465 -4.396 -5.154 1.00 0.00 H new ATOM 0 HG21 THR B 389 5.418 -6.396 -5.942 1.00 0.00 H new ATOM 0 HG22 THR B 389 7.037 -6.306 -6.675 1.00 0.00 H new ATOM 0 HG23 THR B 389 6.842 -6.094 -4.919 1.00 0.00 H new ATOM 1454 N VAL B 390 9.574 -5.008 -5.908 1.00 0.00 N ATOM 1455 CA VAL B 390 10.639 -5.845 -6.419 1.00 0.00 C ATOM 1456 C VAL B 390 10.812 -7.085 -5.555 1.00 0.00 C ATOM 1457 O VAL B 390 10.360 -7.123 -4.409 1.00 0.00 O ATOM 1458 CB VAL B 390 11.971 -5.072 -6.494 1.00 0.00 C ATOM 1459 CG1 VAL B 390 11.876 -3.950 -7.514 1.00 0.00 C ATOM 1460 CG2 VAL B 390 12.351 -4.520 -5.129 1.00 0.00 C ATOM 0 H VAL B 390 9.620 -4.829 -4.905 1.00 0.00 H new ATOM 0 HA VAL B 390 10.359 -6.151 -7.427 1.00 0.00 H new ATOM 0 HB VAL B 390 12.751 -5.764 -6.811 1.00 0.00 H new ATOM 0 HG11 VAL B 390 12.824 -3.414 -7.555 1.00 0.00 H new ATOM 0 HG12 VAL B 390 11.653 -4.368 -8.495 1.00 0.00 H new ATOM 0 HG13 VAL B 390 11.082 -3.261 -7.224 1.00 0.00 H new ATOM 0 HG21 VAL B 390 13.294 -3.978 -5.205 1.00 0.00 H new ATOM 0 HG22 VAL B 390 11.571 -3.843 -4.780 1.00 0.00 H new ATOM 0 HG23 VAL B 390 12.461 -5.342 -4.422 1.00 0.00 H new ATOM 1470 N LYS B 391 11.464 -8.095 -6.125 1.00 0.00 N ATOM 1471 CA LYS B 391 11.717 -9.359 -5.441 1.00 0.00 C ATOM 1472 C LYS B 391 10.642 -10.395 -5.767 1.00 0.00 C ATOM 1473 O LYS B 391 10.457 -11.351 -5.018 1.00 0.00 O ATOM 1474 CB LYS B 391 11.816 -9.140 -3.933 1.00 0.00 C ATOM 1475 CG LYS B 391 12.882 -9.984 -3.258 1.00 0.00 C ATOM 1476 CD LYS B 391 12.785 -11.443 -3.671 1.00 0.00 C ATOM 1477 CE LYS B 391 14.064 -12.193 -3.345 1.00 0.00 C ATOM 1478 NZ LYS B 391 13.802 -13.618 -3.003 1.00 0.00 N ATOM 0 H LYS B 391 11.832 -8.059 -7.076 1.00 0.00 H new ATOM 0 HA LYS B 391 12.670 -9.748 -5.800 1.00 0.00 H new ATOM 0 HB2 LYS B 391 12.025 -8.087 -3.741 1.00 0.00 H new ATOM 0 HB3 LYS B 391 10.850 -9.361 -3.479 1.00 0.00 H new ATOM 0 HG2 LYS B 391 13.869 -9.598 -3.514 1.00 0.00 H new ATOM 0 HG3 LYS B 391 12.779 -9.904 -2.176 1.00 0.00 H new ATOM 0 HD2 LYS B 391 11.945 -11.913 -3.160 1.00 0.00 H new ATOM 0 HD3 LYS B 391 12.585 -11.508 -4.740 1.00 0.00 H new ATOM 0 HE2 LYS B 391 14.741 -12.143 -4.198 1.00 0.00 H new ATOM 0 HE3 LYS B 391 14.567 -11.706 -2.510 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 14.701 -14.094 -2.787 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 13.177 -13.667 -2.174 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 13.345 -14.090 -3.809 1.00 0.00 H new ATOM 1492 N LYS B 392 9.946 -10.176 -6.893 1.00 0.00 N ATOM 1493 CA LYS B 392 8.874 -11.063 -7.379 1.00 0.00 C ATOM 1494 C LYS B 392 8.566 -12.206 -6.412 1.00 0.00 C ATOM 1495 O LYS B 392 9.424 -13.039 -6.122 1.00 0.00 O ATOM 1496 CB LYS B 392 9.249 -11.635 -8.747 1.00 0.00 C ATOM 1497 CG LYS B 392 9.315 -10.587 -9.846 1.00 0.00 C ATOM 1498 CD LYS B 392 8.085 -10.636 -10.739 1.00 0.00 C ATOM 1499 CE LYS B 392 7.082 -9.556 -10.366 1.00 0.00 C ATOM 1500 NZ LYS B 392 5.684 -10.068 -10.384 1.00 0.00 N ATOM 0 H LYS B 392 10.112 -9.372 -7.498 1.00 0.00 H new ATOM 0 HA LYS B 392 7.973 -10.455 -7.458 1.00 0.00 H new ATOM 0 HB2 LYS B 392 10.216 -12.132 -8.671 1.00 0.00 H new ATOM 0 HB3 LYS B 392 8.520 -12.396 -9.026 1.00 0.00 H new ATOM 0 HG2 LYS B 392 9.403 -9.596 -9.400 1.00 0.00 H new ATOM 0 HG3 LYS B 392 10.209 -10.746 -10.448 1.00 0.00 H new ATOM 0 HD2 LYS B 392 8.385 -10.512 -11.780 1.00 0.00 H new ATOM 0 HD3 LYS B 392 7.614 -11.615 -10.657 1.00 0.00 H new ATOM 0 HE2 LYS B 392 7.315 -9.171 -9.373 1.00 0.00 H new ATOM 0 HE3 LYS B 392 7.172 -8.721 -11.061 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 5.030 -9.302 -10.124 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 5.453 -10.412 -11.338 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 5.591 -10.848 -9.703 1.00 0.00 H new ATOM 1514 N PRO B 393 7.323 -12.263 -5.905 1.00 0.00 N ATOM 1515 CA PRO B 393 6.902 -13.301 -4.966 1.00 0.00 C ATOM 1516 C PRO B 393 6.821 -14.689 -5.588 1.00 0.00 C ATOM 1517 O PRO B 393 6.684 -14.847 -6.801 1.00 0.00 O ATOM 1518 CB PRO B 393 5.509 -12.868 -4.506 1.00 0.00 C ATOM 1519 CG PRO B 393 5.291 -11.493 -5.054 1.00 0.00 C ATOM 1520 CD PRO B 393 6.239 -11.322 -6.208 1.00 0.00 C ATOM 0 HA PRO B 393 7.629 -13.389 -4.159 1.00 0.00 H new ATOM 0 HB2 PRO B 393 4.748 -13.557 -4.872 1.00 0.00 H new ATOM 0 HB3 PRO B 393 5.442 -12.867 -3.418 1.00 0.00 H new ATOM 0 HG2 PRO B 393 4.259 -11.368 -5.382 1.00 0.00 H new ATOM 0 HG3 PRO B 393 5.476 -10.739 -4.289 1.00 0.00 H new ATOM 0 HD2 PRO B 393 5.760 -11.555 -7.159 1.00 0.00 H new ATOM 0 HD3 PRO B 393 6.605 -10.298 -6.278 1.00 0.00 H new ATOM 1528 N THR B 394 6.918 -15.684 -4.722 1.00 0.00 N ATOM 1529 CA THR B 394 6.869 -17.084 -5.142 1.00 0.00 C ATOM 1530 C THR B 394 6.008 -17.929 -4.211 1.00 0.00 C ATOM 1531 O THR B 394 5.582 -17.465 -3.152 1.00 0.00 O ATOM 1532 CB THR B 394 8.281 -17.697 -5.206 1.00 0.00 C ATOM 1533 OG1 THR B 394 8.616 -18.365 -3.984 1.00 0.00 O ATOM 1534 CG2 THR B 394 9.325 -16.623 -5.471 1.00 0.00 C ATOM 0 H THR B 394 7.032 -15.552 -3.717 1.00 0.00 H new ATOM 0 HA THR B 394 6.422 -17.090 -6.136 1.00 0.00 H new ATOM 0 HB THR B 394 8.277 -18.419 -6.022 1.00 0.00 H new ATOM 0 HG1 THR B 394 9.553 -18.187 -3.760 1.00 0.00 H new ATOM 0 HG21 THR B 394 10.314 -17.079 -5.512 1.00 0.00 H new ATOM 0 HG22 THR B 394 9.111 -16.134 -6.422 1.00 0.00 H new ATOM 0 HG23 THR B 394 9.299 -15.885 -4.670 1.00 0.00 H new ATOM 1542 N ALA B 395 5.764 -19.180 -4.605 1.00 0.00 N ATOM 1543 CA ALA B 395 4.966 -20.095 -3.800 1.00 0.00 C ATOM 1544 C ALA B 395 5.863 -20.929 -2.897 1.00 0.00 C ATOM 1545 O ALA B 395 5.454 -21.963 -2.368 1.00 0.00 O ATOM 1546 CB ALA B 395 4.121 -20.998 -4.680 1.00 0.00 C ATOM 0 H ALA B 395 6.109 -19.579 -5.478 1.00 0.00 H new ATOM 0 HA ALA B 395 4.296 -19.501 -3.178 1.00 0.00 H new ATOM 0 HB1 ALA B 395 3.535 -21.671 -4.054 1.00 0.00 H new ATOM 0 HB2 ALA B 395 3.450 -20.390 -5.287 1.00 0.00 H new ATOM 0 HB3 ALA B 395 4.771 -21.582 -5.332 1.00 0.00 H new ATOM 1552 N VAL B 396 7.079 -20.442 -2.705 1.00 0.00 N ATOM 1553 CA VAL B 396 8.052 -21.092 -1.838 1.00 0.00 C ATOM 1554 C VAL B 396 8.748 -20.057 -0.958 1.00 0.00 C ATOM 1555 O VAL B 396 9.607 -20.386 -0.140 1.00 0.00 O ATOM 1556 CB VAL B 396 9.104 -21.875 -2.646 1.00 0.00 C ATOM 1557 CG1 VAL B 396 8.440 -22.975 -3.460 1.00 0.00 C ATOM 1558 CG2 VAL B 396 9.895 -20.939 -3.545 1.00 0.00 C ATOM 0 H VAL B 396 7.420 -19.587 -3.144 1.00 0.00 H new ATOM 0 HA VAL B 396 7.510 -21.801 -1.212 1.00 0.00 H new ATOM 0 HB VAL B 396 9.799 -22.340 -1.947 1.00 0.00 H new ATOM 0 HG11 VAL B 396 9.198 -23.518 -4.025 1.00 0.00 H new ATOM 0 HG12 VAL B 396 7.925 -23.663 -2.790 1.00 0.00 H new ATOM 0 HG13 VAL B 396 7.721 -22.533 -4.150 1.00 0.00 H new ATOM 0 HG21 VAL B 396 10.633 -21.512 -4.107 1.00 0.00 H new ATOM 0 HG22 VAL B 396 9.217 -20.441 -4.238 1.00 0.00 H new ATOM 0 HG23 VAL B 396 10.403 -20.192 -2.935 1.00 0.00 H new ATOM 1568 N ASP B 397 8.356 -18.807 -1.152 1.00 0.00 N ATOM 1569 CA ASP B 397 8.899 -17.676 -0.415 1.00 0.00 C ATOM 1570 C ASP B 397 8.231 -16.397 -0.912 1.00 0.00 C ATOM 1571 O ASP B 397 8.897 -15.463 -1.358 1.00 0.00 O ATOM 1572 CB ASP B 397 10.416 -17.588 -0.599 1.00 0.00 C ATOM 1573 CG ASP B 397 11.177 -18.282 0.514 1.00 0.00 C ATOM 1574 OD1 ASP B 397 11.052 -17.849 1.679 1.00 0.00 O ATOM 1575 OD2 ASP B 397 11.900 -19.259 0.222 1.00 0.00 O ATOM 0 H ASP B 397 7.643 -18.546 -1.834 1.00 0.00 H new ATOM 0 HA ASP B 397 8.698 -17.808 0.648 1.00 0.00 H new ATOM 0 HB2 ASP B 397 10.689 -18.035 -1.555 1.00 0.00 H new ATOM 0 HB3 ASP B 397 10.714 -16.540 -0.640 1.00 0.00 H new ATOM 1580 N PRO B 398 6.891 -16.359 -0.849 1.00 0.00 N ATOM 1581 CA PRO B 398 6.099 -15.216 -1.299 1.00 0.00 C ATOM 1582 C PRO B 398 6.745 -13.879 -0.964 1.00 0.00 C ATOM 1583 O PRO B 398 6.627 -12.912 -1.714 1.00 0.00 O ATOM 1584 CB PRO B 398 4.800 -15.387 -0.518 1.00 0.00 C ATOM 1585 CG PRO B 398 4.643 -16.861 -0.368 1.00 0.00 C ATOM 1586 CD PRO B 398 6.035 -17.444 -0.331 1.00 0.00 C ATOM 0 HA PRO B 398 5.980 -15.200 -2.382 1.00 0.00 H new ATOM 0 HB2 PRO B 398 4.853 -14.893 0.452 1.00 0.00 H new ATOM 0 HB3 PRO B 398 3.956 -14.951 -1.052 1.00 0.00 H new ATOM 0 HG2 PRO B 398 4.098 -17.101 0.545 1.00 0.00 H new ATOM 0 HG3 PRO B 398 4.072 -17.276 -1.198 1.00 0.00 H new ATOM 0 HD2 PRO B 398 6.321 -17.729 0.681 1.00 0.00 H new ATOM 0 HD3 PRO B 398 6.109 -18.340 -0.948 1.00 0.00 H new ATOM 1594 N ASN B 399 7.396 -13.828 0.185 1.00 0.00 N ATOM 1595 CA ASN B 399 8.033 -12.611 0.662 1.00 0.00 C ATOM 1596 C ASN B 399 8.520 -11.726 -0.485 1.00 0.00 C ATOM 1597 O ASN B 399 9.125 -12.195 -1.447 1.00 0.00 O ATOM 1598 CB ASN B 399 9.176 -12.948 1.637 1.00 0.00 C ATOM 1599 CG ASN B 399 10.559 -12.828 1.023 1.00 0.00 C ATOM 1600 OD1 ASN B 399 11.458 -12.218 1.602 1.00 0.00 O ATOM 1601 ND2 ASN B 399 10.733 -13.410 -0.152 1.00 0.00 N ATOM 0 H ASN B 399 7.498 -14.626 0.812 1.00 0.00 H new ATOM 0 HA ASN B 399 7.280 -12.035 1.200 1.00 0.00 H new ATOM 0 HB2 ASN B 399 9.113 -12.285 2.500 1.00 0.00 H new ATOM 0 HB3 ASN B 399 9.039 -13.965 2.006 1.00 0.00 H new ATOM 0 HD21 ASN B 399 11.641 -13.364 -0.615 1.00 0.00 H new ATOM 0 HD22 ASN B 399 9.959 -13.905 -0.595 1.00 0.00 H new ATOM 1608 N SER B 400 8.228 -10.437 -0.366 1.00 0.00 N ATOM 1609 CA SER B 400 8.617 -9.466 -1.379 1.00 0.00 C ATOM 1610 C SER B 400 9.017 -8.140 -0.750 1.00 0.00 C ATOM 1611 O SER B 400 8.538 -7.779 0.325 1.00 0.00 O ATOM 1612 CB SER B 400 7.474 -9.247 -2.370 1.00 0.00 C ATOM 1613 OG SER B 400 7.094 -10.466 -2.984 1.00 0.00 O ATOM 0 H SER B 400 7.721 -10.039 0.425 1.00 0.00 H new ATOM 0 HA SER B 400 9.481 -9.866 -1.909 1.00 0.00 H new ATOM 0 HB2 SER B 400 6.618 -8.814 -1.853 1.00 0.00 H new ATOM 0 HB3 SER B 400 7.781 -8.532 -3.133 1.00 0.00 H new ATOM 0 HG SER B 400 6.847 -11.117 -2.294 1.00 0.00 H new ATOM 1619 N ILE B 401 9.899 -7.421 -1.432 1.00 0.00 N ATOM 1620 CA ILE B 401 10.366 -6.131 -0.946 1.00 0.00 C ATOM 1621 C ILE B 401 9.827 -4.997 -1.807 1.00 0.00 C ATOM 1622 O ILE B 401 9.456 -5.195 -2.964 1.00 0.00 O ATOM 1623 CB ILE B 401 11.901 -6.057 -0.904 1.00 0.00 C ATOM 1624 CG1 ILE B 401 12.351 -4.866 -0.057 1.00 0.00 C ATOM 1625 CG2 ILE B 401 12.457 -5.951 -2.309 1.00 0.00 C ATOM 1626 CD1 ILE B 401 13.735 -5.031 0.531 1.00 0.00 C ATOM 0 H ILE B 401 10.305 -7.710 -2.322 1.00 0.00 H new ATOM 0 HA ILE B 401 9.989 -6.022 0.071 1.00 0.00 H new ATOM 0 HB ILE B 401 12.285 -6.969 -0.447 1.00 0.00 H new ATOM 0 HG12 ILE B 401 12.331 -3.966 -0.671 1.00 0.00 H new ATOM 0 HG13 ILE B 401 11.637 -4.716 0.753 1.00 0.00 H new ATOM 0 HG21 ILE B 401 13.545 -5.899 -2.267 1.00 0.00 H new ATOM 0 HG22 ILE B 401 12.157 -6.826 -2.886 1.00 0.00 H new ATOM 0 HG23 ILE B 401 12.069 -5.051 -2.787 1.00 0.00 H new ATOM 0 HD11 ILE B 401 13.988 -4.149 1.119 1.00 0.00 H new ATOM 0 HD12 ILE B 401 13.755 -5.912 1.172 1.00 0.00 H new ATOM 0 HD13 ILE B 401 14.460 -5.151 -0.274 1.00 0.00 H new ATOM 1638 N VAL B 402 9.760 -3.814 -1.216 1.00 0.00 N ATOM 1639 CA VAL B 402 9.234 -2.638 -1.896 1.00 0.00 C ATOM 1640 C VAL B 402 10.263 -1.520 -1.960 1.00 0.00 C ATOM 1641 O VAL B 402 11.135 -1.414 -1.094 1.00 0.00 O ATOM 1642 CB VAL B 402 7.973 -2.107 -1.178 1.00 0.00 C ATOM 1643 CG1 VAL B 402 6.927 -1.653 -2.181 1.00 0.00 C ATOM 1644 CG2 VAL B 402 7.402 -3.168 -0.246 1.00 0.00 C ATOM 0 H VAL B 402 10.066 -3.641 -0.258 1.00 0.00 H new ATOM 0 HA VAL B 402 8.981 -2.948 -2.910 1.00 0.00 H new ATOM 0 HB VAL B 402 8.262 -1.243 -0.580 1.00 0.00 H new ATOM 0 HG11 VAL B 402 6.050 -1.284 -1.650 1.00 0.00 H new ATOM 0 HG12 VAL B 402 7.338 -0.856 -2.800 1.00 0.00 H new ATOM 0 HG13 VAL B 402 6.641 -2.493 -2.814 1.00 0.00 H new ATOM 0 HG21 VAL B 402 6.515 -2.776 0.251 1.00 0.00 H new ATOM 0 HG22 VAL B 402 7.134 -4.053 -0.823 1.00 0.00 H new ATOM 0 HG23 VAL B 402 8.149 -3.435 0.502 1.00 0.00 H new ATOM 1654 N GLU B 403 10.134 -0.672 -2.979 1.00 0.00 N ATOM 1655 CA GLU B 403 11.025 0.465 -3.161 1.00 0.00 C ATOM 1656 C GLU B 403 10.218 1.756 -3.165 1.00 0.00 C ATOM 1657 O GLU B 403 9.316 1.934 -3.984 1.00 0.00 O ATOM 1658 CB GLU B 403 11.803 0.333 -4.472 1.00 0.00 C ATOM 1659 CG GLU B 403 13.270 -0.013 -4.277 1.00 0.00 C ATOM 1660 CD GLU B 403 14.000 -0.229 -5.589 1.00 0.00 C ATOM 1661 OE1 GLU B 403 13.329 -0.520 -6.602 1.00 0.00 O ATOM 1662 OE2 GLU B 403 15.244 -0.110 -5.603 1.00 0.00 O ATOM 0 H GLU B 403 9.413 -0.755 -3.696 1.00 0.00 H new ATOM 0 HA GLU B 403 11.737 0.487 -2.336 1.00 0.00 H new ATOM 0 HB2 GLU B 403 11.335 -0.437 -5.086 1.00 0.00 H new ATOM 0 HB3 GLU B 403 11.730 1.270 -5.024 1.00 0.00 H new ATOM 0 HG2 GLU B 403 13.758 0.789 -3.722 1.00 0.00 H new ATOM 0 HG3 GLU B 403 13.349 -0.915 -3.669 1.00 0.00 H new ATOM 1669 N CYS B 404 10.558 2.658 -2.259 1.00 0.00 N ATOM 1670 CA CYS B 404 9.877 3.940 -2.170 1.00 0.00 C ATOM 1671 C CYS B 404 10.816 5.039 -2.626 1.00 0.00 C ATOM 1672 O CYS B 404 11.788 5.358 -1.935 1.00 0.00 O ATOM 1673 CB CYS B 404 9.407 4.205 -0.740 1.00 0.00 C ATOM 1674 SG CYS B 404 9.311 2.723 0.292 1.00 0.00 S ATOM 0 H CYS B 404 11.302 2.526 -1.574 1.00 0.00 H new ATOM 0 HA CYS B 404 8.999 3.921 -2.816 1.00 0.00 H new ATOM 0 HB2 CYS B 404 10.086 4.917 -0.272 1.00 0.00 H new ATOM 0 HB3 CYS B 404 8.425 4.676 -0.773 1.00 0.00 H new ATOM 0 HG CYS B 404 8.928 3.052 1.490 1.00 0.00 H new ATOM 1680 N ARG B 405 10.546 5.596 -3.805 1.00 0.00 N ATOM 1681 CA ARG B 405 11.400 6.633 -4.350 1.00 0.00 C ATOM 1682 C ARG B 405 10.611 7.811 -4.911 1.00 0.00 C ATOM 1683 O ARG B 405 9.402 7.935 -4.709 1.00 0.00 O ATOM 1684 CB ARG B 405 12.307 6.048 -5.436 1.00 0.00 C ATOM 1685 CG ARG B 405 11.555 5.593 -6.676 1.00 0.00 C ATOM 1686 CD ARG B 405 12.229 4.397 -7.327 1.00 0.00 C ATOM 1687 NE ARG B 405 13.109 4.793 -8.423 1.00 0.00 N ATOM 1688 CZ ARG B 405 14.074 4.019 -8.907 1.00 0.00 C ATOM 1689 NH1 ARG B 405 14.278 2.813 -8.395 1.00 0.00 N ATOM 1690 NH2 ARG B 405 14.835 4.449 -9.904 1.00 0.00 N ATOM 0 H ARG B 405 9.750 5.346 -4.391 1.00 0.00 H new ATOM 0 HA ARG B 405 12.004 7.014 -3.527 1.00 0.00 H new ATOM 0 HB2 ARG B 405 13.045 6.797 -5.723 1.00 0.00 H new ATOM 0 HB3 ARG B 405 12.855 5.202 -5.023 1.00 0.00 H new ATOM 0 HG2 ARG B 405 10.531 5.333 -6.407 1.00 0.00 H new ATOM 0 HG3 ARG B 405 11.499 6.414 -7.391 1.00 0.00 H new ATOM 0 HD2 ARG B 405 12.805 3.854 -6.578 1.00 0.00 H new ATOM 0 HD3 ARG B 405 11.468 3.712 -7.702 1.00 0.00 H new ATOM 0 HE ARG B 405 12.975 5.714 -8.840 1.00 0.00 H new ATOM 0 HH11 ARG B 405 13.694 2.479 -7.629 1.00 0.00 H new ATOM 0 HH12 ARG B 405 15.019 2.220 -8.767 1.00 0.00 H new ATOM 0 HH21 ARG B 405 14.680 5.376 -10.301 1.00 0.00 H new ATOM 0 HH22 ARG B 405 15.575 3.853 -10.274 1.00 0.00 H new ATOM 1704 N VAL B 406 11.337 8.680 -5.602 1.00 0.00 N ATOM 1705 CA VAL B 406 10.760 9.877 -6.186 1.00 0.00 C ATOM 1706 C VAL B 406 11.610 10.423 -7.323 1.00 0.00 C ATOM 1707 O VAL B 406 12.818 10.146 -7.414 1.00 0.00 O ATOM 1708 CB VAL B 406 10.587 10.976 -5.123 1.00 0.00 C ATOM 1709 CG1 VAL B 406 9.156 11.013 -4.633 1.00 0.00 C ATOM 1710 CG2 VAL B 406 11.530 10.744 -3.960 1.00 0.00 C ATOM 0 H VAL B 406 12.337 8.573 -5.771 1.00 0.00 H new ATOM 0 HA VAL B 406 9.787 9.590 -6.585 1.00 0.00 H new ATOM 0 HB VAL B 406 10.827 11.936 -5.579 1.00 0.00 H new ATOM 0 HG11 VAL B 406 9.049 11.795 -3.881 1.00 0.00 H new ATOM 0 HG12 VAL B 406 8.490 11.221 -5.470 1.00 0.00 H new ATOM 0 HG13 VAL B 406 8.897 10.050 -4.194 1.00 0.00 H new ATOM 0 HG21 VAL B 406 11.393 11.531 -3.218 1.00 0.00 H new ATOM 0 HG22 VAL B 406 11.317 9.776 -3.506 1.00 0.00 H new ATOM 0 HG23 VAL B 406 12.559 10.758 -4.318 1.00 0.00 H new ATOM 1720 N GLY B 407 10.955 11.199 -8.186 1.00 0.00 N ATOM 1721 CA GLY B 407 11.621 11.793 -9.326 1.00 0.00 C ATOM 1722 C GLY B 407 12.229 10.748 -10.233 1.00 0.00 C ATOM 1723 O GLY B 407 11.552 10.195 -11.100 1.00 0.00 O ATOM 0 H GLY B 407 9.964 11.426 -8.110 1.00 0.00 H new ATOM 0 HA2 GLY B 407 10.907 12.393 -9.891 1.00 0.00 H new ATOM 0 HA3 GLY B 407 12.401 12.470 -8.978 1.00 0.00 H new ATOM 1727 N ASP B 408 13.506 10.477 -10.026 1.00 0.00 N ATOM 1728 CA ASP B 408 14.215 9.487 -10.821 1.00 0.00 C ATOM 1729 C ASP B 408 15.551 9.149 -10.177 1.00 0.00 C ATOM 1730 O ASP B 408 16.497 8.759 -10.859 1.00 0.00 O ATOM 1731 CB ASP B 408 14.433 10.001 -12.244 1.00 0.00 C ATOM 1732 CG ASP B 408 13.361 9.523 -13.200 1.00 0.00 C ATOM 1733 OD1 ASP B 408 13.419 8.346 -13.619 1.00 0.00 O ATOM 1734 OD2 ASP B 408 12.459 10.322 -13.530 1.00 0.00 O ATOM 0 H ASP B 408 14.076 10.930 -9.311 1.00 0.00 H new ATOM 0 HA ASP B 408 13.608 8.583 -10.866 1.00 0.00 H new ATOM 0 HB2 ASP B 408 14.449 11.091 -12.235 1.00 0.00 H new ATOM 0 HB3 ASP B 408 15.408 9.671 -12.601 1.00 0.00 H new ATOM 1739 N GLY B 409 15.624 9.304 -8.858 1.00 0.00 N ATOM 1740 CA GLY B 409 16.859 9.007 -8.161 1.00 0.00 C ATOM 1741 C GLY B 409 16.801 9.301 -6.675 1.00 0.00 C ATOM 1742 O GLY B 409 17.833 9.550 -6.052 1.00 0.00 O ATOM 0 H GLY B 409 14.858 9.626 -8.266 1.00 0.00 H new ATOM 0 HA2 GLY B 409 17.105 7.955 -8.306 1.00 0.00 H new ATOM 0 HA3 GLY B 409 17.667 9.587 -8.607 1.00 0.00 H new ATOM 1746 N THR B 410 15.607 9.253 -6.093 1.00 0.00 N ATOM 1747 CA THR B 410 15.466 9.500 -4.665 1.00 0.00 C ATOM 1748 C THR B 410 14.638 8.404 -4.005 1.00 0.00 C ATOM 1749 O THR B 410 13.436 8.324 -4.208 1.00 0.00 O ATOM 1750 CB THR B 410 14.819 10.871 -4.387 1.00 0.00 C ATOM 1751 OG1 THR B 410 15.632 11.943 -4.883 1.00 0.00 O ATOM 1752 CG2 THR B 410 14.609 11.078 -2.895 1.00 0.00 C ATOM 0 H THR B 410 14.735 9.048 -6.581 1.00 0.00 H new ATOM 0 HA THR B 410 16.470 9.499 -4.240 1.00 0.00 H new ATOM 0 HB THR B 410 13.858 10.878 -4.902 1.00 0.00 H new ATOM 0 HG1 THR B 410 15.195 12.800 -4.694 1.00 0.00 H new ATOM 0 HG21 THR B 410 14.151 12.052 -2.724 1.00 0.00 H new ATOM 0 HG22 THR B 410 13.955 10.297 -2.508 1.00 0.00 H new ATOM 0 HG23 THR B 410 15.570 11.034 -2.383 1.00 0.00 H new ATOM 1760 N VAL B 411 15.287 7.562 -3.209 1.00 0.00 N ATOM 1761 CA VAL B 411 14.598 6.477 -2.516 1.00 0.00 C ATOM 1762 C VAL B 411 14.363 6.840 -1.058 1.00 0.00 C ATOM 1763 O VAL B 411 15.312 7.007 -0.292 1.00 0.00 O ATOM 1764 CB VAL B 411 15.406 5.168 -2.580 1.00 0.00 C ATOM 1765 CG1 VAL B 411 14.747 4.092 -1.730 1.00 0.00 C ATOM 1766 CG2 VAL B 411 15.548 4.703 -4.020 1.00 0.00 C ATOM 0 H VAL B 411 16.289 7.609 -3.027 1.00 0.00 H new ATOM 0 HA VAL B 411 13.642 6.328 -3.018 1.00 0.00 H new ATOM 0 HB VAL B 411 16.402 5.356 -2.180 1.00 0.00 H new ATOM 0 HG11 VAL B 411 15.332 3.174 -1.787 1.00 0.00 H new ATOM 0 HG12 VAL B 411 14.697 4.427 -0.694 1.00 0.00 H new ATOM 0 HG13 VAL B 411 13.739 3.903 -2.099 1.00 0.00 H new ATOM 0 HG21 VAL B 411 16.122 3.777 -4.048 1.00 0.00 H new ATOM 0 HG22 VAL B 411 14.560 4.531 -4.446 1.00 0.00 H new ATOM 0 HG23 VAL B 411 16.065 5.468 -4.600 1.00 0.00 H new ATOM 1776 N LEU B 412 13.098 6.953 -0.668 1.00 0.00 N ATOM 1777 CA LEU B 412 12.771 7.284 0.709 1.00 0.00 C ATOM 1778 C LEU B 412 13.074 6.098 1.606 1.00 0.00 C ATOM 1779 O LEU B 412 13.504 6.264 2.747 1.00 0.00 O ATOM 1780 CB LEU B 412 11.302 7.693 0.852 1.00 0.00 C ATOM 1781 CG LEU B 412 10.807 8.746 -0.147 1.00 0.00 C ATOM 1782 CD1 LEU B 412 11.899 9.758 -0.467 1.00 0.00 C ATOM 1783 CD2 LEU B 412 10.308 8.081 -1.421 1.00 0.00 C ATOM 0 H LEU B 412 12.292 6.822 -1.280 1.00 0.00 H new ATOM 0 HA LEU B 412 13.383 8.134 1.010 1.00 0.00 H new ATOM 0 HB2 LEU B 412 10.684 6.801 0.749 1.00 0.00 H new ATOM 0 HB3 LEU B 412 11.146 8.074 1.861 1.00 0.00 H new ATOM 0 HG LEU B 412 9.977 9.281 0.315 1.00 0.00 H new ATOM 0 HD11 LEU B 412 11.518 10.492 -1.178 1.00 0.00 H new ATOM 0 HD12 LEU B 412 12.205 10.264 0.448 1.00 0.00 H new ATOM 0 HD13 LEU B 412 12.756 9.243 -0.901 1.00 0.00 H new ATOM 0 HD21 LEU B 412 9.961 8.844 -2.118 1.00 0.00 H new ATOM 0 HD22 LEU B 412 11.120 7.515 -1.878 1.00 0.00 H new ATOM 0 HD23 LEU B 412 9.485 7.407 -1.182 1.00 0.00 H new ATOM 1795 N GLY B 413 12.851 4.895 1.084 1.00 0.00 N ATOM 1796 CA GLY B 413 13.115 3.703 1.864 1.00 0.00 C ATOM 1797 C GLY B 413 12.634 2.436 1.185 1.00 0.00 C ATOM 1798 O GLY B 413 12.157 2.470 0.051 1.00 0.00 O ATOM 0 H GLY B 413 12.495 4.727 0.143 1.00 0.00 H new ATOM 0 HA2 GLY B 413 14.186 3.626 2.049 1.00 0.00 H new ATOM 0 HA3 GLY B 413 12.629 3.796 2.835 1.00 0.00 H new ATOM 1802 N THR B 414 12.772 1.314 1.883 1.00 0.00 N ATOM 1803 CA THR B 414 12.363 0.021 1.344 1.00 0.00 C ATOM 1804 C THR B 414 11.824 -0.888 2.438 1.00 0.00 C ATOM 1805 O THR B 414 12.159 -0.727 3.611 1.00 0.00 O ATOM 1806 CB THR B 414 13.537 -0.685 0.644 1.00 0.00 C ATOM 1807 OG1 THR B 414 13.275 -2.084 0.467 1.00 0.00 O ATOM 1808 CG2 THR B 414 14.817 -0.532 1.450 1.00 0.00 C ATOM 0 H THR B 414 13.164 1.273 2.824 1.00 0.00 H new ATOM 0 HA THR B 414 11.574 0.216 0.618 1.00 0.00 H new ATOM 0 HB THR B 414 13.655 -0.214 -0.332 1.00 0.00 H new ATOM 0 HG1 THR B 414 12.410 -2.201 0.021 1.00 0.00 H new ATOM 0 HG21 THR B 414 15.633 -1.039 0.936 1.00 0.00 H new ATOM 0 HG22 THR B 414 15.056 0.526 1.556 1.00 0.00 H new ATOM 0 HG23 THR B 414 14.680 -0.973 2.437 1.00 0.00 H new ATOM 1816 N GLY B 415 10.990 -1.850 2.054 1.00 0.00 N ATOM 1817 CA GLY B 415 10.428 -2.764 3.030 1.00 0.00 C ATOM 1818 C GLY B 415 10.151 -4.137 2.453 1.00 0.00 C ATOM 1819 O GLY B 415 9.601 -4.259 1.362 1.00 0.00 O ATOM 0 H GLY B 415 10.695 -2.012 1.091 1.00 0.00 H new ATOM 0 HA2 GLY B 415 11.116 -2.859 3.870 1.00 0.00 H new ATOM 0 HA3 GLY B 415 9.501 -2.345 3.422 1.00 0.00 H new ATOM 1823 N VAL B 416 10.519 -5.176 3.193 1.00 0.00 N ATOM 1824 CA VAL B 416 10.297 -6.545 2.749 1.00 0.00 C ATOM 1825 C VAL B 416 9.532 -7.330 3.804 1.00 0.00 C ATOM 1826 O VAL B 416 9.617 -7.032 4.995 1.00 0.00 O ATOM 1827 CB VAL B 416 11.624 -7.272 2.451 1.00 0.00 C ATOM 1828 CG1 VAL B 416 12.347 -7.613 3.743 1.00 0.00 C ATOM 1829 CG2 VAL B 416 11.374 -8.527 1.625 1.00 0.00 C ATOM 0 H VAL B 416 10.972 -5.096 4.103 1.00 0.00 H new ATOM 0 HA VAL B 416 9.714 -6.491 1.829 1.00 0.00 H new ATOM 0 HB VAL B 416 12.260 -6.604 1.870 1.00 0.00 H new ATOM 0 HG11 VAL B 416 13.281 -8.126 3.513 1.00 0.00 H new ATOM 0 HG12 VAL B 416 12.562 -6.697 4.293 1.00 0.00 H new ATOM 0 HG13 VAL B 416 11.718 -8.262 4.352 1.00 0.00 H new ATOM 0 HG21 VAL B 416 12.322 -9.026 1.425 1.00 0.00 H new ATOM 0 HG22 VAL B 416 10.719 -9.201 2.177 1.00 0.00 H new ATOM 0 HG23 VAL B 416 10.902 -8.253 0.681 1.00 0.00 H new ATOM 1839 N GLY B 417 8.791 -8.334 3.364 1.00 0.00 N ATOM 1840 CA GLY B 417 8.027 -9.149 4.285 1.00 0.00 C ATOM 1841 C GLY B 417 7.664 -10.484 3.674 1.00 0.00 C ATOM 1842 O GLY B 417 7.818 -10.667 2.472 1.00 0.00 O ATOM 0 H GLY B 417 8.704 -8.600 2.383 1.00 0.00 H new ATOM 0 HA2 GLY B 417 8.604 -9.309 5.196 1.00 0.00 H new ATOM 0 HA3 GLY B 417 7.118 -8.620 4.573 1.00 0.00 H new ATOM 1846 N ARG B 418 7.194 -11.419 4.498 1.00 0.00 N ATOM 1847 CA ARG B 418 6.824 -12.753 4.022 1.00 0.00 C ATOM 1848 C ARG B 418 5.544 -12.732 3.182 1.00 0.00 C ATOM 1849 O ARG B 418 5.466 -13.398 2.150 1.00 0.00 O ATOM 1850 CB ARG B 418 6.662 -13.712 5.203 1.00 0.00 C ATOM 1851 CG ARG B 418 5.416 -13.458 6.034 1.00 0.00 C ATOM 1852 CD ARG B 418 5.590 -13.949 7.463 1.00 0.00 C ATOM 1853 NE ARG B 418 5.813 -15.391 7.525 1.00 0.00 N ATOM 1854 CZ ARG B 418 4.848 -16.293 7.372 1.00 0.00 C ATOM 1855 NH1 ARG B 418 3.603 -15.900 7.144 1.00 0.00 N ATOM 1856 NH2 ARG B 418 5.128 -17.586 7.448 1.00 0.00 N ATOM 0 H ARG B 418 7.060 -11.278 5.499 1.00 0.00 H new ATOM 0 HA ARG B 418 7.632 -13.103 3.379 1.00 0.00 H new ATOM 0 HB2 ARG B 418 6.634 -14.735 4.827 1.00 0.00 H new ATOM 0 HB3 ARG B 418 7.538 -13.633 5.846 1.00 0.00 H new ATOM 0 HG2 ARG B 418 5.192 -12.391 6.039 1.00 0.00 H new ATOM 0 HG3 ARG B 418 4.564 -13.960 5.577 1.00 0.00 H new ATOM 0 HD2 ARG B 418 6.432 -13.432 7.923 1.00 0.00 H new ATOM 0 HD3 ARG B 418 4.704 -13.694 8.044 1.00 0.00 H new ATOM 0 HE ARG B 418 6.762 -15.725 7.695 1.00 0.00 H new ATOM 0 HH11 ARG B 418 3.385 -14.905 7.086 1.00 0.00 H new ATOM 0 HH12 ARG B 418 2.863 -16.592 7.027 1.00 0.00 H new ATOM 0 HH21 ARG B 418 6.085 -17.891 7.624 1.00 0.00 H new ATOM 0 HH22 ARG B 418 4.386 -18.276 7.330 1.00 0.00 H new ATOM 1870 N ASN B 419 4.546 -11.965 3.616 1.00 0.00 N ATOM 1871 CA ASN B 419 3.284 -11.868 2.881 1.00 0.00 C ATOM 1872 C ASN B 419 3.164 -10.518 2.189 1.00 0.00 C ATOM 1873 O ASN B 419 2.070 -9.980 2.052 1.00 0.00 O ATOM 1874 CB ASN B 419 2.090 -12.067 3.812 1.00 0.00 C ATOM 1875 CG ASN B 419 2.412 -11.732 5.254 1.00 0.00 C ATOM 1876 OD1 ASN B 419 3.031 -12.523 5.964 1.00 0.00 O ATOM 1877 ND2 ASN B 419 1.987 -10.554 5.697 1.00 0.00 N ATOM 0 H ASN B 419 4.584 -11.404 4.467 1.00 0.00 H new ATOM 0 HA ASN B 419 3.282 -12.658 2.130 1.00 0.00 H new ATOM 0 HB2 ASN B 419 1.263 -11.443 3.474 1.00 0.00 H new ATOM 0 HB3 ASN B 419 1.754 -13.102 3.750 1.00 0.00 H new ATOM 0 HD21 ASN B 419 2.171 -10.275 6.661 1.00 0.00 H new ATOM 0 HD22 ASN B 419 1.477 -9.928 5.073 1.00 0.00 H new ATOM 1884 N ILE B 420 4.302 -10.001 1.744 1.00 0.00 N ATOM 1885 CA ILE B 420 4.396 -8.717 1.037 1.00 0.00 C ATOM 1886 C ILE B 420 3.810 -7.523 1.806 1.00 0.00 C ATOM 1887 O ILE B 420 4.410 -6.452 1.804 1.00 0.00 O ATOM 1888 CB ILE B 420 3.786 -8.784 -0.375 1.00 0.00 C ATOM 1889 CG1 ILE B 420 2.297 -8.423 -0.377 1.00 0.00 C ATOM 1890 CG2 ILE B 420 4.002 -10.167 -0.975 1.00 0.00 C ATOM 1891 CD1 ILE B 420 2.021 -7.000 -0.811 1.00 0.00 C ATOM 0 H ILE B 420 5.203 -10.464 1.863 1.00 0.00 H new ATOM 0 HA ILE B 420 5.468 -8.538 0.955 1.00 0.00 H new ATOM 0 HB ILE B 420 4.297 -8.043 -0.990 1.00 0.00 H new ATOM 0 HG12 ILE B 420 1.767 -9.106 -1.041 1.00 0.00 H new ATOM 0 HG13 ILE B 420 1.893 -8.574 0.624 1.00 0.00 H new ATOM 0 HG21 ILE B 420 3.566 -10.202 -1.974 1.00 0.00 H new ATOM 0 HG22 ILE B 420 5.070 -10.374 -1.038 1.00 0.00 H new ATOM 0 HG23 ILE B 420 3.524 -10.916 -0.344 1.00 0.00 H new ATOM 0 HD11 ILE B 420 0.947 -6.815 -0.789 1.00 0.00 H new ATOM 0 HD12 ILE B 420 2.523 -6.309 -0.133 1.00 0.00 H new ATOM 0 HD13 ILE B 420 2.394 -6.850 -1.824 1.00 0.00 H new ATOM 1903 N LYS B 421 2.652 -7.674 2.446 1.00 0.00 N ATOM 1904 CA LYS B 421 2.068 -6.558 3.181 1.00 0.00 C ATOM 1905 C LYS B 421 3.138 -5.872 4.003 1.00 0.00 C ATOM 1906 O LYS B 421 3.455 -4.703 3.780 1.00 0.00 O ATOM 1907 CB LYS B 421 0.928 -7.009 4.077 1.00 0.00 C ATOM 1908 CG LYS B 421 -0.324 -6.209 3.822 1.00 0.00 C ATOM 1909 CD LYS B 421 -0.849 -6.476 2.426 1.00 0.00 C ATOM 1910 CE LYS B 421 -2.115 -7.313 2.453 1.00 0.00 C ATOM 1911 NZ LYS B 421 -2.215 -8.199 1.261 1.00 0.00 N ATOM 0 H LYS B 421 2.111 -8.538 2.471 1.00 0.00 H new ATOM 0 HA LYS B 421 1.657 -5.856 2.456 1.00 0.00 H new ATOM 0 HB2 LYS B 421 0.726 -8.067 3.907 1.00 0.00 H new ATOM 0 HB3 LYS B 421 1.221 -6.905 5.122 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -1.085 -6.468 4.559 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -0.114 -5.146 3.941 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -1.050 -5.529 1.925 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -0.085 -6.990 1.842 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -2.131 -7.919 3.359 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -2.984 -6.657 2.493 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -3.092 -8.755 1.314 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -2.225 -7.619 0.397 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -1.398 -8.842 1.237 1.00 0.00 H new ATOM 1925 N ILE B 422 3.725 -6.619 4.927 1.00 0.00 N ATOM 1926 CA ILE B 422 4.805 -6.083 5.752 1.00 0.00 C ATOM 1927 C ILE B 422 5.782 -5.331 4.867 1.00 0.00 C ATOM 1928 O ILE B 422 6.504 -4.458 5.329 1.00 0.00 O ATOM 1929 CB ILE B 422 5.598 -7.166 6.514 1.00 0.00 C ATOM 1930 CG1 ILE B 422 4.864 -8.505 6.504 1.00 0.00 C ATOM 1931 CG2 ILE B 422 5.873 -6.702 7.936 1.00 0.00 C ATOM 1932 CD1 ILE B 422 4.959 -9.225 5.175 1.00 0.00 C ATOM 0 H ILE B 422 3.477 -7.588 5.125 1.00 0.00 H new ATOM 0 HA ILE B 422 4.333 -5.436 6.491 1.00 0.00 H new ATOM 0 HB ILE B 422 6.550 -7.318 6.005 1.00 0.00 H new ATOM 0 HG12 ILE B 422 5.275 -9.143 7.286 1.00 0.00 H new ATOM 0 HG13 ILE B 422 3.814 -8.339 6.746 1.00 0.00 H new ATOM 0 HG21 ILE B 422 6.433 -7.471 8.468 1.00 0.00 H new ATOM 0 HG22 ILE B 422 6.455 -5.781 7.912 1.00 0.00 H new ATOM 0 HG23 ILE B 422 4.928 -6.521 8.449 1.00 0.00 H new ATOM 0 HD11 ILE B 422 4.417 -10.169 5.233 1.00 0.00 H new ATOM 0 HD12 ILE B 422 4.523 -8.604 4.393 1.00 0.00 H new ATOM 0 HD13 ILE B 422 6.005 -9.421 4.941 1.00 0.00 H new ATOM 1944 N ALA B 423 5.766 -5.661 3.580 1.00 0.00 N ATOM 1945 CA ALA B 423 6.613 -5.004 2.612 1.00 0.00 C ATOM 1946 C ALA B 423 5.923 -3.742 2.101 1.00 0.00 C ATOM 1947 O ALA B 423 6.511 -2.661 2.110 1.00 0.00 O ATOM 1948 CB ALA B 423 6.954 -5.945 1.473 1.00 0.00 C ATOM 0 H ALA B 423 5.167 -6.388 3.188 1.00 0.00 H new ATOM 0 HA ALA B 423 7.550 -4.718 3.091 1.00 0.00 H new ATOM 0 HB1 ALA B 423 7.593 -5.431 0.755 1.00 0.00 H new ATOM 0 HB2 ALA B 423 7.478 -6.817 1.866 1.00 0.00 H new ATOM 0 HB3 ALA B 423 6.037 -6.265 0.979 1.00 0.00 H new ATOM 1954 N GLY B 424 4.663 -3.874 1.673 1.00 0.00 N ATOM 1955 CA GLY B 424 3.933 -2.715 1.190 1.00 0.00 C ATOM 1956 C GLY B 424 3.870 -1.635 2.247 1.00 0.00 C ATOM 1957 O GLY B 424 4.078 -0.449 1.969 1.00 0.00 O ATOM 0 H GLY B 424 4.144 -4.752 1.654 1.00 0.00 H new ATOM 0 HA2 GLY B 424 4.415 -2.324 0.294 1.00 0.00 H new ATOM 0 HA3 GLY B 424 2.923 -3.010 0.905 1.00 0.00 H new ATOM 1961 N ILE B 425 3.618 -2.063 3.475 1.00 0.00 N ATOM 1962 CA ILE B 425 3.565 -1.147 4.600 1.00 0.00 C ATOM 1963 C ILE B 425 4.973 -0.662 4.908 1.00 0.00 C ATOM 1964 O ILE B 425 5.276 0.522 4.768 1.00 0.00 O ATOM 1965 CB ILE B 425 2.943 -1.810 5.844 1.00 0.00 C ATOM 1966 CG1 ILE B 425 1.433 -1.975 5.651 1.00 0.00 C ATOM 1967 CG2 ILE B 425 3.239 -0.986 7.090 1.00 0.00 C ATOM 1968 CD1 ILE B 425 1.030 -2.282 4.221 1.00 0.00 C ATOM 0 H ILE B 425 3.447 -3.039 3.716 1.00 0.00 H new ATOM 0 HA ILE B 425 2.930 -0.303 4.333 1.00 0.00 H new ATOM 0 HB ILE B 425 3.387 -2.797 5.976 1.00 0.00 H new ATOM 0 HG12 ILE B 425 1.078 -2.777 6.299 1.00 0.00 H new ATOM 0 HG13 ILE B 425 0.933 -1.061 5.972 1.00 0.00 H new ATOM 0 HG21 ILE B 425 2.793 -1.468 7.960 1.00 0.00 H new ATOM 0 HG22 ILE B 425 4.317 -0.912 7.230 1.00 0.00 H new ATOM 0 HG23 ILE B 425 2.819 0.013 6.974 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -0.054 -2.385 4.163 1.00 0.00 H new ATOM 0 HD12 ILE B 425 1.353 -1.470 3.570 1.00 0.00 H new ATOM 0 HD13 ILE B 425 1.501 -3.212 3.902 1.00 0.00 H new ATOM 1980 N ARG B 426 5.838 -1.591 5.297 1.00 0.00 N ATOM 1981 CA ARG B 426 7.224 -1.260 5.587 1.00 0.00 C ATOM 1982 C ARG B 426 7.746 -0.277 4.545 1.00 0.00 C ATOM 1983 O ARG B 426 8.578 0.579 4.841 1.00 0.00 O ATOM 1984 CB ARG B 426 8.078 -2.530 5.589 1.00 0.00 C ATOM 1985 CG ARG B 426 9.567 -2.277 5.724 1.00 0.00 C ATOM 1986 CD ARG B 426 9.952 -2.004 7.167 1.00 0.00 C ATOM 1987 NE ARG B 426 11.390 -2.122 7.389 1.00 0.00 N ATOM 1988 CZ ARG B 426 11.997 -3.268 7.680 1.00 0.00 C ATOM 1989 NH1 ARG B 426 11.297 -4.392 7.740 1.00 0.00 N ATOM 1990 NH2 ARG B 426 13.304 -3.293 7.903 1.00 0.00 N ATOM 0 H ARG B 426 5.603 -2.576 5.418 1.00 0.00 H new ATOM 0 HA ARG B 426 7.283 -0.799 6.573 1.00 0.00 H new ATOM 0 HB2 ARG B 426 7.754 -3.171 6.409 1.00 0.00 H new ATOM 0 HB3 ARG B 426 7.896 -3.078 4.665 1.00 0.00 H new ATOM 0 HG2 ARG B 426 10.120 -3.141 5.355 1.00 0.00 H new ATOM 0 HG3 ARG B 426 9.851 -1.428 5.103 1.00 0.00 H new ATOM 0 HD2 ARG B 426 9.625 -1.002 7.445 1.00 0.00 H new ATOM 0 HD3 ARG B 426 9.428 -2.703 7.819 1.00 0.00 H new ATOM 0 HE ARG B 426 11.960 -1.279 7.317 1.00 0.00 H new ATOM 0 HH11 ARG B 426 10.293 -4.377 7.563 1.00 0.00 H new ATOM 0 HH12 ARG B 426 11.763 -5.272 7.963 1.00 0.00 H new ATOM 0 HH21 ARG B 426 13.847 -2.431 7.851 1.00 0.00 H new ATOM 0 HH22 ARG B 426 13.767 -4.174 8.126 1.00 0.00 H new ATOM 2004 N ALA B 427 7.222 -0.389 3.326 1.00 0.00 N ATOM 2005 CA ALA B 427 7.609 0.505 2.246 1.00 0.00 C ATOM 2006 C ALA B 427 7.180 1.924 2.585 1.00 0.00 C ATOM 2007 O ALA B 427 8.009 2.827 2.702 1.00 0.00 O ATOM 2008 CB ALA B 427 6.999 0.065 0.923 1.00 0.00 C ATOM 0 H ALA B 427 6.529 -1.091 3.065 1.00 0.00 H new ATOM 0 HA ALA B 427 8.693 0.471 2.136 1.00 0.00 H new ATOM 0 HB1 ALA B 427 7.306 0.752 0.134 1.00 0.00 H new ATOM 0 HB2 ALA B 427 7.342 -0.941 0.681 1.00 0.00 H new ATOM 0 HB3 ALA B 427 5.912 0.068 1.005 1.00 0.00 H new ATOM 2014 N ALA B 428 5.879 2.111 2.762 1.00 0.00 N ATOM 2015 CA ALA B 428 5.357 3.421 3.115 1.00 0.00 C ATOM 2016 C ALA B 428 6.008 3.891 4.410 1.00 0.00 C ATOM 2017 O ALA B 428 6.566 4.989 4.485 1.00 0.00 O ATOM 2018 CB ALA B 428 3.844 3.391 3.259 1.00 0.00 C ATOM 0 H ALA B 428 5.174 1.380 2.668 1.00 0.00 H new ATOM 0 HA ALA B 428 5.596 4.120 2.314 1.00 0.00 H new ATOM 0 HB1 ALA B 428 3.484 4.385 3.523 1.00 0.00 H new ATOM 0 HB2 ALA B 428 3.395 3.081 2.315 1.00 0.00 H new ATOM 0 HB3 ALA B 428 3.567 2.685 4.042 1.00 0.00 H new ATOM 2024 N GLU B 429 5.954 3.031 5.424 1.00 0.00 N ATOM 2025 CA GLU B 429 6.552 3.330 6.714 1.00 0.00 C ATOM 2026 C GLU B 429 8.024 3.676 6.540 1.00 0.00 C ATOM 2027 O GLU B 429 8.616 4.347 7.381 1.00 0.00 O ATOM 2028 CB GLU B 429 6.402 2.136 7.657 1.00 0.00 C ATOM 2029 CG GLU B 429 4.960 1.814 8.012 1.00 0.00 C ATOM 2030 CD GLU B 429 4.325 2.872 8.892 1.00 0.00 C ATOM 2031 OE1 GLU B 429 5.070 3.575 9.609 1.00 0.00 O ATOM 2032 OE2 GLU B 429 3.082 2.998 8.866 1.00 0.00 O ATOM 0 H GLU B 429 5.500 2.119 5.373 1.00 0.00 H new ATOM 0 HA GLU B 429 6.036 4.186 7.149 1.00 0.00 H new ATOM 0 HB2 GLU B 429 6.857 1.260 7.195 1.00 0.00 H new ATOM 0 HB3 GLU B 429 6.956 2.337 8.574 1.00 0.00 H new ATOM 0 HG2 GLU B 429 4.378 1.712 7.096 1.00 0.00 H new ATOM 0 HG3 GLU B 429 4.922 0.852 8.522 1.00 0.00 H new ATOM 2039 N ASN B 430 8.595 3.230 5.422 1.00 0.00 N ATOM 2040 CA ASN B 430 9.992 3.503 5.105 1.00 0.00 C ATOM 2041 C ASN B 430 10.148 4.938 4.613 1.00 0.00 C ATOM 2042 O ASN B 430 11.118 5.619 4.948 1.00 0.00 O ATOM 2043 CB ASN B 430 10.493 2.526 4.045 1.00 0.00 C ATOM 2044 CG ASN B 430 11.457 1.512 4.618 1.00 0.00 C ATOM 2045 OD1 ASN B 430 12.658 1.553 4.351 1.00 0.00 O ATOM 2046 ND2 ASN B 430 10.931 0.590 5.414 1.00 0.00 N ATOM 0 H ASN B 430 8.107 2.675 4.719 1.00 0.00 H new ATOM 0 HA ASN B 430 10.588 3.375 6.009 1.00 0.00 H new ATOM 0 HB2 ASN B 430 9.644 2.007 3.600 1.00 0.00 H new ATOM 0 HB3 ASN B 430 10.983 3.080 3.244 1.00 0.00 H new ATOM 0 HD21 ASN B 430 11.528 -0.123 5.832 1.00 0.00 H new ATOM 0 HD22 ASN B 430 9.930 0.595 5.608 1.00 0.00 H new ATOM 2053 N ALA B 431 9.177 5.394 3.826 1.00 0.00 N ATOM 2054 CA ALA B 431 9.195 6.747 3.298 1.00 0.00 C ATOM 2055 C ALA B 431 9.139 7.738 4.444 1.00 0.00 C ATOM 2056 O ALA B 431 9.724 8.820 4.384 1.00 0.00 O ATOM 2057 CB ALA B 431 8.041 6.975 2.332 1.00 0.00 C ATOM 0 H ALA B 431 8.368 4.842 3.542 1.00 0.00 H new ATOM 0 HA ALA B 431 10.121 6.894 2.742 1.00 0.00 H new ATOM 0 HB1 ALA B 431 8.080 7.996 1.953 1.00 0.00 H new ATOM 0 HB2 ALA B 431 8.120 6.276 1.500 1.00 0.00 H new ATOM 0 HB3 ALA B 431 7.096 6.817 2.851 1.00 0.00 H new ATOM 2063 N LEU B 432 8.445 7.340 5.500 1.00 0.00 N ATOM 2064 CA LEU B 432 8.324 8.169 6.687 1.00 0.00 C ATOM 2065 C LEU B 432 9.350 7.742 7.730 1.00 0.00 C ATOM 2066 O LEU B 432 9.376 8.272 8.841 1.00 0.00 O ATOM 2067 CB LEU B 432 6.912 8.081 7.267 1.00 0.00 C ATOM 2068 CG LEU B 432 6.303 6.679 7.285 1.00 0.00 C ATOM 2069 CD1 LEU B 432 5.609 6.414 8.612 1.00 0.00 C ATOM 2070 CD2 LEU B 432 5.332 6.509 6.130 1.00 0.00 C ATOM 0 H LEU B 432 7.957 6.446 5.558 1.00 0.00 H new ATOM 0 HA LEU B 432 8.514 9.205 6.406 1.00 0.00 H new ATOM 0 HB2 LEU B 432 6.931 8.465 8.287 1.00 0.00 H new ATOM 0 HB3 LEU B 432 6.258 8.737 6.692 1.00 0.00 H new ATOM 0 HG LEU B 432 7.107 5.952 7.170 1.00 0.00 H new ATOM 0 HD11 LEU B 432 5.182 5.411 8.605 1.00 0.00 H new ATOM 0 HD12 LEU B 432 6.332 6.495 9.423 1.00 0.00 H new ATOM 0 HD13 LEU B 432 4.815 7.146 8.760 1.00 0.00 H new ATOM 0 HD21 LEU B 432 4.907 5.506 6.157 1.00 0.00 H new ATOM 0 HD22 LEU B 432 4.532 7.244 6.216 1.00 0.00 H new ATOM 0 HD23 LEU B 432 5.859 6.655 5.187 1.00 0.00 H new ATOM 2082 N ARG B 433 10.199 6.777 7.367 1.00 0.00 N ATOM 2083 CA ARG B 433 11.225 6.285 8.282 1.00 0.00 C ATOM 2084 C ARG B 433 12.507 7.084 8.134 1.00 0.00 C ATOM 2085 O ARG B 433 13.580 6.636 8.536 1.00 0.00 O ATOM 2086 CB ARG B 433 11.519 4.805 8.033 1.00 0.00 C ATOM 2087 CG ARG B 433 12.097 4.093 9.245 1.00 0.00 C ATOM 2088 CD ARG B 433 11.579 2.668 9.351 1.00 0.00 C ATOM 2089 NE ARG B 433 11.044 2.379 10.678 1.00 0.00 N ATOM 2090 CZ ARG B 433 10.260 1.338 10.946 1.00 0.00 C ATOM 2091 NH1 ARG B 433 9.912 0.501 9.978 1.00 0.00 N ATOM 2092 NH2 ARG B 433 9.821 1.135 12.180 1.00 0.00 N ATOM 0 H ARG B 433 10.195 6.325 6.452 1.00 0.00 H new ATOM 0 HA ARG B 433 10.843 6.404 9.296 1.00 0.00 H new ATOM 0 HB2 ARG B 433 10.599 4.305 7.732 1.00 0.00 H new ATOM 0 HB3 ARG B 433 12.217 4.716 7.201 1.00 0.00 H new ATOM 0 HG2 ARG B 433 13.185 4.082 9.178 1.00 0.00 H new ATOM 0 HG3 ARG B 433 11.839 4.644 10.150 1.00 0.00 H new ATOM 0 HD2 ARG B 433 10.802 2.508 8.604 1.00 0.00 H new ATOM 0 HD3 ARG B 433 12.386 1.971 9.126 1.00 0.00 H new ATOM 0 HE ARG B 433 11.285 3.010 11.442 1.00 0.00 H new ATOM 0 HH11 ARG B 433 10.245 0.655 9.026 1.00 0.00 H new ATOM 0 HH12 ARG B 433 9.311 -0.297 10.185 1.00 0.00 H new ATOM 0 HH21 ARG B 433 10.084 1.778 12.927 1.00 0.00 H new ATOM 0 HH22 ARG B 433 9.220 0.336 12.383 1.00 0.00 H new ATOM 2106 N ASP B 434 12.392 8.276 7.566 1.00 0.00 N ATOM 2107 CA ASP B 434 13.547 9.141 7.379 1.00 0.00 C ATOM 2108 C ASP B 434 13.203 10.576 7.761 1.00 0.00 C ATOM 2109 O ASP B 434 12.919 11.407 6.900 1.00 0.00 O ATOM 2110 CB ASP B 434 14.024 9.082 5.929 1.00 0.00 C ATOM 2111 CG ASP B 434 14.567 7.717 5.556 1.00 0.00 C ATOM 2112 OD1 ASP B 434 15.755 7.453 5.837 1.00 0.00 O ATOM 2113 OD2 ASP B 434 13.805 6.909 4.985 1.00 0.00 O ATOM 0 H ASP B 434 11.512 8.665 7.227 1.00 0.00 H new ATOM 0 HA ASP B 434 14.351 8.791 8.027 1.00 0.00 H new ATOM 0 HB2 ASP B 434 13.196 9.335 5.266 1.00 0.00 H new ATOM 0 HB3 ASP B 434 14.798 9.833 5.773 1.00 0.00 H new ATOM 2118 N LYS B 435 13.230 10.859 9.060 1.00 0.00 N ATOM 2119 CA LYS B 435 12.918 12.195 9.550 1.00 0.00 C ATOM 2120 C LYS B 435 13.669 13.245 8.734 1.00 0.00 C ATOM 2121 O LYS B 435 13.061 14.140 8.149 1.00 0.00 O ATOM 2122 CB LYS B 435 13.258 12.313 11.042 1.00 0.00 C ATOM 2123 CG LYS B 435 14.660 12.826 11.325 1.00 0.00 C ATOM 2124 CD LYS B 435 14.880 13.066 12.806 1.00 0.00 C ATOM 2125 CE LYS B 435 14.012 14.204 13.317 1.00 0.00 C ATOM 2126 NZ LYS B 435 14.774 15.129 14.200 1.00 0.00 N ATOM 0 H LYS B 435 13.464 10.184 9.788 1.00 0.00 H new ATOM 0 HA LYS B 435 11.849 12.371 9.433 1.00 0.00 H new ATOM 0 HB2 LYS B 435 12.537 12.980 11.515 1.00 0.00 H new ATOM 0 HB3 LYS B 435 13.141 11.335 11.508 1.00 0.00 H new ATOM 0 HG2 LYS B 435 15.392 12.105 10.960 1.00 0.00 H new ATOM 0 HG3 LYS B 435 14.826 13.754 10.777 1.00 0.00 H new ATOM 0 HD2 LYS B 435 14.654 12.156 13.361 1.00 0.00 H new ATOM 0 HD3 LYS B 435 15.930 13.297 12.987 1.00 0.00 H new ATOM 0 HE2 LYS B 435 13.607 14.760 12.471 1.00 0.00 H new ATOM 0 HE3 LYS B 435 13.163 13.795 13.865 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 14.147 15.891 14.528 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 15.139 14.604 15.020 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 15.569 15.539 13.670 1.00 0.00 H new ATOM 2140 N LYS B 436 14.991 13.128 8.701 1.00 0.00 N ATOM 2141 CA LYS B 436 15.822 14.065 7.960 1.00 0.00 C ATOM 2142 C LYS B 436 15.284 14.244 6.546 1.00 0.00 C ATOM 2143 O LYS B 436 15.219 15.359 6.029 1.00 0.00 O ATOM 2144 CB LYS B 436 17.270 13.572 7.919 1.00 0.00 C ATOM 2145 CG LYS B 436 17.702 12.855 9.189 1.00 0.00 C ATOM 2146 CD LYS B 436 19.087 13.294 9.634 1.00 0.00 C ATOM 2147 CE LYS B 436 20.132 12.987 8.575 1.00 0.00 C ATOM 2148 NZ LYS B 436 21.386 13.760 8.787 1.00 0.00 N ATOM 0 H LYS B 436 15.510 12.392 9.180 1.00 0.00 H new ATOM 0 HA LYS B 436 15.797 15.030 8.467 1.00 0.00 H new ATOM 0 HB2 LYS B 436 17.392 12.898 7.071 1.00 0.00 H new ATOM 0 HB3 LYS B 436 17.930 14.422 7.748 1.00 0.00 H new ATOM 0 HG2 LYS B 436 16.983 13.055 9.983 1.00 0.00 H new ATOM 0 HG3 LYS B 436 17.698 11.778 9.019 1.00 0.00 H new ATOM 0 HD2 LYS B 436 19.082 14.364 9.843 1.00 0.00 H new ATOM 0 HD3 LYS B 436 19.349 12.789 10.564 1.00 0.00 H new ATOM 0 HE2 LYS B 436 20.357 11.921 8.587 1.00 0.00 H new ATOM 0 HE3 LYS B 436 19.727 13.216 7.589 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 22.072 13.520 8.043 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 21.177 14.778 8.750 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 21.787 13.522 9.717 1.00 0.00 H new ATOM 2162 N MET B 437 14.891 13.134 5.932 1.00 0.00 N ATOM 2163 CA MET B 437 14.347 13.154 4.580 1.00 0.00 C ATOM 2164 C MET B 437 12.962 13.797 4.568 1.00 0.00 C ATOM 2165 O MET B 437 12.688 14.698 3.777 1.00 0.00 O ATOM 2166 CB MET B 437 14.275 11.731 4.030 1.00 0.00 C ATOM 2167 CG MET B 437 13.504 11.615 2.730 1.00 0.00 C ATOM 2168 SD MET B 437 12.589 10.066 2.606 1.00 0.00 S ATOM 2169 CE MET B 437 10.902 10.663 2.649 1.00 0.00 C ATOM 0 H MET B 437 14.939 12.205 6.351 1.00 0.00 H new ATOM 0 HA MET B 437 15.005 13.748 3.946 1.00 0.00 H new ATOM 0 HB2 MET B 437 15.288 11.360 3.875 1.00 0.00 H new ATOM 0 HB3 MET B 437 13.810 11.086 4.776 1.00 0.00 H new ATOM 0 HG2 MET B 437 12.810 12.451 2.647 1.00 0.00 H new ATOM 0 HG3 MET B 437 14.197 11.692 1.892 1.00 0.00 H new ATOM 0 HE1 MET B 437 10.216 9.822 2.545 1.00 0.00 H new ATOM 0 HE2 MET B 437 10.718 11.166 3.598 1.00 0.00 H new ATOM 0 HE3 MET B 437 10.743 11.364 1.830 1.00 0.00 H new ATOM 2179 N LEU B 438 12.096 13.329 5.458 1.00 0.00 N ATOM 2180 CA LEU B 438 10.743 13.862 5.564 1.00 0.00 C ATOM 2181 C LEU B 438 10.775 15.379 5.667 1.00 0.00 C ATOM 2182 O LEU B 438 10.225 16.094 4.824 1.00 0.00 O ATOM 2183 CB LEU B 438 10.053 13.290 6.798 1.00 0.00 C ATOM 2184 CG LEU B 438 9.691 11.809 6.716 1.00 0.00 C ATOM 2185 CD1 LEU B 438 9.214 11.311 8.067 1.00 0.00 C ATOM 2186 CD2 LEU B 438 8.628 11.581 5.654 1.00 0.00 C ATOM 0 H LEU B 438 12.307 12.580 6.118 1.00 0.00 H new ATOM 0 HA LEU B 438 10.190 13.576 4.669 1.00 0.00 H new ATOM 0 HB2 LEU B 438 10.703 13.441 7.660 1.00 0.00 H new ATOM 0 HB3 LEU B 438 9.142 13.860 6.982 1.00 0.00 H new ATOM 0 HG LEU B 438 10.581 11.246 6.435 1.00 0.00 H new ATOM 0 HD11 LEU B 438 8.959 10.254 7.996 1.00 0.00 H new ATOM 0 HD12 LEU B 438 10.006 11.444 8.804 1.00 0.00 H new ATOM 0 HD13 LEU B 438 8.334 11.877 8.373 1.00 0.00 H new ATOM 0 HD21 LEU B 438 8.381 10.520 5.608 1.00 0.00 H new ATOM 0 HD22 LEU B 438 7.734 12.151 5.906 1.00 0.00 H new ATOM 0 HD23 LEU B 438 9.006 11.908 4.685 1.00 0.00 H new ATOM 2198 N ASP B 439 11.446 15.861 6.704 1.00 0.00 N ATOM 2199 CA ASP B 439 11.584 17.291 6.924 1.00 0.00 C ATOM 2200 C ASP B 439 12.270 17.925 5.723 1.00 0.00 C ATOM 2201 O ASP B 439 11.870 18.991 5.248 1.00 0.00 O ATOM 2202 CB ASP B 439 12.386 17.562 8.200 1.00 0.00 C ATOM 2203 CG ASP B 439 12.370 19.028 8.588 1.00 0.00 C ATOM 2204 OD1 ASP B 439 11.279 19.635 8.565 1.00 0.00 O ATOM 2205 OD2 ASP B 439 13.449 19.567 8.913 1.00 0.00 O ATOM 0 H ASP B 439 11.904 15.280 7.407 1.00 0.00 H new ATOM 0 HA ASP B 439 10.594 17.730 7.045 1.00 0.00 H new ATOM 0 HB2 ASP B 439 11.977 16.968 9.017 1.00 0.00 H new ATOM 0 HB3 ASP B 439 13.417 17.238 8.055 1.00 0.00 H new ATOM 2210 N PHE B 440 13.304 17.250 5.231 1.00 0.00 N ATOM 2211 CA PHE B 440 14.038 17.741 4.075 1.00 0.00 C ATOM 2212 C PHE B 440 13.043 18.255 3.043 1.00 0.00 C ATOM 2213 O PHE B 440 13.169 19.367 2.526 1.00 0.00 O ATOM 2214 CB PHE B 440 14.925 16.636 3.483 1.00 0.00 C ATOM 2215 CG PHE B 440 15.037 16.670 1.981 1.00 0.00 C ATOM 2216 CD1 PHE B 440 15.262 17.865 1.317 1.00 0.00 C ATOM 2217 CD2 PHE B 440 14.915 15.507 1.237 1.00 0.00 C ATOM 2218 CE1 PHE B 440 15.364 17.900 -0.061 1.00 0.00 C ATOM 2219 CE2 PHE B 440 15.015 15.535 -0.140 1.00 0.00 C ATOM 2220 CZ PHE B 440 15.239 16.733 -0.791 1.00 0.00 C ATOM 0 H PHE B 440 13.649 16.369 5.612 1.00 0.00 H new ATOM 0 HA PHE B 440 14.695 18.556 4.379 1.00 0.00 H new ATOM 0 HB2 PHE B 440 15.924 16.719 3.912 1.00 0.00 H new ATOM 0 HB3 PHE B 440 14.528 15.667 3.784 1.00 0.00 H new ATOM 0 HD1 PHE B 440 15.359 18.780 1.883 1.00 0.00 H new ATOM 0 HD2 PHE B 440 14.740 14.568 1.740 1.00 0.00 H new ATOM 0 HE1 PHE B 440 15.541 18.838 -0.567 1.00 0.00 H new ATOM 0 HE2 PHE B 440 14.918 14.621 -0.708 1.00 0.00 H new ATOM 0 HZ PHE B 440 15.316 16.757 -1.868 1.00 0.00 H new ATOM 2230 N TYR B 441 12.040 17.431 2.766 1.00 0.00 N ATOM 2231 CA TYR B 441 11.007 17.786 1.814 1.00 0.00 C ATOM 2232 C TYR B 441 10.243 19.004 2.288 1.00 0.00 C ATOM 2233 O TYR B 441 10.032 19.933 1.519 1.00 0.00 O ATOM 2234 CB TYR B 441 10.070 16.608 1.586 1.00 0.00 C ATOM 2235 CG TYR B 441 10.712 15.550 0.736 1.00 0.00 C ATOM 2236 CD1 TYR B 441 10.914 15.763 -0.619 1.00 0.00 C ATOM 2237 CD2 TYR B 441 11.149 14.357 1.288 1.00 0.00 C ATOM 2238 CE1 TYR B 441 11.530 14.815 -1.403 1.00 0.00 C ATOM 2239 CE2 TYR B 441 11.765 13.400 0.512 1.00 0.00 C ATOM 2240 CZ TYR B 441 11.955 13.633 -0.835 1.00 0.00 C ATOM 2241 OH TYR B 441 12.571 12.683 -1.614 1.00 0.00 O ATOM 0 H TYR B 441 11.924 16.511 3.191 1.00 0.00 H new ATOM 0 HA TYR B 441 11.479 18.034 0.863 1.00 0.00 H new ATOM 0 HB2 TYR B 441 9.782 16.180 2.546 1.00 0.00 H new ATOM 0 HB3 TYR B 441 9.156 16.957 1.106 1.00 0.00 H new ATOM 0 HD1 TYR B 441 10.582 16.688 -1.066 1.00 0.00 H new ATOM 0 HD2 TYR B 441 11.005 14.174 2.343 1.00 0.00 H new ATOM 0 HE1 TYR B 441 11.680 14.996 -2.457 1.00 0.00 H new ATOM 0 HE2 TYR B 441 12.097 12.473 0.955 1.00 0.00 H new ATOM 0 HH TYR B 441 13.098 12.084 -1.044 1.00 0.00 H new ATOM 2251 N ALA B 442 9.852 19.017 3.559 1.00 0.00 N ATOM 2252 CA ALA B 442 9.136 20.167 4.102 1.00 0.00 C ATOM 2253 C ALA B 442 9.738 21.446 3.534 1.00 0.00 C ATOM 2254 O ALA B 442 9.070 22.200 2.822 1.00 0.00 O ATOM 2255 CB ALA B 442 9.177 20.183 5.623 1.00 0.00 C ATOM 0 H ALA B 442 10.015 18.259 4.222 1.00 0.00 H new ATOM 0 HA ALA B 442 8.088 20.096 3.810 1.00 0.00 H new ATOM 0 HB1 ALA B 442 8.634 21.053 5.992 1.00 0.00 H new ATOM 0 HB2 ALA B 442 8.714 19.275 6.009 1.00 0.00 H new ATOM 0 HB3 ALA B 442 10.213 20.232 5.959 1.00 0.00 H new ATOM 2261 N LYS B 443 11.016 21.669 3.825 1.00 0.00 N ATOM 2262 CA LYS B 443 11.711 22.840 3.310 1.00 0.00 C ATOM 2263 C LYS B 443 11.475 22.952 1.810 1.00 0.00 C ATOM 2264 O LYS B 443 11.081 24.005 1.309 1.00 0.00 O ATOM 2265 CB LYS B 443 13.210 22.756 3.602 1.00 0.00 C ATOM 2266 CG LYS B 443 13.976 24.009 3.206 1.00 0.00 C ATOM 2267 CD LYS B 443 14.354 23.991 1.733 1.00 0.00 C ATOM 2268 CE LYS B 443 15.708 24.642 1.498 1.00 0.00 C ATOM 2269 NZ LYS B 443 16.392 24.085 0.298 1.00 0.00 N ATOM 0 H LYS B 443 11.586 21.059 4.410 1.00 0.00 H new ATOM 0 HA LYS B 443 11.318 23.727 3.807 1.00 0.00 H new ATOM 0 HB2 LYS B 443 13.355 22.572 4.667 1.00 0.00 H new ATOM 0 HB3 LYS B 443 13.628 21.901 3.071 1.00 0.00 H new ATOM 0 HG2 LYS B 443 13.368 24.889 3.416 1.00 0.00 H new ATOM 0 HG3 LYS B 443 14.878 24.092 3.813 1.00 0.00 H new ATOM 0 HD2 LYS B 443 14.377 22.962 1.374 1.00 0.00 H new ATOM 0 HD3 LYS B 443 13.592 24.514 1.154 1.00 0.00 H new ATOM 0 HE2 LYS B 443 15.577 25.717 1.375 1.00 0.00 H new ATOM 0 HE3 LYS B 443 16.338 24.496 2.375 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 17.311 24.555 0.173 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 16.540 23.064 0.426 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 15.803 24.247 -0.544 1.00 0.00 H new ATOM 2283 N GLN B 444 11.696 21.847 1.096 1.00 0.00 N ATOM 2284 CA GLN B 444 11.482 21.821 -0.346 1.00 0.00 C ATOM 2285 C GLN B 444 10.092 22.361 -0.667 1.00 0.00 C ATOM 2286 O GLN B 444 9.945 23.350 -1.382 1.00 0.00 O ATOM 2287 CB GLN B 444 11.642 20.392 -0.881 1.00 0.00 C ATOM 2288 CG GLN B 444 12.988 20.142 -1.535 1.00 0.00 C ATOM 2289 CD GLN B 444 12.856 19.353 -2.819 1.00 0.00 C ATOM 2290 OE1 GLN B 444 13.652 19.509 -3.744 1.00 0.00 O ATOM 2291 NE2 GLN B 444 11.840 18.500 -2.881 1.00 0.00 N ATOM 0 H GLN B 444 12.021 20.965 1.492 1.00 0.00 H new ATOM 0 HA GLN B 444 12.227 22.452 -0.831 1.00 0.00 H new ATOM 0 HB2 GLN B 444 11.508 19.687 -0.060 1.00 0.00 H new ATOM 0 HB3 GLN B 444 10.852 20.192 -1.605 1.00 0.00 H new ATOM 0 HG2 GLN B 444 13.472 21.096 -1.744 1.00 0.00 H new ATOM 0 HG3 GLN B 444 13.633 19.602 -0.842 1.00 0.00 H new ATOM 0 HE21 GLN B 444 11.205 18.404 -2.088 1.00 0.00 H new ATOM 0 HE22 GLN B 444 11.695 17.940 -3.721 1.00 0.00 H new ATOM 2300 N ARG B 445 9.079 21.706 -0.113 1.00 0.00 N ATOM 2301 CA ARG B 445 7.695 22.111 -0.306 1.00 0.00 C ATOM 2302 C ARG B 445 7.580 23.631 -0.315 1.00 0.00 C ATOM 2303 O ARG B 445 6.856 24.207 -1.127 1.00 0.00 O ATOM 2304 CB ARG B 445 6.827 21.533 0.813 1.00 0.00 C ATOM 2305 CG ARG B 445 5.689 20.663 0.314 1.00 0.00 C ATOM 2306 CD ARG B 445 4.922 21.344 -0.808 1.00 0.00 C ATOM 2307 NE ARG B 445 3.643 21.881 -0.348 1.00 0.00 N ATOM 2308 CZ ARG B 445 2.703 21.149 0.244 1.00 0.00 C ATOM 2309 NH1 ARG B 445 2.888 19.849 0.436 1.00 0.00 N ATOM 2310 NH2 ARG B 445 1.574 21.717 0.645 1.00 0.00 N ATOM 0 H ARG B 445 9.194 20.884 0.479 1.00 0.00 H new ATOM 0 HA ARG B 445 7.350 21.729 -1.267 1.00 0.00 H new ATOM 0 HB2 ARG B 445 7.456 20.945 1.482 1.00 0.00 H new ATOM 0 HB3 ARG B 445 6.415 22.353 1.401 1.00 0.00 H new ATOM 0 HG2 ARG B 445 6.085 19.711 -0.039 1.00 0.00 H new ATOM 0 HG3 ARG B 445 5.011 20.440 1.138 1.00 0.00 H new ATOM 0 HD2 ARG B 445 5.526 22.151 -1.223 1.00 0.00 H new ATOM 0 HD3 ARG B 445 4.747 20.630 -1.613 1.00 0.00 H new ATOM 0 HE ARG B 445 3.460 22.875 -0.489 1.00 0.00 H new ATOM 0 HH11 ARG B 445 3.754 19.406 0.129 1.00 0.00 H new ATOM 0 HH12 ARG B 445 2.164 19.292 0.890 1.00 0.00 H new ATOM 0 HH21 ARG B 445 1.426 22.716 0.500 1.00 0.00 H new ATOM 0 HH22 ARG B 445 0.854 21.155 1.099 1.00 0.00 H new ATOM 2324 N ALA B 446 8.308 24.273 0.594 1.00 0.00 N ATOM 2325 CA ALA B 446 8.297 25.730 0.693 1.00 0.00 C ATOM 2326 C ALA B 446 8.986 26.362 -0.511 1.00 0.00 C ATOM 2327 O ALA B 446 8.555 27.398 -1.016 1.00 0.00 O ATOM 2328 CB ALA B 446 8.963 26.195 1.979 1.00 0.00 C ATOM 0 H ALA B 446 8.912 23.809 1.272 1.00 0.00 H new ATOM 0 HA ALA B 446 7.256 26.052 0.707 1.00 0.00 H new ATOM 0 HB1 ALA B 446 8.941 27.284 2.027 1.00 0.00 H new ATOM 0 HB2 ALA B 446 8.429 25.783 2.835 1.00 0.00 H new ATOM 0 HB3 ALA B 446 9.997 25.852 1.998 1.00 0.00 H new ATOM 2334 N ALA B 447 10.062 25.727 -0.960 1.00 0.00 N ATOM 2335 CA ALA B 447 10.822 26.219 -2.101 1.00 0.00 C ATOM 2336 C ALA B 447 10.054 25.996 -3.395 1.00 0.00 C ATOM 2337 O ALA B 447 9.559 26.946 -4.000 1.00 0.00 O ATOM 2338 CB ALA B 447 12.185 25.549 -2.174 1.00 0.00 C ATOM 0 H ALA B 447 10.428 24.868 -0.550 1.00 0.00 H new ATOM 0 HA ALA B 447 10.973 27.290 -1.967 1.00 0.00 H new ATOM 0 HB1 ALA B 447 12.734 25.933 -3.034 1.00 0.00 H new ATOM 0 HB2 ALA B 447 12.744 25.761 -1.263 1.00 0.00 H new ATOM 0 HB3 ALA B 447 12.056 24.472 -2.277 1.00 0.00 H new