USER MOD reduce.3.24.130724 H: found=0, std=0, add=642, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 643 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 410 THR OG1 : rot 172:sc= 0.559 USER MOD Set 1.2: B 441 TYR OH : rot -140:sc= 0.184 USER MOD Set 2.1: B 368 MET CE :methyl -127:sc= -3.47! (180deg=-7.56!) USER MOD Set 2.2: B 369 ASN : amide:sc= -2.86! K(o=-6.3!,f=-8.2) USER MOD Single : B 371 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.076) USER MOD Single : B 373 GLN : amide:sc= -13! C(o=-13!,f=-12!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 120:sc= -0.292 USER MOD Single : B 380 TYR OH : rot 75:sc= -4.6! USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS : no HD1:sc= -0.551 K(o=-0.55,f=0.085) USER MOD Single : B 387 TYR OH : rot -159:sc= -5.79! USER MOD Single : B 389 THR OG1 : rot 180:sc= 0 USER MOD Single : B 391 LYS NZ :NH3+ -111:sc= 1.06 (180deg=-0.0334) USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot 180:sc= 0.372 USER MOD Single : B 399 ASN : amide:sc= -0.0646 X(o=-0.065,f=0) USER MOD Single : B 400 SER OG : rot 150:sc= 0 USER MOD Single : B 404 CYS SG : rot -170:sc= -6.34 USER MOD Single : B 414 THR OG1 : rot 77:sc= -3.54! USER MOD Single : B 419 ASN : amide:sc= -0.673 K(o=-0.67,f=-3.4!) USER MOD Single : B 421 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0208) USER MOD Single : B 430 ASN : amide:sc= -4.86! C(o=-4.9!,f=-7.9!) USER MOD Single : B 435 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.0366) USER MOD Single : B 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 437 MET CE :methyl -179:sc= -0.851 (180deg=-0.86) USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN : amide:sc= -2.32 K(o=-2.3,f=-4.6!) USER MOD ----------------------------------------------------------------- ATOM 1069 N ASP B 367 -4.766 5.411 -16.828 1.00 0.00 N ATOM 1070 CA ASP B 367 -3.659 4.897 -16.026 1.00 0.00 C ATOM 1071 C ASP B 367 -2.309 5.081 -16.718 1.00 0.00 C ATOM 1072 O ASP B 367 -1.422 5.756 -16.193 1.00 0.00 O ATOM 1073 CB ASP B 367 -3.877 3.417 -15.699 1.00 0.00 C ATOM 1074 CG ASP B 367 -4.981 2.790 -16.530 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -6.144 3.224 -16.394 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -4.682 1.868 -17.317 1.00 0.00 O ATOM 0 HA ASP B 367 -3.639 5.476 -15.103 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -2.948 2.872 -15.866 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -4.121 3.315 -14.642 1.00 0.00 H new ATOM 1081 N MET B 368 -2.154 4.477 -17.896 1.00 0.00 N ATOM 1082 CA MET B 368 -0.902 4.584 -18.641 1.00 0.00 C ATOM 1083 C MET B 368 -0.437 6.036 -18.723 1.00 0.00 C ATOM 1084 O MET B 368 0.716 6.340 -18.420 1.00 0.00 O ATOM 1085 CB MET B 368 -1.044 3.969 -20.040 1.00 0.00 C ATOM 1086 CG MET B 368 -1.491 4.943 -21.120 1.00 0.00 C ATOM 1087 SD MET B 368 -3.270 5.232 -21.105 1.00 0.00 S ATOM 1088 CE MET B 368 -3.352 6.850 -21.864 1.00 0.00 C ATOM 0 H MET B 368 -2.873 3.914 -18.351 1.00 0.00 H new ATOM 0 HA MET B 368 -0.140 4.020 -18.103 1.00 0.00 H new ATOM 0 HB2 MET B 368 -0.086 3.539 -20.332 1.00 0.00 H new ATOM 0 HB3 MET B 368 -1.760 3.149 -19.991 1.00 0.00 H new ATOM 0 HG2 MET B 368 -0.972 5.892 -20.985 1.00 0.00 H new ATOM 0 HG3 MET B 368 -1.198 4.556 -22.096 1.00 0.00 H new ATOM 0 HE1 MET B 368 -3.921 7.524 -21.224 1.00 0.00 H new ATOM 0 HE2 MET B 368 -2.343 7.241 -21.997 1.00 0.00 H new ATOM 0 HE3 MET B 368 -3.841 6.772 -22.835 1.00 0.00 H new ATOM 1098 N ASN B 369 -1.339 6.940 -19.106 1.00 0.00 N ATOM 1099 CA ASN B 369 -0.997 8.354 -19.189 1.00 0.00 C ATOM 1100 C ASN B 369 -0.704 8.895 -17.801 1.00 0.00 C ATOM 1101 O ASN B 369 0.048 9.855 -17.645 1.00 0.00 O ATOM 1102 CB ASN B 369 -2.112 9.156 -19.852 1.00 0.00 C ATOM 1103 CG ASN B 369 -3.266 9.379 -18.920 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -4.337 8.798 -19.083 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -3.051 10.231 -17.936 1.00 0.00 N ATOM 0 H ASN B 369 -2.302 6.719 -19.361 1.00 0.00 H new ATOM 0 HA ASN B 369 -0.105 8.456 -19.808 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -1.721 10.118 -20.183 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -2.459 8.630 -20.741 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -3.793 10.434 -17.266 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -2.143 10.687 -17.845 1.00 0.00 H new ATOM 1112 N ALA B 370 -1.284 8.257 -16.788 1.00 0.00 N ATOM 1113 CA ALA B 370 -1.056 8.667 -15.412 1.00 0.00 C ATOM 1114 C ALA B 370 0.432 8.583 -15.106 1.00 0.00 C ATOM 1115 O ALA B 370 1.108 9.605 -14.985 1.00 0.00 O ATOM 1116 CB ALA B 370 -1.853 7.812 -14.438 1.00 0.00 C ATOM 0 H ALA B 370 -1.911 7.460 -16.896 1.00 0.00 H new ATOM 0 HA ALA B 370 -1.396 9.696 -15.292 1.00 0.00 H new ATOM 0 HB1 ALA B 370 -1.659 8.145 -13.418 1.00 0.00 H new ATOM 0 HB2 ALA B 370 -2.917 7.908 -14.655 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -1.555 6.769 -14.541 1.00 0.00 H new ATOM 1122 N LYS B 371 0.947 7.360 -15.016 1.00 0.00 N ATOM 1123 CA LYS B 371 2.367 7.161 -14.763 1.00 0.00 C ATOM 1124 C LYS B 371 3.163 8.038 -15.721 1.00 0.00 C ATOM 1125 O LYS B 371 4.229 8.557 -15.383 1.00 0.00 O ATOM 1126 CB LYS B 371 2.750 5.687 -14.949 1.00 0.00 C ATOM 1127 CG LYS B 371 1.678 4.708 -14.495 1.00 0.00 C ATOM 1128 CD LYS B 371 1.091 3.945 -15.671 1.00 0.00 C ATOM 1129 CE LYS B 371 0.676 2.537 -15.278 1.00 0.00 C ATOM 1130 NZ LYS B 371 -0.428 2.539 -14.279 1.00 0.00 N ATOM 0 H LYS B 371 0.407 6.500 -15.114 1.00 0.00 H new ATOM 0 HA LYS B 371 2.593 7.438 -13.733 1.00 0.00 H new ATOM 0 HB2 LYS B 371 2.968 5.509 -16.002 1.00 0.00 H new ATOM 0 HB3 LYS B 371 3.668 5.488 -14.395 1.00 0.00 H new ATOM 0 HG2 LYS B 371 2.104 4.005 -13.779 1.00 0.00 H new ATOM 0 HG3 LYS B 371 0.885 5.248 -13.977 1.00 0.00 H new ATOM 0 HD2 LYS B 371 0.227 4.484 -16.059 1.00 0.00 H new ATOM 0 HD3 LYS B 371 1.824 3.897 -16.476 1.00 0.00 H new ATOM 0 HE2 LYS B 371 0.360 1.991 -16.167 1.00 0.00 H new ATOM 0 HE3 LYS B 371 1.535 2.007 -14.867 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -0.783 1.570 -14.152 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -0.073 2.899 -13.370 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -1.200 3.149 -14.616 1.00 0.00 H new ATOM 1144 N ARG B 372 2.604 8.211 -16.918 1.00 0.00 N ATOM 1145 CA ARG B 372 3.210 9.038 -17.952 1.00 0.00 C ATOM 1146 C ARG B 372 3.383 10.463 -17.443 1.00 0.00 C ATOM 1147 O ARG B 372 4.437 11.074 -17.599 1.00 0.00 O ATOM 1148 CB ARG B 372 2.315 9.039 -19.197 1.00 0.00 C ATOM 1149 CG ARG B 372 3.072 9.020 -20.516 1.00 0.00 C ATOM 1150 CD ARG B 372 3.426 10.427 -20.970 1.00 0.00 C ATOM 1151 NE ARG B 372 4.725 10.478 -21.636 1.00 0.00 N ATOM 1152 CZ ARG B 372 5.045 11.380 -22.559 1.00 0.00 C ATOM 1153 NH1 ARG B 372 4.165 12.304 -22.921 1.00 0.00 N ATOM 1154 NH2 ARG B 372 6.246 11.358 -23.119 1.00 0.00 N ATOM 0 H ARG B 372 1.721 7.782 -17.194 1.00 0.00 H new ATOM 0 HA ARG B 372 4.188 8.631 -18.208 1.00 0.00 H new ATOM 0 HB2 ARG B 372 1.657 8.171 -19.157 1.00 0.00 H new ATOM 0 HB3 ARG B 372 1.678 9.923 -19.171 1.00 0.00 H new ATOM 0 HG2 ARG B 372 3.983 8.431 -20.407 1.00 0.00 H new ATOM 0 HG3 ARG B 372 2.466 8.531 -21.279 1.00 0.00 H new ATOM 0 HD2 ARG B 372 2.656 10.793 -21.649 1.00 0.00 H new ATOM 0 HD3 ARG B 372 3.434 11.094 -20.108 1.00 0.00 H new ATOM 0 HE ARG B 372 5.426 9.783 -21.379 1.00 0.00 H new ATOM 0 HH11 ARG B 372 3.240 12.324 -22.491 1.00 0.00 H new ATOM 0 HH12 ARG B 372 4.413 12.995 -23.629 1.00 0.00 H new ATOM 0 HH21 ARG B 372 6.925 10.649 -22.842 1.00 0.00 H new ATOM 0 HH22 ARG B 372 6.491 12.050 -23.827 1.00 0.00 H new ATOM 1168 N GLN B 373 2.328 10.983 -16.833 1.00 0.00 N ATOM 1169 CA GLN B 373 2.332 12.334 -16.295 1.00 0.00 C ATOM 1170 C GLN B 373 3.362 12.489 -15.182 1.00 0.00 C ATOM 1171 O GLN B 373 4.096 13.474 -15.126 1.00 0.00 O ATOM 1172 CB GLN B 373 0.942 12.678 -15.754 1.00 0.00 C ATOM 1173 CG GLN B 373 0.385 13.979 -16.302 1.00 0.00 C ATOM 1174 CD GLN B 373 1.416 15.088 -16.307 1.00 0.00 C ATOM 1175 OE1 GLN B 373 1.586 15.791 -17.303 1.00 0.00 O ATOM 1176 NE2 GLN B 373 2.115 15.246 -15.189 1.00 0.00 N ATOM 0 H GLN B 373 1.449 10.483 -16.698 1.00 0.00 H new ATOM 0 HA GLN B 373 2.598 13.016 -17.103 1.00 0.00 H new ATOM 0 HB2 GLN B 373 0.255 11.867 -15.997 1.00 0.00 H new ATOM 0 HB3 GLN B 373 0.989 12.741 -14.667 1.00 0.00 H new ATOM 0 HG2 GLN B 373 0.023 13.818 -17.317 1.00 0.00 H new ATOM 0 HG3 GLN B 373 -0.472 14.286 -15.703 1.00 0.00 H new ATOM 0 HE21 GLN B 373 1.940 14.639 -14.388 1.00 0.00 H new ATOM 0 HE22 GLN B 373 2.827 15.974 -15.131 1.00 0.00 H new ATOM 1185 N LEU B 374 3.388 11.524 -14.279 1.00 0.00 N ATOM 1186 CA LEU B 374 4.296 11.570 -13.142 1.00 0.00 C ATOM 1187 C LEU B 374 5.763 11.678 -13.553 1.00 0.00 C ATOM 1188 O LEU B 374 6.406 12.698 -13.307 1.00 0.00 O ATOM 1189 CB LEU B 374 4.106 10.338 -12.251 1.00 0.00 C ATOM 1190 CG LEU B 374 2.717 9.701 -12.303 1.00 0.00 C ATOM 1191 CD1 LEU B 374 2.604 8.579 -11.285 1.00 0.00 C ATOM 1192 CD2 LEU B 374 1.648 10.752 -12.061 1.00 0.00 C ATOM 0 H LEU B 374 2.791 10.698 -14.310 1.00 0.00 H new ATOM 0 HA LEU B 374 4.044 12.474 -12.588 1.00 0.00 H new ATOM 0 HB2 LEU B 374 4.843 9.587 -12.536 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.320 10.619 -11.220 1.00 0.00 H new ATOM 0 HG LEU B 374 2.567 9.276 -13.295 1.00 0.00 H new ATOM 0 HD11 LEU B 374 1.608 8.139 -11.338 1.00 0.00 H new ATOM 0 HD12 LEU B 374 3.351 7.815 -11.501 1.00 0.00 H new ATOM 0 HD13 LEU B 374 2.772 8.977 -10.284 1.00 0.00 H new ATOM 0 HD21 LEU B 374 0.664 10.286 -12.101 1.00 0.00 H new ATOM 0 HD22 LEU B 374 1.797 11.203 -11.080 1.00 0.00 H new ATOM 0 HD23 LEU B 374 1.715 11.523 -12.829 1.00 0.00 H new ATOM 1204 N TYR B 375 6.304 10.612 -14.130 1.00 0.00 N ATOM 1205 CA TYR B 375 7.715 10.593 -14.510 1.00 0.00 C ATOM 1206 C TYR B 375 7.985 11.235 -15.872 1.00 0.00 C ATOM 1207 O TYR B 375 9.041 11.834 -16.075 1.00 0.00 O ATOM 1208 CB TYR B 375 8.238 9.156 -14.496 1.00 0.00 C ATOM 1209 CG TYR B 375 8.460 8.608 -13.103 1.00 0.00 C ATOM 1210 CD1 TYR B 375 8.013 9.299 -11.984 1.00 0.00 C ATOM 1211 CD2 TYR B 375 9.116 7.397 -12.906 1.00 0.00 C ATOM 1212 CE1 TYR B 375 8.214 8.802 -10.709 1.00 0.00 C ATOM 1213 CE2 TYR B 375 9.319 6.894 -11.634 1.00 0.00 C ATOM 1214 CZ TYR B 375 8.867 7.600 -10.540 1.00 0.00 C ATOM 1215 OH TYR B 375 9.069 7.103 -9.273 1.00 0.00 O ATOM 0 H TYR B 375 5.794 9.755 -14.345 1.00 0.00 H new ATOM 0 HA TYR B 375 8.246 11.195 -13.772 1.00 0.00 H new ATOM 0 HB2 TYR B 375 7.530 8.515 -15.021 1.00 0.00 H new ATOM 0 HB3 TYR B 375 9.177 9.114 -15.048 1.00 0.00 H new ATOM 0 HD1 TYR B 375 7.500 10.241 -12.112 1.00 0.00 H new ATOM 0 HD2 TYR B 375 9.472 6.841 -13.760 1.00 0.00 H new ATOM 0 HE1 TYR B 375 7.861 9.353 -9.850 1.00 0.00 H new ATOM 0 HE2 TYR B 375 9.830 5.952 -11.498 1.00 0.00 H new ATOM 0 HH TYR B 375 9.543 6.247 -9.329 1.00 0.00 H new ATOM 1225 N SER B 376 7.054 11.100 -16.809 1.00 0.00 N ATOM 1226 CA SER B 376 7.252 11.666 -18.141 1.00 0.00 C ATOM 1227 C SER B 376 6.911 13.154 -18.191 1.00 0.00 C ATOM 1228 O SER B 376 7.371 13.866 -19.084 1.00 0.00 O ATOM 1229 CB SER B 376 6.424 10.905 -19.178 1.00 0.00 C ATOM 1230 OG SER B 376 7.154 10.725 -20.380 1.00 0.00 O ATOM 0 H SER B 376 6.168 10.612 -16.677 1.00 0.00 H new ATOM 0 HA SER B 376 8.311 11.561 -18.378 1.00 0.00 H new ATOM 0 HB2 SER B 376 6.134 9.934 -18.776 1.00 0.00 H new ATOM 0 HB3 SER B 376 5.504 11.451 -19.386 1.00 0.00 H new ATOM 0 HG SER B 376 7.252 9.767 -20.563 1.00 0.00 H new ATOM 1236 N LEU B 377 6.108 13.629 -17.242 1.00 0.00 N ATOM 1237 CA LEU B 377 5.727 15.039 -17.219 1.00 0.00 C ATOM 1238 C LEU B 377 6.085 15.695 -15.892 1.00 0.00 C ATOM 1239 O LEU B 377 5.944 16.908 -15.732 1.00 0.00 O ATOM 1240 CB LEU B 377 4.227 15.190 -17.483 1.00 0.00 C ATOM 1241 CG LEU B 377 3.806 14.972 -18.936 1.00 0.00 C ATOM 1242 CD1 LEU B 377 4.219 16.161 -19.791 1.00 0.00 C ATOM 1243 CD2 LEU B 377 4.415 13.687 -19.473 1.00 0.00 C ATOM 0 H LEU B 377 5.713 13.067 -16.488 1.00 0.00 H new ATOM 0 HA LEU B 377 6.286 15.542 -18.008 1.00 0.00 H new ATOM 0 HB2 LEU B 377 3.689 14.482 -16.853 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.917 16.189 -17.176 1.00 0.00 H new ATOM 0 HG LEU B 377 2.720 14.882 -18.977 1.00 0.00 H new ATOM 0 HD11 LEU B 377 3.912 15.991 -20.823 1.00 0.00 H new ATOM 0 HD12 LEU B 377 3.739 17.064 -19.414 1.00 0.00 H new ATOM 0 HD13 LEU B 377 5.302 16.281 -19.749 1.00 0.00 H new ATOM 0 HD21 LEU B 377 4.107 13.544 -20.509 1.00 0.00 H new ATOM 0 HD22 LEU B 377 5.502 13.751 -19.423 1.00 0.00 H new ATOM 0 HD23 LEU B 377 4.073 12.844 -18.873 1.00 0.00 H new ATOM 1255 N ILE B 378 6.543 14.895 -14.937 1.00 0.00 N ATOM 1256 CA ILE B 378 6.908 15.417 -13.628 1.00 0.00 C ATOM 1257 C ILE B 378 8.102 14.653 -13.032 1.00 0.00 C ATOM 1258 O ILE B 378 9.184 14.678 -13.614 1.00 0.00 O ATOM 1259 CB ILE B 378 5.693 15.385 -12.676 1.00 0.00 C ATOM 1260 CG1 ILE B 378 4.452 15.902 -13.400 1.00 0.00 C ATOM 1261 CG2 ILE B 378 5.961 16.221 -11.436 1.00 0.00 C ATOM 1262 CD1 ILE B 378 4.487 17.393 -13.659 1.00 0.00 C ATOM 0 H ILE B 378 6.670 13.889 -15.044 1.00 0.00 H new ATOM 0 HA ILE B 378 7.217 16.455 -13.752 1.00 0.00 H new ATOM 0 HB ILE B 378 5.522 14.354 -12.365 1.00 0.00 H new ATOM 0 HG12 ILE B 378 4.349 15.378 -14.350 1.00 0.00 H new ATOM 0 HG13 ILE B 378 3.569 15.664 -12.807 1.00 0.00 H new ATOM 0 HG21 ILE B 378 5.093 16.185 -10.778 1.00 0.00 H new ATOM 0 HG22 ILE B 378 6.830 15.825 -10.911 1.00 0.00 H new ATOM 0 HG23 ILE B 378 6.153 17.254 -11.728 1.00 0.00 H new ATOM 0 HD11 ILE B 378 3.576 17.694 -14.176 1.00 0.00 H new ATOM 0 HD12 ILE B 378 4.559 17.925 -12.711 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.352 17.635 -14.277 1.00 0.00 H new ATOM 1274 N GLY B 379 7.897 13.978 -11.886 1.00 0.00 N ATOM 1275 CA GLY B 379 8.956 13.211 -11.227 1.00 0.00 C ATOM 1276 C GLY B 379 10.291 13.231 -11.954 1.00 0.00 C ATOM 1277 O GLY B 379 10.729 12.212 -12.487 1.00 0.00 O ATOM 0 H GLY B 379 7.001 13.952 -11.400 1.00 0.00 H new ATOM 0 HA2 GLY B 379 9.099 13.603 -10.220 1.00 0.00 H new ATOM 0 HA3 GLY B 379 8.628 12.177 -11.123 1.00 0.00 H new ATOM 1281 N TYR B 380 10.933 14.395 -11.980 1.00 0.00 N ATOM 1282 CA TYR B 380 12.224 14.543 -12.653 1.00 0.00 C ATOM 1283 C TYR B 380 13.375 14.084 -11.762 1.00 0.00 C ATOM 1284 O TYR B 380 13.913 12.991 -11.934 1.00 0.00 O ATOM 1285 CB TYR B 380 12.459 15.998 -13.077 1.00 0.00 C ATOM 1286 CG TYR B 380 11.571 17.002 -12.378 1.00 0.00 C ATOM 1287 CD1 TYR B 380 10.269 17.215 -12.806 1.00 0.00 C ATOM 1288 CD2 TYR B 380 12.030 17.734 -11.289 1.00 0.00 C ATOM 1289 CE1 TYR B 380 9.448 18.125 -12.173 1.00 0.00 C ATOM 1290 CE2 TYR B 380 11.215 18.647 -10.648 1.00 0.00 C ATOM 1291 CZ TYR B 380 9.925 18.839 -11.093 1.00 0.00 C ATOM 1292 OH TYR B 380 9.112 19.749 -10.458 1.00 0.00 O ATOM 0 H TYR B 380 10.584 15.249 -11.545 1.00 0.00 H new ATOM 0 HA TYR B 380 12.195 13.911 -13.540 1.00 0.00 H new ATOM 0 HB2 TYR B 380 13.500 16.256 -12.885 1.00 0.00 H new ATOM 0 HB3 TYR B 380 12.303 16.080 -14.153 1.00 0.00 H new ATOM 0 HD1 TYR B 380 9.891 16.658 -13.651 1.00 0.00 H new ATOM 0 HD2 TYR B 380 13.041 17.586 -10.938 1.00 0.00 H new ATOM 0 HE1 TYR B 380 8.437 18.278 -12.521 1.00 0.00 H new ATOM 0 HE2 TYR B 380 11.587 19.207 -9.803 1.00 0.00 H new ATOM 0 HH TYR B 380 8.452 19.273 -9.912 1.00 0.00 H new ATOM 1302 N ALA B 381 13.747 14.939 -10.818 1.00 0.00 N ATOM 1303 CA ALA B 381 14.836 14.652 -9.895 1.00 0.00 C ATOM 1304 C ALA B 381 15.285 15.934 -9.199 1.00 0.00 C ATOM 1305 O ALA B 381 16.473 16.253 -9.160 1.00 0.00 O ATOM 1306 CB ALA B 381 16.008 14.000 -10.616 1.00 0.00 C ATOM 0 H ALA B 381 13.305 15.846 -10.671 1.00 0.00 H new ATOM 0 HA ALA B 381 14.472 13.950 -9.144 1.00 0.00 H new ATOM 0 HB1 ALA B 381 16.807 13.797 -9.903 1.00 0.00 H new ATOM 0 HB2 ALA B 381 15.681 13.065 -11.070 1.00 0.00 H new ATOM 0 HB3 ALA B 381 16.377 14.671 -11.392 1.00 0.00 H new ATOM 1312 N SER B 382 14.315 16.662 -8.652 1.00 0.00 N ATOM 1313 CA SER B 382 14.590 17.915 -7.952 1.00 0.00 C ATOM 1314 C SER B 382 13.608 18.145 -6.800 1.00 0.00 C ATOM 1315 O SER B 382 13.615 19.204 -6.173 1.00 0.00 O ATOM 1316 CB SER B 382 14.525 19.092 -8.929 1.00 0.00 C ATOM 1317 OG SER B 382 15.709 19.867 -8.876 1.00 0.00 O ATOM 0 H SER B 382 13.328 16.405 -8.680 1.00 0.00 H new ATOM 0 HA SER B 382 15.593 17.844 -7.532 1.00 0.00 H new ATOM 0 HB2 SER B 382 14.376 18.719 -9.942 1.00 0.00 H new ATOM 0 HB3 SER B 382 13.666 19.719 -8.691 1.00 0.00 H new ATOM 0 HG SER B 382 15.642 20.611 -9.511 1.00 0.00 H new ATOM 1323 N LEU B 383 12.768 17.149 -6.522 1.00 0.00 N ATOM 1324 CA LEU B 383 11.789 17.250 -5.444 1.00 0.00 C ATOM 1325 C LEU B 383 11.452 15.868 -4.887 1.00 0.00 C ATOM 1326 O LEU B 383 10.439 15.682 -4.216 1.00 0.00 O ATOM 1327 CB LEU B 383 10.518 17.952 -5.935 1.00 0.00 C ATOM 1328 CG LEU B 383 9.745 17.223 -7.036 1.00 0.00 C ATOM 1329 CD1 LEU B 383 10.688 16.731 -8.123 1.00 0.00 C ATOM 1330 CD2 LEU B 383 8.950 16.066 -6.453 1.00 0.00 C ATOM 0 H LEU B 383 12.747 16.264 -7.029 1.00 0.00 H new ATOM 0 HA LEU B 383 12.227 17.845 -4.643 1.00 0.00 H new ATOM 0 HB2 LEU B 383 9.853 18.098 -5.084 1.00 0.00 H new ATOM 0 HB3 LEU B 383 10.789 18.942 -6.301 1.00 0.00 H new ATOM 0 HG LEU B 383 9.047 17.928 -7.486 1.00 0.00 H new ATOM 0 HD11 LEU B 383 10.116 16.216 -8.895 1.00 0.00 H new ATOM 0 HD12 LEU B 383 11.210 17.580 -8.564 1.00 0.00 H new ATOM 0 HD13 LEU B 383 11.415 16.044 -7.690 1.00 0.00 H new ATOM 0 HD21 LEU B 383 8.407 15.559 -7.251 1.00 0.00 H new ATOM 0 HD22 LEU B 383 9.630 15.362 -5.973 1.00 0.00 H new ATOM 0 HD23 LEU B 383 8.242 16.446 -5.716 1.00 0.00 H new ATOM 1342 N ARG B 384 12.327 14.909 -5.165 1.00 0.00 N ATOM 1343 CA ARG B 384 12.161 13.537 -4.695 1.00 0.00 C ATOM 1344 C ARG B 384 10.696 13.120 -4.603 1.00 0.00 C ATOM 1345 O ARG B 384 10.164 12.976 -3.502 1.00 0.00 O ATOM 1346 CB ARG B 384 12.810 13.365 -3.317 1.00 0.00 C ATOM 1347 CG ARG B 384 12.815 11.928 -2.826 1.00 0.00 C ATOM 1348 CD ARG B 384 14.226 11.370 -2.753 1.00 0.00 C ATOM 1349 NE ARG B 384 14.292 9.983 -3.206 1.00 0.00 N ATOM 1350 CZ ARG B 384 14.146 8.935 -2.402 1.00 0.00 C ATOM 1351 NH1 ARG B 384 13.923 9.111 -1.108 1.00 0.00 N ATOM 1352 NH2 ARG B 384 14.220 7.707 -2.894 1.00 0.00 N ATOM 0 H ARG B 384 13.169 15.059 -5.721 1.00 0.00 H new ATOM 0 HA ARG B 384 12.649 12.897 -5.430 1.00 0.00 H new ATOM 0 HB2 ARG B 384 13.836 13.730 -3.359 1.00 0.00 H new ATOM 0 HB3 ARG B 384 12.280 13.986 -2.594 1.00 0.00 H new ATOM 0 HG2 ARG B 384 12.351 11.877 -1.841 1.00 0.00 H new ATOM 0 HG3 ARG B 384 12.213 11.312 -3.494 1.00 0.00 H new ATOM 0 HD2 ARG B 384 14.890 11.982 -3.364 1.00 0.00 H new ATOM 0 HD3 ARG B 384 14.588 11.433 -1.727 1.00 0.00 H new ATOM 0 HE ARG B 384 14.460 9.809 -4.197 1.00 0.00 H new ATOM 0 HH11 ARG B 384 13.863 10.054 -0.725 1.00 0.00 H new ATOM 0 HH12 ARG B 384 13.812 8.303 -0.495 1.00 0.00 H new ATOM 0 HH21 ARG B 384 14.389 7.566 -3.890 1.00 0.00 H new ATOM 0 HH22 ARG B 384 14.108 6.903 -2.277 1.00 0.00 H new ATOM 1366 N LEU B 385 10.047 12.882 -5.744 1.00 0.00 N ATOM 1367 CA LEU B 385 8.660 12.434 -5.712 1.00 0.00 C ATOM 1368 C LEU B 385 8.608 11.132 -4.943 1.00 0.00 C ATOM 1369 O LEU B 385 9.211 10.140 -5.350 1.00 0.00 O ATOM 1370 CB LEU B 385 8.093 12.238 -7.115 1.00 0.00 C ATOM 1371 CG LEU B 385 6.603 12.547 -7.237 1.00 0.00 C ATOM 1372 CD1 LEU B 385 6.388 13.675 -8.225 1.00 0.00 C ATOM 1373 CD2 LEU B 385 5.825 11.306 -7.649 1.00 0.00 C ATOM 0 H LEU B 385 10.448 12.989 -6.676 1.00 0.00 H new ATOM 0 HA LEU B 385 8.050 13.196 -5.228 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.642 12.874 -7.809 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.265 11.207 -7.423 1.00 0.00 H new ATOM 0 HG LEU B 385 6.230 12.863 -6.263 1.00 0.00 H new ATOM 0 HD11 LEU B 385 5.322 13.889 -8.306 1.00 0.00 H new ATOM 0 HD12 LEU B 385 6.912 14.566 -7.879 1.00 0.00 H new ATOM 0 HD13 LEU B 385 6.775 13.382 -9.201 1.00 0.00 H new ATOM 0 HD21 LEU B 385 4.766 11.551 -7.729 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.190 10.951 -8.613 1.00 0.00 H new ATOM 0 HD23 LEU B 385 5.961 10.526 -6.900 1.00 0.00 H new ATOM 1385 N HIS B 386 7.953 11.149 -3.794 1.00 0.00 N ATOM 1386 CA HIS B 386 7.916 9.975 -2.943 1.00 0.00 C ATOM 1387 C HIS B 386 6.518 9.460 -2.628 1.00 0.00 C ATOM 1388 O HIS B 386 5.837 9.978 -1.739 1.00 0.00 O ATOM 1389 CB HIS B 386 8.623 10.306 -1.631 1.00 0.00 C ATOM 1390 CG HIS B 386 9.411 9.176 -1.062 1.00 0.00 C ATOM 1391 ND1 HIS B 386 10.663 9.344 -0.518 1.00 0.00 N ATOM 1392 CD2 HIS B 386 9.119 7.860 -0.937 1.00 0.00 C ATOM 1393 CE1 HIS B 386 11.110 8.184 -0.081 1.00 0.00 C ATOM 1394 NE2 HIS B 386 10.192 7.265 -0.324 1.00 0.00 N ATOM 0 H HIS B 386 7.444 11.956 -3.433 1.00 0.00 H new ATOM 0 HA HIS B 386 8.413 9.179 -3.498 1.00 0.00 H new ATOM 0 HB2 HIS B 386 9.289 11.154 -1.793 1.00 0.00 H new ATOM 0 HB3 HIS B 386 7.879 10.621 -0.899 1.00 0.00 H new ATOM 0 HD2 HIS B 386 8.212 7.371 -1.259 1.00 0.00 H new ATOM 0 HE1 HIS B 386 12.064 8.013 0.395 1.00 0.00 H new ATOM 0 HE2 HIS B 386 10.269 6.274 -0.093 1.00 0.00 H new ATOM 1403 N TYR B 387 6.120 8.390 -3.305 1.00 0.00 N ATOM 1404 CA TYR B 387 4.847 7.760 -3.018 1.00 0.00 C ATOM 1405 C TYR B 387 5.007 6.960 -1.740 1.00 0.00 C ATOM 1406 O TYR B 387 6.130 6.699 -1.309 1.00 0.00 O ATOM 1407 CB TYR B 387 4.430 6.821 -4.142 1.00 0.00 C ATOM 1408 CG TYR B 387 3.667 7.510 -5.230 1.00 0.00 C ATOM 1409 CD1 TYR B 387 4.318 8.354 -6.108 1.00 0.00 C ATOM 1410 CD2 TYR B 387 2.301 7.324 -5.375 1.00 0.00 C ATOM 1411 CE1 TYR B 387 3.635 9.000 -7.107 1.00 0.00 C ATOM 1412 CE2 TYR B 387 1.601 7.965 -6.374 1.00 0.00 C ATOM 1413 CZ TYR B 387 2.273 8.806 -7.241 1.00 0.00 C ATOM 1414 OH TYR B 387 1.585 9.448 -8.244 1.00 0.00 O ATOM 0 H TYR B 387 6.658 7.947 -4.050 1.00 0.00 H new ATOM 0 HA TYR B 387 4.079 8.527 -2.917 1.00 0.00 H new ATOM 0 HB2 TYR B 387 5.319 6.357 -4.568 1.00 0.00 H new ATOM 0 HB3 TYR B 387 3.818 6.019 -3.729 1.00 0.00 H new ATOM 0 HD1 TYR B 387 5.382 8.508 -6.007 1.00 0.00 H new ATOM 0 HD2 TYR B 387 1.778 6.667 -4.695 1.00 0.00 H new ATOM 0 HE1 TYR B 387 4.159 9.657 -7.785 1.00 0.00 H new ATOM 0 HE2 TYR B 387 0.537 7.812 -6.479 1.00 0.00 H new ATOM 0 HH TYR B 387 0.633 9.485 -8.016 1.00 0.00 H new ATOM 1424 N VAL B 388 3.909 6.549 -1.138 1.00 0.00 N ATOM 1425 CA VAL B 388 3.996 5.760 0.076 1.00 0.00 C ATOM 1426 C VAL B 388 2.831 4.788 0.179 1.00 0.00 C ATOM 1427 O VAL B 388 1.859 4.882 -0.571 1.00 0.00 O ATOM 1428 CB VAL B 388 4.068 6.631 1.351 1.00 0.00 C ATOM 1429 CG1 VAL B 388 5.058 6.029 2.330 1.00 0.00 C ATOM 1430 CG2 VAL B 388 4.464 8.070 1.037 1.00 0.00 C ATOM 0 H VAL B 388 2.961 6.743 -1.461 1.00 0.00 H new ATOM 0 HA VAL B 388 4.929 5.200 0.009 1.00 0.00 H new ATOM 0 HB VAL B 388 3.072 6.650 1.794 1.00 0.00 H new ATOM 0 HG11 VAL B 388 5.105 6.647 3.227 1.00 0.00 H new ATOM 0 HG12 VAL B 388 4.737 5.023 2.599 1.00 0.00 H new ATOM 0 HG13 VAL B 388 6.045 5.984 1.869 1.00 0.00 H new ATOM 0 HG21 VAL B 388 4.502 8.647 1.961 1.00 0.00 H new ATOM 0 HG22 VAL B 388 5.444 8.082 0.561 1.00 0.00 H new ATOM 0 HG23 VAL B 388 3.729 8.511 0.364 1.00 0.00 H new ATOM 1440 N THR B 389 2.936 3.852 1.111 1.00 0.00 N ATOM 1441 CA THR B 389 1.892 2.858 1.308 1.00 0.00 C ATOM 1442 C THR B 389 1.506 2.760 2.774 1.00 0.00 C ATOM 1443 O THR B 389 2.325 2.410 3.624 1.00 0.00 O ATOM 1444 CB THR B 389 2.334 1.471 0.806 1.00 0.00 C ATOM 1445 OG1 THR B 389 2.334 1.409 -0.626 1.00 0.00 O ATOM 1446 CG2 THR B 389 1.414 0.379 1.336 1.00 0.00 C ATOM 0 H THR B 389 3.732 3.760 1.742 1.00 0.00 H new ATOM 0 HA THR B 389 1.028 3.183 0.728 1.00 0.00 H new ATOM 0 HB THR B 389 3.347 1.311 1.176 1.00 0.00 H new ATOM 0 HG1 THR B 389 2.620 0.517 -0.915 1.00 0.00 H new ATOM 0 HG21 THR B 389 1.749 -0.590 0.966 1.00 0.00 H new ATOM 0 HG22 THR B 389 1.439 0.380 2.426 1.00 0.00 H new ATOM 0 HG23 THR B 389 0.395 0.565 0.996 1.00 0.00 H new ATOM 1454 N VAL B 390 0.251 3.066 3.063 1.00 0.00 N ATOM 1455 CA VAL B 390 -0.245 3.008 4.424 1.00 0.00 C ATOM 1456 C VAL B 390 -1.545 2.215 4.493 1.00 0.00 C ATOM 1457 O VAL B 390 -2.289 2.128 3.514 1.00 0.00 O ATOM 1458 CB VAL B 390 -0.467 4.420 4.997 1.00 0.00 C ATOM 1459 CG1 VAL B 390 0.817 5.231 4.923 1.00 0.00 C ATOM 1460 CG2 VAL B 390 -1.590 5.125 4.257 1.00 0.00 C ATOM 0 H VAL B 390 -0.441 3.357 2.372 1.00 0.00 H new ATOM 0 HA VAL B 390 0.511 2.504 5.026 1.00 0.00 H new ATOM 0 HB VAL B 390 -0.754 4.327 6.044 1.00 0.00 H new ATOM 0 HG11 VAL B 390 0.643 6.226 5.332 1.00 0.00 H new ATOM 0 HG12 VAL B 390 1.596 4.733 5.500 1.00 0.00 H new ATOM 0 HG13 VAL B 390 1.134 5.316 3.884 1.00 0.00 H new ATOM 0 HG21 VAL B 390 -1.732 6.121 4.676 1.00 0.00 H new ATOM 0 HG22 VAL B 390 -1.334 5.208 3.201 1.00 0.00 H new ATOM 0 HG23 VAL B 390 -2.511 4.552 4.363 1.00 0.00 H new ATOM 1470 N LYS B 391 -1.805 1.630 5.656 1.00 0.00 N ATOM 1471 CA LYS B 391 -3.009 0.837 5.862 1.00 0.00 C ATOM 1472 C LYS B 391 -2.999 -0.418 4.994 1.00 0.00 C ATOM 1473 O LYS B 391 -3.875 -0.605 4.149 1.00 0.00 O ATOM 1474 CB LYS B 391 -4.252 1.674 5.559 1.00 0.00 C ATOM 1475 CG LYS B 391 -5.440 1.333 6.445 1.00 0.00 C ATOM 1476 CD LYS B 391 -5.857 -0.120 6.280 1.00 0.00 C ATOM 1477 CE LYS B 391 -7.282 -0.351 6.755 1.00 0.00 C ATOM 1478 NZ LYS B 391 -7.418 -1.631 7.503 1.00 0.00 N ATOM 0 H LYS B 391 -1.196 1.691 6.472 1.00 0.00 H new ATOM 0 HA LYS B 391 -3.032 0.527 6.907 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -4.009 2.730 5.680 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -4.533 1.530 4.516 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -5.185 1.524 7.487 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -6.279 1.984 6.198 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -5.771 -0.407 5.232 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -5.177 -0.760 6.842 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -7.590 0.477 7.393 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -7.954 -0.359 5.897 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -7.982 -2.302 6.943 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -6.475 -2.033 7.678 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -7.893 -1.454 8.411 1.00 0.00 H new ATOM 1492 N LYS B 392 -2.008 -1.278 5.210 1.00 0.00 N ATOM 1493 CA LYS B 392 -1.895 -2.516 4.445 1.00 0.00 C ATOM 1494 C LYS B 392 -3.191 -3.315 4.529 1.00 0.00 C ATOM 1495 O LYS B 392 -3.809 -3.401 5.590 1.00 0.00 O ATOM 1496 CB LYS B 392 -0.727 -3.359 4.963 1.00 0.00 C ATOM 1497 CG LYS B 392 0.639 -2.769 4.652 1.00 0.00 C ATOM 1498 CD LYS B 392 1.200 -2.002 5.839 1.00 0.00 C ATOM 1499 CE LYS B 392 2.672 -1.673 5.646 1.00 0.00 C ATOM 1500 NZ LYS B 392 3.554 -2.568 6.445 1.00 0.00 N ATOM 0 H LYS B 392 -1.274 -1.142 5.905 1.00 0.00 H new ATOM 0 HA LYS B 392 -1.708 -2.259 3.402 1.00 0.00 H new ATOM 0 HB2 LYS B 392 -0.825 -3.475 6.042 1.00 0.00 H new ATOM 0 HB3 LYS B 392 -0.790 -4.356 4.528 1.00 0.00 H new ATOM 0 HG2 LYS B 392 1.327 -3.568 4.376 1.00 0.00 H new ATOM 0 HG3 LYS B 392 0.562 -2.104 3.792 1.00 0.00 H new ATOM 0 HD2 LYS B 392 0.635 -1.080 5.977 1.00 0.00 H new ATOM 0 HD3 LYS B 392 1.074 -2.592 6.747 1.00 0.00 H new ATOM 0 HE2 LYS B 392 2.928 -1.761 4.590 1.00 0.00 H new ATOM 0 HE3 LYS B 392 2.852 -0.637 5.932 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 4.548 -2.309 6.284 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 3.329 -2.466 7.455 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 3.402 -3.555 6.155 1.00 0.00 H new ATOM 1514 N PRO B 393 -3.623 -3.912 3.408 1.00 0.00 N ATOM 1515 CA PRO B 393 -4.854 -4.701 3.360 1.00 0.00 C ATOM 1516 C PRO B 393 -4.856 -5.832 4.380 1.00 0.00 C ATOM 1517 O PRO B 393 -3.962 -5.923 5.221 1.00 0.00 O ATOM 1518 CB PRO B 393 -4.883 -5.272 1.938 1.00 0.00 C ATOM 1519 CG PRO B 393 -3.510 -5.061 1.394 1.00 0.00 C ATOM 1520 CD PRO B 393 -2.952 -3.860 2.104 1.00 0.00 C ATOM 0 HA PRO B 393 -5.725 -4.090 3.599 1.00 0.00 H new ATOM 0 HB2 PRO B 393 -5.143 -6.330 1.946 1.00 0.00 H new ATOM 0 HB3 PRO B 393 -5.629 -4.765 1.327 1.00 0.00 H new ATOM 0 HG2 PRO B 393 -2.886 -5.938 1.565 1.00 0.00 H new ATOM 0 HG3 PRO B 393 -3.540 -4.896 0.317 1.00 0.00 H new ATOM 0 HD2 PRO B 393 -1.868 -3.917 2.204 1.00 0.00 H new ATOM 0 HD3 PRO B 393 -3.175 -2.936 1.571 1.00 0.00 H new ATOM 1528 N THR B 394 -5.870 -6.688 4.308 1.00 0.00 N ATOM 1529 CA THR B 394 -5.985 -7.805 5.238 1.00 0.00 C ATOM 1530 C THR B 394 -6.838 -8.937 4.672 1.00 0.00 C ATOM 1531 O THR B 394 -6.315 -9.929 4.164 1.00 0.00 O ATOM 1532 CB THR B 394 -6.594 -7.349 6.577 1.00 0.00 C ATOM 1533 OG1 THR B 394 -7.865 -6.717 6.381 1.00 0.00 O ATOM 1534 CG2 THR B 394 -5.672 -6.367 7.284 1.00 0.00 C ATOM 0 H THR B 394 -6.620 -6.630 3.619 1.00 0.00 H new ATOM 0 HA THR B 394 -4.973 -8.176 5.399 1.00 0.00 H new ATOM 0 HB THR B 394 -6.723 -8.242 7.189 1.00 0.00 H new ATOM 0 HG1 THR B 394 -8.229 -6.439 7.247 1.00 0.00 H new ATOM 0 HG21 THR B 394 -6.123 -6.059 8.227 1.00 0.00 H new ATOM 0 HG22 THR B 394 -4.712 -6.845 7.480 1.00 0.00 H new ATOM 0 HG23 THR B 394 -5.519 -5.492 6.652 1.00 0.00 H new ATOM 1542 N ALA B 395 -8.155 -8.785 4.773 1.00 0.00 N ATOM 1543 CA ALA B 395 -9.089 -9.795 4.282 1.00 0.00 C ATOM 1544 C ALA B 395 -10.504 -9.519 4.786 1.00 0.00 C ATOM 1545 O ALA B 395 -11.487 -9.908 4.154 1.00 0.00 O ATOM 1546 CB ALA B 395 -8.645 -11.191 4.696 1.00 0.00 C ATOM 0 H ALA B 395 -8.602 -7.969 5.192 1.00 0.00 H new ATOM 0 HA ALA B 395 -9.094 -9.743 3.193 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -9.356 -11.926 4.319 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -7.658 -11.396 4.283 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -8.603 -11.252 5.783 1.00 0.00 H new ATOM 1552 N VAL B 396 -10.596 -8.826 5.915 1.00 0.00 N ATOM 1553 CA VAL B 396 -11.884 -8.471 6.496 1.00 0.00 C ATOM 1554 C VAL B 396 -12.054 -6.960 6.510 1.00 0.00 C ATOM 1555 O VAL B 396 -13.092 -6.432 6.910 1.00 0.00 O ATOM 1556 CB VAL B 396 -12.035 -9.025 7.925 1.00 0.00 C ATOM 1557 CG1 VAL B 396 -12.539 -10.460 7.889 1.00 0.00 C ATOM 1558 CG2 VAL B 396 -10.713 -8.938 8.673 1.00 0.00 C ATOM 0 H VAL B 396 -9.790 -8.498 6.448 1.00 0.00 H new ATOM 0 HA VAL B 396 -12.660 -8.920 5.876 1.00 0.00 H new ATOM 0 HB VAL B 396 -12.768 -8.418 8.456 1.00 0.00 H new ATOM 0 HG11 VAL B 396 -12.640 -10.836 8.907 1.00 0.00 H new ATOM 0 HG12 VAL B 396 -13.509 -10.493 7.392 1.00 0.00 H new ATOM 0 HG13 VAL B 396 -11.830 -11.081 7.342 1.00 0.00 H new ATOM 0 HG21 VAL B 396 -10.838 -9.334 9.681 1.00 0.00 H new ATOM 0 HG22 VAL B 396 -9.958 -9.521 8.146 1.00 0.00 H new ATOM 0 HG23 VAL B 396 -10.394 -7.897 8.729 1.00 0.00 H new ATOM 1568 N ASP B 397 -11.013 -6.281 6.057 1.00 0.00 N ATOM 1569 CA ASP B 397 -10.988 -4.831 5.984 1.00 0.00 C ATOM 1570 C ASP B 397 -9.645 -4.370 5.443 1.00 0.00 C ATOM 1571 O ASP B 397 -8.931 -3.594 6.079 1.00 0.00 O ATOM 1572 CB ASP B 397 -11.252 -4.212 7.358 1.00 0.00 C ATOM 1573 CG ASP B 397 -12.626 -3.579 7.451 1.00 0.00 C ATOM 1574 OD1 ASP B 397 -13.363 -3.611 6.444 1.00 0.00 O ATOM 1575 OD2 ASP B 397 -12.966 -3.052 8.532 1.00 0.00 O ATOM 0 H ASP B 397 -10.156 -6.725 5.727 1.00 0.00 H new ATOM 0 HA ASP B 397 -11.778 -4.500 5.310 1.00 0.00 H new ATOM 0 HB2 ASP B 397 -11.156 -4.981 8.125 1.00 0.00 H new ATOM 0 HB3 ASP B 397 -10.493 -3.458 7.566 1.00 0.00 H new ATOM 1580 N PRO B 398 -9.287 -4.865 4.251 1.00 0.00 N ATOM 1581 CA PRO B 398 -8.022 -4.534 3.591 1.00 0.00 C ATOM 1582 C PRO B 398 -7.813 -3.038 3.431 1.00 0.00 C ATOM 1583 O PRO B 398 -7.052 -2.423 4.175 1.00 0.00 O ATOM 1584 CB PRO B 398 -8.142 -5.194 2.206 1.00 0.00 C ATOM 1585 CG PRO B 398 -9.582 -5.560 2.060 1.00 0.00 C ATOM 1586 CD PRO B 398 -10.091 -5.797 3.451 1.00 0.00 C ATOM 0 HA PRO B 398 -7.172 -4.883 4.177 1.00 0.00 H new ATOM 0 HB2 PRO B 398 -7.829 -4.510 1.417 1.00 0.00 H new ATOM 0 HB3 PRO B 398 -7.504 -6.075 2.135 1.00 0.00 H new ATOM 0 HG2 PRO B 398 -10.140 -4.761 1.571 1.00 0.00 H new ATOM 0 HG3 PRO B 398 -9.697 -6.452 1.445 1.00 0.00 H new ATOM 0 HD2 PRO B 398 -11.157 -5.586 3.534 1.00 0.00 H new ATOM 0 HD3 PRO B 398 -9.945 -6.831 3.765 1.00 0.00 H new ATOM 1594 N ASN B 399 -8.502 -2.478 2.447 1.00 0.00 N ATOM 1595 CA ASN B 399 -8.419 -1.049 2.138 1.00 0.00 C ATOM 1596 C ASN B 399 -6.970 -0.568 2.142 1.00 0.00 C ATOM 1597 O ASN B 399 -6.300 -0.560 3.173 1.00 0.00 O ATOM 1598 CB ASN B 399 -9.240 -0.225 3.129 1.00 0.00 C ATOM 1599 CG ASN B 399 -10.388 0.506 2.463 1.00 0.00 C ATOM 1600 OD1 ASN B 399 -10.519 1.724 2.586 1.00 0.00 O ATOM 1601 ND2 ASN B 399 -11.229 -0.236 1.750 1.00 0.00 N ATOM 0 H ASN B 399 -9.135 -2.997 1.838 1.00 0.00 H new ATOM 0 HA ASN B 399 -8.831 -0.908 1.139 1.00 0.00 H new ATOM 0 HB2 ASN B 399 -9.633 -0.882 3.905 1.00 0.00 H new ATOM 0 HB3 ASN B 399 -8.590 0.498 3.622 1.00 0.00 H new ATOM 0 HD21 ASN B 399 -12.021 0.201 1.278 1.00 0.00 H new ATOM 0 HD22 ASN B 399 -11.083 -1.243 1.675 1.00 0.00 H new ATOM 1608 N SER B 400 -6.497 -0.144 0.981 1.00 0.00 N ATOM 1609 CA SER B 400 -5.135 0.349 0.855 1.00 0.00 C ATOM 1610 C SER B 400 -5.128 1.837 0.536 1.00 0.00 C ATOM 1611 O SER B 400 -5.628 2.258 -0.509 1.00 0.00 O ATOM 1612 CB SER B 400 -4.387 -0.419 -0.234 1.00 0.00 C ATOM 1613 OG SER B 400 -3.334 0.362 -0.775 1.00 0.00 O ATOM 0 H SER B 400 -7.035 -0.131 0.114 1.00 0.00 H new ATOM 0 HA SER B 400 -4.630 0.194 1.808 1.00 0.00 H new ATOM 0 HB2 SER B 400 -3.984 -1.343 0.180 1.00 0.00 H new ATOM 0 HB3 SER B 400 -5.080 -0.701 -1.027 1.00 0.00 H new ATOM 0 HG SER B 400 -2.610 -0.227 -1.074 1.00 0.00 H new ATOM 1619 N ILE B 401 -4.562 2.626 1.443 1.00 0.00 N ATOM 1620 CA ILE B 401 -4.484 4.060 1.262 1.00 0.00 C ATOM 1621 C ILE B 401 -3.049 4.488 0.961 1.00 0.00 C ATOM 1622 O ILE B 401 -2.187 4.499 1.840 1.00 0.00 O ATOM 1623 CB ILE B 401 -5.026 4.806 2.500 1.00 0.00 C ATOM 1624 CG1 ILE B 401 -4.477 6.233 2.573 1.00 0.00 C ATOM 1625 CG2 ILE B 401 -4.714 4.048 3.780 1.00 0.00 C ATOM 1626 CD1 ILE B 401 -4.969 7.133 1.462 1.00 0.00 C ATOM 0 H ILE B 401 -4.150 2.289 2.313 1.00 0.00 H new ATOM 0 HA ILE B 401 -5.109 4.325 0.409 1.00 0.00 H new ATOM 0 HB ILE B 401 -6.109 4.865 2.396 1.00 0.00 H new ATOM 0 HG12 ILE B 401 -4.754 6.670 3.532 1.00 0.00 H new ATOM 0 HG13 ILE B 401 -3.388 6.196 2.542 1.00 0.00 H new ATOM 0 HG21 ILE B 401 -5.108 4.598 4.634 1.00 0.00 H new ATOM 0 HG22 ILE B 401 -5.175 3.061 3.740 1.00 0.00 H new ATOM 0 HG23 ILE B 401 -3.634 3.940 3.885 1.00 0.00 H new ATOM 0 HD11 ILE B 401 -4.537 8.127 1.581 1.00 0.00 H new ATOM 0 HD12 ILE B 401 -4.669 6.720 0.499 1.00 0.00 H new ATOM 0 HD13 ILE B 401 -6.056 7.202 1.504 1.00 0.00 H new ATOM 1638 N VAL B 402 -2.813 4.843 -0.296 1.00 0.00 N ATOM 1639 CA VAL B 402 -1.504 5.281 -0.749 1.00 0.00 C ATOM 1640 C VAL B 402 -1.260 6.720 -0.327 1.00 0.00 C ATOM 1641 O VAL B 402 -2.210 7.471 -0.089 1.00 0.00 O ATOM 1642 CB VAL B 402 -1.370 5.171 -2.284 1.00 0.00 C ATOM 1643 CG1 VAL B 402 0.045 4.777 -2.676 1.00 0.00 C ATOM 1644 CG2 VAL B 402 -2.376 4.173 -2.840 1.00 0.00 C ATOM 0 H VAL B 402 -3.524 4.835 -1.027 1.00 0.00 H new ATOM 0 HA VAL B 402 -0.761 4.628 -0.290 1.00 0.00 H new ATOM 0 HB VAL B 402 -1.583 6.150 -2.714 1.00 0.00 H new ATOM 0 HG11 VAL B 402 0.115 4.706 -3.761 1.00 0.00 H new ATOM 0 HG12 VAL B 402 0.745 5.530 -2.316 1.00 0.00 H new ATOM 0 HG13 VAL B 402 0.290 3.812 -2.232 1.00 0.00 H new ATOM 0 HG21 VAL B 402 -2.266 4.110 -3.923 1.00 0.00 H new ATOM 0 HG22 VAL B 402 -2.197 3.192 -2.399 1.00 0.00 H new ATOM 0 HG23 VAL B 402 -3.387 4.501 -2.597 1.00 0.00 H new ATOM 1654 N GLU B 403 0.010 7.105 -0.273 1.00 0.00 N ATOM 1655 CA GLU B 403 0.388 8.459 0.092 1.00 0.00 C ATOM 1656 C GLU B 403 1.336 9.032 -0.938 1.00 0.00 C ATOM 1657 O GLU B 403 2.552 8.925 -0.810 1.00 0.00 O ATOM 1658 CB GLU B 403 1.040 8.477 1.475 1.00 0.00 C ATOM 1659 CG GLU B 403 1.016 9.843 2.140 1.00 0.00 C ATOM 1660 CD GLU B 403 -0.327 10.162 2.768 1.00 0.00 C ATOM 1661 OE1 GLU B 403 -0.793 9.366 3.609 1.00 0.00 O ATOM 1662 OE2 GLU B 403 -0.912 11.209 2.418 1.00 0.00 O ATOM 0 H GLU B 403 0.798 6.491 -0.480 1.00 0.00 H new ATOM 0 HA GLU B 403 -0.512 9.074 0.124 1.00 0.00 H new ATOM 0 HB2 GLU B 403 0.529 7.760 2.118 1.00 0.00 H new ATOM 0 HB3 GLU B 403 2.074 8.144 1.385 1.00 0.00 H new ATOM 0 HG2 GLU B 403 1.790 9.884 2.906 1.00 0.00 H new ATOM 0 HG3 GLU B 403 1.258 10.607 1.401 1.00 0.00 H new ATOM 1669 N CYS B 404 0.769 9.664 -1.949 1.00 0.00 N ATOM 1670 CA CYS B 404 1.569 10.290 -2.975 1.00 0.00 C ATOM 1671 C CYS B 404 1.990 11.644 -2.453 1.00 0.00 C ATOM 1672 O CYS B 404 1.138 12.501 -2.201 1.00 0.00 O ATOM 1673 CB CYS B 404 0.781 10.436 -4.279 1.00 0.00 C ATOM 1674 SG CYS B 404 -0.564 9.244 -4.466 1.00 0.00 S ATOM 0 H CYS B 404 -0.239 9.755 -2.078 1.00 0.00 H new ATOM 0 HA CYS B 404 2.440 9.675 -3.200 1.00 0.00 H new ATOM 0 HB2 CYS B 404 0.369 11.444 -4.331 1.00 0.00 H new ATOM 0 HB3 CYS B 404 1.467 10.328 -5.119 1.00 0.00 H new ATOM 0 HG CYS B 404 -1.035 9.308 -5.676 1.00 0.00 H new ATOM 1680 N ARG B 405 3.298 11.806 -2.254 1.00 0.00 N ATOM 1681 CA ARG B 405 3.862 13.043 -1.729 1.00 0.00 C ATOM 1682 C ARG B 405 5.317 13.168 -2.159 1.00 0.00 C ATOM 1683 O ARG B 405 5.886 12.224 -2.696 1.00 0.00 O ATOM 1684 CB ARG B 405 3.743 13.071 -0.204 1.00 0.00 C ATOM 1685 CG ARG B 405 4.822 12.275 0.511 1.00 0.00 C ATOM 1686 CD ARG B 405 4.337 11.778 1.863 1.00 0.00 C ATOM 1687 NE ARG B 405 5.402 11.134 2.625 1.00 0.00 N ATOM 1688 CZ ARG B 405 6.306 11.802 3.335 1.00 0.00 C ATOM 1689 NH1 ARG B 405 6.267 13.126 3.387 1.00 0.00 N ATOM 1690 NH2 ARG B 405 7.249 11.144 3.998 1.00 0.00 N ATOM 0 H ARG B 405 3.992 11.085 -2.452 1.00 0.00 H new ATOM 0 HA ARG B 405 3.306 13.890 -2.130 1.00 0.00 H new ATOM 0 HB2 ARG B 405 3.784 14.106 0.135 1.00 0.00 H new ATOM 0 HB3 ARG B 405 2.767 12.680 0.082 1.00 0.00 H new ATOM 0 HG2 ARG B 405 5.120 11.427 -0.105 1.00 0.00 H new ATOM 0 HG3 ARG B 405 5.707 12.897 0.646 1.00 0.00 H new ATOM 0 HD2 ARG B 405 3.938 12.616 2.435 1.00 0.00 H new ATOM 0 HD3 ARG B 405 3.519 11.073 1.717 1.00 0.00 H new ATOM 0 HE ARG B 405 5.456 10.115 2.612 1.00 0.00 H new ATOM 0 HH11 ARG B 405 5.542 13.635 2.881 1.00 0.00 H new ATOM 0 HH12 ARG B 405 6.962 13.636 3.933 1.00 0.00 H new ATOM 0 HH21 ARG B 405 7.280 10.125 3.963 1.00 0.00 H new ATOM 0 HH22 ARG B 405 7.942 11.657 4.542 1.00 0.00 H new ATOM 1704 N VAL B 406 5.909 14.336 -1.946 1.00 0.00 N ATOM 1705 CA VAL B 406 7.291 14.569 -2.342 1.00 0.00 C ATOM 1706 C VAL B 406 8.128 15.098 -1.186 1.00 0.00 C ATOM 1707 O VAL B 406 7.771 16.090 -0.551 1.00 0.00 O ATOM 1708 CB VAL B 406 7.372 15.562 -3.516 1.00 0.00 C ATOM 1709 CG1 VAL B 406 6.572 15.054 -4.703 1.00 0.00 C ATOM 1710 CG2 VAL B 406 6.883 16.937 -3.089 1.00 0.00 C ATOM 0 H VAL B 406 5.455 15.135 -1.502 1.00 0.00 H new ATOM 0 HA VAL B 406 7.692 13.605 -2.654 1.00 0.00 H new ATOM 0 HB VAL B 406 8.415 15.649 -3.819 1.00 0.00 H new ATOM 0 HG11 VAL B 406 6.642 15.770 -5.522 1.00 0.00 H new ATOM 0 HG12 VAL B 406 6.971 14.093 -5.026 1.00 0.00 H new ATOM 0 HG13 VAL B 406 5.528 14.935 -4.414 1.00 0.00 H new ATOM 0 HG21 VAL B 406 6.948 17.624 -3.932 1.00 0.00 H new ATOM 0 HG22 VAL B 406 5.847 16.868 -2.756 1.00 0.00 H new ATOM 0 HG23 VAL B 406 7.503 17.306 -2.272 1.00 0.00 H new ATOM 1720 N GLY B 407 9.240 14.419 -0.921 1.00 0.00 N ATOM 1721 CA GLY B 407 10.127 14.814 0.158 1.00 0.00 C ATOM 1722 C GLY B 407 10.208 16.317 0.349 1.00 0.00 C ATOM 1723 O GLY B 407 10.359 16.796 1.474 1.00 0.00 O ATOM 0 H GLY B 407 9.544 13.595 -1.440 1.00 0.00 H new ATOM 0 HA2 GLY B 407 9.786 14.355 1.086 1.00 0.00 H new ATOM 0 HA3 GLY B 407 11.126 14.426 -0.042 1.00 0.00 H new ATOM 1727 N ASP B 408 10.113 17.064 -0.746 1.00 0.00 N ATOM 1728 CA ASP B 408 10.182 18.520 -0.681 1.00 0.00 C ATOM 1729 C ASP B 408 9.071 19.072 0.202 1.00 0.00 C ATOM 1730 O ASP B 408 9.219 20.126 0.823 1.00 0.00 O ATOM 1731 CB ASP B 408 10.081 19.125 -2.082 1.00 0.00 C ATOM 1732 CG ASP B 408 10.043 20.641 -2.056 1.00 0.00 C ATOM 1733 OD1 ASP B 408 10.771 21.238 -1.236 1.00 0.00 O ATOM 1734 OD2 ASP B 408 9.284 21.230 -2.854 1.00 0.00 O ATOM 0 H ASP B 408 9.988 16.687 -1.686 1.00 0.00 H new ATOM 0 HA ASP B 408 11.144 18.794 -0.247 1.00 0.00 H new ATOM 0 HB2 ASP B 408 10.931 18.796 -2.679 1.00 0.00 H new ATOM 0 HB3 ASP B 408 9.183 18.750 -2.573 1.00 0.00 H new ATOM 1739 N GLY B 409 7.959 18.351 0.253 1.00 0.00 N ATOM 1740 CA GLY B 409 6.832 18.774 1.055 1.00 0.00 C ATOM 1741 C GLY B 409 5.608 19.032 0.209 1.00 0.00 C ATOM 1742 O GLY B 409 4.952 20.065 0.347 1.00 0.00 O ATOM 0 H GLY B 409 7.819 17.475 -0.251 1.00 0.00 H new ATOM 0 HA2 GLY B 409 6.606 18.008 1.797 1.00 0.00 H new ATOM 0 HA3 GLY B 409 7.094 19.680 1.601 1.00 0.00 H new ATOM 1746 N THR B 410 5.309 18.096 -0.684 1.00 0.00 N ATOM 1747 CA THR B 410 4.164 18.232 -1.572 1.00 0.00 C ATOM 1748 C THR B 410 3.471 16.893 -1.795 1.00 0.00 C ATOM 1749 O THR B 410 4.028 15.996 -2.414 1.00 0.00 O ATOM 1750 CB THR B 410 4.593 18.805 -2.933 1.00 0.00 C ATOM 1751 OG1 THR B 410 5.745 19.646 -2.807 1.00 0.00 O ATOM 1752 CG2 THR B 410 3.473 19.615 -3.559 1.00 0.00 C ATOM 0 H THR B 410 5.843 17.237 -0.811 1.00 0.00 H new ATOM 0 HA THR B 410 3.466 18.917 -1.091 1.00 0.00 H new ATOM 0 HB THR B 410 4.835 17.954 -3.570 1.00 0.00 H new ATOM 0 HG1 THR B 410 6.073 19.887 -3.698 1.00 0.00 H new ATOM 0 HG21 THR B 410 3.802 20.009 -4.520 1.00 0.00 H new ATOM 0 HG22 THR B 410 2.602 18.977 -3.707 1.00 0.00 H new ATOM 0 HG23 THR B 410 3.209 20.442 -2.899 1.00 0.00 H new ATOM 1760 N VAL B 411 2.252 16.768 -1.293 1.00 0.00 N ATOM 1761 CA VAL B 411 1.481 15.536 -1.439 1.00 0.00 C ATOM 1762 C VAL B 411 1.245 15.154 -2.902 1.00 0.00 C ATOM 1763 O VAL B 411 1.705 14.119 -3.357 1.00 0.00 O ATOM 1764 CB VAL B 411 0.117 15.653 -0.738 1.00 0.00 C ATOM 1765 CG1 VAL B 411 -0.582 14.303 -0.715 1.00 0.00 C ATOM 1766 CG2 VAL B 411 0.289 16.197 0.671 1.00 0.00 C ATOM 0 H VAL B 411 1.771 17.506 -0.779 1.00 0.00 H new ATOM 0 HA VAL B 411 2.080 14.754 -0.972 1.00 0.00 H new ATOM 0 HB VAL B 411 -0.505 16.351 -1.298 1.00 0.00 H new ATOM 0 HG11 VAL B 411 -1.546 14.401 -0.216 1.00 0.00 H new ATOM 0 HG12 VAL B 411 -0.736 13.956 -1.737 1.00 0.00 H new ATOM 0 HG13 VAL B 411 0.034 13.583 -0.176 1.00 0.00 H new ATOM 0 HG21 VAL B 411 -0.686 16.274 1.153 1.00 0.00 H new ATOM 0 HG22 VAL B 411 0.926 15.524 1.245 1.00 0.00 H new ATOM 0 HG23 VAL B 411 0.750 17.184 0.626 1.00 0.00 H new ATOM 1776 N LEU B 412 0.524 15.976 -3.647 1.00 0.00 N ATOM 1777 CA LEU B 412 0.222 15.667 -5.044 1.00 0.00 C ATOM 1778 C LEU B 412 -1.028 14.798 -5.109 1.00 0.00 C ATOM 1779 O LEU B 412 -1.898 15.019 -5.950 1.00 0.00 O ATOM 1780 CB LEU B 412 1.375 14.951 -5.767 1.00 0.00 C ATOM 1781 CG LEU B 412 2.747 15.636 -5.719 1.00 0.00 C ATOM 1782 CD1 LEU B 412 2.688 16.956 -4.961 1.00 0.00 C ATOM 1783 CD2 LEU B 412 3.778 14.704 -5.099 1.00 0.00 C ATOM 0 H LEU B 412 0.137 16.859 -3.314 1.00 0.00 H new ATOM 0 HA LEU B 412 0.065 16.617 -5.554 1.00 0.00 H new ATOM 0 HB2 LEU B 412 1.477 13.953 -5.340 1.00 0.00 H new ATOM 0 HB3 LEU B 412 1.094 14.823 -6.812 1.00 0.00 H new ATOM 0 HG LEU B 412 3.046 15.861 -6.743 1.00 0.00 H new ATOM 0 HD11 LEU B 412 3.678 17.412 -4.948 1.00 0.00 H new ATOM 0 HD12 LEU B 412 1.985 17.628 -5.454 1.00 0.00 H new ATOM 0 HD13 LEU B 412 2.359 16.774 -3.938 1.00 0.00 H new ATOM 0 HD21 LEU B 412 4.748 15.201 -5.070 1.00 0.00 H new ATOM 0 HD22 LEU B 412 3.472 14.446 -4.085 1.00 0.00 H new ATOM 0 HD23 LEU B 412 3.854 13.796 -5.697 1.00 0.00 H new ATOM 1795 N GLY B 413 -1.125 13.811 -4.209 1.00 0.00 N ATOM 1796 CA GLY B 413 -2.297 12.955 -4.207 1.00 0.00 C ATOM 1797 C GLY B 413 -2.144 11.712 -3.351 1.00 0.00 C ATOM 1798 O GLY B 413 -1.074 11.442 -2.808 1.00 0.00 O ATOM 0 H GLY B 413 -0.426 13.597 -3.498 1.00 0.00 H new ATOM 0 HA2 GLY B 413 -3.153 13.528 -3.851 1.00 0.00 H new ATOM 0 HA3 GLY B 413 -2.518 12.655 -5.231 1.00 0.00 H new ATOM 1802 N THR B 414 -3.232 10.955 -3.244 1.00 0.00 N ATOM 1803 CA THR B 414 -3.254 9.721 -2.469 1.00 0.00 C ATOM 1804 C THR B 414 -4.115 8.686 -3.182 1.00 0.00 C ATOM 1805 O THR B 414 -4.620 8.950 -4.269 1.00 0.00 O ATOM 1806 CB THR B 414 -3.805 9.954 -1.051 1.00 0.00 C ATOM 1807 OG1 THR B 414 -4.343 8.748 -0.492 1.00 0.00 O ATOM 1808 CG2 THR B 414 -4.896 11.014 -1.061 1.00 0.00 C ATOM 0 H THR B 414 -4.121 11.180 -3.691 1.00 0.00 H new ATOM 0 HA THR B 414 -2.229 9.361 -2.380 1.00 0.00 H new ATOM 0 HB THR B 414 -2.969 10.291 -0.438 1.00 0.00 H new ATOM 0 HG1 THR B 414 -3.610 8.172 -0.191 1.00 0.00 H new ATOM 0 HG21 THR B 414 -5.270 11.161 -0.048 1.00 0.00 H new ATOM 0 HG22 THR B 414 -4.488 11.952 -1.437 1.00 0.00 H new ATOM 0 HG23 THR B 414 -5.713 10.689 -1.705 1.00 0.00 H new ATOM 1816 N GLY B 415 -4.289 7.509 -2.593 1.00 0.00 N ATOM 1817 CA GLY B 415 -5.104 6.505 -3.262 1.00 0.00 C ATOM 1818 C GLY B 415 -5.670 5.447 -2.339 1.00 0.00 C ATOM 1819 O GLY B 415 -4.931 4.672 -1.748 1.00 0.00 O ATOM 0 H GLY B 415 -3.896 7.234 -1.693 1.00 0.00 H new ATOM 0 HA2 GLY B 415 -5.928 7.004 -3.772 1.00 0.00 H new ATOM 0 HA3 GLY B 415 -4.502 6.017 -4.029 1.00 0.00 H new ATOM 1823 N VAL B 416 -6.991 5.382 -2.245 1.00 0.00 N ATOM 1824 CA VAL B 416 -7.634 4.381 -1.416 1.00 0.00 C ATOM 1825 C VAL B 416 -8.278 3.325 -2.295 1.00 0.00 C ATOM 1826 O VAL B 416 -8.780 3.629 -3.377 1.00 0.00 O ATOM 1827 CB VAL B 416 -8.703 4.989 -0.488 1.00 0.00 C ATOM 1828 CG1 VAL B 416 -9.256 3.929 0.457 1.00 0.00 C ATOM 1829 CG2 VAL B 416 -8.126 6.159 0.292 1.00 0.00 C ATOM 0 H VAL B 416 -7.633 6.009 -2.731 1.00 0.00 H new ATOM 0 HA VAL B 416 -6.862 3.936 -0.788 1.00 0.00 H new ATOM 0 HB VAL B 416 -9.524 5.359 -1.102 1.00 0.00 H new ATOM 0 HG11 VAL B 416 -10.010 4.377 1.105 1.00 0.00 H new ATOM 0 HG12 VAL B 416 -9.708 3.124 -0.123 1.00 0.00 H new ATOM 0 HG13 VAL B 416 -8.447 3.527 1.066 1.00 0.00 H new ATOM 0 HG21 VAL B 416 -8.894 6.577 0.943 1.00 0.00 H new ATOM 0 HG22 VAL B 416 -7.287 5.815 0.896 1.00 0.00 H new ATOM 0 HG23 VAL B 416 -7.783 6.926 -0.403 1.00 0.00 H new ATOM 1839 N GLY B 417 -8.263 2.087 -1.834 1.00 0.00 N ATOM 1840 CA GLY B 417 -8.855 1.026 -2.620 1.00 0.00 C ATOM 1841 C GLY B 417 -9.047 -0.262 -1.847 1.00 0.00 C ATOM 1842 O GLY B 417 -8.241 -0.603 -0.983 1.00 0.00 O ATOM 0 H GLY B 417 -7.858 1.799 -0.943 1.00 0.00 H new ATOM 0 HA2 GLY B 417 -9.821 1.361 -2.999 1.00 0.00 H new ATOM 0 HA3 GLY B 417 -8.223 0.830 -3.486 1.00 0.00 H new ATOM 1846 N ARG B 418 -10.117 -0.984 -2.166 1.00 0.00 N ATOM 1847 CA ARG B 418 -10.407 -2.249 -1.497 1.00 0.00 C ATOM 1848 C ARG B 418 -9.345 -3.292 -1.834 1.00 0.00 C ATOM 1849 O ARG B 418 -8.743 -3.888 -0.941 1.00 0.00 O ATOM 1850 CB ARG B 418 -11.795 -2.764 -1.889 1.00 0.00 C ATOM 1851 CG ARG B 418 -12.220 -2.390 -3.301 1.00 0.00 C ATOM 1852 CD ARG B 418 -13.140 -3.442 -3.903 1.00 0.00 C ATOM 1853 NE ARG B 418 -14.545 -3.062 -3.803 1.00 0.00 N ATOM 1854 CZ ARG B 418 -15.552 -3.876 -4.107 1.00 0.00 C ATOM 1855 NH1 ARG B 418 -15.305 -5.109 -4.530 1.00 0.00 N ATOM 1856 NH2 ARG B 418 -16.804 -3.459 -3.989 1.00 0.00 N ATOM 0 H ARG B 418 -10.795 -0.717 -2.880 1.00 0.00 H new ATOM 0 HA ARG B 418 -10.393 -2.073 -0.421 1.00 0.00 H new ATOM 0 HB2 ARG B 418 -11.809 -3.850 -1.792 1.00 0.00 H new ATOM 0 HB3 ARG B 418 -12.529 -2.372 -1.184 1.00 0.00 H new ATOM 0 HG2 ARG B 418 -12.729 -1.426 -3.286 1.00 0.00 H new ATOM 0 HG3 ARG B 418 -11.337 -2.275 -3.929 1.00 0.00 H new ATOM 0 HD2 ARG B 418 -12.880 -3.595 -4.950 1.00 0.00 H new ATOM 0 HD3 ARG B 418 -12.985 -4.393 -3.394 1.00 0.00 H new ATOM 0 HE ARG B 418 -14.767 -2.120 -3.482 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -14.342 -5.433 -4.622 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -16.078 -5.733 -4.763 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -16.998 -2.512 -3.664 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -17.574 -4.085 -4.223 1.00 0.00 H new ATOM 1870 N ASN B 419 -9.112 -3.500 -3.127 1.00 0.00 N ATOM 1871 CA ASN B 419 -8.114 -4.463 -3.577 1.00 0.00 C ATOM 1872 C ASN B 419 -6.719 -3.859 -3.483 1.00 0.00 C ATOM 1873 O ASN B 419 -5.724 -4.580 -3.448 1.00 0.00 O ATOM 1874 CB ASN B 419 -8.404 -4.897 -5.014 1.00 0.00 C ATOM 1875 CG ASN B 419 -9.885 -4.879 -5.334 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -10.722 -5.129 -4.467 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -10.217 -4.581 -6.584 1.00 0.00 N ATOM 0 H ASN B 419 -9.600 -3.015 -3.880 1.00 0.00 H new ATOM 0 HA ASN B 419 -8.161 -5.340 -2.931 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -7.878 -4.237 -5.703 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -8.013 -5.902 -5.173 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -11.199 -4.553 -6.858 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -9.490 -4.380 -7.271 1.00 0.00 H new ATOM 1884 N ILE B 420 -6.675 -2.525 -3.473 1.00 0.00 N ATOM 1885 CA ILE B 420 -5.438 -1.747 -3.405 1.00 0.00 C ATOM 1886 C ILE B 420 -5.014 -1.253 -4.784 1.00 0.00 C ATOM 1887 O ILE B 420 -4.582 -0.110 -4.926 1.00 0.00 O ATOM 1888 CB ILE B 420 -4.257 -2.488 -2.741 1.00 0.00 C ATOM 1889 CG1 ILE B 420 -3.503 -3.344 -3.764 1.00 0.00 C ATOM 1890 CG2 ILE B 420 -4.726 -3.319 -1.555 1.00 0.00 C ATOM 1891 CD1 ILE B 420 -2.378 -2.595 -4.452 1.00 0.00 C ATOM 0 H ILE B 420 -7.514 -1.946 -3.513 1.00 0.00 H new ATOM 0 HA ILE B 420 -5.681 -0.900 -2.764 1.00 0.00 H new ATOM 0 HB ILE B 420 -3.562 -1.740 -2.360 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -3.094 -4.222 -3.264 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -4.205 -3.704 -4.516 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -3.873 -3.829 -1.108 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -5.188 -2.667 -0.814 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -5.454 -4.057 -1.893 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -1.883 -3.255 -5.164 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -2.785 -1.732 -4.979 1.00 0.00 H new ATOM 0 HD13 ILE B 420 -1.656 -2.258 -3.708 1.00 0.00 H new ATOM 1903 N LYS B 421 -5.140 -2.101 -5.806 1.00 0.00 N ATOM 1904 CA LYS B 421 -4.763 -1.684 -7.153 1.00 0.00 C ATOM 1905 C LYS B 421 -5.429 -0.356 -7.455 1.00 0.00 C ATOM 1906 O LYS B 421 -4.806 0.561 -7.991 1.00 0.00 O ATOM 1907 CB LYS B 421 -5.133 -2.751 -8.196 1.00 0.00 C ATOM 1908 CG LYS B 421 -5.969 -2.243 -9.366 1.00 0.00 C ATOM 1909 CD LYS B 421 -7.403 -1.965 -8.950 1.00 0.00 C ATOM 1910 CE LYS B 421 -8.395 -2.632 -9.888 1.00 0.00 C ATOM 1911 NZ LYS B 421 -8.297 -2.094 -11.272 1.00 0.00 N ATOM 0 H LYS B 421 -5.491 -3.056 -5.730 1.00 0.00 H new ATOM 0 HA LYS B 421 -3.681 -1.564 -7.205 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -4.215 -3.189 -8.588 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -5.680 -3.551 -7.698 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -5.522 -1.332 -9.765 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -5.959 -2.981 -10.168 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -7.564 -2.324 -7.934 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -7.578 -0.889 -8.939 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -8.215 -3.707 -9.903 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -9.407 -2.484 -9.511 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -9.076 -2.473 -11.848 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -8.359 -1.056 -11.246 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -7.388 -2.376 -11.691 1.00 0.00 H new ATOM 1925 N ILE B 422 -6.694 -0.244 -7.064 1.00 0.00 N ATOM 1926 CA ILE B 422 -7.422 0.998 -7.254 1.00 0.00 C ATOM 1927 C ILE B 422 -6.645 2.092 -6.566 1.00 0.00 C ATOM 1928 O ILE B 422 -6.554 3.213 -7.051 1.00 0.00 O ATOM 1929 CB ILE B 422 -8.845 0.969 -6.659 1.00 0.00 C ATOM 1930 CG1 ILE B 422 -9.324 -0.464 -6.438 1.00 0.00 C ATOM 1931 CG2 ILE B 422 -9.805 1.730 -7.558 1.00 0.00 C ATOM 1932 CD1 ILE B 422 -8.893 -1.038 -5.106 1.00 0.00 C ATOM 0 H ILE B 422 -7.228 -0.990 -6.619 1.00 0.00 H new ATOM 0 HA ILE B 422 -7.526 1.162 -8.327 1.00 0.00 H new ATOM 0 HB ILE B 422 -8.818 1.459 -5.686 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -10.412 -0.491 -6.503 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -8.941 -1.096 -7.240 1.00 0.00 H new ATOM 0 HG21 ILE B 422 -10.806 1.702 -7.127 1.00 0.00 H new ATOM 0 HG22 ILE B 422 -9.477 2.766 -7.647 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -9.822 1.269 -8.545 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -9.266 -2.058 -5.012 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -7.805 -1.042 -5.047 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -9.298 -0.428 -4.299 1.00 0.00 H new ATOM 1944 N ALA B 423 -6.069 1.728 -5.426 1.00 0.00 N ATOM 1945 CA ALA B 423 -5.268 2.640 -4.641 1.00 0.00 C ATOM 1946 C ALA B 423 -3.946 2.915 -5.344 1.00 0.00 C ATOM 1947 O ALA B 423 -3.399 4.014 -5.249 1.00 0.00 O ATOM 1948 CB ALA B 423 -5.037 2.076 -3.252 1.00 0.00 C ATOM 0 H ALA B 423 -6.148 0.793 -5.026 1.00 0.00 H new ATOM 0 HA ALA B 423 -5.804 3.584 -4.539 1.00 0.00 H new ATOM 0 HB1 ALA B 423 -4.432 2.773 -2.672 1.00 0.00 H new ATOM 0 HB2 ALA B 423 -5.996 1.927 -2.756 1.00 0.00 H new ATOM 0 HB3 ALA B 423 -4.516 1.121 -3.329 1.00 0.00 H new ATOM 1954 N GLY B 424 -3.449 1.920 -6.081 1.00 0.00 N ATOM 1955 CA GLY B 424 -2.210 2.103 -6.814 1.00 0.00 C ATOM 1956 C GLY B 424 -2.405 3.035 -7.996 1.00 0.00 C ATOM 1957 O GLY B 424 -1.882 4.155 -8.014 1.00 0.00 O ATOM 0 H GLY B 424 -3.879 1.001 -6.181 1.00 0.00 H new ATOM 0 HA2 GLY B 424 -1.447 2.509 -6.149 1.00 0.00 H new ATOM 0 HA3 GLY B 424 -1.846 1.137 -7.165 1.00 0.00 H new ATOM 1961 N ILE B 425 -3.179 2.581 -8.980 1.00 0.00 N ATOM 1962 CA ILE B 425 -3.462 3.395 -10.156 1.00 0.00 C ATOM 1963 C ILE B 425 -3.968 4.771 -9.735 1.00 0.00 C ATOM 1964 O ILE B 425 -3.512 5.801 -10.243 1.00 0.00 O ATOM 1965 CB ILE B 425 -4.511 2.723 -11.066 1.00 0.00 C ATOM 1966 CG1 ILE B 425 -3.892 1.532 -11.798 1.00 0.00 C ATOM 1967 CG2 ILE B 425 -5.084 3.722 -12.062 1.00 0.00 C ATOM 1968 CD1 ILE B 425 -3.738 0.304 -10.928 1.00 0.00 C ATOM 0 H ILE B 425 -3.618 1.660 -8.985 1.00 0.00 H new ATOM 0 HA ILE B 425 -2.533 3.499 -10.716 1.00 0.00 H new ATOM 0 HB ILE B 425 -5.327 2.363 -10.440 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -4.512 1.282 -12.659 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -2.914 1.820 -12.183 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -5.821 3.225 -12.693 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -5.561 4.541 -11.523 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -4.281 4.116 -12.685 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -3.293 -0.502 -11.512 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -3.093 0.537 -10.080 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -4.717 -0.009 -10.564 1.00 0.00 H new ATOM 1980 N ARG B 426 -4.909 4.778 -8.794 1.00 0.00 N ATOM 1981 CA ARG B 426 -5.477 6.021 -8.289 1.00 0.00 C ATOM 1982 C ARG B 426 -4.371 6.945 -7.803 1.00 0.00 C ATOM 1983 O ARG B 426 -4.382 8.143 -8.084 1.00 0.00 O ATOM 1984 CB ARG B 426 -6.459 5.738 -7.150 1.00 0.00 C ATOM 1985 CG ARG B 426 -6.961 6.988 -6.450 1.00 0.00 C ATOM 1986 CD ARG B 426 -8.079 7.654 -7.236 1.00 0.00 C ATOM 1987 NE ARG B 426 -8.906 8.514 -6.394 1.00 0.00 N ATOM 1988 CZ ARG B 426 -10.175 8.805 -6.663 1.00 0.00 C ATOM 1989 NH1 ARG B 426 -10.758 8.304 -7.743 1.00 0.00 N ATOM 1990 NH2 ARG B 426 -10.861 9.597 -5.850 1.00 0.00 N ATOM 0 H ARG B 426 -5.293 3.935 -8.367 1.00 0.00 H new ATOM 0 HA ARG B 426 -6.015 6.509 -9.102 1.00 0.00 H new ATOM 0 HB2 ARG B 426 -7.312 5.187 -7.546 1.00 0.00 H new ATOM 0 HB3 ARG B 426 -5.975 5.092 -6.417 1.00 0.00 H new ATOM 0 HG2 ARG B 426 -7.319 6.730 -5.453 1.00 0.00 H new ATOM 0 HG3 ARG B 426 -6.137 7.690 -6.321 1.00 0.00 H new ATOM 0 HD2 ARG B 426 -7.650 8.244 -8.046 1.00 0.00 H new ATOM 0 HD3 ARG B 426 -8.704 6.889 -7.696 1.00 0.00 H new ATOM 0 HE ARG B 426 -8.487 8.913 -5.554 1.00 0.00 H new ATOM 0 HH11 ARG B 426 -10.233 7.694 -8.369 1.00 0.00 H new ATOM 0 HH12 ARG B 426 -11.732 8.529 -7.948 1.00 0.00 H new ATOM 0 HH21 ARG B 426 -10.415 9.983 -5.018 1.00 0.00 H new ATOM 0 HH22 ARG B 426 -11.835 9.820 -6.057 1.00 0.00 H new ATOM 2004 N ALA B 427 -3.409 6.376 -7.082 1.00 0.00 N ATOM 2005 CA ALA B 427 -2.289 7.149 -6.570 1.00 0.00 C ATOM 2006 C ALA B 427 -1.628 7.928 -7.700 1.00 0.00 C ATOM 2007 O ALA B 427 -1.414 9.135 -7.592 1.00 0.00 O ATOM 2008 CB ALA B 427 -1.273 6.251 -5.878 1.00 0.00 C ATOM 0 H ALA B 427 -3.385 5.385 -6.841 1.00 0.00 H new ATOM 0 HA ALA B 427 -2.671 7.854 -5.832 1.00 0.00 H new ATOM 0 HB1 ALA B 427 -0.447 6.856 -5.505 1.00 0.00 H new ATOM 0 HB2 ALA B 427 -1.751 5.736 -5.044 1.00 0.00 H new ATOM 0 HB3 ALA B 427 -0.893 5.517 -6.588 1.00 0.00 H new ATOM 2014 N ALA B 428 -1.321 7.232 -8.792 1.00 0.00 N ATOM 2015 CA ALA B 428 -0.699 7.875 -9.946 1.00 0.00 C ATOM 2016 C ALA B 428 -1.545 9.060 -10.406 1.00 0.00 C ATOM 2017 O ALA B 428 -1.170 10.227 -10.222 1.00 0.00 O ATOM 2018 CB ALA B 428 -0.507 6.885 -11.085 1.00 0.00 C ATOM 0 H ALA B 428 -1.491 6.232 -8.902 1.00 0.00 H new ATOM 0 HA ALA B 428 0.284 8.238 -9.647 1.00 0.00 H new ATOM 0 HB1 ALA B 428 -0.042 7.390 -11.932 1.00 0.00 H new ATOM 0 HB2 ALA B 428 0.134 6.068 -10.753 1.00 0.00 H new ATOM 0 HB3 ALA B 428 -1.475 6.486 -11.388 1.00 0.00 H new ATOM 2024 N GLU B 429 -2.691 8.760 -11.011 1.00 0.00 N ATOM 2025 CA GLU B 429 -3.582 9.807 -11.486 1.00 0.00 C ATOM 2026 C GLU B 429 -3.734 10.882 -10.420 1.00 0.00 C ATOM 2027 O GLU B 429 -3.973 12.051 -10.726 1.00 0.00 O ATOM 2028 CB GLU B 429 -4.950 9.220 -11.841 1.00 0.00 C ATOM 2029 CG GLU B 429 -5.195 9.117 -13.337 1.00 0.00 C ATOM 2030 CD GLU B 429 -6.370 8.220 -13.676 1.00 0.00 C ATOM 2031 OE1 GLU B 429 -7.512 8.725 -13.709 1.00 0.00 O ATOM 2032 OE2 GLU B 429 -6.148 7.013 -13.910 1.00 0.00 O ATOM 0 H GLU B 429 -3.020 7.810 -11.181 1.00 0.00 H new ATOM 0 HA GLU B 429 -3.152 10.254 -12.382 1.00 0.00 H new ATOM 0 HB2 GLU B 429 -5.037 8.228 -11.397 1.00 0.00 H new ATOM 0 HB3 GLU B 429 -5.729 9.838 -11.395 1.00 0.00 H new ATOM 0 HG2 GLU B 429 -5.375 10.113 -13.741 1.00 0.00 H new ATOM 0 HG3 GLU B 429 -4.298 8.733 -13.823 1.00 0.00 H new ATOM 2039 N ASN B 430 -3.581 10.475 -9.164 1.00 0.00 N ATOM 2040 CA ASN B 430 -3.686 11.396 -8.042 1.00 0.00 C ATOM 2041 C ASN B 430 -2.524 12.375 -8.052 1.00 0.00 C ATOM 2042 O ASN B 430 -2.677 13.538 -7.681 1.00 0.00 O ATOM 2043 CB ASN B 430 -3.715 10.631 -6.723 1.00 0.00 C ATOM 2044 CG ASN B 430 -5.080 10.679 -6.070 1.00 0.00 C ATOM 2045 OD1 ASN B 430 -5.311 11.452 -5.140 1.00 0.00 O ATOM 2046 ND2 ASN B 430 -5.993 9.849 -6.556 1.00 0.00 N ATOM 0 H ASN B 430 -3.383 9.510 -8.899 1.00 0.00 H new ATOM 0 HA ASN B 430 -4.617 11.954 -8.141 1.00 0.00 H new ATOM 0 HB2 ASN B 430 -3.434 9.593 -6.900 1.00 0.00 H new ATOM 0 HB3 ASN B 430 -2.973 11.051 -6.044 1.00 0.00 H new ATOM 0 HD21 ASN B 430 -6.932 9.834 -6.158 1.00 0.00 H new ATOM 0 HD22 ASN B 430 -5.756 9.226 -7.328 1.00 0.00 H new ATOM 2053 N ALA B 431 -1.361 11.902 -8.492 1.00 0.00 N ATOM 2054 CA ALA B 431 -0.188 12.749 -8.560 1.00 0.00 C ATOM 2055 C ALA B 431 -0.423 13.840 -9.578 1.00 0.00 C ATOM 2056 O ALA B 431 -0.176 15.017 -9.314 1.00 0.00 O ATOM 2057 CB ALA B 431 1.058 11.960 -8.919 1.00 0.00 C ATOM 0 H ALA B 431 -1.212 10.942 -8.803 1.00 0.00 H new ATOM 0 HA ALA B 431 -0.023 13.185 -7.575 1.00 0.00 H new ATOM 0 HB1 ALA B 431 1.915 12.632 -8.960 1.00 0.00 H new ATOM 0 HB2 ALA B 431 1.233 11.194 -8.164 1.00 0.00 H new ATOM 0 HB3 ALA B 431 0.921 11.487 -9.891 1.00 0.00 H new ATOM 2063 N LEU B 432 -0.914 13.445 -10.748 1.00 0.00 N ATOM 2064 CA LEU B 432 -1.194 14.392 -11.814 1.00 0.00 C ATOM 2065 C LEU B 432 -2.607 14.942 -11.683 1.00 0.00 C ATOM 2066 O LEU B 432 -3.170 15.466 -12.645 1.00 0.00 O ATOM 2067 CB LEU B 432 -1.032 13.707 -13.169 1.00 0.00 C ATOM 2068 CG LEU B 432 -1.937 12.490 -13.380 1.00 0.00 C ATOM 2069 CD1 LEU B 432 -2.768 12.650 -14.642 1.00 0.00 C ATOM 2070 CD2 LEU B 432 -1.111 11.216 -13.441 1.00 0.00 C ATOM 0 H LEU B 432 -1.125 12.474 -10.979 1.00 0.00 H new ATOM 0 HA LEU B 432 -0.489 15.220 -11.738 1.00 0.00 H new ATOM 0 HB2 LEU B 432 -1.234 14.434 -13.955 1.00 0.00 H new ATOM 0 HB3 LEU B 432 0.006 13.395 -13.282 1.00 0.00 H new ATOM 0 HG LEU B 432 -2.617 12.419 -12.531 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -3.404 11.774 -14.773 1.00 0.00 H new ATOM 0 HD12 LEU B 432 -3.390 13.541 -14.557 1.00 0.00 H new ATOM 0 HD13 LEU B 432 -2.107 12.750 -15.503 1.00 0.00 H new ATOM 0 HD21 LEU B 432 -1.771 10.361 -13.591 1.00 0.00 H new ATOM 0 HD22 LEU B 432 -0.405 11.279 -14.269 1.00 0.00 H new ATOM 0 HD23 LEU B 432 -0.564 11.092 -12.506 1.00 0.00 H new ATOM 2082 N ARG B 433 -3.170 14.835 -10.486 1.00 0.00 N ATOM 2083 CA ARG B 433 -4.509 15.341 -10.232 1.00 0.00 C ATOM 2084 C ARG B 433 -4.440 16.792 -9.768 1.00 0.00 C ATOM 2085 O ARG B 433 -5.462 17.415 -9.481 1.00 0.00 O ATOM 2086 CB ARG B 433 -5.221 14.485 -9.182 1.00 0.00 C ATOM 2087 CG ARG B 433 -6.693 14.825 -9.024 1.00 0.00 C ATOM 2088 CD ARG B 433 -7.428 13.774 -8.207 1.00 0.00 C ATOM 2089 NE ARG B 433 -8.750 13.482 -8.756 1.00 0.00 N ATOM 2090 CZ ARG B 433 -9.811 14.262 -8.576 1.00 0.00 C ATOM 2091 NH1 ARG B 433 -9.702 15.377 -7.866 1.00 0.00 N ATOM 2092 NH2 ARG B 433 -10.981 13.928 -9.105 1.00 0.00 N ATOM 0 H ARG B 433 -2.720 14.403 -9.679 1.00 0.00 H new ATOM 0 HA ARG B 433 -5.079 15.291 -11.160 1.00 0.00 H new ATOM 0 HB2 ARG B 433 -5.126 13.434 -9.455 1.00 0.00 H new ATOM 0 HB3 ARG B 433 -4.721 14.611 -8.221 1.00 0.00 H new ATOM 0 HG2 ARG B 433 -6.792 15.797 -8.541 1.00 0.00 H new ATOM 0 HG3 ARG B 433 -7.155 14.910 -10.008 1.00 0.00 H new ATOM 0 HD2 ARG B 433 -6.837 12.859 -8.178 1.00 0.00 H new ATOM 0 HD3 ARG B 433 -7.531 14.120 -7.179 1.00 0.00 H new ATOM 0 HE ARG B 433 -8.865 12.632 -9.308 1.00 0.00 H new ATOM 0 HH11 ARG B 433 -8.804 15.636 -7.458 1.00 0.00 H new ATOM 0 HH12 ARG B 433 -10.516 15.975 -7.728 1.00 0.00 H new ATOM 0 HH21 ARG B 433 -11.068 13.071 -9.651 1.00 0.00 H new ATOM 0 HH22 ARG B 433 -11.794 14.528 -8.965 1.00 0.00 H new ATOM 2106 N ASP B 434 -3.219 17.322 -9.702 1.00 0.00 N ATOM 2107 CA ASP B 434 -3.001 18.699 -9.278 1.00 0.00 C ATOM 2108 C ASP B 434 -2.438 19.533 -10.425 1.00 0.00 C ATOM 2109 O ASP B 434 -1.246 19.836 -10.457 1.00 0.00 O ATOM 2110 CB ASP B 434 -2.044 18.738 -8.086 1.00 0.00 C ATOM 2111 CG ASP B 434 -2.648 18.117 -6.841 1.00 0.00 C ATOM 2112 OD1 ASP B 434 -3.887 17.975 -6.790 1.00 0.00 O ATOM 2113 OD2 ASP B 434 -1.880 17.771 -5.919 1.00 0.00 O ATOM 0 H ASP B 434 -2.366 16.815 -9.938 1.00 0.00 H new ATOM 0 HA ASP B 434 -3.960 19.122 -8.979 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -1.125 18.210 -8.343 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -1.770 19.772 -7.877 1.00 0.00 H new ATOM 2118 N LYS B 435 -3.302 19.895 -11.366 1.00 0.00 N ATOM 2119 CA LYS B 435 -2.895 20.688 -12.520 1.00 0.00 C ATOM 2120 C LYS B 435 -1.887 21.763 -12.121 1.00 0.00 C ATOM 2121 O LYS B 435 -0.876 21.960 -12.796 1.00 0.00 O ATOM 2122 CB LYS B 435 -4.117 21.334 -13.176 1.00 0.00 C ATOM 2123 CG LYS B 435 -4.470 22.697 -12.605 1.00 0.00 C ATOM 2124 CD LYS B 435 -5.803 23.196 -13.135 1.00 0.00 C ATOM 2125 CE LYS B 435 -5.768 23.395 -14.642 1.00 0.00 C ATOM 2126 NZ LYS B 435 -6.391 22.254 -15.367 1.00 0.00 N ATOM 0 H LYS B 435 -4.292 19.651 -11.352 1.00 0.00 H new ATOM 0 HA LYS B 435 -2.416 20.020 -13.236 1.00 0.00 H new ATOM 0 HB2 LYS B 435 -3.933 21.435 -14.246 1.00 0.00 H new ATOM 0 HB3 LYS B 435 -4.973 20.669 -13.061 1.00 0.00 H new ATOM 0 HG2 LYS B 435 -4.509 22.638 -11.517 1.00 0.00 H new ATOM 0 HG3 LYS B 435 -3.687 23.412 -12.857 1.00 0.00 H new ATOM 0 HD2 LYS B 435 -6.587 22.482 -12.880 1.00 0.00 H new ATOM 0 HD3 LYS B 435 -6.059 24.138 -12.649 1.00 0.00 H new ATOM 0 HE2 LYS B 435 -6.290 24.317 -14.899 1.00 0.00 H new ATOM 0 HE3 LYS B 435 -4.735 23.512 -14.969 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 -5.961 22.165 -16.310 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 -6.236 21.376 -14.831 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 -7.412 22.422 -15.467 1.00 0.00 H new ATOM 2140 N LYS B 436 -2.172 22.458 -11.025 1.00 0.00 N ATOM 2141 CA LYS B 436 -1.293 23.518 -10.541 1.00 0.00 C ATOM 2142 C LYS B 436 0.068 22.958 -10.145 1.00 0.00 C ATOM 2143 O LYS B 436 1.104 23.426 -10.617 1.00 0.00 O ATOM 2144 CB LYS B 436 -1.933 24.236 -9.353 1.00 0.00 C ATOM 2145 CG LYS B 436 -3.189 25.011 -9.719 1.00 0.00 C ATOM 2146 CD LYS B 436 -2.869 26.458 -10.059 1.00 0.00 C ATOM 2147 CE LYS B 436 -2.788 26.673 -11.562 1.00 0.00 C ATOM 2148 NZ LYS B 436 -2.609 28.110 -11.909 1.00 0.00 N ATOM 0 H LYS B 436 -3.004 22.307 -10.455 1.00 0.00 H new ATOM 0 HA LYS B 436 -1.146 24.234 -11.350 1.00 0.00 H new ATOM 0 HB2 LYS B 436 -2.179 23.503 -8.585 1.00 0.00 H new ATOM 0 HB3 LYS B 436 -1.206 24.922 -8.918 1.00 0.00 H new ATOM 0 HG2 LYS B 436 -3.677 24.535 -10.570 1.00 0.00 H new ATOM 0 HG3 LYS B 436 -3.894 24.978 -8.888 1.00 0.00 H new ATOM 0 HD2 LYS B 436 -3.635 27.110 -9.638 1.00 0.00 H new ATOM 0 HD3 LYS B 436 -1.922 26.740 -9.599 1.00 0.00 H new ATOM 0 HE2 LYS B 436 -1.957 26.096 -11.967 1.00 0.00 H new ATOM 0 HE3 LYS B 436 -3.697 26.297 -12.032 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 -2.558 28.214 -12.943 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 -3.414 28.658 -11.545 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 -1.729 28.463 -11.482 1.00 0.00 H new ATOM 2162 N MET B 437 0.060 21.948 -9.282 1.00 0.00 N ATOM 2163 CA MET B 437 1.295 21.317 -8.832 1.00 0.00 C ATOM 2164 C MET B 437 2.045 20.733 -10.023 1.00 0.00 C ATOM 2165 O MET B 437 3.274 20.779 -10.086 1.00 0.00 O ATOM 2166 CB MET B 437 0.977 20.225 -7.804 1.00 0.00 C ATOM 2167 CG MET B 437 2.072 19.182 -7.630 1.00 0.00 C ATOM 2168 SD MET B 437 1.445 17.497 -7.776 1.00 0.00 S ATOM 2169 CE MET B 437 2.349 16.914 -9.205 1.00 0.00 C ATOM 0 H MET B 437 -0.788 21.549 -8.880 1.00 0.00 H new ATOM 0 HA MET B 437 1.930 22.065 -8.358 1.00 0.00 H new ATOM 0 HB2 MET B 437 0.785 20.696 -6.840 1.00 0.00 H new ATOM 0 HB3 MET B 437 0.057 19.721 -8.101 1.00 0.00 H new ATOM 0 HG2 MET B 437 2.847 19.345 -8.379 1.00 0.00 H new ATOM 0 HG3 MET B 437 2.540 19.310 -6.654 1.00 0.00 H new ATOM 0 HE1 MET B 437 2.053 15.889 -9.429 1.00 0.00 H new ATOM 0 HE2 MET B 437 2.127 17.551 -10.061 1.00 0.00 H new ATOM 0 HE3 MET B 437 3.418 16.946 -8.997 1.00 0.00 H new ATOM 2179 N LEU B 438 1.288 20.189 -10.969 1.00 0.00 N ATOM 2180 CA LEU B 438 1.858 19.596 -12.171 1.00 0.00 C ATOM 2181 C LEU B 438 2.519 20.652 -13.046 1.00 0.00 C ATOM 2182 O LEU B 438 3.696 20.551 -13.390 1.00 0.00 O ATOM 2183 CB LEU B 438 0.766 18.905 -12.978 1.00 0.00 C ATOM 2184 CG LEU B 438 0.261 17.582 -12.406 1.00 0.00 C ATOM 2185 CD1 LEU B 438 -1.030 17.169 -13.095 1.00 0.00 C ATOM 2186 CD2 LEU B 438 1.321 16.505 -12.556 1.00 0.00 C ATOM 0 H LEU B 438 0.270 20.147 -10.925 1.00 0.00 H new ATOM 0 HA LEU B 438 2.611 18.873 -11.859 1.00 0.00 H new ATOM 0 HB2 LEU B 438 -0.079 19.587 -13.070 1.00 0.00 H new ATOM 0 HB3 LEU B 438 1.142 18.725 -13.985 1.00 0.00 H new ATOM 0 HG LEU B 438 0.055 17.713 -11.344 1.00 0.00 H new ATOM 0 HD11 LEU B 438 -1.379 16.224 -12.678 1.00 0.00 H new ATOM 0 HD12 LEU B 438 -1.788 17.937 -12.939 1.00 0.00 H new ATOM 0 HD13 LEU B 438 -0.850 17.049 -14.163 1.00 0.00 H new ATOM 0 HD21 LEU B 438 0.948 15.567 -12.144 1.00 0.00 H new ATOM 0 HD22 LEU B 438 1.555 16.370 -13.612 1.00 0.00 H new ATOM 0 HD23 LEU B 438 2.222 16.804 -12.020 1.00 0.00 H new ATOM 2198 N ASP B 439 1.741 21.665 -13.400 1.00 0.00 N ATOM 2199 CA ASP B 439 2.230 22.753 -14.237 1.00 0.00 C ATOM 2200 C ASP B 439 3.323 23.537 -13.522 1.00 0.00 C ATOM 2201 O ASP B 439 4.187 24.142 -14.162 1.00 0.00 O ATOM 2202 CB ASP B 439 1.083 23.690 -14.617 1.00 0.00 C ATOM 2203 CG ASP B 439 1.497 24.714 -15.655 1.00 0.00 C ATOM 2204 OD1 ASP B 439 2.535 25.379 -15.450 1.00 0.00 O ATOM 2205 OD2 ASP B 439 0.787 24.849 -16.673 1.00 0.00 O ATOM 0 H ASP B 439 0.765 21.757 -13.120 1.00 0.00 H new ATOM 0 HA ASP B 439 2.650 22.319 -15.144 1.00 0.00 H new ATOM 0 HB2 ASP B 439 0.249 23.103 -15.002 1.00 0.00 H new ATOM 0 HB3 ASP B 439 0.726 24.204 -13.725 1.00 0.00 H new ATOM 2210 N PHE B 440 3.295 23.512 -12.193 1.00 0.00 N ATOM 2211 CA PHE B 440 4.299 24.214 -11.407 1.00 0.00 C ATOM 2212 C PHE B 440 5.643 23.522 -11.559 1.00 0.00 C ATOM 2213 O PHE B 440 6.681 24.169 -11.691 1.00 0.00 O ATOM 2214 CB PHE B 440 3.886 24.266 -9.930 1.00 0.00 C ATOM 2215 CG PHE B 440 5.041 24.206 -8.967 1.00 0.00 C ATOM 2216 CD1 PHE B 440 6.149 25.023 -9.137 1.00 0.00 C ATOM 2217 CD2 PHE B 440 5.017 23.330 -7.895 1.00 0.00 C ATOM 2218 CE1 PHE B 440 7.211 24.965 -8.254 1.00 0.00 C ATOM 2219 CE2 PHE B 440 6.076 23.267 -7.010 1.00 0.00 C ATOM 2220 CZ PHE B 440 7.174 24.086 -7.188 1.00 0.00 C ATOM 0 H PHE B 440 2.593 23.017 -11.643 1.00 0.00 H new ATOM 0 HA PHE B 440 4.383 25.238 -11.772 1.00 0.00 H new ATOM 0 HB2 PHE B 440 3.326 25.184 -9.752 1.00 0.00 H new ATOM 0 HB3 PHE B 440 3.211 23.436 -9.723 1.00 0.00 H new ATOM 0 HD1 PHE B 440 6.182 25.712 -9.968 1.00 0.00 H new ATOM 0 HD2 PHE B 440 4.160 22.689 -7.749 1.00 0.00 H new ATOM 0 HE1 PHE B 440 8.069 25.606 -8.397 1.00 0.00 H new ATOM 0 HE2 PHE B 440 6.045 22.578 -6.179 1.00 0.00 H new ATOM 0 HZ PHE B 440 8.002 24.040 -6.496 1.00 0.00 H new ATOM 2230 N TYR B 441 5.608 22.197 -11.539 1.00 0.00 N ATOM 2231 CA TYR B 441 6.813 21.400 -11.674 1.00 0.00 C ATOM 2232 C TYR B 441 7.337 21.456 -13.098 1.00 0.00 C ATOM 2233 O TYR B 441 8.543 21.567 -13.320 1.00 0.00 O ATOM 2234 CB TYR B 441 6.534 19.969 -11.232 1.00 0.00 C ATOM 2235 CG TYR B 441 6.356 19.871 -9.739 1.00 0.00 C ATOM 2236 CD1 TYR B 441 7.207 20.563 -8.889 1.00 0.00 C ATOM 2237 CD2 TYR B 441 5.337 19.117 -9.180 1.00 0.00 C ATOM 2238 CE1 TYR B 441 7.051 20.505 -7.522 1.00 0.00 C ATOM 2239 CE2 TYR B 441 5.172 19.050 -7.811 1.00 0.00 C ATOM 2240 CZ TYR B 441 6.032 19.747 -6.984 1.00 0.00 C ATOM 2241 OH TYR B 441 5.870 19.685 -5.618 1.00 0.00 O ATOM 0 H TYR B 441 4.753 21.652 -11.430 1.00 0.00 H new ATOM 0 HA TYR B 441 7.590 21.811 -11.029 1.00 0.00 H new ATOM 0 HB2 TYR B 441 5.636 19.603 -11.730 1.00 0.00 H new ATOM 0 HB3 TYR B 441 7.357 19.325 -11.543 1.00 0.00 H new ATOM 0 HD1 TYR B 441 8.006 21.158 -9.307 1.00 0.00 H new ATOM 0 HD2 TYR B 441 4.662 18.574 -9.825 1.00 0.00 H new ATOM 0 HE1 TYR B 441 7.723 21.050 -6.875 1.00 0.00 H new ATOM 0 HE2 TYR B 441 4.375 18.456 -7.389 1.00 0.00 H new ATOM 0 HH TYR B 441 5.637 18.770 -5.357 1.00 0.00 H new ATOM 2251 N ALA B 442 6.428 21.418 -14.064 1.00 0.00 N ATOM 2252 CA ALA B 442 6.823 21.508 -15.459 1.00 0.00 C ATOM 2253 C ALA B 442 7.652 22.768 -15.650 1.00 0.00 C ATOM 2254 O ALA B 442 8.658 22.774 -16.362 1.00 0.00 O ATOM 2255 CB ALA B 442 5.610 21.525 -16.378 1.00 0.00 C ATOM 0 H ALA B 442 5.424 21.327 -13.908 1.00 0.00 H new ATOM 0 HA ALA B 442 7.414 20.630 -15.720 1.00 0.00 H new ATOM 0 HB1 ALA B 442 5.940 21.593 -17.415 1.00 0.00 H new ATOM 0 HB2 ALA B 442 5.036 20.609 -16.239 1.00 0.00 H new ATOM 0 HB3 ALA B 442 4.985 22.385 -16.139 1.00 0.00 H new ATOM 2261 N LYS B 443 7.220 23.834 -14.982 1.00 0.00 N ATOM 2262 CA LYS B 443 7.912 25.112 -15.041 1.00 0.00 C ATOM 2263 C LYS B 443 9.248 25.030 -14.311 1.00 0.00 C ATOM 2264 O LYS B 443 10.294 25.348 -14.876 1.00 0.00 O ATOM 2265 CB LYS B 443 7.047 26.211 -14.426 1.00 0.00 C ATOM 2266 CG LYS B 443 7.789 27.519 -14.219 1.00 0.00 C ATOM 2267 CD LYS B 443 8.326 28.061 -15.533 1.00 0.00 C ATOM 2268 CE LYS B 443 9.833 28.249 -15.485 1.00 0.00 C ATOM 2269 NZ LYS B 443 10.296 29.260 -16.477 1.00 0.00 N ATOM 0 H LYS B 443 6.389 23.834 -14.391 1.00 0.00 H new ATOM 0 HA LYS B 443 8.100 25.354 -16.087 1.00 0.00 H new ATOM 0 HB2 LYS B 443 6.186 26.389 -15.071 1.00 0.00 H new ATOM 0 HB3 LYS B 443 6.661 25.865 -13.467 1.00 0.00 H new ATOM 0 HG2 LYS B 443 7.120 28.252 -13.767 1.00 0.00 H new ATOM 0 HG3 LYS B 443 8.613 27.366 -13.522 1.00 0.00 H new ATOM 0 HD2 LYS B 443 8.069 27.377 -16.342 1.00 0.00 H new ATOM 0 HD3 LYS B 443 7.847 29.014 -15.758 1.00 0.00 H new ATOM 0 HE2 LYS B 443 10.129 28.561 -14.483 1.00 0.00 H new ATOM 0 HE3 LYS B 443 10.325 27.296 -15.681 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 11.329 29.360 -16.414 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 10.036 28.951 -17.435 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 9.846 30.176 -16.275 1.00 0.00 H new ATOM 2283 N GLN B 444 9.210 24.596 -13.053 1.00 0.00 N ATOM 2284 CA GLN B 444 10.422 24.469 -12.260 1.00 0.00 C ATOM 2285 C GLN B 444 11.445 23.620 -13.004 1.00 0.00 C ATOM 2286 O GLN B 444 12.653 23.806 -12.860 1.00 0.00 O ATOM 2287 CB GLN B 444 10.092 23.870 -10.881 1.00 0.00 C ATOM 2288 CG GLN B 444 10.311 22.369 -10.761 1.00 0.00 C ATOM 2289 CD GLN B 444 11.233 22.040 -9.610 1.00 0.00 C ATOM 2290 OE1 GLN B 444 12.126 21.201 -9.725 1.00 0.00 O ATOM 2291 NE2 GLN B 444 11.018 22.717 -8.493 1.00 0.00 N ATOM 0 H GLN B 444 8.355 24.328 -12.566 1.00 0.00 H new ATOM 0 HA GLN B 444 10.855 25.457 -12.101 1.00 0.00 H new ATOM 0 HB2 GLN B 444 10.701 24.372 -10.129 1.00 0.00 H new ATOM 0 HB3 GLN B 444 9.050 24.090 -10.646 1.00 0.00 H new ATOM 0 HG2 GLN B 444 9.353 21.870 -10.617 1.00 0.00 H new ATOM 0 HG3 GLN B 444 10.734 21.985 -11.690 1.00 0.00 H new ATOM 0 HE21 GLN B 444 10.264 23.402 -8.449 1.00 0.00 H new ATOM 0 HE22 GLN B 444 11.607 22.553 -7.676 1.00 0.00 H new ATOM 2300 N ARG B 445 10.941 22.687 -13.807 1.00 0.00 N ATOM 2301 CA ARG B 445 11.792 21.800 -14.591 1.00 0.00 C ATOM 2302 C ARG B 445 12.549 22.584 -15.658 1.00 0.00 C ATOM 2303 O ARG B 445 13.774 22.510 -15.749 1.00 0.00 O ATOM 2304 CB ARG B 445 10.947 20.705 -15.248 1.00 0.00 C ATOM 2305 CG ARG B 445 11.154 19.324 -14.646 1.00 0.00 C ATOM 2306 CD ARG B 445 12.597 18.861 -14.789 1.00 0.00 C ATOM 2307 NE ARG B 445 12.766 17.910 -15.886 1.00 0.00 N ATOM 2308 CZ ARG B 445 12.971 18.265 -17.150 1.00 0.00 C ATOM 2309 NH1 ARG B 445 13.035 19.546 -17.483 1.00 0.00 N ATOM 2310 NH2 ARG B 445 13.116 17.335 -18.086 1.00 0.00 N ATOM 0 H ARG B 445 9.941 22.526 -13.931 1.00 0.00 H new ATOM 0 HA ARG B 445 12.517 21.338 -13.921 1.00 0.00 H new ATOM 0 HB2 ARG B 445 9.894 20.973 -15.165 1.00 0.00 H new ATOM 0 HB3 ARG B 445 11.183 20.666 -16.311 1.00 0.00 H new ATOM 0 HG2 ARG B 445 10.880 19.341 -13.591 1.00 0.00 H new ATOM 0 HG3 ARG B 445 10.492 18.610 -15.136 1.00 0.00 H new ATOM 0 HD2 ARG B 445 13.239 19.726 -14.958 1.00 0.00 H new ATOM 0 HD3 ARG B 445 12.923 18.399 -13.857 1.00 0.00 H new ATOM 0 HE ARG B 445 12.724 16.914 -15.668 1.00 0.00 H new ATOM 0 HH11 ARG B 445 12.927 20.265 -16.768 1.00 0.00 H new ATOM 0 HH12 ARG B 445 13.193 19.813 -18.455 1.00 0.00 H new ATOM 0 HH21 ARG B 445 13.070 16.347 -17.835 1.00 0.00 H new ATOM 0 HH22 ARG B 445 13.273 17.608 -19.056 1.00 0.00 H new