USER MOD reduce.3.24.130724 H: found=0, std=0, add=642, rem=0, adj=16 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 Single : B 368 MET CE :methyl -128:sc= 0 (180deg=-0.0574) USER MOD Single : B 369 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 371 LYS NZ :NH3+ -168:sc= -0.704 (180deg=-1.3!) USER MOD Single : B 373 GLN : amide:sc= -4.97 K(o=-5,f=-6.2!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 160:sc= 0 USER MOD Single : B 380 TYR OH : rot 140:sc= 0.216 USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS : no HE2:sc= -4.7! C(o=-4.7!,f=-4.3!) USER MOD Single : B 387 TYR OH : rot -20:sc= -5.27! 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 130:sc= -0.868 USER MOD Single : B 399 ASN : amide:sc= -2.69! K(o=-2.7!,f=-0.85) USER MOD Single : B 400 SER OG : rot 97:sc= 0.29 USER MOD Single : B 404 CYS SG : rot -150:sc= -1.07 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 63:sc= -6.54! USER MOD Single : B 419 ASN : amide:sc= -8.32! C(o=-8.3!,f=-12!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -1.9! C(o=-1.9!,f=-12!) 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 -151:sc= -0.466 (180deg=-2.34) USER MOD Single : B 441 TYR OH : rot -176:sc= -0.856 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN : amide:sc= -1.28 K(o=-1.3,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1069 N ASP B 367 -4.963 4.475 -16.215 1.00 0.00 N ATOM 1070 CA ASP B 367 -3.631 4.219 -15.682 1.00 0.00 C ATOM 1071 C ASP B 367 -2.594 4.837 -16.610 1.00 0.00 C ATOM 1072 O ASP B 367 -1.954 5.838 -16.272 1.00 0.00 O ATOM 1073 CB ASP B 367 -3.377 2.714 -15.534 1.00 0.00 C ATOM 1074 CG ASP B 367 -4.584 1.956 -15.011 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -5.722 2.419 -15.230 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -4.389 0.895 -14.380 1.00 0.00 O ATOM 0 HA ASP B 367 -3.555 4.669 -14.692 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -3.088 2.303 -16.502 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -2.536 2.558 -14.858 1.00 0.00 H new ATOM 1081 N MET B 368 -2.434 4.221 -17.778 1.00 0.00 N ATOM 1082 CA MET B 368 -1.482 4.695 -18.772 1.00 0.00 C ATOM 1083 C MET B 368 -1.401 6.216 -18.747 1.00 0.00 C ATOM 1084 O MET B 368 -0.311 6.788 -18.794 1.00 0.00 O ATOM 1085 CB MET B 368 -1.880 4.212 -20.168 1.00 0.00 C ATOM 1086 CG MET B 368 -3.353 4.400 -20.487 1.00 0.00 C ATOM 1087 SD MET B 368 -3.703 4.236 -22.248 1.00 0.00 S ATOM 1088 CE MET B 368 -3.157 5.833 -22.850 1.00 0.00 C ATOM 0 H MET B 368 -2.955 3.390 -18.058 1.00 0.00 H new ATOM 0 HA MET B 368 -0.501 4.288 -18.529 1.00 0.00 H new ATOM 0 HB2 MET B 368 -1.287 4.747 -20.910 1.00 0.00 H new ATOM 0 HB3 MET B 368 -1.630 3.155 -20.261 1.00 0.00 H new ATOM 0 HG2 MET B 368 -3.938 3.666 -19.933 1.00 0.00 H new ATOM 0 HG3 MET B 368 -3.673 5.385 -20.146 1.00 0.00 H new ATOM 0 HE1 MET B 368 -3.951 6.290 -23.441 1.00 0.00 H new ATOM 0 HE2 MET B 368 -2.917 6.478 -22.005 1.00 0.00 H new ATOM 0 HE3 MET B 368 -2.271 5.704 -23.471 1.00 0.00 H new ATOM 1098 N ASN B 369 -2.558 6.871 -18.651 1.00 0.00 N ATOM 1099 CA ASN B 369 -2.598 8.325 -18.599 1.00 0.00 C ATOM 1100 C ASN B 369 -1.907 8.815 -17.337 1.00 0.00 C ATOM 1101 O ASN B 369 -1.036 9.683 -17.387 1.00 0.00 O ATOM 1102 CB ASN B 369 -4.041 8.830 -18.640 1.00 0.00 C ATOM 1103 CG ASN B 369 -4.471 9.226 -20.038 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -4.186 10.331 -20.498 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -5.161 8.322 -20.723 1.00 0.00 N ATOM 0 H ASN B 369 -3.471 6.419 -18.608 1.00 0.00 H new ATOM 0 HA ASN B 369 -2.074 8.718 -19.470 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -4.707 8.053 -18.264 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -4.143 9.687 -17.974 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -5.477 8.532 -21.670 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -5.375 7.418 -20.302 1.00 0.00 H new ATOM 1112 N ALA B 370 -2.290 8.234 -16.205 1.00 0.00 N ATOM 1113 CA ALA B 370 -1.696 8.593 -14.928 1.00 0.00 C ATOM 1114 C ALA B 370 -0.181 8.471 -15.003 1.00 0.00 C ATOM 1115 O ALA B 370 0.521 9.472 -15.128 1.00 0.00 O ATOM 1116 CB ALA B 370 -2.248 7.728 -13.805 1.00 0.00 C ATOM 0 H ALA B 370 -3.009 7.513 -16.149 1.00 0.00 H new ATOM 0 HA ALA B 370 -1.955 9.629 -14.709 1.00 0.00 H new ATOM 0 HB1 ALA B 370 -1.786 8.018 -12.861 1.00 0.00 H new ATOM 0 HB2 ALA B 370 -3.327 7.864 -13.738 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -2.027 6.681 -14.010 1.00 0.00 H new ATOM 1122 N LYS B 371 0.318 7.239 -14.909 1.00 0.00 N ATOM 1123 CA LYS B 371 1.760 6.989 -14.958 1.00 0.00 C ATOM 1124 C LYS B 371 2.462 7.999 -15.861 1.00 0.00 C ATOM 1125 O LYS B 371 3.448 8.626 -15.461 1.00 0.00 O ATOM 1126 CB LYS B 371 2.050 5.565 -15.447 1.00 0.00 C ATOM 1127 CG LYS B 371 0.828 4.831 -15.977 1.00 0.00 C ATOM 1128 CD LYS B 371 1.220 3.736 -16.959 1.00 0.00 C ATOM 1129 CE LYS B 371 0.243 2.570 -16.914 1.00 0.00 C ATOM 1130 NZ LYS B 371 0.074 2.038 -15.534 1.00 0.00 N ATOM 0 H LYS B 371 -0.252 6.400 -14.799 1.00 0.00 H new ATOM 0 HA LYS B 371 2.147 7.100 -13.945 1.00 0.00 H new ATOM 0 HB2 LYS B 371 2.804 5.608 -16.233 1.00 0.00 H new ATOM 0 HB3 LYS B 371 2.478 4.990 -14.626 1.00 0.00 H new ATOM 0 HG2 LYS B 371 0.275 4.395 -15.145 1.00 0.00 H new ATOM 0 HG3 LYS B 371 0.160 5.540 -16.467 1.00 0.00 H new ATOM 0 HD2 LYS B 371 1.253 4.146 -17.968 1.00 0.00 H new ATOM 0 HD3 LYS B 371 2.224 3.380 -16.727 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -0.724 2.892 -17.299 1.00 0.00 H new ATOM 0 HE3 LYS B 371 0.598 1.774 -17.569 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -0.431 1.130 -15.572 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 1.008 1.897 -15.100 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -0.473 2.715 -14.965 1.00 0.00 H new ATOM 1144 N ARG B 372 1.945 8.157 -17.078 1.00 0.00 N ATOM 1145 CA ARG B 372 2.523 9.096 -18.031 1.00 0.00 C ATOM 1146 C ARG B 372 2.673 10.473 -17.396 1.00 0.00 C ATOM 1147 O ARG B 372 3.710 11.118 -17.522 1.00 0.00 O ATOM 1148 CB ARG B 372 1.649 9.193 -19.283 1.00 0.00 C ATOM 1149 CG ARG B 372 2.439 9.228 -20.583 1.00 0.00 C ATOM 1150 CD ARG B 372 2.409 10.615 -21.210 1.00 0.00 C ATOM 1151 NE ARG B 372 3.512 10.824 -22.144 1.00 0.00 N ATOM 1152 CZ ARG B 372 3.890 12.025 -22.578 1.00 0.00 C ATOM 1153 NH1 ARG B 372 3.251 13.113 -22.169 1.00 0.00 N ATOM 1154 NH2 ARG B 372 4.906 12.138 -23.424 1.00 0.00 N ATOM 0 H ARG B 372 1.131 7.649 -17.424 1.00 0.00 H new ATOM 0 HA ARG B 372 3.509 8.730 -18.317 1.00 0.00 H new ATOM 0 HB2 ARG B 372 0.968 8.343 -19.306 1.00 0.00 H new ATOM 0 HB3 ARG B 372 1.035 10.091 -19.217 1.00 0.00 H new ATOM 0 HG2 ARG B 372 3.471 8.935 -20.392 1.00 0.00 H new ATOM 0 HG3 ARG B 372 2.026 8.501 -21.282 1.00 0.00 H new ATOM 0 HD2 ARG B 372 1.462 10.755 -21.732 1.00 0.00 H new ATOM 0 HD3 ARG B 372 2.454 11.368 -20.423 1.00 0.00 H new ATOM 0 HE ARG B 372 4.020 10.007 -22.482 1.00 0.00 H new ATOM 0 HH11 ARG B 372 2.468 13.031 -21.520 1.00 0.00 H new ATOM 0 HH12 ARG B 372 3.543 14.032 -22.503 1.00 0.00 H new ATOM 0 HH21 ARG B 372 5.399 11.304 -23.743 1.00 0.00 H new ATOM 0 HH22 ARG B 372 5.194 13.059 -23.755 1.00 0.00 H new ATOM 1168 N GLN B 373 1.630 10.915 -16.707 1.00 0.00 N ATOM 1169 CA GLN B 373 1.651 12.213 -16.049 1.00 0.00 C ATOM 1170 C GLN B 373 2.790 12.292 -15.038 1.00 0.00 C ATOM 1171 O GLN B 373 3.585 13.233 -15.040 1.00 0.00 O ATOM 1172 CB GLN B 373 0.318 12.479 -15.339 1.00 0.00 C ATOM 1173 CG GLN B 373 -0.290 13.824 -15.698 1.00 0.00 C ATOM 1174 CD GLN B 373 0.746 14.928 -15.744 1.00 0.00 C ATOM 1175 OE1 GLN B 373 0.797 15.711 -16.692 1.00 0.00 O ATOM 1176 NE2 GLN B 373 1.583 14.991 -14.715 1.00 0.00 N ATOM 0 H GLN B 373 0.761 10.395 -16.590 1.00 0.00 H new ATOM 0 HA GLN B 373 1.807 12.972 -16.816 1.00 0.00 H new ATOM 0 HB2 GLN B 373 -0.387 11.688 -15.595 1.00 0.00 H new ATOM 0 HB3 GLN B 373 0.472 12.433 -14.261 1.00 0.00 H new ATOM 0 HG2 GLN B 373 -0.783 13.750 -16.667 1.00 0.00 H new ATOM 0 HG3 GLN B 373 -1.058 14.080 -14.968 1.00 0.00 H new ATOM 0 HE21 GLN B 373 1.503 14.320 -13.951 1.00 0.00 H new ATOM 0 HE22 GLN B 373 2.306 15.710 -14.689 1.00 0.00 H new ATOM 1185 N LEU B 374 2.843 11.305 -14.157 1.00 0.00 N ATOM 1186 CA LEU B 374 3.852 11.260 -13.110 1.00 0.00 C ATOM 1187 C LEU B 374 5.278 11.379 -13.643 1.00 0.00 C ATOM 1188 O LEU B 374 5.928 12.404 -13.453 1.00 0.00 O ATOM 1189 CB LEU B 374 3.709 9.970 -12.301 1.00 0.00 C ATOM 1190 CG LEU B 374 2.270 9.496 -12.102 1.00 0.00 C ATOM 1191 CD1 LEU B 374 2.175 8.549 -10.917 1.00 0.00 C ATOM 1192 CD2 LEU B 374 1.344 10.688 -11.912 1.00 0.00 C ATOM 0 H LEU B 374 2.194 10.519 -14.147 1.00 0.00 H new ATOM 0 HA LEU B 374 3.679 12.127 -12.473 1.00 0.00 H new ATOM 0 HB2 LEU B 374 4.271 9.181 -12.800 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.167 10.118 -11.323 1.00 0.00 H new ATOM 0 HG LEU B 374 1.958 8.954 -12.995 1.00 0.00 H new ATOM 0 HD11 LEU B 374 1.142 8.224 -10.793 1.00 0.00 H new ATOM 0 HD12 LEU B 374 2.810 7.681 -11.093 1.00 0.00 H new ATOM 0 HD13 LEU B 374 2.504 9.062 -10.014 1.00 0.00 H new ATOM 0 HD21 LEU B 374 0.322 10.336 -11.771 1.00 0.00 H new ATOM 0 HD22 LEU B 374 1.656 11.255 -11.035 1.00 0.00 H new ATOM 0 HD23 LEU B 374 1.389 11.328 -12.793 1.00 0.00 H new ATOM 1204 N TYR B 375 5.780 10.317 -14.263 1.00 0.00 N ATOM 1205 CA TYR B 375 7.157 10.306 -14.760 1.00 0.00 C ATOM 1206 C TYR B 375 7.321 10.975 -16.128 1.00 0.00 C ATOM 1207 O TYR B 375 8.367 11.557 -16.409 1.00 0.00 O ATOM 1208 CB TYR B 375 7.675 8.869 -14.829 1.00 0.00 C ATOM 1209 CG TYR B 375 8.139 8.319 -13.497 1.00 0.00 C ATOM 1210 CD1 TYR B 375 7.274 8.248 -12.412 1.00 0.00 C ATOM 1211 CD2 TYR B 375 9.441 7.866 -13.328 1.00 0.00 C ATOM 1212 CE1 TYR B 375 7.695 7.741 -11.196 1.00 0.00 C ATOM 1213 CE2 TYR B 375 9.869 7.358 -12.115 1.00 0.00 C ATOM 1214 CZ TYR B 375 8.993 7.297 -11.053 1.00 0.00 C ATOM 1215 OH TYR B 375 9.416 6.792 -9.845 1.00 0.00 O ATOM 0 H TYR B 375 5.261 9.456 -14.434 1.00 0.00 H new ATOM 0 HA TYR B 375 7.742 10.892 -14.052 1.00 0.00 H new ATOM 0 HB2 TYR B 375 6.886 8.227 -15.221 1.00 0.00 H new ATOM 0 HB3 TYR B 375 8.503 8.825 -15.537 1.00 0.00 H new ATOM 0 HD1 TYR B 375 6.257 8.594 -12.520 1.00 0.00 H new ATOM 0 HD2 TYR B 375 10.131 7.911 -14.158 1.00 0.00 H new ATOM 0 HE1 TYR B 375 7.010 7.693 -10.362 1.00 0.00 H new ATOM 0 HE2 TYR B 375 10.885 7.011 -12.001 1.00 0.00 H new ATOM 0 HH TYR B 375 10.356 6.523 -9.914 1.00 0.00 H new ATOM 1225 N SER B 376 6.316 10.865 -16.988 1.00 0.00 N ATOM 1226 CA SER B 376 6.410 11.440 -18.330 1.00 0.00 C ATOM 1227 C SER B 376 6.089 12.937 -18.364 1.00 0.00 C ATOM 1228 O SER B 376 6.403 13.610 -19.346 1.00 0.00 O ATOM 1229 CB SER B 376 5.492 10.691 -19.296 1.00 0.00 C ATOM 1230 OG SER B 376 6.114 10.515 -20.558 1.00 0.00 O ATOM 0 H SER B 376 5.436 10.390 -16.787 1.00 0.00 H new ATOM 0 HA SER B 376 7.448 11.328 -18.642 1.00 0.00 H new ATOM 0 HB2 SER B 376 5.232 9.719 -18.876 1.00 0.00 H new ATOM 0 HB3 SER B 376 4.561 11.244 -19.420 1.00 0.00 H new ATOM 0 HG SER B 376 5.674 9.784 -21.040 1.00 0.00 H new ATOM 1236 N LEU B 377 5.459 13.463 -17.316 1.00 0.00 N ATOM 1237 CA LEU B 377 5.112 14.883 -17.294 1.00 0.00 C ATOM 1238 C LEU B 377 5.759 15.619 -16.124 1.00 0.00 C ATOM 1239 O LEU B 377 5.949 16.833 -16.181 1.00 0.00 O ATOM 1240 CB LEU B 377 3.596 15.057 -17.235 1.00 0.00 C ATOM 1241 CG LEU B 377 2.930 15.359 -18.578 1.00 0.00 C ATOM 1242 CD1 LEU B 377 2.861 16.858 -18.814 1.00 0.00 C ATOM 1243 CD2 LEU B 377 3.683 14.675 -19.708 1.00 0.00 C ATOM 0 H LEU B 377 5.182 12.940 -16.485 1.00 0.00 H new ATOM 0 HA LEU B 377 5.498 15.320 -18.215 1.00 0.00 H new ATOM 0 HB2 LEU B 377 3.156 14.148 -16.824 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.364 15.865 -16.541 1.00 0.00 H new ATOM 0 HG LEU B 377 1.912 14.969 -18.555 1.00 0.00 H new ATOM 0 HD11 LEU B 377 2.384 17.054 -19.774 1.00 0.00 H new ATOM 0 HD12 LEU B 377 2.280 17.325 -18.019 1.00 0.00 H new ATOM 0 HD13 LEU B 377 3.869 17.272 -18.819 1.00 0.00 H new ATOM 0 HD21 LEU B 377 3.197 14.899 -20.657 1.00 0.00 H new ATOM 0 HD22 LEU B 377 4.711 15.037 -19.732 1.00 0.00 H new ATOM 0 HD23 LEU B 377 3.682 13.597 -19.546 1.00 0.00 H new ATOM 1255 N ILE B 378 6.082 14.895 -15.060 1.00 0.00 N ATOM 1256 CA ILE B 378 6.689 15.518 -13.889 1.00 0.00 C ATOM 1257 C ILE B 378 8.020 14.866 -13.521 1.00 0.00 C ATOM 1258 O ILE B 378 9.072 15.497 -13.608 1.00 0.00 O ATOM 1259 CB ILE B 378 5.736 15.466 -12.681 1.00 0.00 C ATOM 1260 CG1 ILE B 378 4.345 15.953 -13.087 1.00 0.00 C ATOM 1261 CG2 ILE B 378 6.281 16.312 -11.541 1.00 0.00 C ATOM 1262 CD1 ILE B 378 4.328 17.391 -13.556 1.00 0.00 C ATOM 0 H ILE B 378 5.937 13.888 -14.982 1.00 0.00 H new ATOM 0 HA ILE B 378 6.881 16.559 -14.150 1.00 0.00 H new ATOM 0 HB ILE B 378 5.659 14.434 -12.340 1.00 0.00 H new ATOM 0 HG12 ILE B 378 3.962 15.314 -13.883 1.00 0.00 H new ATOM 0 HG13 ILE B 378 3.668 15.847 -12.239 1.00 0.00 H new ATOM 0 HG21 ILE B 378 5.597 16.266 -10.694 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.257 15.932 -11.240 1.00 0.00 H new ATOM 0 HG23 ILE B 378 6.381 17.346 -11.871 1.00 0.00 H new ATOM 0 HD11 ILE B 378 3.311 17.673 -13.829 1.00 0.00 H new ATOM 0 HD12 ILE B 378 4.682 18.039 -12.754 1.00 0.00 H new ATOM 0 HD13 ILE B 378 4.979 17.499 -14.423 1.00 0.00 H new ATOM 1274 N GLY B 379 7.969 13.604 -13.109 1.00 0.00 N ATOM 1275 CA GLY B 379 9.179 12.894 -12.734 1.00 0.00 C ATOM 1276 C GLY B 379 10.211 12.880 -13.846 1.00 0.00 C ATOM 1277 O GLY B 379 10.352 11.887 -14.559 1.00 0.00 O ATOM 0 H GLY B 379 7.111 13.059 -13.028 1.00 0.00 H new ATOM 0 HA2 GLY B 379 9.610 13.360 -11.848 1.00 0.00 H new ATOM 0 HA3 GLY B 379 8.926 11.869 -12.464 1.00 0.00 H new ATOM 1281 N TYR B 380 10.926 13.989 -13.996 1.00 0.00 N ATOM 1282 CA TYR B 380 11.945 14.106 -15.035 1.00 0.00 C ATOM 1283 C TYR B 380 13.040 13.055 -14.855 1.00 0.00 C ATOM 1284 O TYR B 380 13.495 12.454 -15.828 1.00 0.00 O ATOM 1285 CB TYR B 380 12.554 15.517 -15.059 1.00 0.00 C ATOM 1286 CG TYR B 380 12.741 16.151 -13.694 1.00 0.00 C ATOM 1287 CD1 TYR B 380 11.690 16.798 -13.054 1.00 0.00 C ATOM 1288 CD2 TYR B 380 13.972 16.108 -13.052 1.00 0.00 C ATOM 1289 CE1 TYR B 380 11.861 17.381 -11.812 1.00 0.00 C ATOM 1290 CE2 TYR B 380 14.151 16.690 -11.811 1.00 0.00 C ATOM 1291 CZ TYR B 380 13.092 17.324 -11.195 1.00 0.00 C ATOM 1292 OH TYR B 380 13.268 17.903 -9.959 1.00 0.00 O ATOM 0 H TYR B 380 10.820 14.819 -13.413 1.00 0.00 H new ATOM 0 HA TYR B 380 11.457 13.929 -15.993 1.00 0.00 H new ATOM 0 HB2 TYR B 380 13.522 15.472 -15.559 1.00 0.00 H new ATOM 0 HB3 TYR B 380 11.915 16.164 -15.660 1.00 0.00 H new ATOM 0 HD1 TYR B 380 10.724 16.846 -13.535 1.00 0.00 H new ATOM 0 HD2 TYR B 380 14.803 15.612 -13.530 1.00 0.00 H new ATOM 0 HE1 TYR B 380 11.034 17.879 -11.328 1.00 0.00 H new ATOM 0 HE2 TYR B 380 15.115 16.649 -11.326 1.00 0.00 H new ATOM 0 HH TYR B 380 13.827 17.322 -9.402 1.00 0.00 H new ATOM 1302 N ALA B 381 13.451 12.833 -13.607 1.00 0.00 N ATOM 1303 CA ALA B 381 14.489 11.847 -13.300 1.00 0.00 C ATOM 1304 C ALA B 381 15.202 12.186 -11.995 1.00 0.00 C ATOM 1305 O ALA B 381 15.826 11.326 -11.374 1.00 0.00 O ATOM 1306 CB ALA B 381 15.501 11.741 -14.431 1.00 0.00 C ATOM 0 H ALA B 381 13.082 13.322 -12.792 1.00 0.00 H new ATOM 0 HA ALA B 381 13.994 10.882 -13.186 1.00 0.00 H new ATOM 0 HB1 ALA B 381 16.259 11.001 -14.173 1.00 0.00 H new ATOM 0 HB2 ALA B 381 14.993 11.437 -15.346 1.00 0.00 H new ATOM 0 HB3 ALA B 381 15.977 12.709 -14.585 1.00 0.00 H new ATOM 1312 N SER B 382 15.102 13.446 -11.588 1.00 0.00 N ATOM 1313 CA SER B 382 15.734 13.911 -10.359 1.00 0.00 C ATOM 1314 C SER B 382 14.719 14.615 -9.464 1.00 0.00 C ATOM 1315 O SER B 382 15.025 15.632 -8.841 1.00 0.00 O ATOM 1316 CB SER B 382 16.892 14.857 -10.683 1.00 0.00 C ATOM 1317 OG SER B 382 18.112 14.145 -10.820 1.00 0.00 O ATOM 0 H SER B 382 14.587 14.167 -12.094 1.00 0.00 H new ATOM 0 HA SER B 382 16.124 13.044 -9.826 1.00 0.00 H new ATOM 0 HB2 SER B 382 16.677 15.397 -11.605 1.00 0.00 H new ATOM 0 HB3 SER B 382 16.989 15.602 -9.893 1.00 0.00 H new ATOM 0 HG SER B 382 18.835 14.772 -11.029 1.00 0.00 H new ATOM 1323 N LEU B 383 13.508 14.067 -9.411 1.00 0.00 N ATOM 1324 CA LEU B 383 12.441 14.639 -8.597 1.00 0.00 C ATOM 1325 C LEU B 383 12.305 13.897 -7.271 1.00 0.00 C ATOM 1326 O LEU B 383 12.021 14.500 -6.236 1.00 0.00 O ATOM 1327 CB LEU B 383 11.114 14.591 -9.359 1.00 0.00 C ATOM 1328 CG LEU B 383 10.256 15.851 -9.244 1.00 0.00 C ATOM 1329 CD1 LEU B 383 9.279 15.942 -10.408 1.00 0.00 C ATOM 1330 CD2 LEU B 383 9.509 15.866 -7.919 1.00 0.00 C ATOM 0 H LEU B 383 13.241 13.226 -9.923 1.00 0.00 H new ATOM 0 HA LEU B 383 12.697 15.677 -8.384 1.00 0.00 H new ATOM 0 HB2 LEU B 383 11.324 14.408 -10.413 1.00 0.00 H new ATOM 0 HB3 LEU B 383 10.535 13.741 -8.997 1.00 0.00 H new ATOM 0 HG LEU B 383 10.914 16.719 -9.280 1.00 0.00 H new ATOM 0 HD11 LEU B 383 8.677 16.845 -10.308 1.00 0.00 H new ATOM 0 HD12 LEU B 383 9.833 15.977 -11.346 1.00 0.00 H new ATOM 0 HD13 LEU B 383 8.626 15.069 -10.404 1.00 0.00 H new ATOM 0 HD21 LEU B 383 8.903 16.770 -7.853 1.00 0.00 H new ATOM 0 HD22 LEU B 383 8.863 14.990 -7.856 1.00 0.00 H new ATOM 0 HD23 LEU B 383 10.225 15.849 -7.097 1.00 0.00 H new ATOM 1342 N ARG B 384 12.510 12.584 -7.310 1.00 0.00 N ATOM 1343 CA ARG B 384 12.409 11.757 -6.112 1.00 0.00 C ATOM 1344 C ARG B 384 10.951 11.513 -5.736 1.00 0.00 C ATOM 1345 O ARG B 384 10.563 11.675 -4.580 1.00 0.00 O ATOM 1346 CB ARG B 384 13.142 12.420 -4.944 1.00 0.00 C ATOM 1347 CG ARG B 384 13.832 11.432 -4.016 1.00 0.00 C ATOM 1348 CD ARG B 384 15.308 11.755 -3.863 1.00 0.00 C ATOM 1349 NE ARG B 384 16.094 10.580 -3.498 1.00 0.00 N ATOM 1350 CZ ARG B 384 16.511 9.671 -4.375 1.00 0.00 C ATOM 1351 NH1 ARG B 384 16.195 9.789 -5.657 1.00 0.00 N ATOM 1352 NH2 ARG B 384 17.244 8.644 -3.968 1.00 0.00 N ATOM 0 H ARG B 384 12.747 12.070 -8.158 1.00 0.00 H new ATOM 0 HA ARG B 384 12.875 10.796 -6.328 1.00 0.00 H new ATOM 0 HB2 ARG B 384 13.884 13.113 -5.339 1.00 0.00 H new ATOM 0 HB3 ARG B 384 12.430 13.010 -4.367 1.00 0.00 H new ATOM 0 HG2 ARG B 384 13.350 11.451 -3.038 1.00 0.00 H new ATOM 0 HG3 ARG B 384 13.718 10.421 -4.408 1.00 0.00 H new ATOM 0 HD2 ARG B 384 15.687 12.167 -4.798 1.00 0.00 H new ATOM 0 HD3 ARG B 384 15.433 12.525 -3.101 1.00 0.00 H new ATOM 0 HE ARG B 384 16.337 10.449 -2.516 1.00 0.00 H new ATOM 0 HH11 ARG B 384 15.631 10.578 -5.973 1.00 0.00 H new ATOM 0 HH12 ARG B 384 16.516 9.091 -6.328 1.00 0.00 H new ATOM 0 HH21 ARG B 384 17.488 8.551 -2.982 1.00 0.00 H new ATOM 0 HH22 ARG B 384 17.564 7.947 -4.641 1.00 0.00 H new ATOM 1366 N LEU B 385 10.147 11.120 -6.719 1.00 0.00 N ATOM 1367 CA LEU B 385 8.732 10.852 -6.492 1.00 0.00 C ATOM 1368 C LEU B 385 8.520 9.398 -6.100 1.00 0.00 C ATOM 1369 O LEU B 385 9.202 8.505 -6.602 1.00 0.00 O ATOM 1370 CB LEU B 385 7.921 11.182 -7.748 1.00 0.00 C ATOM 1371 CG LEU B 385 6.402 11.124 -7.577 1.00 0.00 C ATOM 1372 CD1 LEU B 385 5.728 12.150 -8.477 1.00 0.00 C ATOM 1373 CD2 LEU B 385 5.883 9.726 -7.880 1.00 0.00 C ATOM 0 H LEU B 385 10.452 10.980 -7.682 1.00 0.00 H new ATOM 0 HA LEU B 385 8.389 11.486 -5.674 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.195 12.182 -8.085 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.208 10.489 -8.539 1.00 0.00 H new ATOM 0 HG LEU B 385 6.162 11.361 -6.541 1.00 0.00 H new ATOM 0 HD11 LEU B 385 4.647 12.097 -8.344 1.00 0.00 H new ATOM 0 HD12 LEU B 385 6.077 13.149 -8.215 1.00 0.00 H new ATOM 0 HD13 LEU B 385 5.976 11.940 -9.517 1.00 0.00 H new ATOM 0 HD21 LEU B 385 4.801 9.704 -7.753 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.133 9.460 -8.907 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.343 9.011 -7.197 1.00 0.00 H new ATOM 1385 N HIS B 386 7.578 9.163 -5.193 1.00 0.00 N ATOM 1386 CA HIS B 386 7.301 7.805 -4.738 1.00 0.00 C ATOM 1387 C HIS B 386 5.965 7.692 -4.012 1.00 0.00 C ATOM 1388 O HIS B 386 5.601 8.544 -3.193 1.00 0.00 O ATOM 1389 CB HIS B 386 8.427 7.313 -3.827 1.00 0.00 C ATOM 1390 CG HIS B 386 8.538 8.071 -2.541 1.00 0.00 C ATOM 1391 ND1 HIS B 386 9.521 9.010 -2.301 1.00 0.00 N ATOM 1392 CD2 HIS B 386 7.784 8.025 -1.416 1.00 0.00 C ATOM 1393 CE1 HIS B 386 9.368 9.504 -1.085 1.00 0.00 C ATOM 1394 NE2 HIS B 386 8.322 8.924 -0.529 1.00 0.00 N ATOM 0 H HIS B 386 7.000 9.885 -4.763 1.00 0.00 H new ATOM 0 HA HIS B 386 7.243 7.178 -5.628 1.00 0.00 H new ATOM 0 HB2 HIS B 386 8.266 6.258 -3.604 1.00 0.00 H new ATOM 0 HB3 HIS B 386 9.373 7.385 -4.363 1.00 0.00 H new ATOM 0 HD1 HIS B 386 10.251 9.280 -2.960 1.00 0.00 H new ATOM 0 HD2 HIS B 386 6.921 7.398 -1.248 1.00 0.00 H new ATOM 0 HE1 HIS B 386 9.993 10.255 -0.625 1.00 0.00 H new ATOM 1403 N TYR B 387 5.249 6.613 -4.314 1.00 0.00 N ATOM 1404 CA TYR B 387 3.965 6.339 -3.691 1.00 0.00 C ATOM 1405 C TYR B 387 4.138 5.345 -2.555 1.00 0.00 C ATOM 1406 O TYR B 387 4.939 4.415 -2.653 1.00 0.00 O ATOM 1407 CB TYR B 387 2.980 5.776 -4.710 1.00 0.00 C ATOM 1408 CG TYR B 387 2.478 6.810 -5.678 1.00 0.00 C ATOM 1409 CD1 TYR B 387 3.346 7.420 -6.567 1.00 0.00 C ATOM 1410 CD2 TYR B 387 1.144 7.183 -5.692 1.00 0.00 C ATOM 1411 CE1 TYR B 387 2.899 8.376 -7.452 1.00 0.00 C ATOM 1412 CE2 TYR B 387 0.685 8.139 -6.572 1.00 0.00 C ATOM 1413 CZ TYR B 387 1.565 8.736 -7.452 1.00 0.00 C ATOM 1414 OH TYR B 387 1.113 9.692 -8.333 1.00 0.00 O ATOM 0 H TYR B 387 5.543 5.911 -4.993 1.00 0.00 H new ATOM 0 HA TYR B 387 3.570 7.276 -3.299 1.00 0.00 H new ATOM 0 HB2 TYR B 387 3.461 4.971 -5.265 1.00 0.00 H new ATOM 0 HB3 TYR B 387 2.132 5.338 -4.183 1.00 0.00 H new ATOM 0 HD1 TYR B 387 4.390 7.142 -6.567 1.00 0.00 H new ATOM 0 HD2 TYR B 387 0.454 6.718 -5.004 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.587 8.842 -8.142 1.00 0.00 H new ATOM 0 HE2 TYR B 387 -0.358 8.420 -6.573 1.00 0.00 H new ATOM 0 HH TYR B 387 1.869 10.231 -8.648 1.00 0.00 H new ATOM 1424 N VAL B 388 3.397 5.541 -1.479 1.00 0.00 N ATOM 1425 CA VAL B 388 3.494 4.647 -0.338 1.00 0.00 C ATOM 1426 C VAL B 388 2.159 4.020 0.003 1.00 0.00 C ATOM 1427 O VAL B 388 1.223 4.709 0.402 1.00 0.00 O ATOM 1428 CB VAL B 388 4.038 5.356 0.914 1.00 0.00 C ATOM 1429 CG1 VAL B 388 5.390 4.769 1.277 1.00 0.00 C ATOM 1430 CG2 VAL B 388 4.142 6.858 0.695 1.00 0.00 C ATOM 0 H VAL B 388 2.728 6.303 -1.371 1.00 0.00 H new ATOM 0 HA VAL B 388 4.195 3.867 -0.637 1.00 0.00 H new ATOM 0 HB VAL B 388 3.343 5.196 1.739 1.00 0.00 H new ATOM 0 HG11 VAL B 388 5.778 5.270 2.164 1.00 0.00 H new ATOM 0 HG12 VAL B 388 5.281 3.704 1.480 1.00 0.00 H new ATOM 0 HG13 VAL B 388 6.083 4.911 0.448 1.00 0.00 H new ATOM 0 HG21 VAL B 388 4.529 7.331 1.597 1.00 0.00 H new ATOM 0 HG22 VAL B 388 4.816 7.058 -0.138 1.00 0.00 H new ATOM 0 HG23 VAL B 388 3.155 7.262 0.469 1.00 0.00 H new ATOM 1440 N THR B 389 2.088 2.702 -0.115 1.00 0.00 N ATOM 1441 CA THR B 389 0.870 1.995 0.228 1.00 0.00 C ATOM 1442 C THR B 389 0.573 2.268 1.688 1.00 0.00 C ATOM 1443 O THR B 389 0.994 1.527 2.577 1.00 0.00 O ATOM 1444 CB THR B 389 0.996 0.483 -0.003 1.00 0.00 C ATOM 1445 OG1 THR B 389 1.032 0.169 -1.401 1.00 0.00 O ATOM 1446 CG2 THR B 389 -0.170 -0.258 0.633 1.00 0.00 C ATOM 0 H THR B 389 2.851 2.109 -0.442 1.00 0.00 H new ATOM 0 HA THR B 389 0.062 2.348 -0.413 1.00 0.00 H new ATOM 0 HB THR B 389 1.931 0.166 0.459 1.00 0.00 H new ATOM 0 HG1 THR B 389 1.114 -0.801 -1.516 1.00 0.00 H new ATOM 0 HG21 THR B 389 -0.060 -1.328 0.457 1.00 0.00 H new ATOM 0 HG22 THR B 389 -0.181 -0.066 1.706 1.00 0.00 H new ATOM 0 HG23 THR B 389 -1.105 0.088 0.192 1.00 0.00 H new ATOM 1454 N VAL B 390 -0.111 3.373 1.927 1.00 0.00 N ATOM 1455 CA VAL B 390 -0.422 3.799 3.274 1.00 0.00 C ATOM 1456 C VAL B 390 -1.670 3.097 3.808 1.00 0.00 C ATOM 1457 O VAL B 390 -2.683 2.994 3.118 1.00 0.00 O ATOM 1458 CB VAL B 390 -0.549 5.337 3.315 1.00 0.00 C ATOM 1459 CG1 VAL B 390 -1.346 5.848 2.138 1.00 0.00 C ATOM 1460 CG2 VAL B 390 -1.145 5.826 4.610 1.00 0.00 C ATOM 0 H VAL B 390 -0.463 3.993 1.198 1.00 0.00 H new ATOM 0 HA VAL B 390 0.394 3.510 3.936 1.00 0.00 H new ATOM 0 HB VAL B 390 0.462 5.738 3.251 1.00 0.00 H new ATOM 0 HG11 VAL B 390 -1.420 6.934 2.192 1.00 0.00 H new ATOM 0 HG12 VAL B 390 -0.848 5.564 1.211 1.00 0.00 H new ATOM 0 HG13 VAL B 390 -2.346 5.415 2.160 1.00 0.00 H new ATOM 0 HG21 VAL B 390 -1.214 6.914 4.591 1.00 0.00 H new ATOM 0 HG22 VAL B 390 -2.141 5.401 4.735 1.00 0.00 H new ATOM 0 HG23 VAL B 390 -0.512 5.517 5.442 1.00 0.00 H new ATOM 1470 N LYS B 391 -1.557 2.577 5.033 1.00 0.00 N ATOM 1471 CA LYS B 391 -2.639 1.843 5.680 1.00 0.00 C ATOM 1472 C LYS B 391 -2.533 0.348 5.372 1.00 0.00 C ATOM 1473 O LYS B 391 -2.332 -0.043 4.222 1.00 0.00 O ATOM 1474 CB LYS B 391 -3.993 2.379 5.231 1.00 0.00 C ATOM 1475 CG LYS B 391 -5.147 1.919 6.103 1.00 0.00 C ATOM 1476 CD LYS B 391 -5.393 0.427 5.949 1.00 0.00 C ATOM 1477 CE LYS B 391 -6.870 0.093 6.073 1.00 0.00 C ATOM 1478 NZ LYS B 391 -7.357 0.236 7.473 1.00 0.00 N ATOM 0 H LYS B 391 -0.713 2.655 5.600 1.00 0.00 H new ATOM 0 HA LYS B 391 -2.550 1.983 6.757 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -3.961 3.469 5.230 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -4.177 2.064 4.204 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -4.932 2.149 7.147 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -6.050 2.468 5.836 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -5.023 0.094 4.979 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -4.831 -0.116 6.708 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -7.446 0.748 5.420 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -7.041 -0.928 5.732 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -8.369 -0.001 7.514 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -6.825 -0.408 8.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -7.218 1.216 7.791 1.00 0.00 H new ATOM 1492 N LYS B 392 -2.657 -0.480 6.408 1.00 0.00 N ATOM 1493 CA LYS B 392 -2.562 -1.932 6.248 1.00 0.00 C ATOM 1494 C LYS B 392 -3.912 -2.539 5.857 1.00 0.00 C ATOM 1495 O LYS B 392 -4.906 -2.365 6.561 1.00 0.00 O ATOM 1496 CB LYS B 392 -2.062 -2.572 7.546 1.00 0.00 C ATOM 1497 CG LYS B 392 -0.711 -2.047 8.002 1.00 0.00 C ATOM 1498 CD LYS B 392 0.249 -1.885 6.835 1.00 0.00 C ATOM 1499 CE LYS B 392 0.668 -3.231 6.263 1.00 0.00 C ATOM 1500 NZ LYS B 392 2.062 -3.587 6.646 1.00 0.00 N ATOM 0 H LYS B 392 -2.823 -0.172 7.366 1.00 0.00 H new ATOM 0 HA LYS B 392 -1.853 -2.135 5.446 1.00 0.00 H new ATOM 0 HB2 LYS B 392 -2.795 -2.397 8.333 1.00 0.00 H new ATOM 0 HB3 LYS B 392 -1.995 -3.651 7.407 1.00 0.00 H new ATOM 0 HG2 LYS B 392 -0.843 -1.087 8.501 1.00 0.00 H new ATOM 0 HG3 LYS B 392 -0.282 -2.731 8.734 1.00 0.00 H new ATOM 0 HD2 LYS B 392 -0.224 -1.289 6.055 1.00 0.00 H new ATOM 0 HD3 LYS B 392 1.133 -1.338 7.163 1.00 0.00 H new ATOM 0 HE2 LYS B 392 -0.014 -4.004 6.617 1.00 0.00 H new ATOM 0 HE3 LYS B 392 0.585 -3.205 5.176 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 2.309 -4.511 6.237 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 2.716 -2.863 6.287 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 2.135 -3.637 7.682 1.00 0.00 H new ATOM 1514 N PRO B 393 -3.964 -3.257 4.719 1.00 0.00 N ATOM 1515 CA PRO B 393 -5.195 -3.886 4.227 1.00 0.00 C ATOM 1516 C PRO B 393 -5.593 -5.137 5.013 1.00 0.00 C ATOM 1517 O PRO B 393 -4.790 -5.710 5.750 1.00 0.00 O ATOM 1518 CB PRO B 393 -4.866 -4.268 2.775 1.00 0.00 C ATOM 1519 CG PRO B 393 -3.515 -3.695 2.486 1.00 0.00 C ATOM 1520 CD PRO B 393 -2.837 -3.502 3.812 1.00 0.00 C ATOM 0 HA PRO B 393 -6.041 -3.206 4.329 1.00 0.00 H new ATOM 0 HB2 PRO B 393 -4.864 -5.351 2.649 1.00 0.00 H new ATOM 0 HB3 PRO B 393 -5.613 -3.868 2.089 1.00 0.00 H new ATOM 0 HG2 PRO B 393 -2.938 -4.366 1.850 1.00 0.00 H new ATOM 0 HG3 PRO B 393 -3.602 -2.748 1.954 1.00 0.00 H new ATOM 0 HD2 PRO B 393 -2.265 -4.382 4.106 1.00 0.00 H new ATOM 0 HD3 PRO B 393 -2.143 -2.662 3.793 1.00 0.00 H new ATOM 1528 N THR B 394 -6.847 -5.551 4.835 1.00 0.00 N ATOM 1529 CA THR B 394 -7.377 -6.733 5.511 1.00 0.00 C ATOM 1530 C THR B 394 -7.559 -7.897 4.536 1.00 0.00 C ATOM 1531 O THR B 394 -6.929 -7.935 3.478 1.00 0.00 O ATOM 1532 CB THR B 394 -8.720 -6.435 6.206 1.00 0.00 C ATOM 1533 OG1 THR B 394 -9.832 -6.794 5.378 1.00 0.00 O ATOM 1534 CG2 THR B 394 -8.834 -4.958 6.555 1.00 0.00 C ATOM 0 H THR B 394 -7.517 -5.082 4.225 1.00 0.00 H new ATOM 0 HA THR B 394 -6.645 -7.014 6.268 1.00 0.00 H new ATOM 0 HB THR B 394 -8.743 -7.034 7.116 1.00 0.00 H new ATOM 0 HG1 THR B 394 -10.458 -7.345 5.892 1.00 0.00 H new ATOM 0 HG21 THR B 394 -9.790 -4.773 7.044 1.00 0.00 H new ATOM 0 HG22 THR B 394 -8.022 -4.679 7.227 1.00 0.00 H new ATOM 0 HG23 THR B 394 -8.771 -4.363 5.644 1.00 0.00 H new ATOM 1542 N ALA B 395 -8.414 -8.853 4.901 1.00 0.00 N ATOM 1543 CA ALA B 395 -8.663 -10.022 4.056 1.00 0.00 C ATOM 1544 C ALA B 395 -9.798 -9.768 3.068 1.00 0.00 C ATOM 1545 O ALA B 395 -9.659 -10.025 1.872 1.00 0.00 O ATOM 1546 CB ALA B 395 -8.964 -11.252 4.903 1.00 0.00 C ATOM 0 H ALA B 395 -8.944 -8.842 5.772 1.00 0.00 H new ATOM 0 HA ALA B 395 -7.754 -10.208 3.484 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -9.145 -12.107 4.252 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -8.114 -11.464 5.552 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -9.848 -11.066 5.513 1.00 0.00 H new ATOM 1552 N VAL B 396 -10.915 -9.247 3.566 1.00 0.00 N ATOM 1553 CA VAL B 396 -12.059 -8.944 2.718 1.00 0.00 C ATOM 1554 C VAL B 396 -12.262 -7.444 2.626 1.00 0.00 C ATOM 1555 O VAL B 396 -13.009 -6.943 1.784 1.00 0.00 O ATOM 1556 CB VAL B 396 -13.350 -9.606 3.236 1.00 0.00 C ATOM 1557 CG1 VAL B 396 -13.391 -11.076 2.849 1.00 0.00 C ATOM 1558 CG2 VAL B 396 -13.464 -9.442 4.744 1.00 0.00 C ATOM 0 H VAL B 396 -11.051 -9.026 4.553 1.00 0.00 H new ATOM 0 HA VAL B 396 -11.844 -9.349 1.729 1.00 0.00 H new ATOM 0 HB VAL B 396 -14.202 -9.109 2.772 1.00 0.00 H new ATOM 0 HG11 VAL B 396 -14.310 -11.525 3.224 1.00 0.00 H new ATOM 0 HG12 VAL B 396 -13.359 -11.167 1.763 1.00 0.00 H new ATOM 0 HG13 VAL B 396 -12.533 -11.590 3.282 1.00 0.00 H new ATOM 0 HG21 VAL B 396 -14.382 -9.915 5.093 1.00 0.00 H new ATOM 0 HG22 VAL B 396 -12.607 -9.912 5.227 1.00 0.00 H new ATOM 0 HG23 VAL B 396 -13.485 -8.381 4.994 1.00 0.00 H new ATOM 1568 N ASP B 397 -11.578 -6.744 3.509 1.00 0.00 N ATOM 1569 CA ASP B 397 -11.645 -5.294 3.570 1.00 0.00 C ATOM 1570 C ASP B 397 -10.292 -4.670 3.236 1.00 0.00 C ATOM 1571 O ASP B 397 -9.838 -3.749 3.916 1.00 0.00 O ATOM 1572 CB ASP B 397 -12.106 -4.841 4.956 1.00 0.00 C ATOM 1573 CG ASP B 397 -13.617 -4.772 5.067 1.00 0.00 C ATOM 1574 OD1 ASP B 397 -14.251 -5.839 5.216 1.00 0.00 O ATOM 1575 OD2 ASP B 397 -14.167 -3.653 5.005 1.00 0.00 O ATOM 0 H ASP B 397 -10.960 -7.162 4.205 1.00 0.00 H new ATOM 0 HA ASP B 397 -12.369 -4.957 2.828 1.00 0.00 H new ATOM 0 HB2 ASP B 397 -11.720 -5.530 5.708 1.00 0.00 H new ATOM 0 HB3 ASP B 397 -11.683 -3.861 5.175 1.00 0.00 H new ATOM 1580 N PRO B 398 -9.630 -5.165 2.176 1.00 0.00 N ATOM 1581 CA PRO B 398 -8.332 -4.655 1.755 1.00 0.00 C ATOM 1582 C PRO B 398 -8.296 -3.135 1.731 1.00 0.00 C ATOM 1583 O PRO B 398 -7.222 -2.538 1.800 1.00 0.00 O ATOM 1584 CB PRO B 398 -8.146 -5.192 0.338 1.00 0.00 C ATOM 1585 CG PRO B 398 -9.205 -6.228 0.115 1.00 0.00 C ATOM 1586 CD PRO B 398 -10.106 -6.259 1.323 1.00 0.00 C ATOM 0 HA PRO B 398 -7.548 -4.968 2.444 1.00 0.00 H new ATOM 0 HB2 PRO B 398 -8.234 -4.388 -0.393 1.00 0.00 H new ATOM 0 HB3 PRO B 398 -7.153 -5.625 0.218 1.00 0.00 H new ATOM 0 HG2 PRO B 398 -9.780 -5.995 -0.781 1.00 0.00 H new ATOM 0 HG3 PRO B 398 -8.751 -7.206 -0.044 1.00 0.00 H new ATOM 0 HD2 PRO B 398 -11.149 -6.116 1.042 1.00 0.00 H new ATOM 0 HD3 PRO B 398 -10.044 -7.218 1.838 1.00 0.00 H new ATOM 1594 N ASN B 399 -9.481 -2.521 1.629 1.00 0.00 N ATOM 1595 CA ASN B 399 -9.616 -1.063 1.593 1.00 0.00 C ATOM 1596 C ASN B 399 -8.387 -0.383 2.167 1.00 0.00 C ATOM 1597 O ASN B 399 -8.315 -0.101 3.363 1.00 0.00 O ATOM 1598 CB ASN B 399 -10.852 -0.629 2.367 1.00 0.00 C ATOM 1599 CG ASN B 399 -11.822 0.160 1.512 1.00 0.00 C ATOM 1600 OD1 ASN B 399 -11.866 1.389 1.574 1.00 0.00 O ATOM 1601 ND2 ASN B 399 -12.607 -0.544 0.707 1.00 0.00 N ATOM 0 H ASN B 399 -10.369 -3.020 1.569 1.00 0.00 H new ATOM 0 HA ASN B 399 -9.719 -0.763 0.550 1.00 0.00 H new ATOM 0 HB2 ASN B 399 -11.356 -1.510 2.765 1.00 0.00 H new ATOM 0 HB3 ASN B 399 -10.548 -0.023 3.221 1.00 0.00 H new ATOM 0 HD21 ASN B 399 -13.281 -0.068 0.107 1.00 0.00 H new ATOM 0 HD22 ASN B 399 -12.537 -1.561 0.688 1.00 0.00 H new ATOM 1608 N SER B 400 -7.419 -0.134 1.304 1.00 0.00 N ATOM 1609 CA SER B 400 -6.178 0.502 1.710 1.00 0.00 C ATOM 1610 C SER B 400 -5.992 1.814 0.969 1.00 0.00 C ATOM 1611 O SER B 400 -6.596 2.037 -0.080 1.00 0.00 O ATOM 1612 CB SER B 400 -4.991 -0.424 1.436 1.00 0.00 C ATOM 1613 OG SER B 400 -3.760 0.262 1.595 1.00 0.00 O ATOM 0 H SER B 400 -7.469 -0.364 0.312 1.00 0.00 H new ATOM 0 HA SER B 400 -6.227 0.704 2.780 1.00 0.00 H new ATOM 0 HB2 SER B 400 -5.026 -1.276 2.115 1.00 0.00 H new ATOM 0 HB3 SER B 400 -5.062 -0.821 0.423 1.00 0.00 H new ATOM 0 HG SER B 400 -3.399 0.083 2.488 1.00 0.00 H new ATOM 1619 N ILE B 401 -5.154 2.680 1.515 1.00 0.00 N ATOM 1620 CA ILE B 401 -4.898 3.962 0.898 1.00 0.00 C ATOM 1621 C ILE B 401 -3.468 4.042 0.378 1.00 0.00 C ATOM 1622 O ILE B 401 -2.588 3.280 0.791 1.00 0.00 O ATOM 1623 CB ILE B 401 -5.163 5.118 1.879 1.00 0.00 C ATOM 1624 CG1 ILE B 401 -4.839 6.463 1.226 1.00 0.00 C ATOM 1625 CG2 ILE B 401 -4.355 4.927 3.146 1.00 0.00 C ATOM 1626 CD1 ILE B 401 -5.411 7.650 1.970 1.00 0.00 C ATOM 0 H ILE B 401 -4.643 2.515 2.382 1.00 0.00 H new ATOM 0 HA ILE B 401 -5.584 4.059 0.056 1.00 0.00 H new ATOM 0 HB ILE B 401 -6.221 5.116 2.142 1.00 0.00 H new ATOM 0 HG12 ILE B 401 -3.757 6.574 1.159 1.00 0.00 H new ATOM 0 HG13 ILE B 401 -5.223 6.464 0.206 1.00 0.00 H new ATOM 0 HG21 ILE B 401 -4.552 5.752 3.831 1.00 0.00 H new ATOM 0 HG22 ILE B 401 -4.638 3.987 3.619 1.00 0.00 H new ATOM 0 HG23 ILE B 401 -3.293 4.905 2.901 1.00 0.00 H new ATOM 0 HD11 ILE B 401 -5.142 8.569 1.450 1.00 0.00 H new ATOM 0 HD12 ILE B 401 -6.497 7.563 2.014 1.00 0.00 H new ATOM 0 HD13 ILE B 401 -5.007 7.674 2.982 1.00 0.00 H new ATOM 1638 N VAL B 402 -3.247 4.973 -0.531 1.00 0.00 N ATOM 1639 CA VAL B 402 -1.939 5.179 -1.127 1.00 0.00 C ATOM 1640 C VAL B 402 -1.464 6.589 -0.846 1.00 0.00 C ATOM 1641 O VAL B 402 -2.261 7.528 -0.874 1.00 0.00 O ATOM 1642 CB VAL B 402 -1.984 4.952 -2.652 1.00 0.00 C ATOM 1643 CG1 VAL B 402 -0.680 4.350 -3.149 1.00 0.00 C ATOM 1644 CG2 VAL B 402 -3.162 4.062 -3.022 1.00 0.00 C ATOM 0 H VAL B 402 -3.967 5.607 -0.877 1.00 0.00 H new ATOM 0 HA VAL B 402 -1.249 4.459 -0.687 1.00 0.00 H new ATOM 0 HB VAL B 402 -2.115 5.919 -3.138 1.00 0.00 H new ATOM 0 HG11 VAL B 402 -0.736 4.199 -4.227 1.00 0.00 H new ATOM 0 HG12 VAL B 402 0.144 5.026 -2.920 1.00 0.00 H new ATOM 0 HG13 VAL B 402 -0.511 3.392 -2.657 1.00 0.00 H new ATOM 0 HG21 VAL B 402 -3.179 3.912 -4.101 1.00 0.00 H new ATOM 0 HG22 VAL B 402 -3.061 3.098 -2.523 1.00 0.00 H new ATOM 0 HG23 VAL B 402 -4.091 4.538 -2.707 1.00 0.00 H new ATOM 1654 N GLU B 403 -0.172 6.751 -0.589 1.00 0.00 N ATOM 1655 CA GLU B 403 0.380 8.067 -0.319 1.00 0.00 C ATOM 1656 C GLU B 403 1.180 8.539 -1.524 1.00 0.00 C ATOM 1657 O GLU B 403 2.141 7.888 -1.931 1.00 0.00 O ATOM 1658 CB GLU B 403 1.275 8.031 0.922 1.00 0.00 C ATOM 1659 CG GLU B 403 0.650 8.697 2.138 1.00 0.00 C ATOM 1660 CD GLU B 403 1.584 9.686 2.810 1.00 0.00 C ATOM 1661 OE1 GLU B 403 2.655 9.259 3.290 1.00 0.00 O ATOM 1662 OE2 GLU B 403 1.242 10.886 2.859 1.00 0.00 O ATOM 0 H GLU B 403 0.507 5.991 -0.562 1.00 0.00 H new ATOM 0 HA GLU B 403 -0.439 8.761 -0.132 1.00 0.00 H new ATOM 0 HB2 GLU B 403 1.506 6.994 1.164 1.00 0.00 H new ATOM 0 HB3 GLU B 403 2.220 8.523 0.693 1.00 0.00 H new ATOM 0 HG2 GLU B 403 -0.262 9.212 1.836 1.00 0.00 H new ATOM 0 HG3 GLU B 403 0.360 7.931 2.857 1.00 0.00 H new ATOM 1669 N CYS B 404 0.794 9.673 -2.083 1.00 0.00 N ATOM 1670 CA CYS B 404 1.492 10.229 -3.233 1.00 0.00 C ATOM 1671 C CYS B 404 2.394 11.357 -2.772 1.00 0.00 C ATOM 1672 O CYS B 404 1.909 12.429 -2.414 1.00 0.00 O ATOM 1673 CB CYS B 404 0.491 10.739 -4.272 1.00 0.00 C ATOM 1674 SG CYS B 404 -1.027 9.760 -4.375 1.00 0.00 S ATOM 0 H CYS B 404 0.001 10.228 -1.760 1.00 0.00 H new ATOM 0 HA CYS B 404 2.096 9.450 -3.698 1.00 0.00 H new ATOM 0 HB2 CYS B 404 0.230 11.770 -4.035 1.00 0.00 H new ATOM 0 HB3 CYS B 404 0.972 10.749 -5.250 1.00 0.00 H new ATOM 0 HG CYS B 404 -1.493 9.808 -5.588 1.00 0.00 H new ATOM 1680 N ARG B 405 3.702 11.109 -2.739 1.00 0.00 N ATOM 1681 CA ARG B 405 4.634 12.121 -2.269 1.00 0.00 C ATOM 1682 C ARG B 405 5.887 12.198 -3.129 1.00 0.00 C ATOM 1683 O ARG B 405 6.037 11.469 -4.109 1.00 0.00 O ATOM 1684 CB ARG B 405 5.018 11.830 -0.820 1.00 0.00 C ATOM 1685 CG ARG B 405 5.718 10.492 -0.639 1.00 0.00 C ATOM 1686 CD ARG B 405 5.384 9.864 0.704 1.00 0.00 C ATOM 1687 NE ARG B 405 5.350 10.854 1.775 1.00 0.00 N ATOM 1688 CZ ARG B 405 5.441 10.544 3.063 1.00 0.00 C ATOM 1689 NH1 ARG B 405 5.566 9.277 3.433 1.00 0.00 N ATOM 1690 NH2 ARG B 405 5.406 11.500 3.981 1.00 0.00 N ATOM 0 H ARG B 405 4.131 10.230 -3.028 1.00 0.00 H new ATOM 0 HA ARG B 405 4.133 13.087 -2.339 1.00 0.00 H new ATOM 0 HB2 ARG B 405 5.670 12.625 -0.458 1.00 0.00 H new ATOM 0 HB3 ARG B 405 4.120 11.848 -0.203 1.00 0.00 H new ATOM 0 HG2 ARG B 405 5.424 9.815 -1.441 1.00 0.00 H new ATOM 0 HG3 ARG B 405 6.796 10.631 -0.718 1.00 0.00 H new ATOM 0 HD2 ARG B 405 4.417 9.365 0.641 1.00 0.00 H new ATOM 0 HD3 ARG B 405 6.123 9.099 0.941 1.00 0.00 H new ATOM 0 HE ARG B 405 5.251 11.837 1.521 1.00 0.00 H new ATOM 0 HH11 ARG B 405 5.592 8.540 2.728 1.00 0.00 H new ATOM 0 HH12 ARG B 405 5.636 9.039 4.422 1.00 0.00 H new ATOM 0 HH21 ARG B 405 5.309 12.475 3.698 1.00 0.00 H new ATOM 0 HH22 ARG B 405 5.476 11.260 4.970 1.00 0.00 H new ATOM 1704 N VAL B 406 6.777 13.106 -2.746 1.00 0.00 N ATOM 1705 CA VAL B 406 8.022 13.316 -3.466 1.00 0.00 C ATOM 1706 C VAL B 406 9.127 13.757 -2.525 1.00 0.00 C ATOM 1707 O VAL B 406 8.896 14.533 -1.599 1.00 0.00 O ATOM 1708 CB VAL B 406 7.846 14.358 -4.574 1.00 0.00 C ATOM 1709 CG1 VAL B 406 7.687 13.656 -5.903 1.00 0.00 C ATOM 1710 CG2 VAL B 406 6.650 15.243 -4.281 1.00 0.00 C ATOM 0 H VAL B 406 6.656 13.712 -1.934 1.00 0.00 H new ATOM 0 HA VAL B 406 8.302 12.364 -3.917 1.00 0.00 H new ATOM 0 HB VAL B 406 8.730 14.995 -4.617 1.00 0.00 H new ATOM 0 HG11 VAL B 406 7.562 14.397 -6.693 1.00 0.00 H new ATOM 0 HG12 VAL B 406 8.574 13.056 -6.106 1.00 0.00 H new ATOM 0 HG13 VAL B 406 6.811 13.009 -5.870 1.00 0.00 H new ATOM 0 HG21 VAL B 406 6.538 15.979 -5.077 1.00 0.00 H new ATOM 0 HG22 VAL B 406 5.750 14.631 -4.223 1.00 0.00 H new ATOM 0 HG23 VAL B 406 6.801 15.757 -3.332 1.00 0.00 H new ATOM 1720 N GLY B 407 10.324 13.230 -2.744 1.00 0.00 N ATOM 1721 CA GLY B 407 11.431 13.559 -1.877 1.00 0.00 C ATOM 1722 C GLY B 407 11.098 13.236 -0.437 1.00 0.00 C ATOM 1723 O GLY B 407 11.754 13.720 0.484 1.00 0.00 O ATOM 0 H GLY B 407 10.545 12.585 -3.502 1.00 0.00 H new ATOM 0 HA2 GLY B 407 12.317 13.003 -2.184 1.00 0.00 H new ATOM 0 HA3 GLY B 407 11.671 14.618 -1.971 1.00 0.00 H new ATOM 1727 N ASP B 408 10.051 12.426 -0.254 1.00 0.00 N ATOM 1728 CA ASP B 408 9.592 12.032 1.073 1.00 0.00 C ATOM 1729 C ASP B 408 9.303 13.262 1.919 1.00 0.00 C ATOM 1730 O ASP B 408 9.493 13.259 3.136 1.00 0.00 O ATOM 1731 CB ASP B 408 10.620 11.130 1.767 1.00 0.00 C ATOM 1732 CG ASP B 408 11.854 11.882 2.225 1.00 0.00 C ATOM 1733 OD1 ASP B 408 11.740 12.701 3.162 1.00 0.00 O ATOM 1734 OD2 ASP B 408 12.937 11.651 1.648 1.00 0.00 O ATOM 0 H ASP B 408 9.504 12.030 -1.018 1.00 0.00 H new ATOM 0 HA ASP B 408 8.670 11.462 0.958 1.00 0.00 H new ATOM 0 HB2 ASP B 408 10.153 10.651 2.628 1.00 0.00 H new ATOM 0 HB3 ASP B 408 10.918 10.335 1.083 1.00 0.00 H new ATOM 1739 N GLY B 409 8.844 14.319 1.259 1.00 0.00 N ATOM 1740 CA GLY B 409 8.541 15.550 1.957 1.00 0.00 C ATOM 1741 C GLY B 409 7.281 16.237 1.456 1.00 0.00 C ATOM 1742 O GLY B 409 6.641 16.980 2.201 1.00 0.00 O ATOM 0 H GLY B 409 8.677 14.344 0.253 1.00 0.00 H new ATOM 0 HA2 GLY B 409 8.431 15.338 3.020 1.00 0.00 H new ATOM 0 HA3 GLY B 409 9.384 16.234 1.854 1.00 0.00 H new ATOM 1746 N THR B 410 6.926 16.009 0.193 1.00 0.00 N ATOM 1747 CA THR B 410 5.741 16.637 -0.383 1.00 0.00 C ATOM 1748 C THR B 410 4.732 15.610 -0.890 1.00 0.00 C ATOM 1749 O THR B 410 4.970 14.934 -1.890 1.00 0.00 O ATOM 1750 CB THR B 410 6.119 17.569 -1.549 1.00 0.00 C ATOM 1751 OG1 THR B 410 6.874 18.698 -1.092 1.00 0.00 O ATOM 1752 CG2 THR B 410 4.874 18.078 -2.261 1.00 0.00 C ATOM 0 H THR B 410 7.437 15.400 -0.445 1.00 0.00 H new ATOM 0 HA THR B 410 5.282 17.213 0.421 1.00 0.00 H new ATOM 0 HB THR B 410 6.727 16.983 -2.238 1.00 0.00 H new ATOM 0 HG1 THR B 410 7.101 19.270 -1.855 1.00 0.00 H new ATOM 0 HG21 THR B 410 5.166 18.734 -3.081 1.00 0.00 H new ATOM 0 HG22 THR B 410 4.310 17.233 -2.656 1.00 0.00 H new ATOM 0 HG23 THR B 410 4.253 18.632 -1.557 1.00 0.00 H new ATOM 1760 N VAL B 411 3.592 15.520 -0.207 1.00 0.00 N ATOM 1761 CA VAL B 411 2.528 14.600 -0.600 1.00 0.00 C ATOM 1762 C VAL B 411 1.618 15.253 -1.631 1.00 0.00 C ATOM 1763 O VAL B 411 0.881 16.187 -1.316 1.00 0.00 O ATOM 1764 CB VAL B 411 1.676 14.161 0.604 1.00 0.00 C ATOM 1765 CG1 VAL B 411 0.449 13.385 0.137 1.00 0.00 C ATOM 1766 CG2 VAL B 411 2.505 13.326 1.566 1.00 0.00 C ATOM 0 H VAL B 411 3.382 16.075 0.623 1.00 0.00 H new ATOM 0 HA VAL B 411 3.009 13.720 -1.026 1.00 0.00 H new ATOM 0 HB VAL B 411 1.336 15.053 1.130 1.00 0.00 H new ATOM 0 HG11 VAL B 411 -0.141 13.083 1.002 1.00 0.00 H new ATOM 0 HG12 VAL B 411 -0.156 14.018 -0.512 1.00 0.00 H new ATOM 0 HG13 VAL B 411 0.766 12.499 -0.413 1.00 0.00 H new ATOM 0 HG21 VAL B 411 1.887 13.024 2.411 1.00 0.00 H new ATOM 0 HG22 VAL B 411 2.875 12.439 1.052 1.00 0.00 H new ATOM 0 HG23 VAL B 411 3.349 13.915 1.925 1.00 0.00 H new ATOM 1776 N LEU B 412 1.659 14.752 -2.859 1.00 0.00 N ATOM 1777 CA LEU B 412 0.821 15.287 -3.919 1.00 0.00 C ATOM 1778 C LEU B 412 -0.640 14.996 -3.619 1.00 0.00 C ATOM 1779 O LEU B 412 -1.513 15.822 -3.883 1.00 0.00 O ATOM 1780 CB LEU B 412 1.217 14.692 -5.273 1.00 0.00 C ATOM 1781 CG LEU B 412 2.706 14.802 -5.621 1.00 0.00 C ATOM 1782 CD1 LEU B 412 3.348 15.980 -4.899 1.00 0.00 C ATOM 1783 CD2 LEU B 412 3.429 13.510 -5.273 1.00 0.00 C ATOM 0 H LEU B 412 2.261 13.979 -3.143 1.00 0.00 H new ATOM 0 HA LEU B 412 0.965 16.366 -3.967 1.00 0.00 H new ATOM 0 HB2 LEU B 412 0.933 13.640 -5.287 1.00 0.00 H new ATOM 0 HB3 LEU B 412 0.640 15.188 -6.053 1.00 0.00 H new ATOM 0 HG LEU B 412 2.792 14.973 -6.694 1.00 0.00 H new ATOM 0 HD11 LEU B 412 4.404 16.036 -5.162 1.00 0.00 H new ATOM 0 HD12 LEU B 412 2.850 16.903 -5.195 1.00 0.00 H new ATOM 0 HD13 LEU B 412 3.250 15.844 -3.822 1.00 0.00 H new ATOM 0 HD21 LEU B 412 4.485 13.604 -5.526 1.00 0.00 H new ATOM 0 HD22 LEU B 412 3.328 13.313 -4.206 1.00 0.00 H new ATOM 0 HD23 LEU B 412 2.993 12.686 -5.837 1.00 0.00 H new ATOM 1795 N GLY B 413 -0.906 13.816 -3.064 1.00 0.00 N ATOM 1796 CA GLY B 413 -2.269 13.448 -2.739 1.00 0.00 C ATOM 1797 C GLY B 413 -2.359 12.083 -2.087 1.00 0.00 C ATOM 1798 O GLY B 413 -1.489 11.703 -1.303 1.00 0.00 O ATOM 0 H GLY B 413 -0.204 13.113 -2.835 1.00 0.00 H new ATOM 0 HA2 GLY B 413 -2.695 14.196 -2.070 1.00 0.00 H new ATOM 0 HA3 GLY B 413 -2.871 13.454 -3.648 1.00 0.00 H new ATOM 1802 N THR B 414 -3.415 11.347 -2.411 1.00 0.00 N ATOM 1803 CA THR B 414 -3.625 10.015 -1.857 1.00 0.00 C ATOM 1804 C THR B 414 -4.860 9.359 -2.470 1.00 0.00 C ATOM 1805 O THR B 414 -5.628 10.010 -3.178 1.00 0.00 O ATOM 1806 CB THR B 414 -3.786 10.066 -0.325 1.00 0.00 C ATOM 1807 OG1 THR B 414 -3.879 8.753 0.237 1.00 0.00 O ATOM 1808 CG2 THR B 414 -5.030 10.846 0.066 1.00 0.00 C ATOM 0 H THR B 414 -4.142 11.652 -3.058 1.00 0.00 H new ATOM 0 HA THR B 414 -2.743 9.422 -2.101 1.00 0.00 H new ATOM 0 HB THR B 414 -2.899 10.564 0.067 1.00 0.00 H new ATOM 0 HG1 THR B 414 -3.047 8.264 0.065 1.00 0.00 H new ATOM 0 HG21 THR B 414 -5.120 10.867 1.152 1.00 0.00 H new ATOM 0 HG22 THR B 414 -4.954 11.866 -0.311 1.00 0.00 H new ATOM 0 HG23 THR B 414 -5.910 10.366 -0.362 1.00 0.00 H new ATOM 1816 N GLY B 415 -5.046 8.069 -2.202 1.00 0.00 N ATOM 1817 CA GLY B 415 -6.195 7.363 -2.748 1.00 0.00 C ATOM 1818 C GLY B 415 -6.503 6.077 -2.004 1.00 0.00 C ATOM 1819 O GLY B 415 -5.598 5.402 -1.527 1.00 0.00 O ATOM 0 H GLY B 415 -4.428 7.503 -1.621 1.00 0.00 H new ATOM 0 HA2 GLY B 415 -7.067 8.016 -2.712 1.00 0.00 H new ATOM 0 HA3 GLY B 415 -6.010 7.135 -3.798 1.00 0.00 H new ATOM 1823 N VAL B 416 -7.784 5.732 -1.911 1.00 0.00 N ATOM 1824 CA VAL B 416 -8.204 4.516 -1.220 1.00 0.00 C ATOM 1825 C VAL B 416 -8.973 3.601 -2.161 1.00 0.00 C ATOM 1826 O VAL B 416 -9.556 4.055 -3.145 1.00 0.00 O ATOM 1827 CB VAL B 416 -9.098 4.836 -0.006 1.00 0.00 C ATOM 1828 CG1 VAL B 416 -9.737 3.567 0.540 1.00 0.00 C ATOM 1829 CG2 VAL B 416 -8.298 5.544 1.074 1.00 0.00 C ATOM 0 H VAL B 416 -8.550 6.278 -2.306 1.00 0.00 H new ATOM 0 HA VAL B 416 -7.298 4.018 -0.875 1.00 0.00 H new ATOM 0 HB VAL B 416 -9.895 5.504 -0.333 1.00 0.00 H new ATOM 0 HG11 VAL B 416 -10.364 3.815 1.396 1.00 0.00 H new ATOM 0 HG12 VAL B 416 -10.348 3.105 -0.235 1.00 0.00 H new ATOM 0 HG13 VAL B 416 -8.957 2.871 0.850 1.00 0.00 H new ATOM 0 HG21 VAL B 416 -8.946 5.762 1.923 1.00 0.00 H new ATOM 0 HG22 VAL B 416 -7.478 4.903 1.398 1.00 0.00 H new ATOM 0 HG23 VAL B 416 -7.895 6.476 0.677 1.00 0.00 H new ATOM 1839 N GLY B 417 -8.965 2.312 -1.858 1.00 0.00 N ATOM 1840 CA GLY B 417 -9.665 1.364 -2.698 1.00 0.00 C ATOM 1841 C GLY B 417 -9.863 0.013 -2.035 1.00 0.00 C ATOM 1842 O GLY B 417 -8.977 -0.476 -1.334 1.00 0.00 O ATOM 0 H GLY B 417 -8.490 1.908 -1.051 1.00 0.00 H new ATOM 0 HA2 GLY B 417 -10.638 1.776 -2.968 1.00 0.00 H new ATOM 0 HA3 GLY B 417 -9.108 1.229 -3.625 1.00 0.00 H new ATOM 1846 N ARG B 418 -11.032 -0.588 -2.261 1.00 0.00 N ATOM 1847 CA ARG B 418 -11.351 -1.894 -1.681 1.00 0.00 C ATOM 1848 C ARG B 418 -10.408 -2.974 -2.209 1.00 0.00 C ATOM 1849 O ARG B 418 -9.931 -3.817 -1.451 1.00 0.00 O ATOM 1850 CB ARG B 418 -12.806 -2.278 -1.965 1.00 0.00 C ATOM 1851 CG ARG B 418 -13.343 -1.752 -3.287 1.00 0.00 C ATOM 1852 CD ARG B 418 -14.345 -0.629 -3.069 1.00 0.00 C ATOM 1853 NE ARG B 418 -13.974 0.587 -3.783 1.00 0.00 N ATOM 1854 CZ ARG B 418 -14.243 0.794 -5.067 1.00 0.00 C ATOM 1855 NH1 ARG B 418 -14.868 -0.140 -5.772 1.00 0.00 N ATOM 1856 NH2 ARG B 418 -13.888 1.933 -5.647 1.00 0.00 N ATOM 0 H ARG B 418 -11.773 -0.192 -2.840 1.00 0.00 H new ATOM 0 HA ARG B 418 -11.217 -1.818 -0.602 1.00 0.00 H new ATOM 0 HB2 ARG B 418 -12.891 -3.365 -1.958 1.00 0.00 H new ATOM 0 HB3 ARG B 418 -13.433 -1.904 -1.156 1.00 0.00 H new ATOM 0 HG2 ARG B 418 -12.517 -1.391 -3.900 1.00 0.00 H new ATOM 0 HG3 ARG B 418 -13.818 -2.564 -3.838 1.00 0.00 H new ATOM 0 HD2 ARG B 418 -15.331 -0.955 -3.399 1.00 0.00 H new ATOM 0 HD3 ARG B 418 -14.421 -0.414 -2.003 1.00 0.00 H new ATOM 0 HE ARG B 418 -13.482 1.318 -3.269 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -15.142 -1.016 -5.328 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -15.075 0.018 -6.758 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -13.407 2.652 -5.107 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -14.096 2.089 -6.633 1.00 0.00 H new ATOM 1870 N ASN B 419 -10.122 -2.925 -3.505 1.00 0.00 N ATOM 1871 CA ASN B 419 -9.212 -3.875 -4.128 1.00 0.00 C ATOM 1872 C ASN B 419 -7.865 -3.206 -4.345 1.00 0.00 C ATOM 1873 O ASN B 419 -7.120 -3.564 -5.253 1.00 0.00 O ATOM 1874 CB ASN B 419 -9.776 -4.378 -5.458 1.00 0.00 C ATOM 1875 CG ASN B 419 -9.616 -3.379 -6.586 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -8.514 -3.163 -7.087 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -10.720 -2.761 -6.991 1.00 0.00 N ATOM 0 H ASN B 419 -10.510 -2.233 -4.146 1.00 0.00 H new ATOM 0 HA ASN B 419 -9.091 -4.736 -3.470 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -9.276 -5.307 -5.730 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -10.834 -4.610 -5.333 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -10.674 -2.077 -7.746 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -11.614 -2.971 -6.547 1.00 0.00 H new ATOM 1884 N ILE B 420 -7.572 -2.260 -3.456 1.00 0.00 N ATOM 1885 CA ILE B 420 -6.320 -1.490 -3.435 1.00 0.00 C ATOM 1886 C ILE B 420 -5.883 -0.904 -4.789 1.00 0.00 C ATOM 1887 O ILE B 420 -5.463 0.250 -4.840 1.00 0.00 O ATOM 1888 CB ILE B 420 -5.160 -2.300 -2.833 1.00 0.00 C ATOM 1889 CG1 ILE B 420 -4.422 -3.099 -3.906 1.00 0.00 C ATOM 1890 CG2 ILE B 420 -5.671 -3.221 -1.734 1.00 0.00 C ATOM 1891 CD1 ILE B 420 -3.337 -2.309 -4.607 1.00 0.00 C ATOM 0 H ILE B 420 -8.213 -1.997 -2.708 1.00 0.00 H new ATOM 0 HA ILE B 420 -6.557 -0.639 -2.796 1.00 0.00 H new ATOM 0 HB ILE B 420 -4.450 -1.597 -2.398 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -3.979 -3.984 -3.449 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -5.141 -3.449 -4.646 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -4.838 -3.788 -1.318 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -6.135 -2.626 -0.947 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -6.407 -3.910 -2.149 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -2.855 -2.938 -5.356 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -3.777 -1.439 -5.093 1.00 0.00 H new ATOM 0 HD13 ILE B 420 -2.597 -1.981 -3.877 1.00 0.00 H new ATOM 1903 N LYS B 421 -5.950 -1.669 -5.879 1.00 0.00 N ATOM 1904 CA LYS B 421 -5.532 -1.148 -7.170 1.00 0.00 C ATOM 1905 C LYS B 421 -6.175 0.210 -7.377 1.00 0.00 C ATOM 1906 O LYS B 421 -5.498 1.188 -7.696 1.00 0.00 O ATOM 1907 CB LYS B 421 -5.884 -2.127 -8.297 1.00 0.00 C ATOM 1908 CG LYS B 421 -6.393 -1.471 -9.571 1.00 0.00 C ATOM 1909 CD LYS B 421 -7.837 -1.036 -9.426 1.00 0.00 C ATOM 1910 CE LYS B 421 -8.642 -1.351 -10.677 1.00 0.00 C ATOM 1911 NZ LYS B 421 -9.612 -0.269 -11.001 1.00 0.00 N ATOM 0 H LYS B 421 -6.284 -2.633 -5.891 1.00 0.00 H new ATOM 0 HA LYS B 421 -4.448 -1.031 -7.189 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -5.000 -2.717 -8.537 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -6.642 -2.821 -7.934 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -5.773 -0.607 -9.811 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -6.303 -2.169 -10.403 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -8.285 -1.537 -8.568 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -7.877 0.035 -9.226 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -7.964 -1.494 -11.518 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -9.179 -2.289 -10.537 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -10.141 -0.522 -11.860 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -10.275 -0.149 -10.209 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -9.099 0.621 -11.160 1.00 0.00 H new ATOM 1925 N ILE B 422 -7.481 0.278 -7.147 1.00 0.00 N ATOM 1926 CA ILE B 422 -8.183 1.548 -7.265 1.00 0.00 C ATOM 1927 C ILE B 422 -7.375 2.585 -6.516 1.00 0.00 C ATOM 1928 O ILE B 422 -7.228 3.722 -6.955 1.00 0.00 O ATOM 1929 CB ILE B 422 -9.615 1.524 -6.679 1.00 0.00 C ATOM 1930 CG1 ILE B 422 -10.070 0.098 -6.392 1.00 0.00 C ATOM 1931 CG2 ILE B 422 -10.589 2.214 -7.617 1.00 0.00 C ATOM 1932 CD1 ILE B 422 -9.455 -0.472 -5.138 1.00 0.00 C ATOM 0 H ILE B 422 -8.065 -0.515 -6.883 1.00 0.00 H new ATOM 0 HA ILE B 422 -8.284 1.773 -8.327 1.00 0.00 H new ATOM 0 HB ILE B 422 -9.598 2.068 -5.735 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -11.156 0.080 -6.299 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -9.812 -0.538 -7.239 1.00 0.00 H new ATOM 0 HG21 ILE B 422 -11.590 2.186 -7.187 1.00 0.00 H new ATOM 0 HG22 ILE B 422 -10.284 3.251 -7.760 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -10.593 1.701 -8.579 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -9.816 -1.489 -4.986 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -8.370 -0.483 -5.238 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -9.734 0.144 -4.283 1.00 0.00 H new ATOM 1944 N ALA B 423 -6.818 2.153 -5.386 1.00 0.00 N ATOM 1945 CA ALA B 423 -5.981 3.019 -4.577 1.00 0.00 C ATOM 1946 C ALA B 423 -4.710 3.357 -5.343 1.00 0.00 C ATOM 1947 O ALA B 423 -4.267 4.506 -5.365 1.00 0.00 O ATOM 1948 CB ALA B 423 -5.641 2.364 -3.247 1.00 0.00 C ATOM 0 H ALA B 423 -6.934 1.210 -5.016 1.00 0.00 H new ATOM 0 HA ALA B 423 -6.530 3.937 -4.365 1.00 0.00 H new ATOM 0 HB1 ALA B 423 -5.013 3.035 -2.661 1.00 0.00 H new ATOM 0 HB2 ALA B 423 -6.560 2.156 -2.699 1.00 0.00 H new ATOM 0 HB3 ALA B 423 -5.106 1.431 -3.427 1.00 0.00 H new ATOM 1954 N GLY B 424 -4.133 2.343 -5.985 1.00 0.00 N ATOM 1955 CA GLY B 424 -2.924 2.547 -6.760 1.00 0.00 C ATOM 1956 C GLY B 424 -3.151 3.485 -7.929 1.00 0.00 C ATOM 1957 O GLY B 424 -2.623 4.598 -7.955 1.00 0.00 O ATOM 0 H GLY B 424 -4.483 1.385 -5.981 1.00 0.00 H new ATOM 0 HA2 GLY B 424 -2.144 2.953 -6.115 1.00 0.00 H new ATOM 0 HA3 GLY B 424 -2.564 1.587 -7.130 1.00 0.00 H new ATOM 1961 N ILE B 425 -3.945 3.038 -8.898 1.00 0.00 N ATOM 1962 CA ILE B 425 -4.240 3.853 -10.069 1.00 0.00 C ATOM 1963 C ILE B 425 -4.695 5.252 -9.667 1.00 0.00 C ATOM 1964 O ILE B 425 -4.074 6.250 -10.040 1.00 0.00 O ATOM 1965 CB ILE B 425 -5.328 3.214 -10.953 1.00 0.00 C ATOM 1966 CG1 ILE B 425 -5.114 1.702 -11.060 1.00 0.00 C ATOM 1967 CG2 ILE B 425 -5.325 3.858 -12.329 1.00 0.00 C ATOM 1968 CD1 ILE B 425 -3.679 1.310 -11.340 1.00 0.00 C ATOM 0 H ILE B 425 -4.393 2.121 -8.895 1.00 0.00 H new ATOM 0 HA ILE B 425 -3.313 3.919 -10.639 1.00 0.00 H new ATOM 0 HB ILE B 425 -6.301 3.385 -10.492 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -5.435 1.232 -10.131 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -5.750 1.309 -11.853 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -6.097 3.400 -12.947 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -5.524 4.925 -12.232 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -4.352 3.712 -12.797 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -3.604 0.224 -11.402 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -3.359 1.751 -12.284 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -3.039 1.672 -10.535 1.00 0.00 H new ATOM 1980 N ARG B 426 -5.783 5.325 -8.905 1.00 0.00 N ATOM 1981 CA ARG B 426 -6.304 6.610 -8.465 1.00 0.00 C ATOM 1982 C ARG B 426 -5.186 7.455 -7.870 1.00 0.00 C ATOM 1983 O ARG B 426 -5.071 8.644 -8.169 1.00 0.00 O ATOM 1984 CB ARG B 426 -7.455 6.427 -7.464 1.00 0.00 C ATOM 1985 CG ARG B 426 -7.031 6.388 -5.999 1.00 0.00 C ATOM 1986 CD ARG B 426 -8.130 6.913 -5.092 1.00 0.00 C ATOM 1987 NE ARG B 426 -9.422 6.973 -5.771 1.00 0.00 N ATOM 1988 CZ ARG B 426 -10.202 5.914 -5.965 1.00 0.00 C ATOM 1989 NH1 ARG B 426 -9.829 4.724 -5.514 1.00 0.00 N ATOM 1990 NH2 ARG B 426 -11.354 6.042 -6.610 1.00 0.00 N ATOM 0 H ARG B 426 -6.315 4.516 -8.583 1.00 0.00 H new ATOM 0 HA ARG B 426 -6.706 7.134 -9.332 1.00 0.00 H new ATOM 0 HB2 ARG B 426 -8.168 7.240 -7.599 1.00 0.00 H new ATOM 0 HB3 ARG B 426 -7.979 5.501 -7.700 1.00 0.00 H new ATOM 0 HG2 ARG B 426 -6.782 5.365 -5.717 1.00 0.00 H new ATOM 0 HG3 ARG B 426 -6.129 6.984 -5.863 1.00 0.00 H new ATOM 0 HD2 ARG B 426 -8.212 6.272 -4.214 1.00 0.00 H new ATOM 0 HD3 ARG B 426 -7.861 7.908 -4.736 1.00 0.00 H new ATOM 0 HE ARG B 426 -9.744 7.878 -6.115 1.00 0.00 H new ATOM 0 HH11 ARG B 426 -8.944 4.621 -5.018 1.00 0.00 H new ATOM 0 HH12 ARG B 426 -10.428 3.912 -5.663 1.00 0.00 H new ATOM 0 HH21 ARG B 426 -11.644 6.955 -6.959 1.00 0.00 H new ATOM 0 HH22 ARG B 426 -11.950 5.227 -6.757 1.00 0.00 H new ATOM 2004 N ALA B 427 -4.352 6.836 -7.035 1.00 0.00 N ATOM 2005 CA ALA B 427 -3.241 7.547 -6.423 1.00 0.00 C ATOM 2006 C ALA B 427 -2.491 8.345 -7.479 1.00 0.00 C ATOM 2007 O ALA B 427 -2.271 9.547 -7.326 1.00 0.00 O ATOM 2008 CB ALA B 427 -2.299 6.586 -5.714 1.00 0.00 C ATOM 0 H ALA B 427 -4.427 5.853 -6.772 1.00 0.00 H new ATOM 0 HA ALA B 427 -3.642 8.233 -5.677 1.00 0.00 H new ATOM 0 HB1 ALA B 427 -1.478 7.146 -5.266 1.00 0.00 H new ATOM 0 HB2 ALA B 427 -2.843 6.052 -4.934 1.00 0.00 H new ATOM 0 HB3 ALA B 427 -1.900 5.870 -6.433 1.00 0.00 H new ATOM 2014 N ALA B 428 -2.113 7.672 -8.564 1.00 0.00 N ATOM 2015 CA ALA B 428 -1.405 8.333 -9.650 1.00 0.00 C ATOM 2016 C ALA B 428 -2.175 9.570 -10.091 1.00 0.00 C ATOM 2017 O ALA B 428 -1.622 10.670 -10.171 1.00 0.00 O ATOM 2018 CB ALA B 428 -1.197 7.391 -10.826 1.00 0.00 C ATOM 0 H ALA B 428 -2.285 6.677 -8.711 1.00 0.00 H new ATOM 0 HA ALA B 428 -0.422 8.633 -9.286 1.00 0.00 H new ATOM 0 HB1 ALA B 428 -0.666 7.914 -11.621 1.00 0.00 H new ATOM 0 HB2 ALA B 428 -0.612 6.530 -10.503 1.00 0.00 H new ATOM 0 HB3 ALA B 428 -2.165 7.053 -11.197 1.00 0.00 H new ATOM 2024 N GLU B 429 -3.465 9.385 -10.356 1.00 0.00 N ATOM 2025 CA GLU B 429 -4.318 10.492 -10.767 1.00 0.00 C ATOM 2026 C GLU B 429 -4.266 11.602 -9.723 1.00 0.00 C ATOM 2027 O GLU B 429 -4.333 12.787 -10.051 1.00 0.00 O ATOM 2028 CB GLU B 429 -5.759 10.017 -10.960 1.00 0.00 C ATOM 2029 CG GLU B 429 -5.920 8.992 -12.070 1.00 0.00 C ATOM 2030 CD GLU B 429 -7.369 8.780 -12.460 1.00 0.00 C ATOM 2031 OE1 GLU B 429 -8.152 8.315 -11.604 1.00 0.00 O ATOM 2032 OE2 GLU B 429 -7.722 9.078 -13.620 1.00 0.00 O ATOM 0 H GLU B 429 -3.939 8.484 -10.294 1.00 0.00 H new ATOM 0 HA GLU B 429 -3.953 10.880 -11.718 1.00 0.00 H new ATOM 0 HB2 GLU B 429 -6.119 9.587 -10.025 1.00 0.00 H new ATOM 0 HB3 GLU B 429 -6.390 10.878 -11.178 1.00 0.00 H new ATOM 0 HG2 GLU B 429 -5.356 9.317 -12.944 1.00 0.00 H new ATOM 0 HG3 GLU B 429 -5.491 8.043 -11.748 1.00 0.00 H new ATOM 2039 N ASN B 430 -4.136 11.203 -8.461 1.00 0.00 N ATOM 2040 CA ASN B 430 -4.059 12.157 -7.365 1.00 0.00 C ATOM 2041 C ASN B 430 -2.858 13.082 -7.546 1.00 0.00 C ATOM 2042 O ASN B 430 -2.949 14.286 -7.305 1.00 0.00 O ATOM 2043 CB ASN B 430 -3.964 11.419 -6.027 1.00 0.00 C ATOM 2044 CG ASN B 430 -5.182 11.650 -5.157 1.00 0.00 C ATOM 2045 OD1 ASN B 430 -5.098 12.281 -4.104 1.00 0.00 O ATOM 2046 ND2 ASN B 430 -6.325 11.138 -5.597 1.00 0.00 N ATOM 0 H ASN B 430 -4.082 10.226 -8.175 1.00 0.00 H new ATOM 0 HA ASN B 430 -4.965 12.763 -7.367 1.00 0.00 H new ATOM 0 HB2 ASN B 430 -3.849 10.351 -6.211 1.00 0.00 H new ATOM 0 HB3 ASN B 430 -3.072 11.749 -5.495 1.00 0.00 H new ATOM 0 HD21 ASN B 430 -7.181 11.261 -5.056 1.00 0.00 H new ATOM 0 HD22 ASN B 430 -6.348 10.622 -6.476 1.00 0.00 H new ATOM 2053 N ALA B 431 -1.731 12.514 -7.975 1.00 0.00 N ATOM 2054 CA ALA B 431 -0.521 13.296 -8.188 1.00 0.00 C ATOM 2055 C ALA B 431 -0.737 14.309 -9.300 1.00 0.00 C ATOM 2056 O ALA B 431 -0.335 15.467 -9.195 1.00 0.00 O ATOM 2057 CB ALA B 431 0.663 12.396 -8.514 1.00 0.00 C ATOM 0 H ALA B 431 -1.634 11.520 -8.180 1.00 0.00 H new ATOM 0 HA ALA B 431 -0.295 13.829 -7.264 1.00 0.00 H new ATOM 0 HB1 ALA B 431 1.553 13.007 -8.668 1.00 0.00 H new ATOM 0 HB2 ALA B 431 0.835 11.707 -7.687 1.00 0.00 H new ATOM 0 HB3 ALA B 431 0.450 11.829 -9.421 1.00 0.00 H new ATOM 2063 N LEU B 432 -1.391 13.859 -10.363 1.00 0.00 N ATOM 2064 CA LEU B 432 -1.683 14.721 -11.499 1.00 0.00 C ATOM 2065 C LEU B 432 -2.959 15.520 -11.249 1.00 0.00 C ATOM 2066 O LEU B 432 -3.454 16.209 -12.140 1.00 0.00 O ATOM 2067 CB LEU B 432 -1.822 13.898 -12.781 1.00 0.00 C ATOM 2068 CG LEU B 432 -2.592 12.586 -12.636 1.00 0.00 C ATOM 2069 CD1 LEU B 432 -3.747 12.531 -13.623 1.00 0.00 C ATOM 2070 CD2 LEU B 432 -1.662 11.401 -12.840 1.00 0.00 C ATOM 0 H LEU B 432 -1.729 12.902 -10.462 1.00 0.00 H new ATOM 0 HA LEU B 432 -0.852 15.415 -11.621 1.00 0.00 H new ATOM 0 HB2 LEU B 432 -2.319 14.510 -13.534 1.00 0.00 H new ATOM 0 HB3 LEU B 432 -0.825 13.675 -13.159 1.00 0.00 H new ATOM 0 HG LEU B 432 -3.001 12.537 -11.627 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -4.283 11.589 -13.504 1.00 0.00 H new ATOM 0 HD12 LEU B 432 -4.427 13.362 -13.434 1.00 0.00 H new ATOM 0 HD13 LEU B 432 -3.361 12.603 -14.640 1.00 0.00 H new ATOM 0 HD21 LEU B 432 -2.225 10.474 -12.734 1.00 0.00 H new ATOM 0 HD22 LEU B 432 -1.226 11.448 -13.838 1.00 0.00 H new ATOM 0 HD23 LEU B 432 -0.867 11.430 -12.095 1.00 0.00 H new ATOM 2082 N ARG B 433 -3.490 15.418 -10.030 1.00 0.00 N ATOM 2083 CA ARG B 433 -4.710 16.131 -9.667 1.00 0.00 C ATOM 2084 C ARG B 433 -4.386 17.456 -8.991 1.00 0.00 C ATOM 2085 O ARG B 433 -5.248 18.083 -8.376 1.00 0.00 O ATOM 2086 CB ARG B 433 -5.571 15.272 -8.745 1.00 0.00 C ATOM 2087 CG ARG B 433 -6.795 14.702 -9.432 1.00 0.00 C ATOM 2088 CD ARG B 433 -7.854 14.274 -8.428 1.00 0.00 C ATOM 2089 NE ARG B 433 -9.017 13.678 -9.080 1.00 0.00 N ATOM 2090 CZ ARG B 433 -10.148 13.385 -8.445 1.00 0.00 C ATOM 2091 NH1 ARG B 433 -10.269 13.642 -7.149 1.00 0.00 N ATOM 2092 NH2 ARG B 433 -11.158 12.836 -9.104 1.00 0.00 N ATOM 0 H ARG B 433 -3.094 14.850 -9.281 1.00 0.00 H new ATOM 0 HA ARG B 433 -5.265 16.338 -10.582 1.00 0.00 H new ATOM 0 HB2 ARG B 433 -4.968 14.453 -8.354 1.00 0.00 H new ATOM 0 HB3 ARG B 433 -5.887 15.871 -7.891 1.00 0.00 H new ATOM 0 HG2 ARG B 433 -7.214 15.448 -10.107 1.00 0.00 H new ATOM 0 HG3 ARG B 433 -6.505 13.847 -10.042 1.00 0.00 H new ATOM 0 HD2 ARG B 433 -7.423 13.557 -7.730 1.00 0.00 H new ATOM 0 HD3 ARG B 433 -8.169 15.138 -7.843 1.00 0.00 H new ATOM 0 HE ARG B 433 -8.958 13.475 -10.078 1.00 0.00 H new ATOM 0 HH11 ARG B 433 -9.494 14.065 -6.638 1.00 0.00 H new ATOM 0 HH12 ARG B 433 -11.137 13.417 -6.663 1.00 0.00 H new ATOM 0 HH21 ARG B 433 -11.069 12.637 -10.100 1.00 0.00 H new ATOM 0 HH22 ARG B 433 -12.025 12.612 -8.615 1.00 0.00 H new ATOM 2106 N ASP B 434 -3.134 17.870 -9.110 1.00 0.00 N ATOM 2107 CA ASP B 434 -2.680 19.119 -8.512 1.00 0.00 C ATOM 2108 C ASP B 434 -2.025 20.015 -9.559 1.00 0.00 C ATOM 2109 O ASP B 434 -0.800 20.096 -9.640 1.00 0.00 O ATOM 2110 CB ASP B 434 -1.696 18.832 -7.377 1.00 0.00 C ATOM 2111 CG ASP B 434 -2.334 18.055 -6.242 1.00 0.00 C ATOM 2112 OD1 ASP B 434 -3.370 18.514 -5.717 1.00 0.00 O ATOM 2113 OD2 ASP B 434 -1.797 16.988 -5.880 1.00 0.00 O ATOM 0 H ASP B 434 -2.411 17.359 -9.617 1.00 0.00 H new ATOM 0 HA ASP B 434 -3.548 19.641 -8.108 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -0.849 18.269 -7.768 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -1.303 19.774 -6.993 1.00 0.00 H new ATOM 2118 N LYS B 435 -2.851 20.679 -10.363 1.00 0.00 N ATOM 2119 CA LYS B 435 -2.353 21.564 -11.411 1.00 0.00 C ATOM 2120 C LYS B 435 -1.261 22.485 -10.877 1.00 0.00 C ATOM 2121 O LYS B 435 -0.165 22.547 -11.431 1.00 0.00 O ATOM 2122 CB LYS B 435 -3.499 22.389 -12.001 1.00 0.00 C ATOM 2123 CG LYS B 435 -3.765 23.688 -11.258 1.00 0.00 C ATOM 2124 CD LYS B 435 -4.859 24.499 -11.934 1.00 0.00 C ATOM 2125 CE LYS B 435 -6.236 23.941 -11.619 1.00 0.00 C ATOM 2126 NZ LYS B 435 -7.296 24.978 -11.747 1.00 0.00 N ATOM 0 H LYS B 435 -3.868 20.621 -10.309 1.00 0.00 H new ATOM 0 HA LYS B 435 -1.922 20.945 -12.198 1.00 0.00 H new ATOM 0 HB2 LYS B 435 -3.272 22.617 -13.042 1.00 0.00 H new ATOM 0 HB3 LYS B 435 -4.407 21.787 -11.997 1.00 0.00 H new ATOM 0 HG2 LYS B 435 -4.055 23.469 -10.230 1.00 0.00 H new ATOM 0 HG3 LYS B 435 -2.849 24.277 -11.212 1.00 0.00 H new ATOM 0 HD2 LYS B 435 -4.801 25.537 -11.605 1.00 0.00 H new ATOM 0 HD3 LYS B 435 -4.702 24.497 -13.013 1.00 0.00 H new ATOM 0 HE2 LYS B 435 -6.455 23.112 -12.293 1.00 0.00 H new ATOM 0 HE3 LYS B 435 -6.242 23.538 -10.606 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 -8.221 24.558 -11.524 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 -7.101 25.757 -11.086 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 -7.308 25.344 -12.720 1.00 0.00 H new ATOM 2140 N LYS B 436 -1.565 23.197 -9.796 1.00 0.00 N ATOM 2141 CA LYS B 436 -0.602 24.110 -9.191 1.00 0.00 C ATOM 2142 C LYS B 436 0.689 23.379 -8.845 1.00 0.00 C ATOM 2143 O LYS B 436 1.786 23.902 -9.045 1.00 0.00 O ATOM 2144 CB LYS B 436 -1.195 24.749 -7.936 1.00 0.00 C ATOM 2145 CG LYS B 436 -2.576 25.344 -8.155 1.00 0.00 C ATOM 2146 CD LYS B 436 -2.628 26.805 -7.738 1.00 0.00 C ATOM 2147 CE LYS B 436 -3.640 27.581 -8.564 1.00 0.00 C ATOM 2148 NZ LYS B 436 -4.374 28.586 -7.745 1.00 0.00 N ATOM 0 H LYS B 436 -2.468 23.159 -9.323 1.00 0.00 H new ATOM 0 HA LYS B 436 -0.373 24.894 -9.913 1.00 0.00 H new ATOM 0 HB2 LYS B 436 -1.252 23.998 -7.148 1.00 0.00 H new ATOM 0 HB3 LYS B 436 -0.523 25.531 -7.583 1.00 0.00 H new ATOM 0 HG2 LYS B 436 -2.849 25.255 -9.207 1.00 0.00 H new ATOM 0 HG3 LYS B 436 -3.312 24.776 -7.586 1.00 0.00 H new ATOM 0 HD2 LYS B 436 -2.888 26.875 -6.682 1.00 0.00 H new ATOM 0 HD3 LYS B 436 -1.641 27.253 -7.853 1.00 0.00 H new ATOM 0 HE2 LYS B 436 -3.129 28.085 -9.384 1.00 0.00 H new ATOM 0 HE3 LYS B 436 -4.352 26.887 -9.011 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 -5.054 29.093 -8.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 -4.883 28.103 -6.977 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 -3.698 29.264 -7.339 1.00 0.00 H new ATOM 2162 N MET B 437 0.551 22.160 -8.334 1.00 0.00 N ATOM 2163 CA MET B 437 1.704 21.347 -7.968 1.00 0.00 C ATOM 2164 C MET B 437 2.419 20.850 -9.218 1.00 0.00 C ATOM 2165 O MET B 437 3.641 20.938 -9.328 1.00 0.00 O ATOM 2166 CB MET B 437 1.265 20.159 -7.112 1.00 0.00 C ATOM 2167 CG MET B 437 2.375 19.159 -6.835 1.00 0.00 C ATOM 2168 SD MET B 437 1.818 17.450 -6.990 1.00 0.00 S ATOM 2169 CE MET B 437 2.700 16.939 -8.461 1.00 0.00 C ATOM 0 H MET B 437 -0.350 21.713 -8.164 1.00 0.00 H new ATOM 0 HA MET B 437 2.392 21.964 -7.390 1.00 0.00 H new ATOM 0 HB2 MET B 437 0.878 20.530 -6.163 1.00 0.00 H new ATOM 0 HB3 MET B 437 0.444 19.646 -7.613 1.00 0.00 H new ATOM 0 HG2 MET B 437 3.198 19.334 -7.527 1.00 0.00 H new ATOM 0 HG3 MET B 437 2.764 19.322 -5.830 1.00 0.00 H new ATOM 0 HE1 MET B 437 2.129 16.168 -8.978 1.00 0.00 H new ATOM 0 HE2 MET B 437 2.834 17.796 -9.121 1.00 0.00 H new ATOM 0 HE3 MET B 437 3.675 16.542 -8.181 1.00 0.00 H new ATOM 2179 N LEU B 438 1.642 20.338 -10.166 1.00 0.00 N ATOM 2180 CA LEU B 438 2.196 19.841 -11.417 1.00 0.00 C ATOM 2181 C LEU B 438 2.967 20.948 -12.121 1.00 0.00 C ATOM 2182 O LEU B 438 4.176 20.843 -12.331 1.00 0.00 O ATOM 2183 CB LEU B 438 1.079 19.331 -12.326 1.00 0.00 C ATOM 2184 CG LEU B 438 0.455 18.001 -11.903 1.00 0.00 C ATOM 2185 CD1 LEU B 438 -0.766 17.695 -12.753 1.00 0.00 C ATOM 2186 CD2 LEU B 438 1.474 16.879 -12.010 1.00 0.00 C ATOM 0 H LEU B 438 0.628 20.257 -10.091 1.00 0.00 H new ATOM 0 HA LEU B 438 2.874 19.017 -11.195 1.00 0.00 H new ATOM 0 HB2 LEU B 438 0.294 20.086 -12.369 1.00 0.00 H new ATOM 0 HB3 LEU B 438 1.474 19.224 -13.336 1.00 0.00 H new ATOM 0 HG LEU B 438 0.140 18.081 -10.863 1.00 0.00 H new ATOM 0 HD11 LEU B 438 -1.199 16.745 -12.439 1.00 0.00 H new ATOM 0 HD12 LEU B 438 -1.503 18.488 -12.629 1.00 0.00 H new ATOM 0 HD13 LEU B 438 -0.473 17.632 -13.801 1.00 0.00 H new ATOM 0 HD21 LEU B 438 1.014 15.939 -11.705 1.00 0.00 H new ATOM 0 HD22 LEU B 438 1.818 16.797 -13.041 1.00 0.00 H new ATOM 0 HD23 LEU B 438 2.322 17.095 -11.361 1.00 0.00 H new ATOM 2198 N ASP B 439 2.257 22.015 -12.469 1.00 0.00 N ATOM 2199 CA ASP B 439 2.870 23.155 -13.134 1.00 0.00 C ATOM 2200 C ASP B 439 4.050 23.659 -12.316 1.00 0.00 C ATOM 2201 O ASP B 439 5.047 24.131 -12.863 1.00 0.00 O ATOM 2202 CB ASP B 439 1.846 24.276 -13.328 1.00 0.00 C ATOM 2203 CG ASP B 439 2.362 25.380 -14.228 1.00 0.00 C ATOM 2204 OD1 ASP B 439 3.568 25.366 -14.552 1.00 0.00 O ATOM 2205 OD2 ASP B 439 1.560 26.258 -14.609 1.00 0.00 O ATOM 0 H ASP B 439 1.256 22.113 -12.301 1.00 0.00 H new ATOM 0 HA ASP B 439 3.226 22.838 -14.114 1.00 0.00 H new ATOM 0 HB2 ASP B 439 0.933 23.861 -13.754 1.00 0.00 H new ATOM 0 HB3 ASP B 439 1.582 24.696 -12.357 1.00 0.00 H new ATOM 2210 N PHE B 440 3.930 23.541 -10.998 1.00 0.00 N ATOM 2211 CA PHE B 440 4.990 23.970 -10.099 1.00 0.00 C ATOM 2212 C PHE B 440 6.268 23.203 -10.417 1.00 0.00 C ATOM 2213 O PHE B 440 7.367 23.760 -10.397 1.00 0.00 O ATOM 2214 CB PHE B 440 4.574 23.751 -8.640 1.00 0.00 C ATOM 2215 CG PHE B 440 5.729 23.575 -7.695 1.00 0.00 C ATOM 2216 CD1 PHE B 440 6.419 24.675 -7.210 1.00 0.00 C ATOM 2217 CD2 PHE B 440 6.121 22.310 -7.291 1.00 0.00 C ATOM 2218 CE1 PHE B 440 7.481 24.515 -6.340 1.00 0.00 C ATOM 2219 CE2 PHE B 440 7.182 22.143 -6.421 1.00 0.00 C ATOM 2220 CZ PHE B 440 7.862 23.247 -5.945 1.00 0.00 C ATOM 0 H PHE B 440 3.110 23.152 -10.531 1.00 0.00 H new ATOM 0 HA PHE B 440 5.173 25.035 -10.241 1.00 0.00 H new ATOM 0 HB2 PHE B 440 3.976 24.601 -8.312 1.00 0.00 H new ATOM 0 HB3 PHE B 440 3.934 22.870 -8.584 1.00 0.00 H new ATOM 0 HD1 PHE B 440 6.124 25.668 -7.515 1.00 0.00 H new ATOM 0 HD2 PHE B 440 5.592 21.444 -7.660 1.00 0.00 H new ATOM 0 HE1 PHE B 440 8.012 25.379 -5.970 1.00 0.00 H new ATOM 0 HE2 PHE B 440 7.479 21.151 -6.114 1.00 0.00 H new ATOM 0 HZ PHE B 440 8.691 23.119 -5.265 1.00 0.00 H new ATOM 2230 N TYR B 441 6.107 21.922 -10.734 1.00 0.00 N ATOM 2231 CA TYR B 441 7.235 21.073 -11.081 1.00 0.00 C ATOM 2232 C TYR B 441 7.654 21.323 -12.521 1.00 0.00 C ATOM 2233 O TYR B 441 8.818 21.157 -12.875 1.00 0.00 O ATOM 2234 CB TYR B 441 6.881 19.604 -10.869 1.00 0.00 C ATOM 2235 CG TYR B 441 6.853 19.219 -9.412 1.00 0.00 C ATOM 2236 CD1 TYR B 441 8.027 19.154 -8.675 1.00 0.00 C ATOM 2237 CD2 TYR B 441 5.657 18.936 -8.770 1.00 0.00 C ATOM 2238 CE1 TYR B 441 8.011 18.816 -7.338 1.00 0.00 C ATOM 2239 CE2 TYR B 441 5.630 18.595 -7.432 1.00 0.00 C ATOM 2240 CZ TYR B 441 6.811 18.536 -6.719 1.00 0.00 C ATOM 2241 OH TYR B 441 6.791 18.201 -5.385 1.00 0.00 O ATOM 0 H TYR B 441 5.203 21.451 -10.757 1.00 0.00 H new ATOM 0 HA TYR B 441 8.073 21.318 -10.429 1.00 0.00 H new ATOM 0 HB2 TYR B 441 5.907 19.401 -11.313 1.00 0.00 H new ATOM 0 HB3 TYR B 441 7.606 18.980 -11.392 1.00 0.00 H new ATOM 0 HD1 TYR B 441 8.969 19.372 -9.156 1.00 0.00 H new ATOM 0 HD2 TYR B 441 4.732 18.983 -9.325 1.00 0.00 H new ATOM 0 HE1 TYR B 441 8.934 18.771 -6.779 1.00 0.00 H new ATOM 0 HE2 TYR B 441 4.691 18.376 -6.946 1.00 0.00 H new ATOM 0 HH TYR B 441 5.876 17.973 -5.119 1.00 0.00 H new ATOM 2251 N ALA B 442 6.700 21.755 -13.342 1.00 0.00 N ATOM 2252 CA ALA B 442 6.988 22.066 -14.735 1.00 0.00 C ATOM 2253 C ALA B 442 8.041 23.162 -14.785 1.00 0.00 C ATOM 2254 O ALA B 442 9.086 23.013 -15.422 1.00 0.00 O ATOM 2255 CB ALA B 442 5.728 22.493 -15.475 1.00 0.00 C ATOM 0 H ALA B 442 5.728 21.896 -13.067 1.00 0.00 H new ATOM 0 HA ALA B 442 7.366 21.172 -15.232 1.00 0.00 H new ATOM 0 HB1 ALA B 442 5.974 22.719 -16.513 1.00 0.00 H new ATOM 0 HB2 ALA B 442 4.996 21.686 -15.443 1.00 0.00 H new ATOM 0 HB3 ALA B 442 5.310 23.381 -15.000 1.00 0.00 H new ATOM 2261 N LYS B 443 7.774 24.250 -14.069 1.00 0.00 N ATOM 2262 CA LYS B 443 8.715 25.355 -13.989 1.00 0.00 C ATOM 2263 C LYS B 443 10.016 24.839 -13.397 1.00 0.00 C ATOM 2264 O LYS B 443 11.101 25.089 -13.922 1.00 0.00 O ATOM 2265 CB LYS B 443 8.144 26.479 -13.121 1.00 0.00 C ATOM 2266 CG LYS B 443 9.098 27.645 -12.921 1.00 0.00 C ATOM 2267 CD LYS B 443 9.505 27.786 -11.464 1.00 0.00 C ATOM 2268 CE LYS B 443 10.321 29.048 -11.235 1.00 0.00 C ATOM 2269 NZ LYS B 443 9.453 30.243 -11.047 1.00 0.00 N ATOM 0 H LYS B 443 6.914 24.387 -13.538 1.00 0.00 H new ATOM 0 HA LYS B 443 8.897 25.759 -14.985 1.00 0.00 H new ATOM 0 HB2 LYS B 443 7.226 26.847 -13.578 1.00 0.00 H new ATOM 0 HB3 LYS B 443 7.874 26.071 -12.147 1.00 0.00 H new ATOM 0 HG2 LYS B 443 9.986 27.500 -13.536 1.00 0.00 H new ATOM 0 HG3 LYS B 443 8.624 28.567 -13.259 1.00 0.00 H new ATOM 0 HD2 LYS B 443 8.614 27.808 -10.836 1.00 0.00 H new ATOM 0 HD3 LYS B 443 10.086 26.915 -11.161 1.00 0.00 H new ATOM 0 HE2 LYS B 443 10.954 28.917 -10.357 1.00 0.00 H new ATOM 0 HE3 LYS B 443 10.984 29.211 -12.085 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 10.047 31.083 -10.894 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 8.867 30.383 -11.895 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 8.838 30.099 -10.221 1.00 0.00 H new ATOM 2283 N GLN B 444 9.884 24.088 -12.306 1.00 0.00 N ATOM 2284 CA GLN B 444 11.024 23.492 -11.634 1.00 0.00 C ATOM 2285 C GLN B 444 11.768 22.560 -12.587 1.00 0.00 C ATOM 2286 O GLN B 444 12.918 22.192 -12.346 1.00 0.00 O ATOM 2287 CB GLN B 444 10.544 22.717 -10.405 1.00 0.00 C ATOM 2288 CG GLN B 444 10.769 23.456 -9.101 1.00 0.00 C ATOM 2289 CD GLN B 444 11.827 22.793 -8.246 1.00 0.00 C ATOM 2290 OE1 GLN B 444 11.787 22.861 -7.017 1.00 0.00 O ATOM 2291 NE2 GLN B 444 12.785 22.146 -8.899 1.00 0.00 N ATOM 0 H GLN B 444 8.986 23.879 -11.869 1.00 0.00 H new ATOM 0 HA GLN B 444 11.707 24.280 -11.317 1.00 0.00 H new ATOM 0 HB2 GLN B 444 9.481 22.502 -10.513 1.00 0.00 H new ATOM 0 HB3 GLN B 444 11.061 21.758 -10.365 1.00 0.00 H new ATOM 0 HG2 GLN B 444 11.066 24.483 -9.313 1.00 0.00 H new ATOM 0 HG3 GLN B 444 9.832 23.504 -8.546 1.00 0.00 H new ATOM 0 HE21 GLN B 444 12.777 22.116 -9.919 1.00 0.00 H new ATOM 0 HE22 GLN B 444 13.529 21.678 -8.381 1.00 0.00 H new ATOM 2300 N ARG B 445 11.094 22.184 -13.672 1.00 0.00 N ATOM 2301 CA ARG B 445 11.674 21.297 -14.673 1.00 0.00 C ATOM 2302 C ARG B 445 12.618 22.070 -15.581 1.00 0.00 C ATOM 2303 O ARG B 445 13.750 21.653 -15.819 1.00 0.00 O ATOM 2304 CB ARG B 445 10.567 20.641 -15.502 1.00 0.00 C ATOM 2305 CG ARG B 445 10.742 19.142 -15.677 1.00 0.00 C ATOM 2306 CD ARG B 445 11.980 18.819 -16.500 1.00 0.00 C ATOM 2307 NE ARG B 445 11.640 18.360 -17.845 1.00 0.00 N ATOM 2308 CZ ARG B 445 11.520 19.167 -18.896 1.00 0.00 C ATOM 2309 NH1 ARG B 445 11.700 20.474 -18.761 1.00 0.00 N ATOM 2310 NH2 ARG B 445 11.213 18.665 -20.085 1.00 0.00 N ATOM 0 H ARG B 445 10.141 22.483 -13.879 1.00 0.00 H new ATOM 0 HA ARG B 445 12.240 20.518 -14.162 1.00 0.00 H new ATOM 0 HB2 ARG B 445 9.606 20.832 -15.025 1.00 0.00 H new ATOM 0 HB3 ARG B 445 10.534 21.111 -16.485 1.00 0.00 H new ATOM 0 HG2 ARG B 445 10.819 18.667 -14.699 1.00 0.00 H new ATOM 0 HG3 ARG B 445 9.860 18.726 -16.165 1.00 0.00 H new ATOM 0 HD2 ARG B 445 12.611 19.705 -16.568 1.00 0.00 H new ATOM 0 HD3 ARG B 445 12.563 18.051 -15.992 1.00 0.00 H new ATOM 0 HE ARG B 445 11.486 17.362 -17.987 1.00 0.00 H new ATOM 0 HH11 ARG B 445 11.932 20.865 -17.848 1.00 0.00 H new ATOM 0 HH12 ARG B 445 11.607 21.088 -19.570 1.00 0.00 H new ATOM 0 HH21 ARG B 445 11.069 17.661 -20.193 1.00 0.00 H new ATOM 0 HH22 ARG B 445 11.121 19.283 -20.891 1.00 0.00 H new