USER MOD reduce.3.24.130724 H: found=0, std=0, add=642, rem=0, adj=15 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 387 TYR OH : rot -20:sc= -3.29! USER MOD Set 1.2: B 404 CYS SG : rot 97:sc= -4.86! USER MOD Set 2.1: B 368 MET CE :methyl 171:sc= -4.96! (180deg=-2.56) USER MOD Set 2.2: B 369 ASN : amide:sc= -3! C(o=-8!,f=-13!) USER MOD Single : B 371 LYS NZ :NH3+ -138:sc= -0.733 (180deg=-1.6) USER MOD Single : B 373 GLN : amide:sc= -14.1! C(o=-14!,f=-10!) 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 180:sc= 0 USER MOD Single : B 382 SER OG : rot -55:sc= 0.689 USER MOD Single : B 386 HIS : no HD1:sc= -0.488 X(o=-0.49,f=-0.055) 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 -170:sc= 0.232 USER MOD Single : B 399 ASN : amide:sc= -0.467 K(o=-0.47,f=-2.2!) USER MOD Single : B 400 SER OG : rot 180:sc= -0.0432 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 180:sc= -0.0167 USER MOD Single : B 419 ASN : amide:sc= -3.49 K(o=-3.5,f=-9.8!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -2.91 K(o=-2.9,f=-14!) USER MOD Single : B 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 437 MET CE :methyl -152:sc= -5.56! (180deg=-11.8!) USER MOD Single : B 441 TYR OH : rot 130:sc= -0.34 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN : amide:sc= -1.25 K(o=-1.3,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1069 N ASP B 367 -5.088 4.551 -15.432 1.00 0.00 N ATOM 1070 CA ASP B 367 -3.712 4.272 -15.043 1.00 0.00 C ATOM 1071 C ASP B 367 -2.746 4.787 -16.099 1.00 0.00 C ATOM 1072 O ASP B 367 -1.989 5.726 -15.854 1.00 0.00 O ATOM 1073 CB ASP B 367 -3.510 2.770 -14.834 1.00 0.00 C ATOM 1074 CG ASP B 367 -2.543 2.467 -13.707 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -2.078 3.423 -13.050 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -2.249 1.274 -13.481 1.00 0.00 O ATOM 0 HA ASP B 367 -3.510 4.787 -14.104 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -4.471 2.304 -14.619 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -3.139 2.324 -15.757 1.00 0.00 H new ATOM 1081 N MET B 368 -2.774 4.158 -17.268 1.00 0.00 N ATOM 1082 CA MET B 368 -1.900 4.546 -18.369 1.00 0.00 C ATOM 1083 C MET B 368 -1.654 6.051 -18.358 1.00 0.00 C ATOM 1084 O MET B 368 -0.506 6.501 -18.371 1.00 0.00 O ATOM 1085 CB MET B 368 -2.507 4.130 -19.709 1.00 0.00 C ATOM 1086 CG MET B 368 -1.632 4.475 -20.902 1.00 0.00 C ATOM 1087 SD MET B 368 -2.534 5.343 -22.200 1.00 0.00 S ATOM 1088 CE MET B 368 -3.102 6.791 -21.311 1.00 0.00 C ATOM 0 H MET B 368 -3.394 3.376 -17.478 1.00 0.00 H new ATOM 0 HA MET B 368 -0.947 4.034 -18.238 1.00 0.00 H new ATOM 0 HB2 MET B 368 -2.688 3.055 -19.699 1.00 0.00 H new ATOM 0 HB3 MET B 368 -3.476 4.615 -19.826 1.00 0.00 H new ATOM 0 HG2 MET B 368 -0.798 5.093 -20.569 1.00 0.00 H new ATOM 0 HG3 MET B 368 -1.206 3.559 -21.312 1.00 0.00 H new ATOM 0 HE1 MET B 368 -3.538 7.502 -22.013 1.00 0.00 H new ATOM 0 HE2 MET B 368 -3.854 6.497 -20.579 1.00 0.00 H new ATOM 0 HE3 MET B 368 -2.260 7.257 -20.799 1.00 0.00 H new ATOM 1098 N ASN B 369 -2.737 6.826 -18.322 1.00 0.00 N ATOM 1099 CA ASN B 369 -2.626 8.280 -18.300 1.00 0.00 C ATOM 1100 C ASN B 369 -1.847 8.735 -17.071 1.00 0.00 C ATOM 1101 O ASN B 369 -0.991 9.615 -17.156 1.00 0.00 O ATOM 1102 CB ASN B 369 -4.013 8.927 -18.308 1.00 0.00 C ATOM 1103 CG ASN B 369 -4.618 8.979 -19.699 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -3.927 9.259 -20.678 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -5.915 8.714 -19.789 1.00 0.00 N ATOM 0 H ASN B 369 -3.694 6.473 -18.308 1.00 0.00 H new ATOM 0 HA ASN B 369 -2.089 8.594 -19.195 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -4.676 8.368 -17.647 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -3.942 9.938 -17.907 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -6.379 8.738 -20.697 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -6.448 8.487 -18.950 1.00 0.00 H new ATOM 1112 N ALA B 370 -2.144 8.120 -15.931 1.00 0.00 N ATOM 1113 CA ALA B 370 -1.468 8.452 -14.686 1.00 0.00 C ATOM 1114 C ALA B 370 0.026 8.177 -14.792 1.00 0.00 C ATOM 1115 O ALA B 370 0.820 9.100 -14.975 1.00 0.00 O ATOM 1116 CB ALA B 370 -2.064 7.680 -13.519 1.00 0.00 C ATOM 0 H ALA B 370 -2.850 7.388 -15.845 1.00 0.00 H new ATOM 0 HA ALA B 370 -1.613 9.517 -14.503 1.00 0.00 H new ATOM 0 HB1 ALA B 370 -1.540 7.947 -12.601 1.00 0.00 H new ATOM 0 HB2 ALA B 370 -3.121 7.929 -13.420 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -1.959 6.610 -13.699 1.00 0.00 H new ATOM 1122 N LYS B 371 0.405 6.902 -14.665 1.00 0.00 N ATOM 1123 CA LYS B 371 1.813 6.508 -14.739 1.00 0.00 C ATOM 1124 C LYS B 371 2.582 7.421 -15.685 1.00 0.00 C ATOM 1125 O LYS B 371 3.683 7.876 -15.369 1.00 0.00 O ATOM 1126 CB LYS B 371 1.952 5.050 -15.191 1.00 0.00 C ATOM 1127 CG LYS B 371 0.879 4.595 -16.170 1.00 0.00 C ATOM 1128 CD LYS B 371 0.411 3.181 -15.859 1.00 0.00 C ATOM 1129 CE LYS B 371 0.427 2.295 -17.097 1.00 0.00 C ATOM 1130 NZ LYS B 371 -0.873 1.596 -17.293 1.00 0.00 N ATOM 0 H LYS B 371 -0.242 6.128 -14.511 1.00 0.00 H new ATOM 0 HA LYS B 371 2.236 6.603 -13.739 1.00 0.00 H new ATOM 0 HB2 LYS B 371 2.930 4.916 -15.653 1.00 0.00 H new ATOM 0 HB3 LYS B 371 1.924 4.405 -14.313 1.00 0.00 H new ATOM 0 HG2 LYS B 371 0.031 5.279 -16.127 1.00 0.00 H new ATOM 0 HG3 LYS B 371 1.270 4.636 -17.187 1.00 0.00 H new ATOM 0 HD2 LYS B 371 1.053 2.746 -15.093 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -0.598 3.214 -15.449 1.00 0.00 H new ATOM 0 HE2 LYS B 371 0.650 2.901 -17.975 1.00 0.00 H new ATOM 0 HE3 LYS B 371 1.226 1.559 -17.007 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -0.698 0.611 -17.576 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -1.412 1.611 -16.404 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -1.418 2.078 -18.036 1.00 0.00 H new ATOM 1144 N ARG B 372 1.990 7.694 -16.842 1.00 0.00 N ATOM 1145 CA ARG B 372 2.619 8.563 -17.825 1.00 0.00 C ATOM 1146 C ARG B 372 2.887 9.938 -17.223 1.00 0.00 C ATOM 1147 O ARG B 372 4.028 10.391 -17.166 1.00 0.00 O ATOM 1148 CB ARG B 372 1.735 8.694 -19.068 1.00 0.00 C ATOM 1149 CG ARG B 372 2.520 8.936 -20.349 1.00 0.00 C ATOM 1150 CD ARG B 372 2.798 10.417 -20.558 1.00 0.00 C ATOM 1151 NE ARG B 372 2.098 10.950 -21.725 1.00 0.00 N ATOM 1152 CZ ARG B 372 1.731 12.222 -21.846 1.00 0.00 C ATOM 1153 NH1 ARG B 372 1.987 13.085 -20.871 1.00 0.00 N ATOM 1154 NH2 ARG B 372 1.107 12.632 -22.942 1.00 0.00 N ATOM 0 H ARG B 372 1.080 7.327 -17.120 1.00 0.00 H new ATOM 0 HA ARG B 372 3.570 8.118 -18.120 1.00 0.00 H new ATOM 0 HB2 ARG B 372 1.143 7.786 -19.180 1.00 0.00 H new ATOM 0 HB3 ARG B 372 1.034 9.515 -18.920 1.00 0.00 H new ATOM 0 HG2 ARG B 372 3.462 8.389 -20.309 1.00 0.00 H new ATOM 0 HG3 ARG B 372 1.961 8.546 -21.199 1.00 0.00 H new ATOM 0 HD2 ARG B 372 2.494 10.971 -19.670 1.00 0.00 H new ATOM 0 HD3 ARG B 372 3.870 10.570 -20.678 1.00 0.00 H new ATOM 0 HE ARG B 372 1.879 10.311 -22.489 1.00 0.00 H new ATOM 0 HH11 ARG B 372 2.466 12.773 -20.026 1.00 0.00 H new ATOM 0 HH12 ARG B 372 1.704 14.060 -20.966 1.00 0.00 H new ATOM 0 HH21 ARG B 372 0.908 11.971 -23.693 1.00 0.00 H new ATOM 0 HH22 ARG B 372 0.826 13.608 -23.034 1.00 0.00 H new ATOM 1168 N GLN B 373 1.831 10.600 -16.767 1.00 0.00 N ATOM 1169 CA GLN B 373 1.970 11.920 -16.168 1.00 0.00 C ATOM 1170 C GLN B 373 3.106 11.941 -15.151 1.00 0.00 C ATOM 1171 O GLN B 373 4.026 12.756 -15.235 1.00 0.00 O ATOM 1172 CB GLN B 373 0.661 12.346 -15.491 1.00 0.00 C ATOM 1173 CG GLN B 373 0.330 13.815 -15.705 1.00 0.00 C ATOM 1174 CD GLN B 373 1.383 14.749 -15.132 1.00 0.00 C ATOM 1175 OE1 GLN B 373 1.579 15.857 -15.633 1.00 0.00 O ATOM 1176 NE2 GLN B 373 2.066 14.311 -14.079 1.00 0.00 N ATOM 0 H GLN B 373 0.875 10.247 -16.800 1.00 0.00 H new ATOM 0 HA GLN B 373 2.203 12.624 -16.966 1.00 0.00 H new ATOM 0 HB2 GLN B 373 -0.156 11.736 -15.876 1.00 0.00 H new ATOM 0 HB3 GLN B 373 0.730 12.147 -14.422 1.00 0.00 H new ATOM 0 HG2 GLN B 373 0.224 14.006 -16.773 1.00 0.00 H new ATOM 0 HG3 GLN B 373 -0.633 14.036 -15.245 1.00 0.00 H new ATOM 0 HE21 GLN B 373 1.873 13.386 -13.694 1.00 0.00 H new ATOM 0 HE22 GLN B 373 2.783 14.900 -13.656 1.00 0.00 H new ATOM 1185 N LEU B 374 3.009 11.045 -14.181 1.00 0.00 N ATOM 1186 CA LEU B 374 3.986 10.934 -13.102 1.00 0.00 C ATOM 1187 C LEU B 374 5.438 10.960 -13.574 1.00 0.00 C ATOM 1188 O LEU B 374 6.172 11.904 -13.280 1.00 0.00 O ATOM 1189 CB LEU B 374 3.733 9.648 -12.317 1.00 0.00 C ATOM 1190 CG LEU B 374 2.259 9.316 -12.088 1.00 0.00 C ATOM 1191 CD1 LEU B 374 2.097 8.432 -10.861 1.00 0.00 C ATOM 1192 CD2 LEU B 374 1.444 10.594 -11.946 1.00 0.00 C ATOM 0 H LEU B 374 2.247 10.370 -14.117 1.00 0.00 H new ATOM 0 HA LEU B 374 3.850 11.814 -12.474 1.00 0.00 H new ATOM 0 HB2 LEU B 374 4.200 8.818 -12.847 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.228 9.727 -11.349 1.00 0.00 H new ATOM 0 HG LEU B 374 1.887 8.768 -12.953 1.00 0.00 H new ATOM 0 HD11 LEU B 374 1.041 8.205 -10.713 1.00 0.00 H new ATOM 0 HD12 LEU B 374 2.651 7.504 -11.005 1.00 0.00 H new ATOM 0 HD13 LEU B 374 2.483 8.952 -9.984 1.00 0.00 H new ATOM 0 HD21 LEU B 374 0.396 10.341 -11.783 1.00 0.00 H new ATOM 0 HD22 LEU B 374 1.814 11.169 -11.098 1.00 0.00 H new ATOM 0 HD23 LEU B 374 1.537 11.188 -12.855 1.00 0.00 H new ATOM 1204 N TYR B 375 5.873 9.902 -14.250 1.00 0.00 N ATOM 1205 CA TYR B 375 7.265 9.806 -14.682 1.00 0.00 C ATOM 1206 C TYR B 375 7.520 10.402 -16.060 1.00 0.00 C ATOM 1207 O TYR B 375 8.503 11.117 -16.251 1.00 0.00 O ATOM 1208 CB TYR B 375 7.718 8.348 -14.659 1.00 0.00 C ATOM 1209 CG TYR B 375 8.301 7.925 -13.332 1.00 0.00 C ATOM 1210 CD1 TYR B 375 7.796 8.433 -12.142 1.00 0.00 C ATOM 1211 CD2 TYR B 375 9.356 7.026 -13.267 1.00 0.00 C ATOM 1212 CE1 TYR B 375 8.326 8.055 -10.924 1.00 0.00 C ATOM 1213 CE2 TYR B 375 9.893 6.643 -12.053 1.00 0.00 C ATOM 1214 CZ TYR B 375 9.374 7.160 -10.885 1.00 0.00 C ATOM 1215 OH TYR B 375 9.906 6.783 -9.673 1.00 0.00 O ATOM 0 H TYR B 375 5.290 9.106 -14.509 1.00 0.00 H new ATOM 0 HA TYR B 375 7.847 10.398 -13.975 1.00 0.00 H new ATOM 0 HB2 TYR B 375 6.869 7.707 -14.896 1.00 0.00 H new ATOM 0 HB3 TYR B 375 8.462 8.193 -15.441 1.00 0.00 H new ATOM 0 HD1 TYR B 375 6.976 9.135 -12.170 1.00 0.00 H new ATOM 0 HD2 TYR B 375 9.764 6.619 -14.180 1.00 0.00 H new ATOM 0 HE1 TYR B 375 7.922 8.458 -10.007 1.00 0.00 H new ATOM 0 HE2 TYR B 375 10.715 5.943 -12.019 1.00 0.00 H new ATOM 0 HH TYR B 375 10.636 6.146 -9.820 1.00 0.00 H new ATOM 1225 N SER B 376 6.662 10.104 -17.025 1.00 0.00 N ATOM 1226 CA SER B 376 6.845 10.617 -18.377 1.00 0.00 C ATOM 1227 C SER B 376 6.657 12.129 -18.438 1.00 0.00 C ATOM 1228 O SER B 376 7.126 12.777 -19.372 1.00 0.00 O ATOM 1229 CB SER B 376 5.876 9.928 -19.337 1.00 0.00 C ATOM 1230 OG SER B 376 6.084 8.527 -19.353 1.00 0.00 O ATOM 0 H SER B 376 5.839 9.515 -16.900 1.00 0.00 H new ATOM 0 HA SER B 376 7.869 10.398 -18.678 1.00 0.00 H new ATOM 0 HB2 SER B 376 4.850 10.143 -19.039 1.00 0.00 H new ATOM 0 HB3 SER B 376 6.007 10.330 -20.342 1.00 0.00 H new ATOM 0 HG SER B 376 5.700 8.149 -20.171 1.00 0.00 H new ATOM 1236 N LEU B 377 5.969 12.694 -17.451 1.00 0.00 N ATOM 1237 CA LEU B 377 5.736 14.121 -17.425 1.00 0.00 C ATOM 1238 C LEU B 377 6.517 14.776 -16.297 1.00 0.00 C ATOM 1239 O LEU B 377 7.066 15.864 -16.464 1.00 0.00 O ATOM 1240 CB LEU B 377 4.248 14.403 -17.273 1.00 0.00 C ATOM 1241 CG LEU B 377 3.683 15.376 -18.299 1.00 0.00 C ATOM 1242 CD1 LEU B 377 4.153 15.006 -19.697 1.00 0.00 C ATOM 1243 CD2 LEU B 377 2.164 15.409 -18.232 1.00 0.00 C ATOM 0 H LEU B 377 5.567 12.182 -16.665 1.00 0.00 H new ATOM 0 HA LEU B 377 6.082 14.545 -18.367 1.00 0.00 H new ATOM 0 HB2 LEU B 377 3.703 13.462 -17.345 1.00 0.00 H new ATOM 0 HB3 LEU B 377 4.066 14.801 -16.275 1.00 0.00 H new ATOM 0 HG LEU B 377 4.053 16.374 -18.065 1.00 0.00 H new ATOM 0 HD11 LEU B 377 3.740 15.711 -20.418 1.00 0.00 H new ATOM 0 HD12 LEU B 377 5.242 15.042 -19.736 1.00 0.00 H new ATOM 0 HD13 LEU B 377 3.814 13.999 -19.940 1.00 0.00 H new ATOM 0 HD21 LEU B 377 1.782 16.111 -18.974 1.00 0.00 H new ATOM 0 HD22 LEU B 377 1.769 14.414 -18.437 1.00 0.00 H new ATOM 0 HD23 LEU B 377 1.850 15.726 -17.237 1.00 0.00 H new ATOM 1255 N ILE B 378 6.577 14.107 -15.152 1.00 0.00 N ATOM 1256 CA ILE B 378 7.303 14.620 -14.007 1.00 0.00 C ATOM 1257 C ILE B 378 8.288 13.560 -13.515 1.00 0.00 C ATOM 1258 O ILE B 378 8.763 12.743 -14.302 1.00 0.00 O ATOM 1259 CB ILE B 378 6.331 15.018 -12.873 1.00 0.00 C ATOM 1260 CG1 ILE B 378 5.007 15.502 -13.469 1.00 0.00 C ATOM 1261 CG2 ILE B 378 6.943 16.105 -11.999 1.00 0.00 C ATOM 1262 CD1 ILE B 378 5.102 16.866 -14.120 1.00 0.00 C ATOM 0 H ILE B 378 6.128 13.205 -14.996 1.00 0.00 H new ATOM 0 HA ILE B 378 7.851 15.513 -14.307 1.00 0.00 H new ATOM 0 HB ILE B 378 6.143 14.143 -12.251 1.00 0.00 H new ATOM 0 HG12 ILE B 378 4.664 14.778 -14.208 1.00 0.00 H new ATOM 0 HG13 ILE B 378 4.254 15.535 -12.682 1.00 0.00 H new ATOM 0 HG21 ILE B 378 6.244 16.372 -11.207 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.869 15.738 -11.557 1.00 0.00 H new ATOM 0 HG23 ILE B 378 7.155 16.985 -12.607 1.00 0.00 H new ATOM 0 HD11 ILE B 378 4.128 17.146 -14.521 1.00 0.00 H new ATOM 0 HD12 ILE B 378 5.415 17.602 -13.379 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.832 16.833 -14.929 1.00 0.00 H new ATOM 1274 N GLY B 379 8.601 13.569 -12.226 1.00 0.00 N ATOM 1275 CA GLY B 379 9.533 12.595 -11.686 1.00 0.00 C ATOM 1276 C GLY B 379 10.712 12.347 -12.606 1.00 0.00 C ATOM 1277 O GLY B 379 10.877 11.243 -13.126 1.00 0.00 O ATOM 0 H GLY B 379 8.228 14.231 -11.545 1.00 0.00 H new ATOM 0 HA2 GLY B 379 9.897 12.943 -10.719 1.00 0.00 H new ATOM 0 HA3 GLY B 379 9.010 11.655 -11.510 1.00 0.00 H new ATOM 1281 N TYR B 380 11.532 13.374 -12.812 1.00 0.00 N ATOM 1282 CA TYR B 380 12.697 13.257 -13.684 1.00 0.00 C ATOM 1283 C TYR B 380 13.871 12.605 -12.957 1.00 0.00 C ATOM 1284 O TYR B 380 14.332 11.535 -13.353 1.00 0.00 O ATOM 1285 CB TYR B 380 13.110 14.627 -14.241 1.00 0.00 C ATOM 1286 CG TYR B 380 13.024 15.764 -13.244 1.00 0.00 C ATOM 1287 CD1 TYR B 380 11.817 16.403 -12.990 1.00 0.00 C ATOM 1288 CD2 TYR B 380 14.154 16.208 -12.567 1.00 0.00 C ATOM 1289 CE1 TYR B 380 11.736 17.446 -12.089 1.00 0.00 C ATOM 1290 CE2 TYR B 380 14.082 17.251 -11.664 1.00 0.00 C ATOM 1291 CZ TYR B 380 12.871 17.867 -11.429 1.00 0.00 C ATOM 1292 OH TYR B 380 12.796 18.908 -10.533 1.00 0.00 O ATOM 0 H TYR B 380 11.412 14.294 -12.388 1.00 0.00 H new ATOM 0 HA TYR B 380 12.415 12.616 -14.519 1.00 0.00 H new ATOM 0 HB2 TYR B 380 14.134 14.561 -14.610 1.00 0.00 H new ATOM 0 HB3 TYR B 380 12.477 14.863 -15.097 1.00 0.00 H new ATOM 0 HD1 TYR B 380 10.926 16.078 -13.507 1.00 0.00 H new ATOM 0 HD2 TYR B 380 15.105 15.729 -12.750 1.00 0.00 H new ATOM 0 HE1 TYR B 380 10.789 17.930 -11.902 1.00 0.00 H new ATOM 0 HE2 TYR B 380 14.969 17.582 -11.145 1.00 0.00 H new ATOM 0 HH TYR B 380 13.684 19.079 -10.155 1.00 0.00 H new ATOM 1302 N ALA B 381 14.349 13.245 -11.893 1.00 0.00 N ATOM 1303 CA ALA B 381 15.466 12.703 -11.127 1.00 0.00 C ATOM 1304 C ALA B 381 16.151 13.778 -10.290 1.00 0.00 C ATOM 1305 O ALA B 381 17.279 14.174 -10.584 1.00 0.00 O ATOM 1306 CB ALA B 381 16.478 12.033 -12.044 1.00 0.00 C ATOM 0 H ALA B 381 13.984 14.131 -11.545 1.00 0.00 H new ATOM 0 HA ALA B 381 15.056 11.956 -10.447 1.00 0.00 H new ATOM 0 HB1 ALA B 381 17.301 11.637 -11.450 1.00 0.00 H new ATOM 0 HB2 ALA B 381 15.996 11.218 -12.584 1.00 0.00 H new ATOM 0 HB3 ALA B 381 16.863 12.763 -12.756 1.00 0.00 H new ATOM 1312 N SER B 382 15.471 14.230 -9.237 1.00 0.00 N ATOM 1313 CA SER B 382 16.028 15.251 -8.341 1.00 0.00 C ATOM 1314 C SER B 382 14.946 16.038 -7.585 1.00 0.00 C ATOM 1315 O SER B 382 15.201 17.151 -7.128 1.00 0.00 O ATOM 1316 CB SER B 382 16.905 16.228 -9.128 1.00 0.00 C ATOM 1317 OG SER B 382 17.139 17.414 -8.389 1.00 0.00 O ATOM 0 H SER B 382 14.537 13.909 -8.981 1.00 0.00 H new ATOM 0 HA SER B 382 16.625 14.719 -7.601 1.00 0.00 H new ATOM 0 HB2 SER B 382 17.856 15.753 -9.370 1.00 0.00 H new ATOM 0 HB3 SER B 382 16.422 16.475 -10.073 1.00 0.00 H new ATOM 0 HG SER B 382 16.282 17.806 -8.120 1.00 0.00 H new ATOM 1323 N LEU B 383 13.747 15.476 -7.449 1.00 0.00 N ATOM 1324 CA LEU B 383 12.668 16.161 -6.745 1.00 0.00 C ATOM 1325 C LEU B 383 12.240 15.378 -5.510 1.00 0.00 C ATOM 1326 O LEU B 383 11.733 15.949 -4.545 1.00 0.00 O ATOM 1327 CB LEU B 383 11.467 16.366 -7.672 1.00 0.00 C ATOM 1328 CG LEU B 383 10.965 15.102 -8.374 1.00 0.00 C ATOM 1329 CD1 LEU B 383 9.504 15.254 -8.769 1.00 0.00 C ATOM 1330 CD2 LEU B 383 11.821 14.797 -9.594 1.00 0.00 C ATOM 0 H LEU B 383 13.500 14.556 -7.814 1.00 0.00 H new ATOM 0 HA LEU B 383 13.041 17.134 -6.427 1.00 0.00 H new ATOM 0 HB2 LEU B 383 10.648 16.790 -7.091 1.00 0.00 H new ATOM 0 HB3 LEU B 383 11.734 17.102 -8.430 1.00 0.00 H new ATOM 0 HG LEU B 383 11.045 14.266 -7.679 1.00 0.00 H new ATOM 0 HD11 LEU B 383 9.165 14.345 -9.267 1.00 0.00 H new ATOM 0 HD12 LEU B 383 8.902 15.425 -7.877 1.00 0.00 H new ATOM 0 HD13 LEU B 383 9.397 16.101 -9.447 1.00 0.00 H new ATOM 0 HD21 LEU B 383 11.451 13.895 -10.082 1.00 0.00 H new ATOM 0 HD22 LEU B 383 11.772 15.633 -10.291 1.00 0.00 H new ATOM 0 HD23 LEU B 383 12.855 14.644 -9.284 1.00 0.00 H new ATOM 1342 N ARG B 384 12.451 14.067 -5.549 1.00 0.00 N ATOM 1343 CA ARG B 384 12.094 13.192 -4.437 1.00 0.00 C ATOM 1344 C ARG B 384 10.603 12.871 -4.433 1.00 0.00 C ATOM 1345 O ARG B 384 9.942 12.968 -3.399 1.00 0.00 O ATOM 1346 CB ARG B 384 12.490 13.825 -3.101 1.00 0.00 C ATOM 1347 CG ARG B 384 12.390 12.867 -1.925 1.00 0.00 C ATOM 1348 CD ARG B 384 13.655 12.041 -1.769 1.00 0.00 C ATOM 1349 NE ARG B 384 14.573 12.629 -0.799 1.00 0.00 N ATOM 1350 CZ ARG B 384 15.778 12.137 -0.533 1.00 0.00 C ATOM 1351 NH1 ARG B 384 16.208 11.051 -1.161 1.00 0.00 N ATOM 1352 NH2 ARG B 384 16.555 12.731 0.362 1.00 0.00 N ATOM 0 H ARG B 384 12.870 13.584 -6.344 1.00 0.00 H new ATOM 0 HA ARG B 384 12.644 12.260 -4.569 1.00 0.00 H new ATOM 0 HB2 ARG B 384 13.513 14.196 -3.172 1.00 0.00 H new ATOM 0 HB3 ARG B 384 11.851 14.688 -2.913 1.00 0.00 H new ATOM 0 HG2 ARG B 384 12.207 13.431 -1.010 1.00 0.00 H new ATOM 0 HG3 ARG B 384 11.537 12.204 -2.066 1.00 0.00 H new ATOM 0 HD2 ARG B 384 13.392 11.031 -1.454 1.00 0.00 H new ATOM 0 HD3 ARG B 384 14.153 11.955 -2.734 1.00 0.00 H new ATOM 0 HE ARG B 384 14.273 13.465 -0.297 1.00 0.00 H new ATOM 0 HH11 ARG B 384 15.613 10.591 -1.850 1.00 0.00 H new ATOM 0 HH12 ARG B 384 17.134 10.675 -0.955 1.00 0.00 H new ATOM 0 HH21 ARG B 384 16.228 13.566 0.847 1.00 0.00 H new ATOM 0 HH22 ARG B 384 17.480 12.352 0.566 1.00 0.00 H new ATOM 1366 N LEU B 385 10.080 12.471 -5.588 1.00 0.00 N ATOM 1367 CA LEU B 385 8.672 12.116 -5.704 1.00 0.00 C ATOM 1368 C LEU B 385 8.470 10.672 -5.281 1.00 0.00 C ATOM 1369 O LEU B 385 9.216 9.788 -5.702 1.00 0.00 O ATOM 1370 CB LEU B 385 8.185 12.321 -7.141 1.00 0.00 C ATOM 1371 CG LEU B 385 6.666 12.392 -7.307 1.00 0.00 C ATOM 1372 CD1 LEU B 385 6.303 12.828 -8.719 1.00 0.00 C ATOM 1373 CD2 LEU B 385 6.031 11.048 -6.985 1.00 0.00 C ATOM 0 H LEU B 385 10.610 12.385 -6.455 1.00 0.00 H new ATOM 0 HA LEU B 385 8.090 12.764 -5.049 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.621 13.242 -7.528 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.565 11.506 -7.757 1.00 0.00 H new ATOM 0 HG LEU B 385 6.278 13.133 -6.608 1.00 0.00 H new ATOM 0 HD11 LEU B 385 5.218 12.873 -8.818 1.00 0.00 H new ATOM 0 HD12 LEU B 385 6.726 13.813 -8.916 1.00 0.00 H new ATOM 0 HD13 LEU B 385 6.704 12.111 -9.436 1.00 0.00 H new ATOM 0 HD21 LEU B 385 4.950 11.117 -7.108 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.425 10.288 -7.660 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.262 10.774 -5.956 1.00 0.00 H new ATOM 1385 N HIS B 386 7.472 10.425 -4.439 1.00 0.00 N ATOM 1386 CA HIS B 386 7.230 9.063 -3.979 1.00 0.00 C ATOM 1387 C HIS B 386 5.866 8.880 -3.328 1.00 0.00 C ATOM 1388 O HIS B 386 5.329 9.784 -2.678 1.00 0.00 O ATOM 1389 CB HIS B 386 8.328 8.637 -3.001 1.00 0.00 C ATOM 1390 CG HIS B 386 8.321 9.405 -1.718 1.00 0.00 C ATOM 1391 ND1 HIS B 386 9.245 10.385 -1.422 1.00 0.00 N ATOM 1392 CD2 HIS B 386 7.498 9.330 -0.644 1.00 0.00 C ATOM 1393 CE1 HIS B 386 8.991 10.881 -0.225 1.00 0.00 C ATOM 1394 NE2 HIS B 386 7.936 10.258 0.268 1.00 0.00 N ATOM 0 H HIS B 386 6.833 11.129 -4.069 1.00 0.00 H new ATOM 0 HA HIS B 386 7.245 8.430 -4.866 1.00 0.00 H new ATOM 0 HB2 HIS B 386 8.213 7.576 -2.780 1.00 0.00 H new ATOM 0 HB3 HIS B 386 9.298 8.759 -3.482 1.00 0.00 H new ATOM 0 HD2 HIS B 386 6.655 8.665 -0.527 1.00 0.00 H new ATOM 0 HE1 HIS B 386 9.551 11.663 0.267 1.00 0.00 H new ATOM 0 HE2 HIS B 386 7.515 10.437 1.179 1.00 0.00 H new ATOM 1403 N TYR B 387 5.331 7.677 -3.504 1.00 0.00 N ATOM 1404 CA TYR B 387 4.046 7.302 -2.940 1.00 0.00 C ATOM 1405 C TYR B 387 4.248 6.418 -1.720 1.00 0.00 C ATOM 1406 O TYR B 387 5.168 5.601 -1.680 1.00 0.00 O ATOM 1407 CB TYR B 387 3.213 6.540 -3.966 1.00 0.00 C ATOM 1408 CG TYR B 387 2.722 7.394 -5.100 1.00 0.00 C ATOM 1409 CD1 TYR B 387 3.613 8.031 -5.949 1.00 0.00 C ATOM 1410 CD2 TYR B 387 1.365 7.562 -5.322 1.00 0.00 C ATOM 1411 CE1 TYR B 387 3.166 8.812 -6.991 1.00 0.00 C ATOM 1412 CE2 TYR B 387 0.906 8.338 -6.361 1.00 0.00 C ATOM 1413 CZ TYR B 387 1.810 8.964 -7.195 1.00 0.00 C ATOM 1414 OH TYR B 387 1.357 9.741 -8.235 1.00 0.00 O ATOM 0 H TYR B 387 5.779 6.936 -4.043 1.00 0.00 H new ATOM 0 HA TYR B 387 3.523 8.215 -2.654 1.00 0.00 H new ATOM 0 HB2 TYR B 387 3.810 5.723 -4.371 1.00 0.00 H new ATOM 0 HB3 TYR B 387 2.356 6.091 -3.464 1.00 0.00 H new ATOM 0 HD1 TYR B 387 4.675 7.913 -5.791 1.00 0.00 H new ATOM 0 HD2 TYR B 387 0.656 7.076 -4.669 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.872 9.302 -7.644 1.00 0.00 H new ATOM 0 HE2 TYR B 387 -0.155 8.457 -6.523 1.00 0.00 H new ATOM 0 HH TYR B 387 2.068 10.351 -8.522 1.00 0.00 H new ATOM 1424 N VAL B 388 3.378 6.570 -0.736 1.00 0.00 N ATOM 1425 CA VAL B 388 3.461 5.770 0.470 1.00 0.00 C ATOM 1426 C VAL B 388 2.159 5.033 0.718 1.00 0.00 C ATOM 1427 O VAL B 388 1.087 5.635 0.774 1.00 0.00 O ATOM 1428 CB VAL B 388 3.814 6.617 1.700 1.00 0.00 C ATOM 1429 CG1 VAL B 388 5.266 6.385 2.075 1.00 0.00 C ATOM 1430 CG2 VAL B 388 3.545 8.091 1.438 1.00 0.00 C ATOM 0 H VAL B 388 2.608 7.239 -0.750 1.00 0.00 H new ATOM 0 HA VAL B 388 4.263 5.048 0.314 1.00 0.00 H new ATOM 0 HB VAL B 388 3.182 6.313 2.535 1.00 0.00 H new ATOM 0 HG11 VAL B 388 5.517 6.987 2.949 1.00 0.00 H new ATOM 0 HG12 VAL B 388 5.418 5.330 2.305 1.00 0.00 H new ATOM 0 HG13 VAL B 388 5.907 6.671 1.241 1.00 0.00 H new ATOM 0 HG21 VAL B 388 3.803 8.671 2.324 1.00 0.00 H new ATOM 0 HG22 VAL B 388 4.150 8.427 0.596 1.00 0.00 H new ATOM 0 HG23 VAL B 388 2.489 8.233 1.206 1.00 0.00 H new ATOM 1440 N THR B 389 2.262 3.722 0.857 1.00 0.00 N ATOM 1441 CA THR B 389 1.095 2.887 1.090 1.00 0.00 C ATOM 1442 C THR B 389 0.733 2.857 2.569 1.00 0.00 C ATOM 1443 O THR B 389 1.568 2.546 3.419 1.00 0.00 O ATOM 1444 CB THR B 389 1.326 1.450 0.586 1.00 0.00 C ATOM 1445 OG1 THR B 389 1.217 1.375 -0.840 1.00 0.00 O ATOM 1446 CG2 THR B 389 0.317 0.485 1.197 1.00 0.00 C ATOM 0 H THR B 389 3.144 3.212 0.812 1.00 0.00 H new ATOM 0 HA THR B 389 0.268 3.325 0.531 1.00 0.00 H new ATOM 0 HB THR B 389 2.334 1.169 0.890 1.00 0.00 H new ATOM 0 HG1 THR B 389 1.370 0.452 -1.132 1.00 0.00 H new ATOM 0 HG21 THR B 389 0.504 -0.522 0.823 1.00 0.00 H new ATOM 0 HG22 THR B 389 0.417 0.494 2.282 1.00 0.00 H new ATOM 0 HG23 THR B 389 -0.692 0.792 0.923 1.00 0.00 H new ATOM 1454 N VAL B 390 -0.516 3.182 2.864 1.00 0.00 N ATOM 1455 CA VAL B 390 -0.998 3.193 4.235 1.00 0.00 C ATOM 1456 C VAL B 390 -2.353 2.504 4.338 1.00 0.00 C ATOM 1457 O VAL B 390 -3.095 2.425 3.357 1.00 0.00 O ATOM 1458 CB VAL B 390 -1.108 4.630 4.773 1.00 0.00 C ATOM 1459 CG1 VAL B 390 0.264 5.281 4.835 1.00 0.00 C ATOM 1460 CG2 VAL B 390 -2.050 5.450 3.911 1.00 0.00 C ATOM 0 H VAL B 390 -1.216 3.442 2.169 1.00 0.00 H new ATOM 0 HA VAL B 390 -0.274 2.647 4.840 1.00 0.00 H new ATOM 0 HB VAL B 390 -1.515 4.590 5.783 1.00 0.00 H new ATOM 0 HG11 VAL B 390 0.168 6.297 5.218 1.00 0.00 H new ATOM 0 HG12 VAL B 390 0.911 4.704 5.496 1.00 0.00 H new ATOM 0 HG13 VAL B 390 0.699 5.309 3.836 1.00 0.00 H new ATOM 0 HG21 VAL B 390 -2.116 6.464 4.306 1.00 0.00 H new ATOM 0 HG22 VAL B 390 -1.672 5.483 2.889 1.00 0.00 H new ATOM 0 HG23 VAL B 390 -3.040 4.993 3.917 1.00 0.00 H new ATOM 1470 N LYS B 391 -2.660 2.001 5.528 1.00 0.00 N ATOM 1471 CA LYS B 391 -3.916 1.307 5.773 1.00 0.00 C ATOM 1472 C LYS B 391 -3.789 -0.170 5.424 1.00 0.00 C ATOM 1473 O LYS B 391 -4.532 -0.683 4.587 1.00 0.00 O ATOM 1474 CB LYS B 391 -5.046 1.939 4.963 1.00 0.00 C ATOM 1475 CG LYS B 391 -6.432 1.498 5.404 1.00 0.00 C ATOM 1476 CD LYS B 391 -6.557 1.479 6.918 1.00 0.00 C ATOM 1477 CE LYS B 391 -7.963 1.846 7.363 1.00 0.00 C ATOM 1478 NZ LYS B 391 -8.922 0.726 7.156 1.00 0.00 N ATOM 0 H LYS B 391 -2.050 2.062 6.343 1.00 0.00 H new ATOM 0 HA LYS B 391 -4.152 1.398 6.833 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -4.976 3.024 5.043 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -4.912 1.688 3.911 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -7.179 2.172 4.985 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -6.641 0.504 5.008 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -6.302 0.488 7.293 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -5.842 2.178 7.352 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -7.949 2.122 8.417 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -8.302 2.721 6.809 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -9.869 1.017 7.472 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -8.955 0.479 6.146 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -8.613 -0.102 7.705 1.00 0.00 H new ATOM 1492 N LYS B 392 -2.840 -0.848 6.069 1.00 0.00 N ATOM 1493 CA LYS B 392 -2.611 -2.270 5.824 1.00 0.00 C ATOM 1494 C LYS B 392 -3.924 -2.976 5.511 1.00 0.00 C ATOM 1495 O LYS B 392 -4.865 -2.941 6.304 1.00 0.00 O ATOM 1496 CB LYS B 392 -1.936 -2.919 7.036 1.00 0.00 C ATOM 1497 CG LYS B 392 -0.848 -2.058 7.658 1.00 0.00 C ATOM 1498 CD LYS B 392 0.440 -2.839 7.863 1.00 0.00 C ATOM 1499 CE LYS B 392 1.390 -2.659 6.688 1.00 0.00 C ATOM 1500 NZ LYS B 392 2.792 -2.431 7.133 1.00 0.00 N ATOM 0 H LYS B 392 -2.218 -0.435 6.764 1.00 0.00 H new ATOM 0 HA LYS B 392 -1.950 -2.368 4.963 1.00 0.00 H new ATOM 0 HB2 LYS B 392 -2.692 -3.136 7.790 1.00 0.00 H new ATOM 0 HB3 LYS B 392 -1.505 -3.873 6.734 1.00 0.00 H new ATOM 0 HG2 LYS B 392 -0.654 -1.198 7.017 1.00 0.00 H new ATOM 0 HG3 LYS B 392 -1.194 -1.670 8.616 1.00 0.00 H new ATOM 0 HD2 LYS B 392 0.926 -2.508 8.780 1.00 0.00 H new ATOM 0 HD3 LYS B 392 0.210 -3.897 7.988 1.00 0.00 H new ATOM 0 HE2 LYS B 392 1.351 -3.543 6.052 1.00 0.00 H new ATOM 0 HE3 LYS B 392 1.061 -1.815 6.082 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 3.405 -2.314 6.301 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 2.835 -1.573 7.719 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 3.117 -3.247 7.690 1.00 0.00 H new ATOM 1514 N PRO B 393 -4.011 -3.617 4.336 1.00 0.00 N ATOM 1515 CA PRO B 393 -5.220 -4.318 3.909 1.00 0.00 C ATOM 1516 C PRO B 393 -5.576 -5.485 4.821 1.00 0.00 C ATOM 1517 O PRO B 393 -4.750 -5.960 5.601 1.00 0.00 O ATOM 1518 CB PRO B 393 -4.891 -4.830 2.505 1.00 0.00 C ATOM 1519 CG PRO B 393 -3.659 -4.098 2.080 1.00 0.00 C ATOM 1520 CD PRO B 393 -2.939 -3.693 3.335 1.00 0.00 C ATOM 0 HA PRO B 393 -6.084 -3.654 3.937 1.00 0.00 H new ATOM 0 HB2 PRO B 393 -4.723 -5.907 2.512 1.00 0.00 H new ATOM 0 HB3 PRO B 393 -5.715 -4.640 1.817 1.00 0.00 H new ATOM 0 HG2 PRO B 393 -3.027 -4.733 1.460 1.00 0.00 H new ATOM 0 HG3 PRO B 393 -3.916 -3.223 1.483 1.00 0.00 H new ATOM 0 HD2 PRO B 393 -2.179 -4.423 3.615 1.00 0.00 H new ATOM 0 HD3 PRO B 393 -2.432 -2.735 3.216 1.00 0.00 H new ATOM 1528 N THR B 394 -6.821 -5.925 4.719 1.00 0.00 N ATOM 1529 CA THR B 394 -7.314 -7.028 5.539 1.00 0.00 C ATOM 1530 C THR B 394 -8.104 -8.039 4.716 1.00 0.00 C ATOM 1531 O THR B 394 -8.427 -7.797 3.553 1.00 0.00 O ATOM 1532 CB THR B 394 -8.205 -6.516 6.687 1.00 0.00 C ATOM 1533 OG1 THR B 394 -9.551 -6.297 6.247 1.00 0.00 O ATOM 1534 CG2 THR B 394 -7.667 -5.210 7.253 1.00 0.00 C ATOM 0 H THR B 394 -7.511 -5.536 4.076 1.00 0.00 H new ATOM 0 HA THR B 394 -6.434 -7.520 5.952 1.00 0.00 H new ATOM 0 HB THR B 394 -8.197 -7.286 7.459 1.00 0.00 H new ATOM 0 HG1 THR B 394 -10.051 -5.827 6.946 1.00 0.00 H new ATOM 0 HG21 THR B 394 -8.314 -4.870 8.062 1.00 0.00 H new ATOM 0 HG22 THR B 394 -6.659 -5.368 7.637 1.00 0.00 H new ATOM 0 HG23 THR B 394 -7.642 -4.456 6.467 1.00 0.00 H new ATOM 1542 N ALA B 395 -8.416 -9.175 5.336 1.00 0.00 N ATOM 1543 CA ALA B 395 -9.174 -10.230 4.673 1.00 0.00 C ATOM 1544 C ALA B 395 -10.661 -10.087 4.956 1.00 0.00 C ATOM 1545 O ALA B 395 -11.442 -11.012 4.733 1.00 0.00 O ATOM 1546 CB ALA B 395 -8.695 -11.602 5.097 1.00 0.00 C ATOM 0 H ALA B 395 -8.154 -9.387 6.299 1.00 0.00 H new ATOM 0 HA ALA B 395 -9.009 -10.126 3.601 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -9.280 -12.366 4.585 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -7.643 -11.716 4.837 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -8.817 -11.713 6.174 1.00 0.00 H new ATOM 1552 N VAL B 396 -11.043 -8.908 5.417 1.00 0.00 N ATOM 1553 CA VAL B 396 -12.434 -8.602 5.705 1.00 0.00 C ATOM 1554 C VAL B 396 -12.771 -7.218 5.165 1.00 0.00 C ATOM 1555 O VAL B 396 -13.812 -6.643 5.480 1.00 0.00 O ATOM 1556 CB VAL B 396 -12.735 -8.651 7.215 1.00 0.00 C ATOM 1557 CG1 VAL B 396 -12.562 -10.063 7.756 1.00 0.00 C ATOM 1558 CG2 VAL B 396 -11.849 -7.673 7.971 1.00 0.00 C ATOM 0 H VAL B 396 -10.400 -8.138 5.602 1.00 0.00 H new ATOM 0 HA VAL B 396 -13.049 -9.359 5.219 1.00 0.00 H new ATOM 0 HB VAL B 396 -13.774 -8.356 7.364 1.00 0.00 H new ATOM 0 HG11 VAL B 396 -12.780 -10.073 8.824 1.00 0.00 H new ATOM 0 HG12 VAL B 396 -13.246 -10.737 7.240 1.00 0.00 H new ATOM 0 HG13 VAL B 396 -11.536 -10.392 7.592 1.00 0.00 H new ATOM 0 HG21 VAL B 396 -12.077 -7.723 9.036 1.00 0.00 H new ATOM 0 HG22 VAL B 396 -10.802 -7.932 7.812 1.00 0.00 H new ATOM 0 HG23 VAL B 396 -12.031 -6.661 7.608 1.00 0.00 H new ATOM 1568 N ASP B 397 -11.857 -6.694 4.356 1.00 0.00 N ATOM 1569 CA ASP B 397 -11.996 -5.377 3.755 1.00 0.00 C ATOM 1570 C ASP B 397 -10.640 -4.919 3.231 1.00 0.00 C ATOM 1571 O ASP B 397 -10.069 -3.943 3.717 1.00 0.00 O ATOM 1572 CB ASP B 397 -12.531 -4.373 4.779 1.00 0.00 C ATOM 1573 CG ASP B 397 -13.959 -3.955 4.490 1.00 0.00 C ATOM 1574 OD1 ASP B 397 -14.493 -4.352 3.434 1.00 0.00 O ATOM 1575 OD2 ASP B 397 -14.543 -3.227 5.321 1.00 0.00 O ATOM 0 H ASP B 397 -10.995 -7.175 4.099 1.00 0.00 H new ATOM 0 HA ASP B 397 -12.706 -5.434 2.930 1.00 0.00 H new ATOM 0 HB2 ASP B 397 -12.479 -4.812 5.775 1.00 0.00 H new ATOM 0 HB3 ASP B 397 -11.892 -3.490 4.786 1.00 0.00 H new ATOM 1580 N PRO B 398 -10.110 -5.634 2.227 1.00 0.00 N ATOM 1581 CA PRO B 398 -8.817 -5.335 1.618 1.00 0.00 C ATOM 1582 C PRO B 398 -8.559 -3.839 1.512 1.00 0.00 C ATOM 1583 O PRO B 398 -7.412 -3.394 1.532 1.00 0.00 O ATOM 1584 CB PRO B 398 -8.924 -5.973 0.222 1.00 0.00 C ATOM 1585 CG PRO B 398 -10.247 -6.683 0.178 1.00 0.00 C ATOM 1586 CD PRO B 398 -10.727 -6.798 1.598 1.00 0.00 C ATOM 0 HA PRO B 398 -7.986 -5.719 2.210 1.00 0.00 H new ATOM 0 HB2 PRO B 398 -8.865 -5.213 -0.557 1.00 0.00 H new ATOM 0 HB3 PRO B 398 -8.104 -6.670 0.050 1.00 0.00 H new ATOM 0 HG2 PRO B 398 -10.963 -6.128 -0.428 1.00 0.00 H new ATOM 0 HG3 PRO B 398 -10.142 -7.669 -0.275 1.00 0.00 H new ATOM 0 HD2 PRO B 398 -11.815 -6.768 1.664 1.00 0.00 H new ATOM 0 HD3 PRO B 398 -10.405 -7.730 2.062 1.00 0.00 H new ATOM 1594 N ASN B 399 -9.644 -3.078 1.392 1.00 0.00 N ATOM 1595 CA ASN B 399 -9.585 -1.624 1.274 1.00 0.00 C ATOM 1596 C ASN B 399 -8.283 -1.050 1.823 1.00 0.00 C ATOM 1597 O ASN B 399 -7.953 -1.230 2.995 1.00 0.00 O ATOM 1598 CB ASN B 399 -10.771 -0.988 2.000 1.00 0.00 C ATOM 1599 CG ASN B 399 -12.095 -1.304 1.335 1.00 0.00 C ATOM 1600 OD1 ASN B 399 -12.559 -2.444 1.356 1.00 0.00 O ATOM 1601 ND2 ASN B 399 -12.712 -0.292 0.736 1.00 0.00 N ATOM 0 H ASN B 399 -10.592 -3.454 1.374 1.00 0.00 H new ATOM 0 HA ASN B 399 -9.629 -1.388 0.211 1.00 0.00 H new ATOM 0 HB2 ASN B 399 -10.793 -1.340 3.031 1.00 0.00 H new ATOM 0 HB3 ASN B 399 -10.634 0.093 2.035 1.00 0.00 H new ATOM 0 HD21 ASN B 399 -13.606 -0.444 0.269 1.00 0.00 H new ATOM 0 HD22 ASN B 399 -12.292 0.637 0.743 1.00 0.00 H new ATOM 1608 N SER B 400 -7.559 -0.343 0.965 1.00 0.00 N ATOM 1609 CA SER B 400 -6.300 0.283 1.344 1.00 0.00 C ATOM 1610 C SER B 400 -6.161 1.627 0.643 1.00 0.00 C ATOM 1611 O SER B 400 -6.748 1.842 -0.417 1.00 0.00 O ATOM 1612 CB SER B 400 -5.117 -0.620 0.986 1.00 0.00 C ATOM 1613 OG SER B 400 -3.908 0.119 0.946 1.00 0.00 O ATOM 0 H SER B 400 -7.826 -0.188 -0.007 1.00 0.00 H new ATOM 0 HA SER B 400 -6.300 0.438 2.423 1.00 0.00 H new ATOM 0 HB2 SER B 400 -5.033 -1.423 1.719 1.00 0.00 H new ATOM 0 HB3 SER B 400 -5.293 -1.089 0.018 1.00 0.00 H new ATOM 0 HG SER B 400 -3.166 -0.479 0.717 1.00 0.00 H new ATOM 1619 N ILE B 401 -5.391 2.534 1.232 1.00 0.00 N ATOM 1620 CA ILE B 401 -5.203 3.848 0.638 1.00 0.00 C ATOM 1621 C ILE B 401 -3.737 4.114 0.333 1.00 0.00 C ATOM 1622 O ILE B 401 -2.841 3.484 0.896 1.00 0.00 O ATOM 1623 CB ILE B 401 -5.748 4.969 1.542 1.00 0.00 C ATOM 1624 CG1 ILE B 401 -5.910 6.263 0.742 1.00 0.00 C ATOM 1625 CG2 ILE B 401 -4.830 5.186 2.731 1.00 0.00 C ATOM 1626 CD1 ILE B 401 -6.714 7.324 1.460 1.00 0.00 C ATOM 0 H ILE B 401 -4.893 2.385 2.110 1.00 0.00 H new ATOM 0 HA ILE B 401 -5.767 3.849 -0.295 1.00 0.00 H new ATOM 0 HB ILE B 401 -6.727 4.670 1.917 1.00 0.00 H new ATOM 0 HG12 ILE B 401 -4.923 6.663 0.510 1.00 0.00 H new ATOM 0 HG13 ILE B 401 -6.393 6.035 -0.208 1.00 0.00 H new ATOM 0 HG21 ILE B 401 -5.230 5.982 3.359 1.00 0.00 H new ATOM 0 HG22 ILE B 401 -4.762 4.265 3.311 1.00 0.00 H new ATOM 0 HG23 ILE B 401 -3.838 5.467 2.378 1.00 0.00 H new ATOM 0 HD11 ILE B 401 -6.787 8.212 0.832 1.00 0.00 H new ATOM 0 HD12 ILE B 401 -7.714 6.944 1.668 1.00 0.00 H new ATOM 0 HD13 ILE B 401 -6.221 7.582 2.398 1.00 0.00 H new ATOM 1638 N VAL B 402 -3.509 5.052 -0.572 1.00 0.00 N ATOM 1639 CA VAL B 402 -2.167 5.425 -0.984 1.00 0.00 C ATOM 1640 C VAL B 402 -1.925 6.897 -0.715 1.00 0.00 C ATOM 1641 O VAL B 402 -2.862 7.698 -0.715 1.00 0.00 O ATOM 1642 CB VAL B 402 -1.946 5.149 -2.487 1.00 0.00 C ATOM 1643 CG1 VAL B 402 -0.569 4.555 -2.732 1.00 0.00 C ATOM 1644 CG2 VAL B 402 -3.034 4.230 -3.027 1.00 0.00 C ATOM 0 H VAL B 402 -4.249 5.575 -1.041 1.00 0.00 H new ATOM 0 HA VAL B 402 -1.467 4.821 -0.407 1.00 0.00 H new ATOM 0 HB VAL B 402 -2.003 6.098 -3.020 1.00 0.00 H new ATOM 0 HG11 VAL B 402 -0.437 4.369 -3.798 1.00 0.00 H new ATOM 0 HG12 VAL B 402 0.195 5.253 -2.388 1.00 0.00 H new ATOM 0 HG13 VAL B 402 -0.475 3.616 -2.186 1.00 0.00 H new ATOM 0 HG21 VAL B 402 -2.862 4.047 -4.088 1.00 0.00 H new ATOM 0 HG22 VAL B 402 -3.012 3.284 -2.487 1.00 0.00 H new ATOM 0 HG23 VAL B 402 -4.008 4.701 -2.894 1.00 0.00 H new ATOM 1654 N GLU B 403 -0.668 7.257 -0.500 1.00 0.00 N ATOM 1655 CA GLU B 403 -0.312 8.642 -0.246 1.00 0.00 C ATOM 1656 C GLU B 403 0.698 9.120 -1.278 1.00 0.00 C ATOM 1657 O GLU B 403 1.752 8.517 -1.457 1.00 0.00 O ATOM 1658 CB GLU B 403 0.263 8.792 1.164 1.00 0.00 C ATOM 1659 CG GLU B 403 -0.797 9.030 2.228 1.00 0.00 C ATOM 1660 CD GLU B 403 -0.231 8.993 3.635 1.00 0.00 C ATOM 1661 OE1 GLU B 403 0.956 9.340 3.808 1.00 0.00 O ATOM 1662 OE2 GLU B 403 -0.975 8.616 4.565 1.00 0.00 O ATOM 0 H GLU B 403 0.120 6.609 -0.497 1.00 0.00 H new ATOM 0 HA GLU B 403 -1.211 9.254 -0.323 1.00 0.00 H new ATOM 0 HB2 GLU B 403 0.825 7.893 1.417 1.00 0.00 H new ATOM 0 HB3 GLU B 403 0.969 9.622 1.174 1.00 0.00 H new ATOM 0 HG2 GLU B 403 -1.269 9.997 2.056 1.00 0.00 H new ATOM 0 HG3 GLU B 403 -1.577 8.274 2.134 1.00 0.00 H new ATOM 1669 N CYS B 404 0.374 10.213 -1.950 1.00 0.00 N ATOM 1670 CA CYS B 404 1.264 10.773 -2.953 1.00 0.00 C ATOM 1671 C CYS B 404 1.835 12.085 -2.453 1.00 0.00 C ATOM 1672 O CYS B 404 1.105 13.063 -2.299 1.00 0.00 O ATOM 1673 CB CYS B 404 0.519 10.989 -4.271 1.00 0.00 C ATOM 1674 SG CYS B 404 1.574 11.537 -5.632 1.00 0.00 S ATOM 0 H CYS B 404 -0.496 10.729 -1.819 1.00 0.00 H new ATOM 0 HA CYS B 404 2.079 10.072 -3.132 1.00 0.00 H new ATOM 0 HB2 CYS B 404 0.030 10.058 -4.557 1.00 0.00 H new ATOM 0 HB3 CYS B 404 -0.268 11.727 -4.115 1.00 0.00 H new ATOM 0 HG CYS B 404 1.912 10.513 -6.359 1.00 0.00 H new ATOM 1680 N ARG B 405 3.136 12.106 -2.181 1.00 0.00 N ATOM 1681 CA ARG B 405 3.768 13.314 -1.680 1.00 0.00 C ATOM 1682 C ARG B 405 5.192 13.455 -2.191 1.00 0.00 C ATOM 1683 O ARG B 405 5.662 12.655 -3.005 1.00 0.00 O ATOM 1684 CB ARG B 405 3.759 13.322 -0.149 1.00 0.00 C ATOM 1685 CG ARG B 405 4.658 12.264 0.468 1.00 0.00 C ATOM 1686 CD ARG B 405 4.601 12.302 1.987 1.00 0.00 C ATOM 1687 NE ARG B 405 3.246 12.101 2.491 1.00 0.00 N ATOM 1688 CZ ARG B 405 2.944 12.033 3.783 1.00 0.00 C ATOM 1689 NH1 ARG B 405 3.899 12.157 4.695 1.00 0.00 N ATOM 1690 NH2 ARG B 405 1.689 11.842 4.165 1.00 0.00 N ATOM 0 H ARG B 405 3.763 11.310 -2.298 1.00 0.00 H new ATOM 0 HA ARG B 405 3.193 14.164 -2.049 1.00 0.00 H new ATOM 0 HB2 ARG B 405 4.073 14.305 0.203 1.00 0.00 H new ATOM 0 HB3 ARG B 405 2.738 13.169 0.201 1.00 0.00 H new ATOM 0 HG2 ARG B 405 4.356 11.278 0.116 1.00 0.00 H new ATOM 0 HG3 ARG B 405 5.685 12.420 0.137 1.00 0.00 H new ATOM 0 HD2 ARG B 405 5.256 11.532 2.393 1.00 0.00 H new ATOM 0 HD3 ARG B 405 4.980 13.261 2.340 1.00 0.00 H new ATOM 0 HE ARG B 405 2.489 12.008 1.814 1.00 0.00 H new ATOM 0 HH11 ARG B 405 4.866 12.305 4.404 1.00 0.00 H new ATOM 0 HH12 ARG B 405 3.667 12.105 5.687 1.00 0.00 H new ATOM 0 HH21 ARG B 405 0.952 11.747 3.466 1.00 0.00 H new ATOM 0 HH22 ARG B 405 1.460 11.790 5.158 1.00 0.00 H new ATOM 1704 N VAL B 406 5.871 14.490 -1.711 1.00 0.00 N ATOM 1705 CA VAL B 406 7.239 14.761 -2.118 1.00 0.00 C ATOM 1706 C VAL B 406 8.039 15.369 -0.979 1.00 0.00 C ATOM 1707 O VAL B 406 7.508 16.118 -0.155 1.00 0.00 O ATOM 1708 CB VAL B 406 7.280 15.706 -3.325 1.00 0.00 C ATOM 1709 CG1 VAL B 406 7.543 14.917 -4.587 1.00 0.00 C ATOM 1710 CG2 VAL B 406 5.978 16.473 -3.432 1.00 0.00 C ATOM 0 H VAL B 406 5.493 15.156 -1.037 1.00 0.00 H new ATOM 0 HA VAL B 406 7.685 13.807 -2.397 1.00 0.00 H new ATOM 0 HB VAL B 406 8.089 16.424 -3.190 1.00 0.00 H new ATOM 0 HG11 VAL B 406 7.571 15.594 -5.440 1.00 0.00 H new ATOM 0 HG12 VAL B 406 8.500 14.402 -4.501 1.00 0.00 H new ATOM 0 HG13 VAL B 406 6.748 14.185 -4.731 1.00 0.00 H new ATOM 0 HG21 VAL B 406 6.019 17.141 -4.293 1.00 0.00 H new ATOM 0 HG22 VAL B 406 5.152 15.772 -3.555 1.00 0.00 H new ATOM 0 HG23 VAL B 406 5.825 17.058 -2.525 1.00 0.00 H new ATOM 1720 N GLY B 407 9.315 15.013 -0.924 1.00 0.00 N ATOM 1721 CA GLY B 407 10.171 15.501 0.135 1.00 0.00 C ATOM 1722 C GLY B 407 9.747 14.950 1.483 1.00 0.00 C ATOM 1723 O GLY B 407 10.283 15.340 2.518 1.00 0.00 O ATOM 0 H GLY B 407 9.771 14.395 -1.595 1.00 0.00 H new ATOM 0 HA2 GLY B 407 11.203 15.216 -0.068 1.00 0.00 H new ATOM 0 HA3 GLY B 407 10.139 16.590 0.159 1.00 0.00 H new ATOM 1727 N ASP B 408 8.774 14.034 1.457 1.00 0.00 N ATOM 1728 CA ASP B 408 8.261 13.410 2.672 1.00 0.00 C ATOM 1729 C ASP B 408 7.364 14.363 3.455 1.00 0.00 C ATOM 1730 O ASP B 408 7.411 14.401 4.684 1.00 0.00 O ATOM 1731 CB ASP B 408 9.411 12.937 3.559 1.00 0.00 C ATOM 1732 CG ASP B 408 8.922 12.210 4.797 1.00 0.00 C ATOM 1733 OD1 ASP B 408 7.704 11.949 4.888 1.00 0.00 O ATOM 1734 OD2 ASP B 408 9.755 11.905 5.675 1.00 0.00 O ATOM 0 H ASP B 408 8.326 13.709 0.600 1.00 0.00 H new ATOM 0 HA ASP B 408 7.663 12.550 2.369 1.00 0.00 H new ATOM 0 HB2 ASP B 408 10.061 12.276 2.985 1.00 0.00 H new ATOM 0 HB3 ASP B 408 10.013 13.795 3.858 1.00 0.00 H new ATOM 1739 N GLY B 409 6.544 15.129 2.741 1.00 0.00 N ATOM 1740 CA GLY B 409 5.651 16.061 3.403 1.00 0.00 C ATOM 1741 C GLY B 409 4.584 16.619 2.480 1.00 0.00 C ATOM 1742 O GLY B 409 3.399 16.598 2.810 1.00 0.00 O ATOM 0 H GLY B 409 6.482 15.121 1.723 1.00 0.00 H new ATOM 0 HA2 GLY B 409 5.170 15.560 4.243 1.00 0.00 H new ATOM 0 HA3 GLY B 409 6.235 16.885 3.814 1.00 0.00 H new ATOM 1746 N THR B 410 5.003 17.124 1.325 1.00 0.00 N ATOM 1747 CA THR B 410 4.070 17.694 0.361 1.00 0.00 C ATOM 1748 C THR B 410 3.260 16.606 -0.331 1.00 0.00 C ATOM 1749 O THR B 410 3.704 16.030 -1.321 1.00 0.00 O ATOM 1750 CB THR B 410 4.809 18.526 -0.705 1.00 0.00 C ATOM 1751 OG1 THR B 410 5.316 19.748 -0.153 1.00 0.00 O ATOM 1752 CG2 THR B 410 3.885 18.869 -1.864 1.00 0.00 C ATOM 0 H THR B 410 5.980 17.150 1.034 1.00 0.00 H new ATOM 0 HA THR B 410 3.395 18.344 0.918 1.00 0.00 H new ATOM 0 HB THR B 410 5.639 17.917 -1.062 1.00 0.00 H new ATOM 0 HG1 THR B 410 5.781 20.254 -0.851 1.00 0.00 H new ATOM 0 HG21 THR B 410 4.430 19.456 -2.603 1.00 0.00 H new ATOM 0 HG22 THR B 410 3.524 17.950 -2.326 1.00 0.00 H new ATOM 0 HG23 THR B 410 3.038 19.447 -1.495 1.00 0.00 H new ATOM 1760 N VAL B 411 2.066 16.331 0.191 1.00 0.00 N ATOM 1761 CA VAL B 411 1.193 15.313 -0.381 1.00 0.00 C ATOM 1762 C VAL B 411 0.395 15.865 -1.556 1.00 0.00 C ATOM 1763 O VAL B 411 -0.495 16.697 -1.378 1.00 0.00 O ATOM 1764 CB VAL B 411 0.209 14.774 0.671 1.00 0.00 C ATOM 1765 CG1 VAL B 411 -0.749 13.771 0.045 1.00 0.00 C ATOM 1766 CG2 VAL B 411 0.963 14.150 1.833 1.00 0.00 C ATOM 0 H VAL B 411 1.682 16.801 1.011 1.00 0.00 H new ATOM 0 HA VAL B 411 1.836 14.504 -0.729 1.00 0.00 H new ATOM 0 HB VAL B 411 -0.378 15.608 1.054 1.00 0.00 H new ATOM 0 HG11 VAL B 411 -1.437 13.401 0.805 1.00 0.00 H new ATOM 0 HG12 VAL B 411 -1.314 14.256 -0.751 1.00 0.00 H new ATOM 0 HG13 VAL B 411 -0.183 12.936 -0.369 1.00 0.00 H new ATOM 0 HG21 VAL B 411 0.252 13.774 2.568 1.00 0.00 H new ATOM 0 HG22 VAL B 411 1.577 13.327 1.468 1.00 0.00 H new ATOM 0 HG23 VAL B 411 1.602 14.901 2.298 1.00 0.00 H new ATOM 1776 N LEU B 412 0.706 15.385 -2.753 1.00 0.00 N ATOM 1777 CA LEU B 412 0.006 15.817 -3.952 1.00 0.00 C ATOM 1778 C LEU B 412 -1.452 15.378 -3.902 1.00 0.00 C ATOM 1779 O LEU B 412 -2.336 16.064 -4.414 1.00 0.00 O ATOM 1780 CB LEU B 412 0.684 15.242 -5.197 1.00 0.00 C ATOM 1781 CG LEU B 412 2.132 15.686 -5.410 1.00 0.00 C ATOM 1782 CD1 LEU B 412 2.373 17.056 -4.791 1.00 0.00 C ATOM 1783 CD2 LEU B 412 3.092 14.660 -4.828 1.00 0.00 C ATOM 0 H LEU B 412 1.439 14.696 -2.918 1.00 0.00 H new ATOM 0 HA LEU B 412 0.043 16.905 -4.001 1.00 0.00 H new ATOM 0 HB2 LEU B 412 0.659 14.154 -5.136 1.00 0.00 H new ATOM 0 HB3 LEU B 412 0.101 15.525 -6.073 1.00 0.00 H new ATOM 0 HG LEU B 412 2.314 15.761 -6.482 1.00 0.00 H new ATOM 0 HD11 LEU B 412 3.409 17.352 -4.954 1.00 0.00 H new ATOM 0 HD12 LEU B 412 1.710 17.786 -5.254 1.00 0.00 H new ATOM 0 HD13 LEU B 412 2.173 17.012 -3.720 1.00 0.00 H new ATOM 0 HD21 LEU B 412 4.118 14.990 -4.988 1.00 0.00 H new ATOM 0 HD22 LEU B 412 2.907 14.554 -3.759 1.00 0.00 H new ATOM 0 HD23 LEU B 412 2.940 13.699 -5.320 1.00 0.00 H new ATOM 1795 N GLY B 413 -1.698 14.227 -3.280 1.00 0.00 N ATOM 1796 CA GLY B 413 -3.052 13.718 -3.176 1.00 0.00 C ATOM 1797 C GLY B 413 -3.119 12.380 -2.464 1.00 0.00 C ATOM 1798 O GLY B 413 -2.213 12.023 -1.709 1.00 0.00 O ATOM 0 H GLY B 413 -0.984 13.640 -2.848 1.00 0.00 H new ATOM 0 HA2 GLY B 413 -3.668 14.441 -2.641 1.00 0.00 H new ATOM 0 HA3 GLY B 413 -3.475 13.615 -4.175 1.00 0.00 H new ATOM 1802 N THR B 414 -4.196 11.639 -2.705 1.00 0.00 N ATOM 1803 CA THR B 414 -4.382 10.333 -2.083 1.00 0.00 C ATOM 1804 C THR B 414 -5.318 9.459 -2.909 1.00 0.00 C ATOM 1805 O THR B 414 -5.985 9.940 -3.824 1.00 0.00 O ATOM 1806 CB THR B 414 -4.950 10.467 -0.658 1.00 0.00 C ATOM 1807 OG1 THR B 414 -5.184 11.839 -0.314 1.00 0.00 O ATOM 1808 CG2 THR B 414 -3.994 9.870 0.364 1.00 0.00 C ATOM 0 H THR B 414 -4.954 11.921 -3.327 1.00 0.00 H new ATOM 0 HA THR B 414 -3.400 9.863 -2.034 1.00 0.00 H new ATOM 0 HB THR B 414 -5.896 9.925 -0.642 1.00 0.00 H new ATOM 0 HG1 THR B 414 -5.546 11.891 0.595 1.00 0.00 H new ATOM 0 HG21 THR B 414 -4.417 9.976 1.363 1.00 0.00 H new ATOM 0 HG22 THR B 414 -3.841 8.813 0.145 1.00 0.00 H new ATOM 0 HG23 THR B 414 -3.038 10.392 0.317 1.00 0.00 H new ATOM 1816 N GLY B 415 -5.364 8.168 -2.582 1.00 0.00 N ATOM 1817 CA GLY B 415 -6.227 7.252 -3.310 1.00 0.00 C ATOM 1818 C GLY B 415 -6.532 5.990 -2.524 1.00 0.00 C ATOM 1819 O GLY B 415 -5.624 5.288 -2.097 1.00 0.00 O ATOM 0 H GLY B 415 -4.822 7.742 -1.830 1.00 0.00 H new ATOM 0 HA2 GLY B 415 -7.161 7.757 -3.557 1.00 0.00 H new ATOM 0 HA3 GLY B 415 -5.752 6.982 -4.253 1.00 0.00 H new ATOM 1823 N VAL B 416 -7.815 5.700 -2.338 1.00 0.00 N ATOM 1824 CA VAL B 416 -8.228 4.514 -1.602 1.00 0.00 C ATOM 1825 C VAL B 416 -9.156 3.650 -2.444 1.00 0.00 C ATOM 1826 O VAL B 416 -9.860 4.151 -3.321 1.00 0.00 O ATOM 1827 CB VAL B 416 -8.940 4.888 -0.288 1.00 0.00 C ATOM 1828 CG1 VAL B 416 -10.277 5.554 -0.571 1.00 0.00 C ATOM 1829 CG2 VAL B 416 -9.122 3.660 0.592 1.00 0.00 C ATOM 0 H VAL B 416 -8.585 6.270 -2.687 1.00 0.00 H new ATOM 0 HA VAL B 416 -7.324 3.952 -1.366 1.00 0.00 H new ATOM 0 HB VAL B 416 -8.314 5.601 0.249 1.00 0.00 H new ATOM 0 HG11 VAL B 416 -10.763 5.810 0.371 1.00 0.00 H new ATOM 0 HG12 VAL B 416 -10.116 6.461 -1.154 1.00 0.00 H new ATOM 0 HG13 VAL B 416 -10.913 4.870 -1.133 1.00 0.00 H new ATOM 0 HG21 VAL B 416 -9.627 3.945 1.515 1.00 0.00 H new ATOM 0 HG22 VAL B 416 -9.723 2.920 0.064 1.00 0.00 H new ATOM 0 HG23 VAL B 416 -8.147 3.234 0.828 1.00 0.00 H new ATOM 1839 N GLY B 417 -9.148 2.347 -2.183 1.00 0.00 N ATOM 1840 CA GLY B 417 -9.993 1.447 -2.940 1.00 0.00 C ATOM 1841 C GLY B 417 -10.102 0.063 -2.322 1.00 0.00 C ATOM 1842 O GLY B 417 -9.260 -0.337 -1.519 1.00 0.00 O ATOM 0 H GLY B 417 -8.575 1.902 -1.466 1.00 0.00 H new ATOM 0 HA2 GLY B 417 -10.990 1.880 -3.023 1.00 0.00 H new ATOM 0 HA3 GLY B 417 -9.599 1.355 -3.952 1.00 0.00 H new ATOM 1846 N ARG B 418 -11.156 -0.660 -2.699 1.00 0.00 N ATOM 1847 CA ARG B 418 -11.411 -2.009 -2.184 1.00 0.00 C ATOM 1848 C ARG B 418 -10.358 -3.016 -2.655 1.00 0.00 C ATOM 1849 O ARG B 418 -9.843 -3.800 -1.858 1.00 0.00 O ATOM 1850 CB ARG B 418 -12.802 -2.475 -2.617 1.00 0.00 C ATOM 1851 CG ARG B 418 -13.205 -1.977 -3.996 1.00 0.00 C ATOM 1852 CD ARG B 418 -14.092 -2.976 -4.719 1.00 0.00 C ATOM 1853 NE ARG B 418 -14.326 -2.588 -6.107 1.00 0.00 N ATOM 1854 CZ ARG B 418 -15.397 -2.954 -6.802 1.00 0.00 C ATOM 1855 NH1 ARG B 418 -16.327 -3.712 -6.240 1.00 0.00 N ATOM 1856 NH2 ARG B 418 -15.537 -2.560 -8.061 1.00 0.00 N ATOM 0 H ARG B 418 -11.855 -0.332 -3.366 1.00 0.00 H new ATOM 0 HA ARG B 418 -11.356 -1.960 -1.096 1.00 0.00 H new ATOM 0 HB2 ARG B 418 -12.830 -3.565 -2.610 1.00 0.00 H new ATOM 0 HB3 ARG B 418 -13.535 -2.132 -1.887 1.00 0.00 H new ATOM 0 HG2 ARG B 418 -13.731 -1.027 -3.900 1.00 0.00 H new ATOM 0 HG3 ARG B 418 -12.311 -1.788 -4.590 1.00 0.00 H new ATOM 0 HD2 ARG B 418 -13.628 -3.962 -4.690 1.00 0.00 H new ATOM 0 HD3 ARG B 418 -15.046 -3.058 -4.199 1.00 0.00 H new ATOM 0 HE ARG B 418 -13.629 -2.004 -6.568 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -16.221 -4.015 -5.272 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -17.149 -3.992 -6.775 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -14.822 -1.976 -8.495 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -16.359 -2.841 -8.595 1.00 0.00 H new ATOM 1870 N ASN B 419 -10.029 -2.981 -3.943 1.00 0.00 N ATOM 1871 CA ASN B 419 -9.023 -3.880 -4.500 1.00 0.00 C ATOM 1872 C ASN B 419 -7.693 -3.153 -4.606 1.00 0.00 C ATOM 1873 O ASN B 419 -6.863 -3.464 -5.458 1.00 0.00 O ATOM 1874 CB ASN B 419 -9.454 -4.399 -5.875 1.00 0.00 C ATOM 1875 CG ASN B 419 -10.475 -3.501 -6.544 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -11.609 -3.380 -6.080 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -10.078 -2.869 -7.641 1.00 0.00 N ATOM 0 H ASN B 419 -10.444 -2.341 -4.620 1.00 0.00 H new ATOM 0 HA ASN B 419 -8.915 -4.737 -3.835 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -8.577 -4.487 -6.517 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -9.872 -5.400 -5.767 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -10.723 -2.253 -8.136 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -9.128 -2.999 -7.989 1.00 0.00 H new ATOM 1884 N ILE B 420 -7.506 -2.213 -3.686 1.00 0.00 N ATOM 1885 CA ILE B 420 -6.286 -1.405 -3.567 1.00 0.00 C ATOM 1886 C ILE B 420 -5.811 -0.740 -4.869 1.00 0.00 C ATOM 1887 O ILE B 420 -5.432 0.429 -4.848 1.00 0.00 O ATOM 1888 CB ILE B 420 -5.136 -2.219 -2.951 1.00 0.00 C ATOM 1889 CG1 ILE B 420 -4.255 -2.863 -4.029 1.00 0.00 C ATOM 1890 CG2 ILE B 420 -5.699 -3.279 -2.019 1.00 0.00 C ATOM 1891 CD1 ILE B 420 -3.129 -1.968 -4.503 1.00 0.00 C ATOM 0 H ILE B 420 -8.210 -1.982 -2.985 1.00 0.00 H new ATOM 0 HA ILE B 420 -6.571 -0.589 -2.902 1.00 0.00 H new ATOM 0 HB ILE B 420 -4.505 -1.536 -2.382 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -3.833 -3.788 -3.637 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -4.877 -3.133 -4.882 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -4.881 -3.853 -1.585 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -6.268 -2.799 -1.223 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -6.353 -3.946 -2.580 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -2.547 -2.488 -5.264 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -3.545 -1.053 -4.925 1.00 0.00 H new ATOM 0 HD13 ILE B 420 -2.484 -1.718 -3.661 1.00 0.00 H new ATOM 1903 N LYS B 421 -5.809 -1.456 -5.992 1.00 0.00 N ATOM 1904 CA LYS B 421 -5.359 -0.864 -7.238 1.00 0.00 C ATOM 1905 C LYS B 421 -6.018 0.488 -7.402 1.00 0.00 C ATOM 1906 O LYS B 421 -5.352 1.487 -7.660 1.00 0.00 O ATOM 1907 CB LYS B 421 -5.670 -1.783 -8.422 1.00 0.00 C ATOM 1908 CG LYS B 421 -5.971 -1.054 -9.719 1.00 0.00 C ATOM 1909 CD LYS B 421 -7.367 -0.464 -9.703 1.00 0.00 C ATOM 1910 CE LYS B 421 -7.983 -0.453 -11.094 1.00 0.00 C ATOM 1911 NZ LYS B 421 -9.463 -0.600 -11.048 1.00 0.00 N ATOM 0 H LYS B 421 -6.109 -2.429 -6.060 1.00 0.00 H new ATOM 0 HA LYS B 421 -4.277 -0.733 -7.212 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -4.822 -2.449 -8.582 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -6.524 -2.410 -8.165 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -5.239 -0.261 -9.872 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -5.874 -1.743 -10.558 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -7.999 -1.041 -9.028 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -7.329 0.553 -9.313 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -7.727 0.479 -11.597 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -7.556 -1.263 -11.686 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -9.843 -0.588 -12.016 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -9.708 -1.501 -10.591 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -9.873 0.186 -10.505 1.00 0.00 H new ATOM 1925 N ILE B 422 -7.332 0.521 -7.215 1.00 0.00 N ATOM 1926 CA ILE B 422 -8.055 1.778 -7.310 1.00 0.00 C ATOM 1927 C ILE B 422 -7.301 2.812 -6.511 1.00 0.00 C ATOM 1928 O ILE B 422 -7.201 3.962 -6.907 1.00 0.00 O ATOM 1929 CB ILE B 422 -9.498 1.709 -6.767 1.00 0.00 C ATOM 1930 CG1 ILE B 422 -9.970 0.264 -6.641 1.00 0.00 C ATOM 1931 CG2 ILE B 422 -10.431 2.510 -7.660 1.00 0.00 C ATOM 1932 CD1 ILE B 422 -9.437 -0.424 -5.404 1.00 0.00 C ATOM 0 H ILE B 422 -7.908 -0.293 -7.001 1.00 0.00 H new ATOM 0 HA ILE B 422 -8.125 2.029 -8.368 1.00 0.00 H new ATOM 0 HB ILE B 422 -9.512 2.147 -5.769 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -11.060 0.244 -6.621 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -9.657 -0.293 -7.524 1.00 0.00 H new ATOM 0 HG21 ILE B 422 -11.447 2.455 -7.268 1.00 0.00 H new ATOM 0 HG22 ILE B 422 -10.107 3.551 -7.684 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -10.409 2.100 -8.670 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -9.807 -1.449 -5.370 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -8.347 -0.432 -5.433 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -9.772 0.113 -4.516 1.00 0.00 H new ATOM 1944 N ALA B 423 -6.745 2.369 -5.388 1.00 0.00 N ATOM 1945 CA ALA B 423 -5.968 3.239 -4.532 1.00 0.00 C ATOM 1946 C ALA B 423 -4.667 3.614 -5.227 1.00 0.00 C ATOM 1947 O ALA B 423 -4.287 4.783 -5.272 1.00 0.00 O ATOM 1948 CB ALA B 423 -5.699 2.565 -3.197 1.00 0.00 C ATOM 0 H ALA B 423 -6.822 1.408 -5.054 1.00 0.00 H new ATOM 0 HA ALA B 423 -6.533 4.151 -4.338 1.00 0.00 H new ATOM 0 HB1 ALA B 423 -5.114 3.232 -2.564 1.00 0.00 H new ATOM 0 HB2 ALA B 423 -6.646 2.338 -2.707 1.00 0.00 H new ATOM 0 HB3 ALA B 423 -5.145 1.641 -3.361 1.00 0.00 H new ATOM 1954 N GLY B 424 -3.998 2.611 -5.794 1.00 0.00 N ATOM 1955 CA GLY B 424 -2.759 2.863 -6.503 1.00 0.00 C ATOM 1956 C GLY B 424 -2.964 3.833 -7.647 1.00 0.00 C ATOM 1957 O GLY B 424 -2.360 4.907 -7.679 1.00 0.00 O ATOM 0 H GLY B 424 -4.292 1.635 -5.774 1.00 0.00 H new ATOM 0 HA2 GLY B 424 -2.018 3.265 -5.812 1.00 0.00 H new ATOM 0 HA3 GLY B 424 -2.361 1.924 -6.887 1.00 0.00 H new ATOM 1961 N ILE B 425 -3.836 3.463 -8.582 1.00 0.00 N ATOM 1962 CA ILE B 425 -4.131 4.321 -9.722 1.00 0.00 C ATOM 1963 C ILE B 425 -4.715 5.653 -9.261 1.00 0.00 C ATOM 1964 O ILE B 425 -4.381 6.708 -9.800 1.00 0.00 O ATOM 1965 CB ILE B 425 -5.119 3.650 -10.696 1.00 0.00 C ATOM 1966 CG1 ILE B 425 -4.736 2.185 -10.939 1.00 0.00 C ATOM 1967 CG2 ILE B 425 -5.163 4.415 -12.009 1.00 0.00 C ATOM 1968 CD1 ILE B 425 -3.266 1.888 -10.726 1.00 0.00 C ATOM 0 H ILE B 425 -4.347 2.580 -8.572 1.00 0.00 H new ATOM 0 HA ILE B 425 -3.189 4.495 -10.241 1.00 0.00 H new ATOM 0 HB ILE B 425 -6.112 3.669 -10.247 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -5.324 1.552 -10.275 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -5.007 1.914 -11.960 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -5.864 3.931 -12.689 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -5.486 5.439 -11.823 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -4.170 4.424 -12.458 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -3.077 0.832 -10.918 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -2.670 2.493 -11.409 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -2.992 2.125 -9.698 1.00 0.00 H new ATOM 1980 N ARG B 426 -5.585 5.597 -8.254 1.00 0.00 N ATOM 1981 CA ARG B 426 -6.209 6.800 -7.714 1.00 0.00 C ATOM 1982 C ARG B 426 -5.146 7.781 -7.239 1.00 0.00 C ATOM 1983 O ARG B 426 -5.247 8.985 -7.473 1.00 0.00 O ATOM 1984 CB ARG B 426 -7.150 6.446 -6.560 1.00 0.00 C ATOM 1985 CG ARG B 426 -7.699 7.653 -5.822 1.00 0.00 C ATOM 1986 CD ARG B 426 -8.600 8.481 -6.721 1.00 0.00 C ATOM 1987 NE ARG B 426 -9.361 9.476 -5.972 1.00 0.00 N ATOM 1988 CZ ARG B 426 -10.234 10.305 -6.532 1.00 0.00 C ATOM 1989 NH1 ARG B 426 -10.456 10.250 -7.839 1.00 0.00 N ATOM 1990 NH2 ARG B 426 -10.885 11.189 -5.788 1.00 0.00 N ATOM 0 H ARG B 426 -5.872 4.732 -7.797 1.00 0.00 H new ATOM 0 HA ARG B 426 -6.791 7.269 -8.507 1.00 0.00 H new ATOM 0 HB2 ARG B 426 -7.983 5.861 -6.950 1.00 0.00 H new ATOM 0 HB3 ARG B 426 -6.618 5.811 -5.852 1.00 0.00 H new ATOM 0 HG2 ARG B 426 -8.258 7.324 -4.946 1.00 0.00 H new ATOM 0 HG3 ARG B 426 -6.875 8.269 -5.462 1.00 0.00 H new ATOM 0 HD2 ARG B 426 -7.995 8.982 -7.477 1.00 0.00 H new ATOM 0 HD3 ARG B 426 -9.288 7.822 -7.249 1.00 0.00 H new ATOM 0 HE ARG B 426 -9.214 9.538 -4.964 1.00 0.00 H new ATOM 0 HH11 ARG B 426 -9.956 9.571 -8.413 1.00 0.00 H new ATOM 0 HH12 ARG B 426 -11.127 10.887 -8.270 1.00 0.00 H new ATOM 0 HH21 ARG B 426 -10.716 11.233 -4.783 1.00 0.00 H new ATOM 0 HH22 ARG B 426 -11.555 11.825 -6.221 1.00 0.00 H new ATOM 2004 N ALA B 427 -4.120 7.255 -6.577 1.00 0.00 N ATOM 2005 CA ALA B 427 -3.035 8.086 -6.082 1.00 0.00 C ATOM 2006 C ALA B 427 -2.318 8.771 -7.242 1.00 0.00 C ATOM 2007 O ALA B 427 -2.036 9.968 -7.190 1.00 0.00 O ATOM 2008 CB ALA B 427 -2.052 7.267 -5.257 1.00 0.00 C ATOM 0 H ALA B 427 -4.020 6.261 -6.373 1.00 0.00 H new ATOM 0 HA ALA B 427 -3.463 8.852 -5.435 1.00 0.00 H new ATOM 0 HB1 ALA B 427 -1.250 7.913 -4.899 1.00 0.00 H new ATOM 0 HB2 ALA B 427 -2.570 6.826 -4.405 1.00 0.00 H new ATOM 0 HB3 ALA B 427 -1.630 6.474 -5.875 1.00 0.00 H new ATOM 2014 N ALA B 428 -2.032 8.007 -8.292 1.00 0.00 N ATOM 2015 CA ALA B 428 -1.355 8.552 -9.463 1.00 0.00 C ATOM 2016 C ALA B 428 -2.135 9.735 -10.024 1.00 0.00 C ATOM 2017 O ALA B 428 -1.624 10.856 -10.093 1.00 0.00 O ATOM 2018 CB ALA B 428 -1.162 7.485 -10.531 1.00 0.00 C ATOM 0 H ALA B 428 -2.257 7.014 -8.356 1.00 0.00 H new ATOM 0 HA ALA B 428 -0.369 8.899 -9.153 1.00 0.00 H new ATOM 0 HB1 ALA B 428 -0.655 7.920 -11.392 1.00 0.00 H new ATOM 0 HB2 ALA B 428 -0.559 6.671 -10.128 1.00 0.00 H new ATOM 0 HB3 ALA B 428 -2.134 7.099 -10.839 1.00 0.00 H new ATOM 2024 N GLU B 429 -3.382 9.486 -10.408 1.00 0.00 N ATOM 2025 CA GLU B 429 -4.231 10.540 -10.942 1.00 0.00 C ATOM 2026 C GLU B 429 -4.216 11.735 -10.002 1.00 0.00 C ATOM 2027 O GLU B 429 -4.332 12.881 -10.432 1.00 0.00 O ATOM 2028 CB GLU B 429 -5.663 10.035 -11.125 1.00 0.00 C ATOM 2029 CG GLU B 429 -5.953 9.522 -12.525 1.00 0.00 C ATOM 2030 CD GLU B 429 -6.115 8.015 -12.570 1.00 0.00 C ATOM 2031 OE1 GLU B 429 -6.508 7.428 -11.540 1.00 0.00 O ATOM 2032 OE2 GLU B 429 -5.847 7.421 -13.636 1.00 0.00 O ATOM 0 H GLU B 429 -3.824 8.568 -10.359 1.00 0.00 H new ATOM 0 HA GLU B 429 -3.845 10.842 -11.916 1.00 0.00 H new ATOM 0 HB2 GLU B 429 -5.852 9.236 -10.408 1.00 0.00 H new ATOM 0 HB3 GLU B 429 -6.357 10.843 -10.892 1.00 0.00 H new ATOM 0 HG2 GLU B 429 -6.862 9.993 -12.900 1.00 0.00 H new ATOM 0 HG3 GLU B 429 -5.143 9.817 -13.192 1.00 0.00 H new ATOM 2039 N ASN B 430 -4.062 11.448 -8.711 1.00 0.00 N ATOM 2040 CA ASN B 430 -4.018 12.488 -7.693 1.00 0.00 C ATOM 2041 C ASN B 430 -2.804 13.388 -7.896 1.00 0.00 C ATOM 2042 O ASN B 430 -2.889 14.605 -7.729 1.00 0.00 O ATOM 2043 CB ASN B 430 -3.987 11.861 -6.300 1.00 0.00 C ATOM 2044 CG ASN B 430 -5.309 12.015 -5.574 1.00 0.00 C ATOM 2045 OD1 ASN B 430 -5.425 12.802 -4.634 1.00 0.00 O ATOM 2046 ND2 ASN B 430 -6.316 11.264 -6.004 1.00 0.00 N ATOM 0 H ASN B 430 -3.966 10.500 -8.347 1.00 0.00 H new ATOM 0 HA ASN B 430 -4.916 13.099 -7.784 1.00 0.00 H new ATOM 0 HB2 ASN B 430 -3.742 10.802 -6.385 1.00 0.00 H new ATOM 0 HB3 ASN B 430 -3.195 12.325 -5.712 1.00 0.00 H new ATOM 0 HD21 ASN B 430 -7.228 11.327 -5.552 1.00 0.00 H new ATOM 0 HD22 ASN B 430 -6.177 10.624 -6.786 1.00 0.00 H new ATOM 2053 N ALA B 431 -1.670 12.785 -8.258 1.00 0.00 N ATOM 2054 CA ALA B 431 -0.446 13.543 -8.478 1.00 0.00 C ATOM 2055 C ALA B 431 -0.610 14.477 -9.664 1.00 0.00 C ATOM 2056 O ALA B 431 -0.185 15.632 -9.625 1.00 0.00 O ATOM 2057 CB ALA B 431 0.743 12.618 -8.692 1.00 0.00 C ATOM 0 H ALA B 431 -1.578 11.780 -8.403 1.00 0.00 H new ATOM 0 HA ALA B 431 -0.253 14.138 -7.585 1.00 0.00 H new ATOM 0 HB1 ALA B 431 1.642 13.213 -8.854 1.00 0.00 H new ATOM 0 HB2 ALA B 431 0.877 11.989 -7.812 1.00 0.00 H new ATOM 0 HB3 ALA B 431 0.562 11.989 -9.564 1.00 0.00 H new ATOM 2063 N LEU B 432 -1.243 13.973 -10.716 1.00 0.00 N ATOM 2064 CA LEU B 432 -1.479 14.767 -11.913 1.00 0.00 C ATOM 2065 C LEU B 432 -2.765 15.572 -11.777 1.00 0.00 C ATOM 2066 O LEU B 432 -3.236 16.179 -12.738 1.00 0.00 O ATOM 2067 CB LEU B 432 -1.562 13.863 -13.142 1.00 0.00 C ATOM 2068 CG LEU B 432 -2.398 12.597 -12.964 1.00 0.00 C ATOM 2069 CD1 LEU B 432 -3.355 12.422 -14.134 1.00 0.00 C ATOM 2070 CD2 LEU B 432 -1.497 11.380 -12.825 1.00 0.00 C ATOM 0 H LEU B 432 -1.601 13.019 -10.764 1.00 0.00 H new ATOM 0 HA LEU B 432 -0.644 15.457 -12.035 1.00 0.00 H new ATOM 0 HB2 LEU B 432 -1.976 14.439 -13.969 1.00 0.00 H new ATOM 0 HB3 LEU B 432 -0.551 13.574 -13.429 1.00 0.00 H new ATOM 0 HG LEU B 432 -2.985 12.697 -12.051 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -3.943 11.515 -13.991 1.00 0.00 H new ATOM 0 HD12 LEU B 432 -4.022 13.282 -14.190 1.00 0.00 H new ATOM 0 HD13 LEU B 432 -2.786 12.343 -15.061 1.00 0.00 H new ATOM 0 HD21 LEU B 432 -2.109 10.487 -12.699 1.00 0.00 H new ATOM 0 HD22 LEU B 432 -0.884 11.277 -13.721 1.00 0.00 H new ATOM 0 HD23 LEU B 432 -0.851 11.503 -11.956 1.00 0.00 H new ATOM 2082 N ARG B 433 -3.331 15.571 -10.572 1.00 0.00 N ATOM 2083 CA ARG B 433 -4.564 16.298 -10.305 1.00 0.00 C ATOM 2084 C ARG B 433 -4.264 17.687 -9.756 1.00 0.00 C ATOM 2085 O ARG B 433 -5.158 18.381 -9.272 1.00 0.00 O ATOM 2086 CB ARG B 433 -5.428 15.522 -9.310 1.00 0.00 C ATOM 2087 CG ARG B 433 -6.918 15.749 -9.493 1.00 0.00 C ATOM 2088 CD ARG B 433 -7.729 14.858 -8.566 1.00 0.00 C ATOM 2089 NE ARG B 433 -8.388 13.773 -9.285 1.00 0.00 N ATOM 2090 CZ ARG B 433 -9.522 13.922 -9.961 1.00 0.00 C ATOM 2091 NH1 ARG B 433 -10.111 15.108 -10.015 1.00 0.00 N ATOM 2092 NH2 ARG B 433 -10.067 12.887 -10.585 1.00 0.00 N ATOM 0 H ARG B 433 -2.953 15.073 -9.766 1.00 0.00 H new ATOM 0 HA ARG B 433 -5.107 16.406 -11.244 1.00 0.00 H new ATOM 0 HB2 ARG B 433 -5.216 14.458 -9.410 1.00 0.00 H new ATOM 0 HB3 ARG B 433 -5.147 15.809 -8.297 1.00 0.00 H new ATOM 0 HG2 ARG B 433 -7.156 16.794 -9.297 1.00 0.00 H new ATOM 0 HG3 ARG B 433 -7.194 15.548 -10.528 1.00 0.00 H new ATOM 0 HD2 ARG B 433 -7.074 14.440 -7.801 1.00 0.00 H new ATOM 0 HD3 ARG B 433 -8.479 15.459 -8.051 1.00 0.00 H new ATOM 0 HE ARG B 433 -7.955 12.850 -9.268 1.00 0.00 H new ATOM 0 HH11 ARG B 433 -9.694 15.907 -9.537 1.00 0.00 H new ATOM 0 HH12 ARG B 433 -10.982 15.222 -10.534 1.00 0.00 H new ATOM 0 HH21 ARG B 433 -9.616 11.973 -10.547 1.00 0.00 H new ATOM 0 HH22 ARG B 433 -10.938 13.005 -11.103 1.00 0.00 H new ATOM 2106 N ASP B 434 -2.999 18.089 -9.833 1.00 0.00 N ATOM 2107 CA ASP B 434 -2.586 19.395 -9.341 1.00 0.00 C ATOM 2108 C ASP B 434 -1.864 20.182 -10.432 1.00 0.00 C ATOM 2109 O ASP B 434 -0.636 20.244 -10.458 1.00 0.00 O ATOM 2110 CB ASP B 434 -1.678 19.235 -8.119 1.00 0.00 C ATOM 2111 CG ASP B 434 -2.152 18.138 -7.185 1.00 0.00 C ATOM 2112 OD1 ASP B 434 -3.007 18.421 -6.321 1.00 0.00 O ATOM 2113 OD2 ASP B 434 -1.666 16.995 -7.320 1.00 0.00 O ATOM 0 H ASP B 434 -2.245 17.529 -10.231 1.00 0.00 H new ATOM 0 HA ASP B 434 -3.478 19.950 -9.051 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -0.664 19.013 -8.450 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -1.636 20.179 -7.575 1.00 0.00 H new ATOM 2118 N LYS B 435 -2.640 20.777 -11.332 1.00 0.00 N ATOM 2119 CA LYS B 435 -2.083 21.558 -12.431 1.00 0.00 C ATOM 2120 C LYS B 435 -0.995 22.505 -11.933 1.00 0.00 C ATOM 2121 O LYS B 435 0.094 22.570 -12.502 1.00 0.00 O ATOM 2122 CB LYS B 435 -3.188 22.356 -13.126 1.00 0.00 C ATOM 2123 CG LYS B 435 -3.452 23.711 -12.489 1.00 0.00 C ATOM 2124 CD LYS B 435 -4.518 24.486 -13.244 1.00 0.00 C ATOM 2125 CE LYS B 435 -5.729 23.617 -13.543 1.00 0.00 C ATOM 2126 NZ LYS B 435 -6.771 24.359 -14.304 1.00 0.00 N ATOM 0 H LYS B 435 -3.659 20.733 -11.322 1.00 0.00 H new ATOM 0 HA LYS B 435 -1.637 20.866 -13.145 1.00 0.00 H new ATOM 0 HB2 LYS B 435 -2.917 22.502 -14.172 1.00 0.00 H new ATOM 0 HB3 LYS B 435 -4.109 21.773 -13.114 1.00 0.00 H new ATOM 0 HG2 LYS B 435 -3.766 23.572 -11.455 1.00 0.00 H new ATOM 0 HG3 LYS B 435 -2.528 24.289 -12.467 1.00 0.00 H new ATOM 0 HD2 LYS B 435 -4.825 25.351 -12.657 1.00 0.00 H new ATOM 0 HD3 LYS B 435 -4.102 24.866 -14.177 1.00 0.00 H new ATOM 0 HE2 LYS B 435 -5.416 22.743 -14.114 1.00 0.00 H new ATOM 0 HE3 LYS B 435 -6.154 23.252 -12.608 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 -7.580 23.731 -14.488 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 -7.088 25.179 -13.749 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 -6.374 24.686 -15.208 1.00 0.00 H new ATOM 2140 N LYS B 436 -1.303 23.241 -10.873 1.00 0.00 N ATOM 2141 CA LYS B 436 -0.358 24.188 -10.299 1.00 0.00 C ATOM 2142 C LYS B 436 0.934 23.486 -9.893 1.00 0.00 C ATOM 2143 O LYS B 436 2.028 23.954 -10.205 1.00 0.00 O ATOM 2144 CB LYS B 436 -0.983 24.894 -9.097 1.00 0.00 C ATOM 2145 CG LYS B 436 -2.310 25.565 -9.419 1.00 0.00 C ATOM 2146 CD LYS B 436 -3.098 25.880 -8.159 1.00 0.00 C ATOM 2147 CE LYS B 436 -3.211 27.379 -7.936 1.00 0.00 C ATOM 2148 NZ LYS B 436 -4.625 27.844 -7.988 1.00 0.00 N ATOM 0 H LYS B 436 -2.202 23.200 -10.393 1.00 0.00 H new ATOM 0 HA LYS B 436 -0.115 24.934 -11.056 1.00 0.00 H new ATOM 0 HB2 LYS B 436 -1.134 24.170 -8.297 1.00 0.00 H new ATOM 0 HB3 LYS B 436 -0.286 25.643 -8.721 1.00 0.00 H new ATOM 0 HG2 LYS B 436 -2.128 26.485 -9.974 1.00 0.00 H new ATOM 0 HG3 LYS B 436 -2.900 24.915 -10.065 1.00 0.00 H new ATOM 0 HD2 LYS B 436 -4.095 25.446 -8.233 1.00 0.00 H new ATOM 0 HD3 LYS B 436 -2.612 25.418 -7.299 1.00 0.00 H new ATOM 0 HE2 LYS B 436 -2.780 27.635 -6.968 1.00 0.00 H new ATOM 0 HE3 LYS B 436 -2.628 27.903 -8.693 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 -4.659 28.872 -7.831 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 -5.029 27.623 -8.920 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 -5.176 27.363 -7.249 1.00 0.00 H new ATOM 2162 N MET B 437 0.801 22.352 -9.211 1.00 0.00 N ATOM 2163 CA MET B 437 1.965 21.583 -8.784 1.00 0.00 C ATOM 2164 C MET B 437 2.720 21.070 -9.999 1.00 0.00 C ATOM 2165 O MET B 437 3.857 21.468 -10.255 1.00 0.00 O ATOM 2166 CB MET B 437 1.542 20.406 -7.903 1.00 0.00 C ATOM 2167 CG MET B 437 2.711 19.688 -7.249 1.00 0.00 C ATOM 2168 SD MET B 437 2.995 18.047 -7.941 1.00 0.00 S ATOM 2169 CE MET B 437 1.327 17.395 -7.978 1.00 0.00 C ATOM 0 H MET B 437 -0.096 21.947 -8.943 1.00 0.00 H new ATOM 0 HA MET B 437 2.616 22.236 -8.202 1.00 0.00 H new ATOM 0 HB2 MET B 437 0.867 20.767 -7.127 1.00 0.00 H new ATOM 0 HB3 MET B 437 0.980 19.694 -8.507 1.00 0.00 H new ATOM 0 HG2 MET B 437 3.613 20.289 -7.367 1.00 0.00 H new ATOM 0 HG3 MET B 437 2.525 19.599 -6.179 1.00 0.00 H new ATOM 0 HE1 MET B 437 1.359 16.309 -7.892 1.00 0.00 H new ATOM 0 HE2 MET B 437 0.756 17.808 -7.146 1.00 0.00 H new ATOM 0 HE3 MET B 437 0.849 17.670 -8.918 1.00 0.00 H new ATOM 2179 N LEU B 438 2.073 20.192 -10.756 1.00 0.00 N ATOM 2180 CA LEU B 438 2.676 19.634 -11.957 1.00 0.00 C ATOM 2181 C LEU B 438 3.462 20.710 -12.695 1.00 0.00 C ATOM 2182 O LEU B 438 4.692 20.663 -12.773 1.00 0.00 O ATOM 2183 CB LEU B 438 1.592 19.069 -12.878 1.00 0.00 C ATOM 2184 CG LEU B 438 0.747 17.940 -12.284 1.00 0.00 C ATOM 2185 CD1 LEU B 438 -0.503 17.722 -13.122 1.00 0.00 C ATOM 2186 CD2 LEU B 438 1.559 16.657 -12.193 1.00 0.00 C ATOM 0 H LEU B 438 1.132 19.852 -10.559 1.00 0.00 H new ATOM 0 HA LEU B 438 3.352 18.830 -11.666 1.00 0.00 H new ATOM 0 HB2 LEU B 438 0.927 19.882 -13.170 1.00 0.00 H new ATOM 0 HB3 LEU B 438 2.067 18.704 -13.788 1.00 0.00 H new ATOM 0 HG LEU B 438 0.445 18.225 -11.276 1.00 0.00 H new ATOM 0 HD11 LEU B 438 -1.096 16.916 -12.689 1.00 0.00 H new ATOM 0 HD12 LEU B 438 -1.094 18.638 -13.139 1.00 0.00 H new ATOM 0 HD13 LEU B 438 -0.217 17.455 -14.139 1.00 0.00 H new ATOM 0 HD21 LEU B 438 0.942 15.865 -11.768 1.00 0.00 H new ATOM 0 HD22 LEU B 438 1.890 16.364 -13.190 1.00 0.00 H new ATOM 0 HD23 LEU B 438 2.428 16.821 -11.556 1.00 0.00 H new ATOM 2198 N ASP B 439 2.736 21.685 -13.231 1.00 0.00 N ATOM 2199 CA ASP B 439 3.349 22.787 -13.962 1.00 0.00 C ATOM 2200 C ASP B 439 4.520 23.368 -13.178 1.00 0.00 C ATOM 2201 O ASP B 439 5.583 23.641 -13.738 1.00 0.00 O ATOM 2202 CB ASP B 439 2.315 23.883 -14.236 1.00 0.00 C ATOM 2203 CG ASP B 439 2.855 24.974 -15.139 1.00 0.00 C ATOM 2204 OD1 ASP B 439 3.543 25.883 -14.627 1.00 0.00 O ATOM 2205 OD2 ASP B 439 2.591 24.921 -16.358 1.00 0.00 O ATOM 0 H ASP B 439 1.719 21.734 -13.172 1.00 0.00 H new ATOM 0 HA ASP B 439 3.720 22.401 -14.911 1.00 0.00 H new ATOM 0 HB2 ASP B 439 1.432 23.439 -14.695 1.00 0.00 H new ATOM 0 HB3 ASP B 439 1.996 24.322 -13.291 1.00 0.00 H new ATOM 2210 N PHE B 440 4.317 23.552 -11.878 1.00 0.00 N ATOM 2211 CA PHE B 440 5.356 24.097 -11.018 1.00 0.00 C ATOM 2212 C PHE B 440 6.644 23.296 -11.185 1.00 0.00 C ATOM 2213 O PHE B 440 7.747 23.836 -11.084 1.00 0.00 O ATOM 2214 CB PHE B 440 4.884 24.093 -9.556 1.00 0.00 C ATOM 2215 CG PHE B 440 5.948 23.729 -8.555 1.00 0.00 C ATOM 2216 CD1 PHE B 440 7.051 24.547 -8.367 1.00 0.00 C ATOM 2217 CD2 PHE B 440 5.839 22.571 -7.802 1.00 0.00 C ATOM 2218 CE1 PHE B 440 8.027 24.215 -7.445 1.00 0.00 C ATOM 2219 CE2 PHE B 440 6.811 22.235 -6.879 1.00 0.00 C ATOM 2220 CZ PHE B 440 7.907 23.057 -6.700 1.00 0.00 C ATOM 0 H PHE B 440 3.444 23.332 -11.399 1.00 0.00 H new ATOM 0 HA PHE B 440 5.559 25.129 -11.305 1.00 0.00 H new ATOM 0 HB2 PHE B 440 4.496 25.081 -9.311 1.00 0.00 H new ATOM 0 HB3 PHE B 440 4.056 23.392 -9.457 1.00 0.00 H new ATOM 0 HD1 PHE B 440 7.149 25.453 -8.946 1.00 0.00 H new ATOM 0 HD2 PHE B 440 4.985 21.924 -7.938 1.00 0.00 H new ATOM 0 HE1 PHE B 440 8.882 24.860 -7.307 1.00 0.00 H new ATOM 0 HE2 PHE B 440 6.714 21.330 -6.298 1.00 0.00 H new ATOM 0 HZ PHE B 440 8.668 22.795 -5.980 1.00 0.00 H new ATOM 2230 N TYR B 441 6.493 22.003 -11.449 1.00 0.00 N ATOM 2231 CA TYR B 441 7.639 21.132 -11.635 1.00 0.00 C ATOM 2232 C TYR B 441 8.272 21.359 -12.996 1.00 0.00 C ATOM 2233 O TYR B 441 9.491 21.415 -13.115 1.00 0.00 O ATOM 2234 CB TYR B 441 7.233 19.674 -11.456 1.00 0.00 C ATOM 2235 CG TYR B 441 7.241 19.262 -10.007 1.00 0.00 C ATOM 2236 CD1 TYR B 441 8.408 18.822 -9.400 1.00 0.00 C ATOM 2237 CD2 TYR B 441 6.090 19.346 -9.237 1.00 0.00 C ATOM 2238 CE1 TYR B 441 8.429 18.467 -8.068 1.00 0.00 C ATOM 2239 CE2 TYR B 441 6.100 18.998 -7.902 1.00 0.00 C ATOM 2240 CZ TYR B 441 7.272 18.558 -7.321 1.00 0.00 C ATOM 2241 OH TYR B 441 7.290 18.210 -5.990 1.00 0.00 O ATOM 0 H TYR B 441 5.589 21.539 -11.538 1.00 0.00 H new ATOM 0 HA TYR B 441 8.384 21.373 -10.876 1.00 0.00 H new ATOM 0 HB2 TYR B 441 6.237 19.521 -11.871 1.00 0.00 H new ATOM 0 HB3 TYR B 441 7.914 19.036 -12.019 1.00 0.00 H new ATOM 0 HD1 TYR B 441 9.316 18.756 -9.981 1.00 0.00 H new ATOM 0 HD2 TYR B 441 5.172 19.689 -9.690 1.00 0.00 H new ATOM 0 HE1 TYR B 441 9.345 18.120 -7.612 1.00 0.00 H new ATOM 0 HE2 TYR B 441 5.196 19.069 -7.315 1.00 0.00 H new ATOM 0 HH TYR B 441 6.881 18.925 -5.459 1.00 0.00 H new ATOM 2251 N ALA B 442 7.444 21.522 -14.019 1.00 0.00 N ATOM 2252 CA ALA B 442 7.961 21.781 -15.354 1.00 0.00 C ATOM 2253 C ALA B 442 8.983 22.906 -15.276 1.00 0.00 C ATOM 2254 O ALA B 442 10.072 22.831 -15.857 1.00 0.00 O ATOM 2255 CB ALA B 442 6.842 22.140 -16.321 1.00 0.00 C ATOM 0 H ALA B 442 6.427 21.480 -13.952 1.00 0.00 H new ATOM 0 HA ALA B 442 8.437 20.876 -15.733 1.00 0.00 H new ATOM 0 HB1 ALA B 442 7.261 22.328 -17.309 1.00 0.00 H new ATOM 0 HB2 ALA B 442 6.132 21.315 -16.379 1.00 0.00 H new ATOM 0 HB3 ALA B 442 6.330 23.035 -15.968 1.00 0.00 H new ATOM 2261 N LYS B 443 8.631 23.941 -14.517 1.00 0.00 N ATOM 2262 CA LYS B 443 9.512 25.078 -14.317 1.00 0.00 C ATOM 2263 C LYS B 443 10.782 24.627 -13.611 1.00 0.00 C ATOM 2264 O LYS B 443 11.891 24.913 -14.063 1.00 0.00 O ATOM 2265 CB LYS B 443 8.809 26.161 -13.497 1.00 0.00 C ATOM 2266 CG LYS B 443 9.728 27.289 -13.059 1.00 0.00 C ATOM 2267 CD LYS B 443 10.277 27.054 -11.661 1.00 0.00 C ATOM 2268 CE LYS B 443 11.556 27.842 -11.426 1.00 0.00 C ATOM 2269 NZ LYS B 443 11.522 28.587 -10.136 1.00 0.00 N ATOM 0 H LYS B 443 7.737 24.011 -14.031 1.00 0.00 H new ATOM 0 HA LYS B 443 9.773 25.497 -15.289 1.00 0.00 H new ATOM 0 HB2 LYS B 443 7.992 26.578 -14.086 1.00 0.00 H new ATOM 0 HB3 LYS B 443 8.363 25.704 -12.614 1.00 0.00 H new ATOM 0 HG2 LYS B 443 10.554 27.380 -13.764 1.00 0.00 H new ATOM 0 HG3 LYS B 443 9.183 28.233 -13.082 1.00 0.00 H new ATOM 0 HD2 LYS B 443 9.529 27.342 -10.922 1.00 0.00 H new ATOM 0 HD3 LYS B 443 10.472 25.991 -11.519 1.00 0.00 H new ATOM 0 HE2 LYS B 443 12.407 27.161 -11.429 1.00 0.00 H new ATOM 0 HE3 LYS B 443 11.706 28.544 -12.246 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 12.412 29.111 -10.014 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 10.725 29.255 -10.142 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 11.405 27.916 -9.350 1.00 0.00 H new ATOM 2283 N GLN B 444 10.614 23.902 -12.507 1.00 0.00 N ATOM 2284 CA GLN B 444 11.752 23.398 -11.759 1.00 0.00 C ATOM 2285 C GLN B 444 12.650 22.578 -12.677 1.00 0.00 C ATOM 2286 O GLN B 444 13.874 22.614 -12.558 1.00 0.00 O ATOM 2287 CB GLN B 444 11.285 22.542 -10.582 1.00 0.00 C ATOM 2288 CG GLN B 444 11.098 23.327 -9.296 1.00 0.00 C ATOM 2289 CD GLN B 444 11.873 22.727 -8.144 1.00 0.00 C ATOM 2290 OE1 GLN B 444 12.351 23.439 -7.261 1.00 0.00 O ATOM 2291 NE2 GLN B 444 12.000 21.404 -8.147 1.00 0.00 N ATOM 0 H GLN B 444 9.705 23.654 -12.117 1.00 0.00 H new ATOM 0 HA GLN B 444 12.316 24.245 -11.367 1.00 0.00 H new ATOM 0 HB2 GLN B 444 10.343 22.061 -10.845 1.00 0.00 H new ATOM 0 HB3 GLN B 444 12.011 21.748 -10.411 1.00 0.00 H new ATOM 0 HG2 GLN B 444 11.419 24.357 -9.451 1.00 0.00 H new ATOM 0 HG3 GLN B 444 10.038 23.358 -9.042 1.00 0.00 H new ATOM 0 HE21 GLN B 444 11.587 20.854 -8.900 1.00 0.00 H new ATOM 0 HE22 GLN B 444 12.511 20.939 -7.396 1.00 0.00 H new ATOM 2300 N ARG B 445 12.023 21.847 -13.596 1.00 0.00 N ATOM 2301 CA ARG B 445 12.746 21.017 -14.551 1.00 0.00 C ATOM 2302 C ARG B 445 13.760 21.849 -15.318 1.00 0.00 C ATOM 2303 O ARG B 445 14.942 21.516 -15.368 1.00 0.00 O ATOM 2304 CB ARG B 445 11.772 20.354 -15.525 1.00 0.00 C ATOM 2305 CG ARG B 445 11.557 18.874 -15.260 1.00 0.00 C ATOM 2306 CD ARG B 445 12.878 18.126 -15.165 1.00 0.00 C ATOM 2307 NE ARG B 445 13.753 18.413 -16.298 1.00 0.00 N ATOM 2308 CZ ARG B 445 13.738 17.727 -17.437 1.00 0.00 C ATOM 2309 NH1 ARG B 445 12.901 16.709 -17.594 1.00 0.00 N ATOM 2310 NH2 ARG B 445 14.562 18.057 -18.422 1.00 0.00 N ATOM 0 H ARG B 445 11.009 21.814 -13.698 1.00 0.00 H new ATOM 0 HA ARG B 445 13.275 20.241 -13.998 1.00 0.00 H new ATOM 0 HB2 ARG B 445 10.812 20.867 -15.471 1.00 0.00 H new ATOM 0 HB3 ARG B 445 12.145 20.482 -16.541 1.00 0.00 H new ATOM 0 HG2 ARG B 445 10.998 18.747 -14.333 1.00 0.00 H new ATOM 0 HG3 ARG B 445 10.951 18.445 -16.058 1.00 0.00 H new ATOM 0 HD2 ARG B 445 13.383 18.399 -14.239 1.00 0.00 H new ATOM 0 HD3 ARG B 445 12.685 17.054 -15.119 1.00 0.00 H new ATOM 0 HE ARG B 445 14.414 19.185 -16.211 1.00 0.00 H new ATOM 0 HH11 ARG B 445 12.266 16.450 -16.839 1.00 0.00 H new ATOM 0 HH12 ARG B 445 12.893 16.186 -18.469 1.00 0.00 H new ATOM 0 HH21 ARG B 445 15.208 18.838 -18.306 1.00 0.00 H new ATOM 0 HH22 ARG B 445 14.550 17.530 -19.295 1.00 0.00 H new