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 Set 1.1: B 368 MET CE :methyl -112:sc= -12.5! (180deg=-7.81!) USER MOD Set 1.2: B 369 ASN : amide:sc= -7.54! C(o=-20!,f=-18!) USER MOD Single : B 371 LYS NZ :NH3+ -166:sc= -2.24 (180deg=-2.87!) USER MOD Single : B 373 GLN : amide:sc= -8.45 K(o=-8.4,f=-9.4!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 150:sc= 0 USER MOD Single : B 380 TYR OH : rot 180:sc= 0 USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS : no HE2:sc= 0.0982! C(o=0.098!,f=-6.7!) USER MOD Single : B 387 TYR OH : rot -33:sc= -3.45! 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 118:sc= -2.88! USER MOD Single : B 399 ASN : amide:sc= -1.28 X(o=-1.3,f=-1.3) USER MOD Single : B 400 SER OG : rot 57:sc= -0.538 USER MOD Single : B 404 CYS SG : rot -160:sc= -2.25! USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 63:sc= -2.17! USER MOD Single : B 419 ASN : amide:sc= -4.71! C(o=-4.7!,f=-14!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -3.8! C(o=-3.8!,f=-5!) 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 -154:sc= -1.15 (180deg=-3.71!) USER MOD Single : B 441 TYR OH : rot 130:sc= -3.21! USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN : amide:sc= -1.6 K(o=-1.6,f=-0.96) USER MOD ----------------------------------------------------------------- ATOM 1069 N ASP B 367 -4.435 3.822 -16.154 1.00 0.00 N ATOM 1070 CA ASP B 367 -3.107 3.614 -15.591 1.00 0.00 C ATOM 1071 C ASP B 367 -2.056 4.333 -16.429 1.00 0.00 C ATOM 1072 O ASP B 367 -1.584 5.411 -16.060 1.00 0.00 O ATOM 1073 CB ASP B 367 -2.786 2.119 -15.513 1.00 0.00 C ATOM 1074 CG ASP B 367 -3.423 1.329 -16.638 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -3.868 1.952 -17.624 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -3.479 0.086 -16.532 1.00 0.00 O ATOM 0 HA ASP B 367 -3.093 4.027 -14.582 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -1.705 1.981 -15.543 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -3.131 1.726 -14.557 1.00 0.00 H new ATOM 1081 N MET B 368 -1.687 3.728 -17.556 1.00 0.00 N ATOM 1082 CA MET B 368 -0.689 4.315 -18.438 1.00 0.00 C ATOM 1083 C MET B 368 -0.845 5.836 -18.488 1.00 0.00 C ATOM 1084 O MET B 368 0.140 6.567 -18.392 1.00 0.00 O ATOM 1085 CB MET B 368 -0.774 3.702 -19.841 1.00 0.00 C ATOM 1086 CG MET B 368 -1.716 4.424 -20.787 1.00 0.00 C ATOM 1087 SD MET B 368 -3.444 4.006 -20.496 1.00 0.00 S ATOM 1088 CE MET B 368 -4.189 5.627 -20.582 1.00 0.00 C ATOM 0 H MET B 368 -2.064 2.836 -17.876 1.00 0.00 H new ATOM 0 HA MET B 368 0.300 4.091 -18.037 1.00 0.00 H new ATOM 0 HB2 MET B 368 0.224 3.691 -20.280 1.00 0.00 H new ATOM 0 HB3 MET B 368 -1.094 2.664 -19.751 1.00 0.00 H new ATOM 0 HG2 MET B 368 -1.583 5.500 -20.676 1.00 0.00 H new ATOM 0 HG3 MET B 368 -1.454 4.175 -21.815 1.00 0.00 H new ATOM 0 HE1 MET B 368 -4.555 5.912 -19.596 1.00 0.00 H new ATOM 0 HE2 MET B 368 -3.446 6.351 -20.917 1.00 0.00 H new ATOM 0 HE3 MET B 368 -5.021 5.608 -21.286 1.00 0.00 H new ATOM 1098 N ASN B 369 -2.086 6.313 -18.618 1.00 0.00 N ATOM 1099 CA ASN B 369 -2.344 7.749 -18.652 1.00 0.00 C ATOM 1100 C ASN B 369 -1.694 8.432 -17.456 1.00 0.00 C ATOM 1101 O ASN B 369 -0.870 9.334 -17.610 1.00 0.00 O ATOM 1102 CB ASN B 369 -3.848 8.027 -18.636 1.00 0.00 C ATOM 1103 CG ASN B 369 -4.393 8.364 -20.005 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -3.754 9.066 -20.789 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -5.582 7.860 -20.299 1.00 0.00 N ATOM 0 H ASN B 369 -2.919 5.729 -18.700 1.00 0.00 H new ATOM 0 HA ASN B 369 -1.917 8.147 -19.573 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -4.371 7.154 -18.246 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -4.054 8.852 -17.954 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -6.005 8.049 -21.208 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -6.074 7.283 -19.617 1.00 0.00 H new ATOM 1112 N ALA B 370 -2.073 7.993 -16.258 1.00 0.00 N ATOM 1113 CA ALA B 370 -1.529 8.558 -15.032 1.00 0.00 C ATOM 1114 C ALA B 370 -0.014 8.429 -15.009 1.00 0.00 C ATOM 1115 O ALA B 370 0.700 9.420 -15.167 1.00 0.00 O ATOM 1116 CB ALA B 370 -2.135 7.896 -13.806 1.00 0.00 C ATOM 0 H ALA B 370 -2.755 7.248 -16.113 1.00 0.00 H new ATOM 0 HA ALA B 370 -1.789 9.616 -15.008 1.00 0.00 H new ATOM 0 HB1 ALA B 370 -1.709 8.339 -12.906 1.00 0.00 H new ATOM 0 HB2 ALA B 370 -3.215 8.045 -13.808 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -1.916 6.828 -13.823 1.00 0.00 H new ATOM 1122 N LYS B 371 0.475 7.205 -14.812 1.00 0.00 N ATOM 1123 CA LYS B 371 1.913 6.960 -14.772 1.00 0.00 C ATOM 1124 C LYS B 371 2.628 7.862 -15.768 1.00 0.00 C ATOM 1125 O LYS B 371 3.761 8.288 -15.538 1.00 0.00 O ATOM 1126 CB LYS B 371 2.217 5.496 -15.087 1.00 0.00 C ATOM 1127 CG LYS B 371 1.670 5.044 -16.429 1.00 0.00 C ATOM 1128 CD LYS B 371 2.445 3.859 -16.979 1.00 0.00 C ATOM 1129 CE LYS B 371 1.676 2.561 -16.799 1.00 0.00 C ATOM 1130 NZ LYS B 371 0.776 2.609 -15.613 1.00 0.00 N ATOM 0 H LYS B 371 -0.101 6.374 -14.679 1.00 0.00 H new ATOM 0 HA LYS B 371 2.271 7.184 -13.767 1.00 0.00 H new ATOM 0 HB2 LYS B 371 3.296 5.345 -15.073 1.00 0.00 H new ATOM 0 HB3 LYS B 371 1.797 4.868 -14.301 1.00 0.00 H new ATOM 0 HG2 LYS B 371 0.619 4.774 -16.322 1.00 0.00 H new ATOM 0 HG3 LYS B 371 1.716 5.870 -17.138 1.00 0.00 H new ATOM 0 HD2 LYS B 371 2.652 4.017 -18.037 1.00 0.00 H new ATOM 0 HD3 LYS B 371 3.408 3.786 -16.474 1.00 0.00 H new ATOM 0 HE2 LYS B 371 1.087 2.361 -17.694 1.00 0.00 H new ATOM 0 HE3 LYS B 371 2.379 1.735 -16.689 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 0.453 1.648 -15.383 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 1.292 3.004 -14.801 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -0.047 3.209 -15.825 1.00 0.00 H new ATOM 1144 N ARG B 372 1.946 8.165 -16.868 1.00 0.00 N ATOM 1145 CA ARG B 372 2.502 9.036 -17.889 1.00 0.00 C ATOM 1146 C ARG B 372 2.682 10.437 -17.321 1.00 0.00 C ATOM 1147 O ARG B 372 3.771 10.995 -17.355 1.00 0.00 O ATOM 1148 CB ARG B 372 1.593 9.070 -19.121 1.00 0.00 C ATOM 1149 CG ARG B 372 2.160 8.326 -20.320 1.00 0.00 C ATOM 1150 CD ARG B 372 2.716 9.287 -21.361 1.00 0.00 C ATOM 1151 NE ARG B 372 1.675 10.124 -21.949 1.00 0.00 N ATOM 1152 CZ ARG B 372 1.923 11.129 -22.786 1.00 0.00 C ATOM 1153 NH1 ARG B 372 3.170 11.415 -23.130 1.00 0.00 N ATOM 1154 NH2 ARG B 372 0.923 11.845 -23.280 1.00 0.00 N ATOM 0 H ARG B 372 1.008 7.819 -17.072 1.00 0.00 H new ATOM 0 HA ARG B 372 3.473 8.648 -18.196 1.00 0.00 H new ATOM 0 HB2 ARG B 372 0.627 8.638 -18.861 1.00 0.00 H new ATOM 0 HB3 ARG B 372 1.413 10.108 -19.400 1.00 0.00 H new ATOM 0 HG2 ARG B 372 2.948 7.649 -19.990 1.00 0.00 H new ATOM 0 HG3 ARG B 372 1.380 7.712 -20.770 1.00 0.00 H new ATOM 0 HD2 ARG B 372 3.473 9.921 -20.900 1.00 0.00 H new ATOM 0 HD3 ARG B 372 3.212 8.720 -22.149 1.00 0.00 H new ATOM 0 HE ARG B 372 0.704 9.928 -21.705 1.00 0.00 H new ATOM 0 HH11 ARG B 372 3.942 10.865 -22.753 1.00 0.00 H new ATOM 0 HH12 ARG B 372 3.358 12.185 -23.771 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -0.038 11.626 -23.019 1.00 0.00 H new ATOM 0 HH22 ARG B 372 1.115 12.615 -23.921 1.00 0.00 H new ATOM 1168 N GLN B 373 1.613 10.996 -16.775 1.00 0.00 N ATOM 1169 CA GLN B 373 1.682 12.324 -16.184 1.00 0.00 C ATOM 1170 C GLN B 373 2.803 12.387 -15.152 1.00 0.00 C ATOM 1171 O GLN B 373 3.495 13.397 -15.018 1.00 0.00 O ATOM 1172 CB GLN B 373 0.346 12.689 -15.524 1.00 0.00 C ATOM 1173 CG GLN B 373 -0.040 14.147 -15.710 1.00 0.00 C ATOM 1174 CD GLN B 373 0.936 15.098 -15.043 1.00 0.00 C ATOM 1175 OE1 GLN B 373 1.279 16.142 -15.598 1.00 0.00 O ATOM 1176 NE2 GLN B 373 1.388 14.741 -13.845 1.00 0.00 N ATOM 0 H GLN B 373 0.694 10.555 -16.729 1.00 0.00 H new ATOM 0 HA GLN B 373 1.889 13.041 -16.978 1.00 0.00 H new ATOM 0 HB2 GLN B 373 -0.440 12.057 -15.938 1.00 0.00 H new ATOM 0 HB3 GLN B 373 0.404 12.469 -14.458 1.00 0.00 H new ATOM 0 HG2 GLN B 373 -0.091 14.373 -16.775 1.00 0.00 H new ATOM 0 HG3 GLN B 373 -1.037 14.310 -15.301 1.00 0.00 H new ATOM 0 HE21 GLN B 373 1.077 13.866 -13.422 1.00 0.00 H new ATOM 0 HE22 GLN B 373 2.046 15.342 -13.348 1.00 0.00 H new ATOM 1185 N LEU B 374 2.964 11.299 -14.412 1.00 0.00 N ATOM 1186 CA LEU B 374 3.977 11.224 -13.369 1.00 0.00 C ATOM 1187 C LEU B 374 5.406 11.307 -13.914 1.00 0.00 C ATOM 1188 O LEU B 374 6.044 12.355 -13.822 1.00 0.00 O ATOM 1189 CB LEU B 374 3.796 9.941 -12.551 1.00 0.00 C ATOM 1190 CG LEU B 374 2.343 9.522 -12.320 1.00 0.00 C ATOM 1191 CD1 LEU B 374 2.258 8.484 -11.212 1.00 0.00 C ATOM 1192 CD2 LEU B 374 1.486 10.732 -11.985 1.00 0.00 C ATOM 0 H LEU B 374 2.404 10.453 -14.515 1.00 0.00 H new ATOM 0 HA LEU B 374 3.835 12.094 -12.728 1.00 0.00 H new ATOM 0 HB2 LEU B 374 4.317 9.128 -13.058 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.278 10.074 -11.583 1.00 0.00 H new ATOM 0 HG LEU B 374 1.963 9.076 -13.239 1.00 0.00 H new ATOM 0 HD11 LEU B 374 1.217 8.197 -11.061 1.00 0.00 H new ATOM 0 HD12 LEU B 374 2.840 7.605 -11.491 1.00 0.00 H new ATOM 0 HD13 LEU B 374 2.656 8.904 -10.288 1.00 0.00 H new ATOM 0 HD21 LEU B 374 0.456 10.415 -11.824 1.00 0.00 H new ATOM 0 HD22 LEU B 374 1.865 11.207 -11.080 1.00 0.00 H new ATOM 0 HD23 LEU B 374 1.522 11.443 -12.810 1.00 0.00 H new ATOM 1204 N TYR B 375 5.923 10.198 -14.443 1.00 0.00 N ATOM 1205 CA TYR B 375 7.297 10.161 -14.945 1.00 0.00 C ATOM 1206 C TYR B 375 7.418 10.646 -16.388 1.00 0.00 C ATOM 1207 O TYR B 375 8.458 10.464 -17.019 1.00 0.00 O ATOM 1208 CB TYR B 375 7.855 8.740 -14.828 1.00 0.00 C ATOM 1209 CG TYR B 375 8.189 8.331 -13.409 1.00 0.00 C ATOM 1210 CD1 TYR B 375 7.524 8.895 -12.326 1.00 0.00 C ATOM 1211 CD2 TYR B 375 9.170 7.380 -13.152 1.00 0.00 C ATOM 1212 CE1 TYR B 375 7.827 8.524 -11.030 1.00 0.00 C ATOM 1213 CE2 TYR B 375 9.478 7.004 -11.858 1.00 0.00 C ATOM 1214 CZ TYR B 375 8.803 7.579 -10.802 1.00 0.00 C ATOM 1215 OH TYR B 375 9.108 7.210 -9.511 1.00 0.00 O ATOM 0 H TYR B 375 5.415 9.318 -14.535 1.00 0.00 H new ATOM 0 HA TYR B 375 7.878 10.847 -14.329 1.00 0.00 H new ATOM 0 HB2 TYR B 375 7.127 8.039 -15.237 1.00 0.00 H new ATOM 0 HB3 TYR B 375 8.753 8.661 -15.440 1.00 0.00 H new ATOM 0 HD1 TYR B 375 6.758 9.636 -12.501 1.00 0.00 H new ATOM 0 HD2 TYR B 375 9.700 6.928 -13.977 1.00 0.00 H new ATOM 0 HE1 TYR B 375 7.301 8.973 -10.200 1.00 0.00 H new ATOM 0 HE2 TYR B 375 10.243 6.264 -11.675 1.00 0.00 H new ATOM 0 HH TYR B 375 9.817 6.533 -9.523 1.00 0.00 H new ATOM 1225 N SER B 376 6.367 11.262 -16.910 1.00 0.00 N ATOM 1226 CA SER B 376 6.401 11.761 -18.283 1.00 0.00 C ATOM 1227 C SER B 376 6.009 13.233 -18.359 1.00 0.00 C ATOM 1228 O SER B 376 6.249 13.887 -19.375 1.00 0.00 O ATOM 1229 CB SER B 376 5.489 10.932 -19.188 1.00 0.00 C ATOM 1230 OG SER B 376 6.043 10.793 -20.484 1.00 0.00 O ATOM 0 H SER B 376 5.491 11.428 -16.415 1.00 0.00 H new ATOM 0 HA SER B 376 7.429 11.665 -18.632 1.00 0.00 H new ATOM 0 HB2 SER B 376 5.334 9.947 -18.748 1.00 0.00 H new ATOM 0 HB3 SER B 376 4.511 11.408 -19.257 1.00 0.00 H new ATOM 0 HG SER B 376 5.756 9.940 -20.873 1.00 0.00 H new ATOM 1236 N LEU B 377 5.407 13.759 -17.297 1.00 0.00 N ATOM 1237 CA LEU B 377 5.000 15.157 -17.292 1.00 0.00 C ATOM 1238 C LEU B 377 5.581 15.912 -16.101 1.00 0.00 C ATOM 1239 O LEU B 377 5.676 17.139 -16.130 1.00 0.00 O ATOM 1240 CB LEU B 377 3.474 15.269 -17.287 1.00 0.00 C ATOM 1241 CG LEU B 377 2.822 15.291 -18.670 1.00 0.00 C ATOM 1242 CD1 LEU B 377 2.937 13.930 -19.338 1.00 0.00 C ATOM 1243 CD2 LEU B 377 1.365 15.716 -18.563 1.00 0.00 C ATOM 0 H LEU B 377 5.193 13.246 -16.441 1.00 0.00 H new ATOM 0 HA LEU B 377 5.392 15.613 -18.201 1.00 0.00 H new ATOM 0 HB2 LEU B 377 3.065 14.431 -16.723 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.193 16.178 -16.755 1.00 0.00 H new ATOM 0 HG LEU B 377 3.348 16.019 -19.288 1.00 0.00 H new ATOM 0 HD11 LEU B 377 2.467 13.966 -20.321 1.00 0.00 H new ATOM 0 HD12 LEU B 377 3.989 13.666 -19.448 1.00 0.00 H new ATOM 0 HD13 LEU B 377 2.437 13.180 -18.725 1.00 0.00 H new ATOM 0 HD21 LEU B 377 0.915 15.727 -19.556 1.00 0.00 H new ATOM 0 HD22 LEU B 377 0.826 15.012 -17.928 1.00 0.00 H new ATOM 0 HD23 LEU B 377 1.308 16.714 -18.128 1.00 0.00 H new ATOM 1255 N ILE B 378 5.959 15.192 -15.045 1.00 0.00 N ATOM 1256 CA ILE B 378 6.511 15.840 -13.860 1.00 0.00 C ATOM 1257 C ILE B 378 7.719 15.091 -13.301 1.00 0.00 C ATOM 1258 O ILE B 378 8.850 15.561 -13.411 1.00 0.00 O ATOM 1259 CB ILE B 378 5.445 15.965 -12.757 1.00 0.00 C ATOM 1260 CG1 ILE B 378 4.106 16.391 -13.362 1.00 0.00 C ATOM 1261 CG2 ILE B 378 5.891 16.958 -11.698 1.00 0.00 C ATOM 1262 CD1 ILE B 378 4.174 17.699 -14.120 1.00 0.00 C ATOM 0 H ILE B 378 5.894 14.176 -14.987 1.00 0.00 H new ATOM 0 HA ILE B 378 6.836 16.832 -14.174 1.00 0.00 H new ATOM 0 HB ILE B 378 5.318 14.992 -12.283 1.00 0.00 H new ATOM 0 HG12 ILE B 378 3.755 15.608 -14.035 1.00 0.00 H new ATOM 0 HG13 ILE B 378 3.368 16.480 -12.565 1.00 0.00 H new ATOM 0 HG21 ILE B 378 5.126 17.034 -10.926 1.00 0.00 H new ATOM 0 HG22 ILE B 378 6.825 16.618 -11.251 1.00 0.00 H new ATOM 0 HG23 ILE B 378 6.043 17.935 -12.156 1.00 0.00 H new ATOM 0 HD11 ILE B 378 3.189 17.939 -14.521 1.00 0.00 H new ATOM 0 HD12 ILE B 378 4.495 18.494 -13.446 1.00 0.00 H new ATOM 0 HD13 ILE B 378 4.887 17.608 -14.939 1.00 0.00 H new ATOM 1274 N GLY B 379 7.463 13.936 -12.688 1.00 0.00 N ATOM 1275 CA GLY B 379 8.525 13.135 -12.096 1.00 0.00 C ATOM 1276 C GLY B 379 9.729 12.945 -13.004 1.00 0.00 C ATOM 1277 O GLY B 379 9.882 11.898 -13.631 1.00 0.00 O ATOM 0 H GLY B 379 6.529 13.537 -12.590 1.00 0.00 H new ATOM 0 HA2 GLY B 379 8.851 13.608 -11.170 1.00 0.00 H new ATOM 0 HA3 GLY B 379 8.124 12.157 -11.830 1.00 0.00 H new ATOM 1281 N TYR B 380 10.586 13.960 -13.071 1.00 0.00 N ATOM 1282 CA TYR B 380 11.782 13.902 -13.904 1.00 0.00 C ATOM 1283 C TYR B 380 12.866 13.049 -13.249 1.00 0.00 C ATOM 1284 O TYR B 380 12.580 12.240 -12.366 1.00 0.00 O ATOM 1285 CB TYR B 380 12.306 15.315 -14.170 1.00 0.00 C ATOM 1286 CG TYR B 380 12.730 16.052 -12.920 1.00 0.00 C ATOM 1287 CD1 TYR B 380 13.996 15.874 -12.377 1.00 0.00 C ATOM 1288 CD2 TYR B 380 11.860 16.929 -12.283 1.00 0.00 C ATOM 1289 CE1 TYR B 380 14.384 16.547 -11.234 1.00 0.00 C ATOM 1290 CE2 TYR B 380 12.240 17.607 -11.140 1.00 0.00 C ATOM 1291 CZ TYR B 380 13.502 17.413 -10.620 1.00 0.00 C ATOM 1292 OH TYR B 380 13.885 18.086 -9.482 1.00 0.00 O ATOM 0 H TYR B 380 10.474 14.834 -12.557 1.00 0.00 H new ATOM 0 HA TYR B 380 11.515 13.437 -14.853 1.00 0.00 H new ATOM 0 HB2 TYR B 380 13.155 15.256 -14.852 1.00 0.00 H new ATOM 0 HB3 TYR B 380 11.531 15.891 -14.675 1.00 0.00 H new ATOM 0 HD1 TYR B 380 14.689 15.198 -12.856 1.00 0.00 H new ATOM 0 HD2 TYR B 380 10.871 17.083 -12.688 1.00 0.00 H new ATOM 0 HE1 TYR B 380 15.372 16.396 -10.824 1.00 0.00 H new ATOM 0 HE2 TYR B 380 11.552 18.285 -10.657 1.00 0.00 H new ATOM 0 HH TYR B 380 13.149 18.656 -9.176 1.00 0.00 H new ATOM 1302 N ALA B 381 14.109 13.226 -13.693 1.00 0.00 N ATOM 1303 CA ALA B 381 15.229 12.465 -13.156 1.00 0.00 C ATOM 1304 C ALA B 381 15.789 13.104 -11.888 1.00 0.00 C ATOM 1305 O ALA B 381 16.478 14.122 -11.947 1.00 0.00 O ATOM 1306 CB ALA B 381 16.330 12.313 -14.194 1.00 0.00 C ATOM 0 H ALA B 381 14.363 13.891 -14.424 1.00 0.00 H new ATOM 0 HA ALA B 381 14.850 11.476 -12.897 1.00 0.00 H new ATOM 0 HB1 ALA B 381 17.155 11.741 -13.769 1.00 0.00 H new ATOM 0 HB2 ALA B 381 15.938 11.790 -15.066 1.00 0.00 H new ATOM 0 HB3 ALA B 381 16.688 13.299 -14.492 1.00 0.00 H new ATOM 1312 N SER B 382 15.492 12.484 -10.749 1.00 0.00 N ATOM 1313 CA SER B 382 15.967 12.964 -9.452 1.00 0.00 C ATOM 1314 C SER B 382 14.973 13.924 -8.807 1.00 0.00 C ATOM 1315 O SER B 382 15.354 14.988 -8.318 1.00 0.00 O ATOM 1316 CB SER B 382 17.329 13.646 -9.596 1.00 0.00 C ATOM 1317 OG SER B 382 18.094 13.508 -8.411 1.00 0.00 O ATOM 0 H SER B 382 14.920 11.641 -10.697 1.00 0.00 H new ATOM 0 HA SER B 382 16.068 12.095 -8.802 1.00 0.00 H new ATOM 0 HB2 SER B 382 17.871 13.211 -10.436 1.00 0.00 H new ATOM 0 HB3 SER B 382 17.188 14.703 -9.821 1.00 0.00 H new ATOM 0 HG SER B 382 18.961 13.950 -8.528 1.00 0.00 H new ATOM 1323 N LEU B 383 13.702 13.539 -8.792 1.00 0.00 N ATOM 1324 CA LEU B 383 12.667 14.366 -8.186 1.00 0.00 C ATOM 1325 C LEU B 383 12.296 13.824 -6.809 1.00 0.00 C ATOM 1326 O LEU B 383 11.792 14.556 -5.956 1.00 0.00 O ATOM 1327 CB LEU B 383 11.428 14.425 -9.080 1.00 0.00 C ATOM 1328 CG LEU B 383 10.539 15.651 -8.861 1.00 0.00 C ATOM 1329 CD1 LEU B 383 9.607 15.858 -10.044 1.00 0.00 C ATOM 1330 CD2 LEU B 383 9.742 15.505 -7.574 1.00 0.00 C ATOM 0 H LEU B 383 13.365 12.663 -9.191 1.00 0.00 H new ATOM 0 HA LEU B 383 13.059 15.377 -8.074 1.00 0.00 H new ATOM 0 HB2 LEU B 383 11.747 14.406 -10.122 1.00 0.00 H new ATOM 0 HB3 LEU B 383 10.833 13.527 -8.913 1.00 0.00 H new ATOM 0 HG LEU B 383 11.180 16.528 -8.774 1.00 0.00 H new ATOM 0 HD11 LEU B 383 8.984 16.735 -9.867 1.00 0.00 H new ATOM 0 HD12 LEU B 383 10.196 16.007 -10.949 1.00 0.00 H new ATOM 0 HD13 LEU B 383 8.972 14.980 -10.165 1.00 0.00 H new ATOM 0 HD21 LEU B 383 9.115 16.385 -7.433 1.00 0.00 H new ATOM 0 HD22 LEU B 383 9.113 14.617 -7.634 1.00 0.00 H new ATOM 0 HD23 LEU B 383 10.426 15.408 -6.731 1.00 0.00 H new ATOM 1342 N ARG B 384 12.557 12.536 -6.602 1.00 0.00 N ATOM 1343 CA ARG B 384 12.261 11.883 -5.331 1.00 0.00 C ATOM 1344 C ARG B 384 10.791 11.485 -5.240 1.00 0.00 C ATOM 1345 O ARG B 384 10.335 11.000 -4.205 1.00 0.00 O ATOM 1346 CB ARG B 384 12.629 12.797 -4.160 1.00 0.00 C ATOM 1347 CG ARG B 384 12.991 12.039 -2.892 1.00 0.00 C ATOM 1348 CD ARG B 384 14.327 11.325 -3.030 1.00 0.00 C ATOM 1349 NE ARG B 384 14.674 10.570 -1.828 1.00 0.00 N ATOM 1350 CZ ARG B 384 15.601 9.614 -1.797 1.00 0.00 C ATOM 1351 NH1 ARG B 384 16.265 9.297 -2.900 1.00 0.00 N ATOM 1352 NH2 ARG B 384 15.862 8.977 -0.663 1.00 0.00 N ATOM 0 H ARG B 384 12.975 11.922 -7.301 1.00 0.00 H new ATOM 0 HA ARG B 384 12.863 10.976 -5.278 1.00 0.00 H new ATOM 0 HB2 ARG B 384 13.470 13.427 -4.451 1.00 0.00 H new ATOM 0 HB3 ARG B 384 11.791 13.462 -3.950 1.00 0.00 H new ATOM 0 HG2 ARG B 384 13.033 12.732 -2.052 1.00 0.00 H new ATOM 0 HG3 ARG B 384 12.211 11.312 -2.666 1.00 0.00 H new ATOM 0 HD2 ARG B 384 14.289 10.649 -3.884 1.00 0.00 H new ATOM 0 HD3 ARG B 384 15.109 12.056 -3.236 1.00 0.00 H new ATOM 0 HE ARG B 384 14.178 10.787 -0.964 1.00 0.00 H new ATOM 0 HH11 ARG B 384 16.066 9.785 -3.773 1.00 0.00 H new ATOM 0 HH12 ARG B 384 16.975 8.565 -2.875 1.00 0.00 H new ATOM 0 HH21 ARG B 384 15.352 9.219 0.187 1.00 0.00 H new ATOM 0 HH22 ARG B 384 16.572 8.245 -0.641 1.00 0.00 H new ATOM 1366 N LEU B 385 10.053 11.686 -6.326 1.00 0.00 N ATOM 1367 CA LEU B 385 8.640 11.339 -6.355 1.00 0.00 C ATOM 1368 C LEU B 385 8.450 9.870 -6.027 1.00 0.00 C ATOM 1369 O LEU B 385 9.171 9.010 -6.533 1.00 0.00 O ATOM 1370 CB LEU B 385 8.035 11.657 -7.725 1.00 0.00 C ATOM 1371 CG LEU B 385 6.508 11.757 -7.753 1.00 0.00 C ATOM 1372 CD1 LEU B 385 6.050 12.591 -8.939 1.00 0.00 C ATOM 1373 CD2 LEU B 385 5.881 10.370 -7.804 1.00 0.00 C ATOM 0 H LEU B 385 10.409 12.086 -7.194 1.00 0.00 H new ATOM 0 HA LEU B 385 8.125 11.936 -5.602 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.452 12.600 -8.079 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.346 10.886 -8.430 1.00 0.00 H new ATOM 0 HG LEU B 385 6.180 12.249 -6.837 1.00 0.00 H new ATOM 0 HD11 LEU B 385 4.962 12.651 -8.943 1.00 0.00 H new ATOM 0 HD12 LEU B 385 6.469 13.594 -8.862 1.00 0.00 H new ATOM 0 HD13 LEU B 385 6.391 12.126 -9.864 1.00 0.00 H new ATOM 0 HD21 LEU B 385 4.795 10.462 -7.823 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.217 9.852 -8.702 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.181 9.802 -6.923 1.00 0.00 H new ATOM 1385 N HIS B 386 7.478 9.585 -5.173 1.00 0.00 N ATOM 1386 CA HIS B 386 7.211 8.205 -4.780 1.00 0.00 C ATOM 1387 C HIS B 386 5.881 8.056 -4.055 1.00 0.00 C ATOM 1388 O HIS B 386 5.442 8.950 -3.327 1.00 0.00 O ATOM 1389 CB HIS B 386 8.342 7.675 -3.896 1.00 0.00 C ATOM 1390 CG HIS B 386 8.557 8.471 -2.648 1.00 0.00 C ATOM 1391 ND1 HIS B 386 9.554 9.414 -2.519 1.00 0.00 N ATOM 1392 CD2 HIS B 386 7.903 8.451 -1.462 1.00 0.00 C ATOM 1393 CE1 HIS B 386 9.506 9.939 -1.307 1.00 0.00 C ATOM 1394 NE2 HIS B 386 8.515 9.371 -0.648 1.00 0.00 N ATOM 0 H HIS B 386 6.867 10.279 -4.742 1.00 0.00 H new ATOM 0 HA HIS B 386 7.155 7.619 -5.697 1.00 0.00 H new ATOM 0 HB2 HIS B 386 8.124 6.642 -3.624 1.00 0.00 H new ATOM 0 HB3 HIS B 386 9.267 7.664 -4.473 1.00 0.00 H new ATOM 0 HD1 HIS B 386 10.224 9.667 -3.245 1.00 0.00 H new ATOM 0 HD2 HIS B 386 7.059 7.828 -1.205 1.00 0.00 H new ATOM 0 HE1 HIS B 386 10.166 10.703 -0.922 1.00 0.00 H new ATOM 1403 N TYR B 387 5.256 6.901 -4.257 1.00 0.00 N ATOM 1404 CA TYR B 387 3.985 6.590 -3.626 1.00 0.00 C ATOM 1405 C TYR B 387 4.202 5.721 -2.399 1.00 0.00 C ATOM 1406 O TYR B 387 5.010 4.791 -2.420 1.00 0.00 O ATOM 1407 CB TYR B 387 3.065 5.863 -4.603 1.00 0.00 C ATOM 1408 CG TYR B 387 2.536 6.753 -5.693 1.00 0.00 C ATOM 1409 CD1 TYR B 387 3.404 7.469 -6.501 1.00 0.00 C ATOM 1410 CD2 TYR B 387 1.172 6.882 -5.910 1.00 0.00 C ATOM 1411 CE1 TYR B 387 2.931 8.292 -7.499 1.00 0.00 C ATOM 1412 CE2 TYR B 387 0.686 7.704 -6.907 1.00 0.00 C ATOM 1413 CZ TYR B 387 1.572 8.408 -7.701 1.00 0.00 C ATOM 1414 OH TYR B 387 1.099 9.230 -8.696 1.00 0.00 O ATOM 0 H TYR B 387 5.616 6.161 -4.859 1.00 0.00 H new ATOM 0 HA TYR B 387 3.518 7.528 -3.326 1.00 0.00 H new ATOM 0 HB2 TYR B 387 3.608 5.032 -5.053 1.00 0.00 H new ATOM 0 HB3 TYR B 387 2.227 5.436 -4.053 1.00 0.00 H new ATOM 0 HD1 TYR B 387 4.469 7.380 -6.346 1.00 0.00 H new ATOM 0 HD2 TYR B 387 0.480 6.331 -5.290 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.621 8.844 -8.120 1.00 0.00 H new ATOM 0 HE2 TYR B 387 -0.378 7.796 -7.065 1.00 0.00 H new ATOM 0 HH TYR B 387 1.697 9.999 -8.797 1.00 0.00 H new ATOM 1424 N VAL B 388 3.470 6.016 -1.339 1.00 0.00 N ATOM 1425 CA VAL B 388 3.577 5.249 -0.116 1.00 0.00 C ATOM 1426 C VAL B 388 2.257 4.582 0.213 1.00 0.00 C ATOM 1427 O VAL B 388 1.240 5.243 0.414 1.00 0.00 O ATOM 1428 CB VAL B 388 4.024 6.111 1.070 1.00 0.00 C ATOM 1429 CG1 VAL B 388 5.477 5.814 1.387 1.00 0.00 C ATOM 1430 CG2 VAL B 388 3.819 7.589 0.773 1.00 0.00 C ATOM 0 H VAL B 388 2.796 6.781 -1.303 1.00 0.00 H new ATOM 0 HA VAL B 388 4.339 4.489 -0.286 1.00 0.00 H new ATOM 0 HB VAL B 388 3.415 5.867 1.940 1.00 0.00 H new ATOM 0 HG11 VAL B 388 5.798 6.426 2.230 1.00 0.00 H new ATOM 0 HG12 VAL B 388 5.586 4.760 1.641 1.00 0.00 H new ATOM 0 HG13 VAL B 388 6.093 6.043 0.518 1.00 0.00 H new ATOM 0 HG21 VAL B 388 4.143 8.181 1.629 1.00 0.00 H new ATOM 0 HG22 VAL B 388 4.404 7.868 -0.104 1.00 0.00 H new ATOM 0 HG23 VAL B 388 2.763 7.778 0.580 1.00 0.00 H new ATOM 1440 N THR B 389 2.285 3.263 0.255 1.00 0.00 N ATOM 1441 CA THR B 389 1.092 2.487 0.546 1.00 0.00 C ATOM 1442 C THR B 389 0.796 2.482 2.038 1.00 0.00 C ATOM 1443 O THR B 389 1.665 2.183 2.855 1.00 0.00 O ATOM 1444 CB THR B 389 1.230 1.034 0.054 1.00 0.00 C ATOM 1445 OG1 THR B 389 1.325 0.973 -1.375 1.00 0.00 O ATOM 1446 CG2 THR B 389 0.042 0.187 0.495 1.00 0.00 C ATOM 0 H THR B 389 3.123 2.705 0.091 1.00 0.00 H new ATOM 0 HA THR B 389 0.267 2.962 0.015 1.00 0.00 H new ATOM 0 HB THR B 389 2.145 0.641 0.496 1.00 0.00 H new ATOM 0 HG1 THR B 389 1.413 0.039 -1.657 1.00 0.00 H new ATOM 0 HG21 THR B 389 0.168 -0.833 0.133 1.00 0.00 H new ATOM 0 HG22 THR B 389 -0.016 0.181 1.583 1.00 0.00 H new ATOM 0 HG23 THR B 389 -0.876 0.607 0.085 1.00 0.00 H new ATOM 1454 N VAL B 390 -0.442 2.809 2.383 1.00 0.00 N ATOM 1455 CA VAL B 390 -0.862 2.835 3.773 1.00 0.00 C ATOM 1456 C VAL B 390 -2.237 2.194 3.932 1.00 0.00 C ATOM 1457 O VAL B 390 -3.036 2.160 2.991 1.00 0.00 O ATOM 1458 CB VAL B 390 -0.898 4.272 4.332 1.00 0.00 C ATOM 1459 CG1 VAL B 390 0.496 4.877 4.345 1.00 0.00 C ATOM 1460 CG2 VAL B 390 -1.851 5.131 3.521 1.00 0.00 C ATOM 0 H VAL B 390 -1.172 3.060 1.717 1.00 0.00 H new ATOM 0 HA VAL B 390 -0.127 2.264 4.340 1.00 0.00 H new ATOM 0 HB VAL B 390 -1.260 4.235 5.360 1.00 0.00 H new ATOM 0 HG11 VAL B 390 0.449 5.891 4.743 1.00 0.00 H new ATOM 0 HG12 VAL B 390 1.150 4.271 4.972 1.00 0.00 H new ATOM 0 HG13 VAL B 390 0.891 4.904 3.329 1.00 0.00 H new ATOM 0 HG21 VAL B 390 -1.865 6.142 3.928 1.00 0.00 H new ATOM 0 HG22 VAL B 390 -1.519 5.162 2.483 1.00 0.00 H new ATOM 0 HG23 VAL B 390 -2.854 4.706 3.569 1.00 0.00 H new ATOM 1470 N LYS B 391 -2.499 1.682 5.127 1.00 0.00 N ATOM 1471 CA LYS B 391 -3.766 1.032 5.417 1.00 0.00 C ATOM 1472 C LYS B 391 -3.722 -0.432 4.988 1.00 0.00 C ATOM 1473 O LYS B 391 -4.619 -0.913 4.296 1.00 0.00 O ATOM 1474 CB LYS B 391 -4.902 1.760 4.703 1.00 0.00 C ATOM 1475 CG LYS B 391 -6.161 1.891 5.540 1.00 0.00 C ATOM 1476 CD LYS B 391 -6.614 0.544 6.078 1.00 0.00 C ATOM 1477 CE LYS B 391 -7.194 0.672 7.476 1.00 0.00 C ATOM 1478 NZ LYS B 391 -6.355 -0.023 8.490 1.00 0.00 N ATOM 0 H LYS B 391 -1.848 1.705 5.912 1.00 0.00 H new ATOM 0 HA LYS B 391 -3.943 1.072 6.492 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -4.561 2.755 4.416 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -5.142 1.228 3.782 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -5.978 2.573 6.370 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -6.956 2.329 4.937 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -7.362 0.117 5.410 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -5.770 -0.145 6.094 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -7.281 1.726 7.738 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -8.201 0.256 7.491 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -6.784 0.088 9.431 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -6.292 -1.034 8.255 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -5.401 0.391 8.494 1.00 0.00 H new ATOM 1492 N LYS B 392 -2.661 -1.127 5.400 1.00 0.00 N ATOM 1493 CA LYS B 392 -2.469 -2.536 5.061 1.00 0.00 C ATOM 1494 C LYS B 392 -3.805 -3.251 4.883 1.00 0.00 C ATOM 1495 O LYS B 392 -4.538 -3.468 5.848 1.00 0.00 O ATOM 1496 CB LYS B 392 -1.646 -3.233 6.146 1.00 0.00 C ATOM 1497 CG LYS B 392 -0.203 -2.758 6.210 1.00 0.00 C ATOM 1498 CD LYS B 392 -0.057 -1.533 7.099 1.00 0.00 C ATOM 1499 CE LYS B 392 0.575 -0.371 6.348 1.00 0.00 C ATOM 1500 NZ LYS B 392 0.673 0.852 7.193 1.00 0.00 N ATOM 0 H LYS B 392 -1.916 -0.732 5.974 1.00 0.00 H new ATOM 0 HA LYS B 392 -1.930 -2.581 4.114 1.00 0.00 H new ATOM 0 HB2 LYS B 392 -2.119 -3.066 7.114 1.00 0.00 H new ATOM 0 HB3 LYS B 392 -1.659 -4.308 5.967 1.00 0.00 H new ATOM 0 HG2 LYS B 392 0.429 -3.561 6.589 1.00 0.00 H new ATOM 0 HG3 LYS B 392 0.149 -2.523 5.205 1.00 0.00 H new ATOM 0 HD2 LYS B 392 -1.036 -1.236 7.474 1.00 0.00 H new ATOM 0 HD3 LYS B 392 0.554 -1.782 7.966 1.00 0.00 H new ATOM 0 HE2 LYS B 392 1.570 -0.657 6.008 1.00 0.00 H new ATOM 0 HE3 LYS B 392 -0.015 -0.151 5.458 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 1.109 1.620 6.643 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 -0.279 1.141 7.497 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 1.257 0.650 8.029 1.00 0.00 H new ATOM 1514 N PRO B 393 -4.145 -3.613 3.634 1.00 0.00 N ATOM 1515 CA PRO B 393 -5.401 -4.287 3.320 1.00 0.00 C ATOM 1516 C PRO B 393 -5.700 -5.464 4.234 1.00 0.00 C ATOM 1517 O PRO B 393 -4.809 -6.029 4.869 1.00 0.00 O ATOM 1518 CB PRO B 393 -5.230 -4.784 1.884 1.00 0.00 C ATOM 1519 CG PRO B 393 -3.848 -4.401 1.457 1.00 0.00 C ATOM 1520 CD PRO B 393 -3.341 -3.372 2.431 1.00 0.00 C ATOM 0 HA PRO B 393 -6.237 -3.600 3.452 1.00 0.00 H new ATOM 0 HB2 PRO B 393 -5.366 -5.864 1.830 1.00 0.00 H new ATOM 0 HB3 PRO B 393 -5.976 -4.335 1.228 1.00 0.00 H new ATOM 0 HG2 PRO B 393 -3.195 -5.273 1.447 1.00 0.00 H new ATOM 0 HG3 PRO B 393 -3.858 -3.998 0.444 1.00 0.00 H new ATOM 0 HD2 PRO B 393 -2.276 -3.497 2.628 1.00 0.00 H new ATOM 0 HD3 PRO B 393 -3.479 -2.359 2.053 1.00 0.00 H new ATOM 1528 N THR B 394 -6.975 -5.812 4.289 1.00 0.00 N ATOM 1529 CA THR B 394 -7.438 -6.914 5.122 1.00 0.00 C ATOM 1530 C THR B 394 -8.210 -7.949 4.311 1.00 0.00 C ATOM 1531 O THR B 394 -8.625 -7.689 3.182 1.00 0.00 O ATOM 1532 CB THR B 394 -8.329 -6.414 6.272 1.00 0.00 C ATOM 1533 OG1 THR B 394 -9.407 -5.610 5.780 1.00 0.00 O ATOM 1534 CG2 THR B 394 -7.526 -5.585 7.262 1.00 0.00 C ATOM 0 H THR B 394 -7.714 -5.345 3.763 1.00 0.00 H new ATOM 0 HA THR B 394 -6.545 -7.382 5.536 1.00 0.00 H new ATOM 0 HB THR B 394 -8.730 -7.297 6.769 1.00 0.00 H new ATOM 0 HG1 THR B 394 -10.261 -6.040 5.997 1.00 0.00 H new ATOM 0 HG21 THR B 394 -8.179 -5.244 8.065 1.00 0.00 H new ATOM 0 HG22 THR B 394 -6.724 -6.194 7.680 1.00 0.00 H new ATOM 0 HG23 THR B 394 -7.098 -4.722 6.751 1.00 0.00 H new ATOM 1542 N ALA B 395 -8.400 -9.122 4.907 1.00 0.00 N ATOM 1543 CA ALA B 395 -9.126 -10.210 4.259 1.00 0.00 C ATOM 1544 C ALA B 395 -10.617 -10.113 4.549 1.00 0.00 C ATOM 1545 O ALA B 395 -11.369 -11.064 4.338 1.00 0.00 O ATOM 1546 CB ALA B 395 -8.599 -11.551 4.727 1.00 0.00 C ATOM 0 H ALA B 395 -8.060 -9.344 5.842 1.00 0.00 H new ATOM 0 HA ALA B 395 -8.973 -10.123 3.183 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -9.151 -12.351 4.234 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -7.541 -11.633 4.478 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -8.725 -11.635 5.806 1.00 0.00 H new ATOM 1552 N VAL B 396 -11.032 -8.950 5.021 1.00 0.00 N ATOM 1553 CA VAL B 396 -12.429 -8.692 5.339 1.00 0.00 C ATOM 1554 C VAL B 396 -12.799 -7.262 4.939 1.00 0.00 C ATOM 1555 O VAL B 396 -13.877 -6.757 5.251 1.00 0.00 O ATOM 1556 CB VAL B 396 -12.683 -8.933 6.843 1.00 0.00 C ATOM 1557 CG1 VAL B 396 -11.424 -8.624 7.636 1.00 0.00 C ATOM 1558 CG2 VAL B 396 -13.864 -8.123 7.361 1.00 0.00 C ATOM 0 H VAL B 396 -10.413 -8.158 5.195 1.00 0.00 H new ATOM 0 HA VAL B 396 -13.061 -9.378 4.775 1.00 0.00 H new ATOM 0 HB VAL B 396 -12.939 -9.984 6.975 1.00 0.00 H new ATOM 0 HG11 VAL B 396 -11.610 -8.796 8.696 1.00 0.00 H new ATOM 0 HG12 VAL B 396 -10.614 -9.272 7.300 1.00 0.00 H new ATOM 0 HG13 VAL B 396 -11.143 -7.582 7.481 1.00 0.00 H new ATOM 0 HG21 VAL B 396 -14.005 -8.324 8.423 1.00 0.00 H new ATOM 0 HG22 VAL B 396 -13.668 -7.061 7.216 1.00 0.00 H new ATOM 0 HG23 VAL B 396 -14.765 -8.404 6.815 1.00 0.00 H new ATOM 1568 N ASP B 397 -11.880 -6.628 4.224 1.00 0.00 N ATOM 1569 CA ASP B 397 -12.055 -5.264 3.745 1.00 0.00 C ATOM 1570 C ASP B 397 -10.745 -4.760 3.152 1.00 0.00 C ATOM 1571 O ASP B 397 -10.182 -3.765 3.609 1.00 0.00 O ATOM 1572 CB ASP B 397 -12.511 -4.343 4.880 1.00 0.00 C ATOM 1573 CG ASP B 397 -11.716 -4.552 6.155 1.00 0.00 C ATOM 1574 OD1 ASP B 397 -11.789 -5.660 6.727 1.00 0.00 O ATOM 1575 OD2 ASP B 397 -11.022 -3.606 6.584 1.00 0.00 O ATOM 0 H ASP B 397 -10.989 -7.047 3.959 1.00 0.00 H new ATOM 0 HA ASP B 397 -12.826 -5.259 2.975 1.00 0.00 H new ATOM 0 HB2 ASP B 397 -12.414 -3.305 4.562 1.00 0.00 H new ATOM 0 HB3 ASP B 397 -13.568 -4.517 5.082 1.00 0.00 H new ATOM 1580 N PRO B 398 -10.242 -5.460 2.126 1.00 0.00 N ATOM 1581 CA PRO B 398 -8.991 -5.122 1.453 1.00 0.00 C ATOM 1582 C PRO B 398 -8.812 -3.618 1.280 1.00 0.00 C ATOM 1583 O PRO B 398 -7.688 -3.115 1.290 1.00 0.00 O ATOM 1584 CB PRO B 398 -9.110 -5.821 0.089 1.00 0.00 C ATOM 1585 CG PRO B 398 -10.420 -6.550 0.099 1.00 0.00 C ATOM 1586 CD PRO B 398 -10.851 -6.650 1.534 1.00 0.00 C ATOM 0 HA PRO B 398 -8.122 -5.442 2.028 1.00 0.00 H new ATOM 0 HB2 PRO B 398 -9.076 -5.095 -0.723 1.00 0.00 H new ATOM 0 HB3 PRO B 398 -8.282 -6.513 -0.066 1.00 0.00 H new ATOM 0 HG2 PRO B 398 -11.164 -6.016 -0.492 1.00 0.00 H new ATOM 0 HG3 PRO B 398 -10.314 -7.541 -0.343 1.00 0.00 H new ATOM 0 HD2 PRO B 398 -11.936 -6.644 1.634 1.00 0.00 H new ATOM 0 HD3 PRO B 398 -10.493 -7.566 2.003 1.00 0.00 H new ATOM 1594 N ASN B 399 -9.929 -2.916 1.121 1.00 0.00 N ATOM 1595 CA ASN B 399 -9.930 -1.465 0.944 1.00 0.00 C ATOM 1596 C ASN B 399 -8.691 -0.824 1.561 1.00 0.00 C ATOM 1597 O ASN B 399 -8.553 -0.767 2.783 1.00 0.00 O ATOM 1598 CB ASN B 399 -11.190 -0.860 1.567 1.00 0.00 C ATOM 1599 CG ASN B 399 -12.449 -1.233 0.808 1.00 0.00 C ATOM 1600 OD1 ASN B 399 -13.024 -2.300 1.023 1.00 0.00 O ATOM 1601 ND2 ASN B 399 -12.884 -0.353 -0.088 1.00 0.00 N ATOM 0 H ASN B 399 -10.859 -3.335 1.111 1.00 0.00 H new ATOM 0 HA ASN B 399 -9.918 -1.262 -0.127 1.00 0.00 H new ATOM 0 HB2 ASN B 399 -11.279 -1.197 2.600 1.00 0.00 H new ATOM 0 HB3 ASN B 399 -11.093 0.225 1.593 1.00 0.00 H new ATOM 0 HD21 ASN B 399 -13.726 -0.550 -0.630 1.00 0.00 H new ATOM 0 HD22 ASN B 399 -12.376 0.519 -0.234 1.00 0.00 H new ATOM 1608 N SER B 400 -7.794 -0.340 0.708 1.00 0.00 N ATOM 1609 CA SER B 400 -6.566 0.299 1.166 1.00 0.00 C ATOM 1610 C SER B 400 -6.399 1.669 0.516 1.00 0.00 C ATOM 1611 O SER B 400 -7.040 1.969 -0.491 1.00 0.00 O ATOM 1612 CB SER B 400 -5.357 -0.583 0.845 1.00 0.00 C ATOM 1613 OG SER B 400 -5.569 -1.916 1.276 1.00 0.00 O ATOM 0 H SER B 400 -7.895 -0.378 -0.306 1.00 0.00 H new ATOM 0 HA SER B 400 -6.631 0.431 2.246 1.00 0.00 H new ATOM 0 HB2 SER B 400 -5.169 -0.570 -0.229 1.00 0.00 H new ATOM 0 HB3 SER B 400 -4.469 -0.178 1.329 1.00 0.00 H new ATOM 0 HG SER B 400 -6.381 -2.270 0.856 1.00 0.00 H new ATOM 1619 N ILE B 401 -5.539 2.498 1.097 1.00 0.00 N ATOM 1620 CA ILE B 401 -5.295 3.832 0.573 1.00 0.00 C ATOM 1621 C ILE B 401 -3.825 3.996 0.189 1.00 0.00 C ATOM 1622 O ILE B 401 -2.949 3.358 0.773 1.00 0.00 O ATOM 1623 CB ILE B 401 -5.705 4.893 1.615 1.00 0.00 C ATOM 1624 CG1 ILE B 401 -5.430 6.316 1.118 1.00 0.00 C ATOM 1625 CG2 ILE B 401 -4.995 4.639 2.928 1.00 0.00 C ATOM 1626 CD1 ILE B 401 -6.679 7.067 0.714 1.00 0.00 C ATOM 0 H ILE B 401 -5.000 2.267 1.932 1.00 0.00 H new ATOM 0 HA ILE B 401 -5.899 3.972 -0.324 1.00 0.00 H new ATOM 0 HB ILE B 401 -6.780 4.807 1.771 1.00 0.00 H new ATOM 0 HG12 ILE B 401 -4.918 6.874 1.903 1.00 0.00 H new ATOM 0 HG13 ILE B 401 -4.752 6.270 0.266 1.00 0.00 H new ATOM 0 HG21 ILE B 401 -5.293 5.395 3.655 1.00 0.00 H new ATOM 0 HG22 ILE B 401 -5.263 3.651 3.301 1.00 0.00 H new ATOM 0 HG23 ILE B 401 -3.917 4.689 2.774 1.00 0.00 H new ATOM 0 HD11 ILE B 401 -6.408 8.066 0.373 1.00 0.00 H new ATOM 0 HD12 ILE B 401 -7.181 6.532 -0.092 1.00 0.00 H new ATOM 0 HD13 ILE B 401 -7.350 7.145 1.570 1.00 0.00 H new ATOM 1638 N VAL B 402 -3.560 4.849 -0.794 1.00 0.00 N ATOM 1639 CA VAL B 402 -2.204 5.095 -1.259 1.00 0.00 C ATOM 1640 C VAL B 402 -1.851 6.565 -1.088 1.00 0.00 C ATOM 1641 O VAL B 402 -2.737 7.421 -1.081 1.00 0.00 O ATOM 1642 CB VAL B 402 -2.045 4.714 -2.747 1.00 0.00 C ATOM 1643 CG1 VAL B 402 -0.735 3.983 -2.980 1.00 0.00 C ATOM 1644 CG2 VAL B 402 -3.219 3.868 -3.217 1.00 0.00 C ATOM 0 H VAL B 402 -4.275 5.385 -1.287 1.00 0.00 H new ATOM 0 HA VAL B 402 -1.533 4.477 -0.662 1.00 0.00 H new ATOM 0 HB VAL B 402 -2.031 5.635 -3.330 1.00 0.00 H new ATOM 0 HG11 VAL B 402 -0.645 3.725 -4.035 1.00 0.00 H new ATOM 0 HG12 VAL B 402 0.097 4.626 -2.692 1.00 0.00 H new ATOM 0 HG13 VAL B 402 -0.715 3.073 -2.381 1.00 0.00 H new ATOM 0 HG21 VAL B 402 -3.085 3.612 -4.268 1.00 0.00 H new ATOM 0 HG22 VAL B 402 -3.270 2.955 -2.624 1.00 0.00 H new ATOM 0 HG23 VAL B 402 -4.145 4.431 -3.096 1.00 0.00 H new ATOM 1654 N GLU B 403 -0.565 6.868 -0.956 1.00 0.00 N ATOM 1655 CA GLU B 403 -0.131 8.249 -0.794 1.00 0.00 C ATOM 1656 C GLU B 403 0.860 8.633 -1.885 1.00 0.00 C ATOM 1657 O GLU B 403 1.840 7.930 -2.121 1.00 0.00 O ATOM 1658 CB GLU B 403 0.506 8.443 0.584 1.00 0.00 C ATOM 1659 CG GLU B 403 -0.489 8.850 1.660 1.00 0.00 C ATOM 1660 CD GLU B 403 -1.204 10.146 1.330 1.00 0.00 C ATOM 1661 OE1 GLU B 403 -0.742 10.862 0.417 1.00 0.00 O ATOM 1662 OE2 GLU B 403 -2.223 10.445 1.985 1.00 0.00 O ATOM 0 H GLU B 403 0.190 6.182 -0.958 1.00 0.00 H new ATOM 0 HA GLU B 403 -1.005 8.896 -0.877 1.00 0.00 H new ATOM 0 HB2 GLU B 403 0.994 7.516 0.884 1.00 0.00 H new ATOM 0 HB3 GLU B 403 1.283 9.204 0.512 1.00 0.00 H new ATOM 0 HG2 GLU B 403 -1.224 8.056 1.789 1.00 0.00 H new ATOM 0 HG3 GLU B 403 0.033 8.959 2.611 1.00 0.00 H new ATOM 1669 N CYS B 404 0.612 9.761 -2.533 1.00 0.00 N ATOM 1670 CA CYS B 404 1.501 10.246 -3.580 1.00 0.00 C ATOM 1671 C CYS B 404 2.176 11.518 -3.104 1.00 0.00 C ATOM 1672 O CYS B 404 1.513 12.538 -2.910 1.00 0.00 O ATOM 1673 CB CYS B 404 0.727 10.504 -4.875 1.00 0.00 C ATOM 1674 SG CYS B 404 -1.029 10.859 -4.629 1.00 0.00 S ATOM 0 H CYS B 404 -0.196 10.357 -2.353 1.00 0.00 H new ATOM 0 HA CYS B 404 2.255 9.488 -3.790 1.00 0.00 H new ATOM 0 HB2 CYS B 404 1.186 11.342 -5.399 1.00 0.00 H new ATOM 0 HB3 CYS B 404 0.823 9.632 -5.523 1.00 0.00 H new ATOM 0 HG CYS B 404 -1.673 10.654 -5.740 1.00 0.00 H new ATOM 1680 N ARG B 405 3.488 11.456 -2.892 1.00 0.00 N ATOM 1681 CA ARG B 405 4.219 12.615 -2.411 1.00 0.00 C ATOM 1682 C ARG B 405 5.560 12.774 -3.117 1.00 0.00 C ATOM 1683 O ARG B 405 5.820 12.150 -4.149 1.00 0.00 O ATOM 1684 CB ARG B 405 4.421 12.521 -0.890 1.00 0.00 C ATOM 1685 CG ARG B 405 5.779 11.973 -0.465 1.00 0.00 C ATOM 1686 CD ARG B 405 5.643 10.939 0.641 1.00 0.00 C ATOM 1687 NE ARG B 405 5.120 11.518 1.874 1.00 0.00 N ATOM 1688 CZ ARG B 405 5.146 10.894 3.048 1.00 0.00 C ATOM 1689 NH1 ARG B 405 5.684 9.685 3.146 1.00 0.00 N ATOM 1690 NH2 ARG B 405 4.639 11.477 4.125 1.00 0.00 N ATOM 0 H ARG B 405 4.058 10.624 -3.045 1.00 0.00 H new ATOM 0 HA ARG B 405 3.624 13.499 -2.639 1.00 0.00 H new ATOM 0 HB2 ARG B 405 4.292 13.513 -0.457 1.00 0.00 H new ATOM 0 HB3 ARG B 405 3.640 11.886 -0.471 1.00 0.00 H new ATOM 0 HG2 ARG B 405 6.276 11.524 -1.325 1.00 0.00 H new ATOM 0 HG3 ARG B 405 6.412 12.792 -0.123 1.00 0.00 H new ATOM 0 HD2 ARG B 405 4.982 10.138 0.309 1.00 0.00 H new ATOM 0 HD3 ARG B 405 6.616 10.489 0.837 1.00 0.00 H new ATOM 0 HE ARG B 405 4.712 12.452 1.833 1.00 0.00 H new ATOM 0 HH11 ARG B 405 6.078 9.234 2.320 1.00 0.00 H new ATOM 0 HH12 ARG B 405 5.704 9.207 4.047 1.00 0.00 H new ATOM 0 HH21 ARG B 405 4.227 12.407 4.055 1.00 0.00 H new ATOM 0 HH22 ARG B 405 4.661 10.995 5.024 1.00 0.00 H new ATOM 1704 N VAL B 406 6.399 13.627 -2.545 1.00 0.00 N ATOM 1705 CA VAL B 406 7.713 13.901 -3.103 1.00 0.00 C ATOM 1706 C VAL B 406 8.659 14.445 -2.047 1.00 0.00 C ATOM 1707 O VAL B 406 8.264 15.231 -1.185 1.00 0.00 O ATOM 1708 CB VAL B 406 7.624 14.902 -4.261 1.00 0.00 C ATOM 1709 CG1 VAL B 406 7.754 14.171 -5.578 1.00 0.00 C ATOM 1710 CG2 VAL B 406 6.317 15.667 -4.198 1.00 0.00 C ATOM 0 H VAL B 406 6.190 14.143 -1.690 1.00 0.00 H new ATOM 0 HA VAL B 406 8.103 12.954 -3.476 1.00 0.00 H new ATOM 0 HB VAL B 406 8.440 15.620 -4.177 1.00 0.00 H new ATOM 0 HG11 VAL B 406 7.690 14.886 -6.399 1.00 0.00 H new ATOM 0 HG12 VAL B 406 8.715 13.659 -5.617 1.00 0.00 H new ATOM 0 HG13 VAL B 406 6.950 13.441 -5.670 1.00 0.00 H new ATOM 0 HG21 VAL B 406 6.269 16.374 -5.027 1.00 0.00 H new ATOM 0 HG22 VAL B 406 5.483 14.969 -4.268 1.00 0.00 H new ATOM 0 HG23 VAL B 406 6.258 16.210 -3.254 1.00 0.00 H new ATOM 1720 N GLY B 407 9.906 13.999 -2.108 1.00 0.00 N ATOM 1721 CA GLY B 407 10.889 14.430 -1.139 1.00 0.00 C ATOM 1722 C GLY B 407 10.534 13.954 0.255 1.00 0.00 C ATOM 1723 O GLY B 407 11.184 14.326 1.232 1.00 0.00 O ATOM 0 H GLY B 407 10.253 13.347 -2.811 1.00 0.00 H new ATOM 0 HA2 GLY B 407 11.870 14.046 -1.418 1.00 0.00 H new ATOM 0 HA3 GLY B 407 10.958 15.518 -1.147 1.00 0.00 H new ATOM 1727 N ASP B 408 9.493 13.126 0.342 1.00 0.00 N ATOM 1728 CA ASP B 408 9.045 12.593 1.623 1.00 0.00 C ATOM 1729 C ASP B 408 8.358 13.670 2.456 1.00 0.00 C ATOM 1730 O ASP B 408 8.484 13.693 3.680 1.00 0.00 O ATOM 1731 CB ASP B 408 10.230 12.013 2.397 1.00 0.00 C ATOM 1732 CG ASP B 408 9.796 11.064 3.497 1.00 0.00 C ATOM 1733 OD1 ASP B 408 9.079 10.088 3.191 1.00 0.00 O ATOM 1734 OD2 ASP B 408 10.174 11.296 4.665 1.00 0.00 O ATOM 0 H ASP B 408 8.946 12.812 -0.460 1.00 0.00 H new ATOM 0 HA ASP B 408 8.323 11.801 1.424 1.00 0.00 H new ATOM 0 HB2 ASP B 408 10.888 11.487 1.706 1.00 0.00 H new ATOM 0 HB3 ASP B 408 10.810 12.827 2.832 1.00 0.00 H new ATOM 1739 N GLY B 409 7.635 14.564 1.788 1.00 0.00 N ATOM 1740 CA GLY B 409 6.946 15.629 2.493 1.00 0.00 C ATOM 1741 C GLY B 409 5.753 16.176 1.732 1.00 0.00 C ATOM 1742 O GLY B 409 4.663 16.312 2.290 1.00 0.00 O ATOM 0 H GLY B 409 7.514 14.570 0.775 1.00 0.00 H new ATOM 0 HA2 GLY B 409 6.612 15.258 3.462 1.00 0.00 H new ATOM 0 HA3 GLY B 409 7.648 16.440 2.688 1.00 0.00 H new ATOM 1746 N THR B 410 5.957 16.503 0.459 1.00 0.00 N ATOM 1747 CA THR B 410 4.890 17.051 -0.371 1.00 0.00 C ATOM 1748 C THR B 410 3.993 15.953 -0.933 1.00 0.00 C ATOM 1749 O THR B 410 4.376 15.244 -1.861 1.00 0.00 O ATOM 1750 CB THR B 410 5.464 17.877 -1.541 1.00 0.00 C ATOM 1751 OG1 THR B 410 6.156 19.039 -1.067 1.00 0.00 O ATOM 1752 CG2 THR B 410 4.359 18.326 -2.489 1.00 0.00 C ATOM 0 H THR B 410 6.852 16.398 -0.020 1.00 0.00 H new ATOM 0 HA THR B 410 4.295 17.698 0.273 1.00 0.00 H new ATOM 0 HB THR B 410 6.162 17.229 -2.071 1.00 0.00 H new ATOM 0 HG1 THR B 410 6.511 19.542 -1.829 1.00 0.00 H new ATOM 0 HG21 THR B 410 4.792 18.906 -3.304 1.00 0.00 H new ATOM 0 HG22 THR B 410 3.851 17.452 -2.896 1.00 0.00 H new ATOM 0 HG23 THR B 410 3.642 18.942 -1.946 1.00 0.00 H new ATOM 1760 N VAL B 411 2.790 15.831 -0.376 1.00 0.00 N ATOM 1761 CA VAL B 411 1.826 14.832 -0.828 1.00 0.00 C ATOM 1762 C VAL B 411 0.942 15.399 -1.930 1.00 0.00 C ATOM 1763 O VAL B 411 0.111 16.272 -1.679 1.00 0.00 O ATOM 1764 CB VAL B 411 0.927 14.352 0.325 1.00 0.00 C ATOM 1765 CG1 VAL B 411 -0.156 13.417 -0.194 1.00 0.00 C ATOM 1766 CG2 VAL B 411 1.758 13.670 1.399 1.00 0.00 C ATOM 0 H VAL B 411 2.459 16.415 0.392 1.00 0.00 H new ATOM 0 HA VAL B 411 2.399 13.986 -1.208 1.00 0.00 H new ATOM 0 HB VAL B 411 0.442 15.221 0.769 1.00 0.00 H new ATOM 0 HG11 VAL B 411 -0.781 13.088 0.636 1.00 0.00 H new ATOM 0 HG12 VAL B 411 -0.770 13.942 -0.925 1.00 0.00 H new ATOM 0 HG13 VAL B 411 0.307 12.550 -0.665 1.00 0.00 H new ATOM 0 HG21 VAL B 411 1.106 13.337 2.207 1.00 0.00 H new ATOM 0 HG22 VAL B 411 2.272 12.810 0.970 1.00 0.00 H new ATOM 0 HG23 VAL B 411 2.492 14.373 1.792 1.00 0.00 H new ATOM 1776 N LEU B 412 1.111 14.896 -3.148 1.00 0.00 N ATOM 1777 CA LEU B 412 0.308 15.356 -4.271 1.00 0.00 C ATOM 1778 C LEU B 412 -1.152 14.996 -4.047 1.00 0.00 C ATOM 1779 O LEU B 412 -2.053 15.745 -4.425 1.00 0.00 O ATOM 1780 CB LEU B 412 0.802 14.746 -5.587 1.00 0.00 C ATOM 1781 CG LEU B 412 2.280 14.991 -5.908 1.00 0.00 C ATOM 1782 CD1 LEU B 412 2.765 16.287 -5.275 1.00 0.00 C ATOM 1783 CD2 LEU B 412 3.126 13.819 -5.434 1.00 0.00 C ATOM 0 H LEU B 412 1.793 14.174 -3.380 1.00 0.00 H new ATOM 0 HA LEU B 412 0.406 16.439 -4.340 1.00 0.00 H new ATOM 0 HB2 LEU B 412 0.627 13.671 -5.558 1.00 0.00 H new ATOM 0 HB3 LEU B 412 0.199 15.145 -6.402 1.00 0.00 H new ATOM 0 HG LEU B 412 2.384 15.082 -6.989 1.00 0.00 H new ATOM 0 HD11 LEU B 412 3.817 16.439 -5.517 1.00 0.00 H new ATOM 0 HD12 LEU B 412 2.180 17.122 -5.661 1.00 0.00 H new ATOM 0 HD13 LEU B 412 2.646 16.230 -4.193 1.00 0.00 H new ATOM 0 HD21 LEU B 412 4.173 14.008 -5.669 1.00 0.00 H new ATOM 0 HD22 LEU B 412 3.012 13.700 -4.357 1.00 0.00 H new ATOM 0 HD23 LEU B 412 2.800 12.908 -5.936 1.00 0.00 H new ATOM 1795 N GLY B 413 -1.383 13.841 -3.425 1.00 0.00 N ATOM 1796 CA GLY B 413 -2.743 13.409 -3.163 1.00 0.00 C ATOM 1797 C GLY B 413 -2.805 12.027 -2.541 1.00 0.00 C ATOM 1798 O GLY B 413 -1.903 11.626 -1.803 1.00 0.00 O ATOM 0 H GLY B 413 -0.657 13.202 -3.101 1.00 0.00 H new ATOM 0 HA2 GLY B 413 -3.226 14.125 -2.498 1.00 0.00 H new ATOM 0 HA3 GLY B 413 -3.307 13.409 -4.096 1.00 0.00 H new ATOM 1802 N THR B 414 -3.875 11.298 -2.841 1.00 0.00 N ATOM 1803 CA THR B 414 -4.058 9.954 -2.305 1.00 0.00 C ATOM 1804 C THR B 414 -5.200 9.228 -3.008 1.00 0.00 C ATOM 1805 O THR B 414 -5.990 9.842 -3.725 1.00 0.00 O ATOM 1806 CB THR B 414 -4.339 9.993 -0.791 1.00 0.00 C ATOM 1807 OG1 THR B 414 -4.523 8.676 -0.257 1.00 0.00 O ATOM 1808 CG2 THR B 414 -5.586 10.812 -0.492 1.00 0.00 C ATOM 0 H THR B 414 -4.628 11.615 -3.452 1.00 0.00 H new ATOM 0 HA THR B 414 -3.129 9.412 -2.483 1.00 0.00 H new ATOM 0 HB THR B 414 -3.470 10.454 -0.321 1.00 0.00 H new ATOM 0 HG1 THR B 414 -3.696 8.161 -0.363 1.00 0.00 H new ATOM 0 HG21 THR B 414 -5.764 10.825 0.583 1.00 0.00 H new ATOM 0 HG22 THR B 414 -5.445 11.832 -0.849 1.00 0.00 H new ATOM 0 HG23 THR B 414 -6.444 10.366 -0.996 1.00 0.00 H new ATOM 1816 N GLY B 415 -5.283 7.917 -2.796 1.00 0.00 N ATOM 1817 CA GLY B 415 -6.333 7.130 -3.419 1.00 0.00 C ATOM 1818 C GLY B 415 -6.657 5.867 -2.642 1.00 0.00 C ATOM 1819 O GLY B 415 -5.759 5.164 -2.187 1.00 0.00 O ATOM 0 H GLY B 415 -4.643 7.387 -2.205 1.00 0.00 H new ATOM 0 HA2 GLY B 415 -7.233 7.738 -3.508 1.00 0.00 H new ATOM 0 HA3 GLY B 415 -6.029 6.861 -4.431 1.00 0.00 H new ATOM 1823 N VAL B 416 -7.945 5.575 -2.501 1.00 0.00 N ATOM 1824 CA VAL B 416 -8.388 4.387 -1.784 1.00 0.00 C ATOM 1825 C VAL B 416 -9.254 3.515 -2.687 1.00 0.00 C ATOM 1826 O VAL B 416 -9.943 4.022 -3.572 1.00 0.00 O ATOM 1827 CB VAL B 416 -9.196 4.756 -0.524 1.00 0.00 C ATOM 1828 CG1 VAL B 416 -10.533 5.375 -0.905 1.00 0.00 C ATOM 1829 CG2 VAL B 416 -9.403 3.532 0.354 1.00 0.00 C ATOM 0 H VAL B 416 -8.702 6.147 -2.875 1.00 0.00 H new ATOM 0 HA VAL B 416 -7.495 3.840 -1.481 1.00 0.00 H new ATOM 0 HB VAL B 416 -8.628 5.494 0.043 1.00 0.00 H new ATOM 0 HG11 VAL B 416 -11.087 5.628 -0.001 1.00 0.00 H new ATOM 0 HG12 VAL B 416 -10.362 6.278 -1.491 1.00 0.00 H new ATOM 0 HG13 VAL B 416 -11.108 4.663 -1.496 1.00 0.00 H new ATOM 0 HG21 VAL B 416 -9.975 3.811 1.239 1.00 0.00 H new ATOM 0 HG22 VAL B 416 -9.948 2.771 -0.205 1.00 0.00 H new ATOM 0 HG23 VAL B 416 -8.435 3.135 0.659 1.00 0.00 H new ATOM 1839 N GLY B 417 -9.216 2.205 -2.472 1.00 0.00 N ATOM 1840 CA GLY B 417 -10.008 1.309 -3.293 1.00 0.00 C ATOM 1841 C GLY B 417 -10.166 -0.077 -2.688 1.00 0.00 C ATOM 1842 O GLY B 417 -9.306 -0.531 -1.934 1.00 0.00 O ATOM 0 H GLY B 417 -8.656 1.750 -1.751 1.00 0.00 H new ATOM 0 HA2 GLY B 417 -10.995 1.745 -3.447 1.00 0.00 H new ATOM 0 HA3 GLY B 417 -9.542 1.219 -4.274 1.00 0.00 H new ATOM 1846 N ARG B 418 -11.274 -0.744 -3.016 1.00 0.00 N ATOM 1847 CA ARG B 418 -11.561 -2.082 -2.495 1.00 0.00 C ATOM 1848 C ARG B 418 -10.518 -3.108 -2.943 1.00 0.00 C ATOM 1849 O ARG B 418 -10.030 -3.895 -2.133 1.00 0.00 O ATOM 1850 CB ARG B 418 -12.956 -2.534 -2.931 1.00 0.00 C ATOM 1851 CG ARG B 418 -13.316 -2.117 -4.346 1.00 0.00 C ATOM 1852 CD ARG B 418 -14.162 -3.174 -5.038 1.00 0.00 C ATOM 1853 NE ARG B 418 -15.271 -3.623 -4.201 1.00 0.00 N ATOM 1854 CZ ARG B 418 -16.013 -4.692 -4.474 1.00 0.00 C ATOM 1855 NH1 ARG B 418 -15.770 -5.409 -5.562 1.00 0.00 N ATOM 1856 NH2 ARG B 418 -16.998 -5.045 -3.659 1.00 0.00 N ATOM 0 H ARG B 418 -11.990 -0.377 -3.643 1.00 0.00 H new ATOM 0 HA ARG B 418 -11.521 -2.021 -1.407 1.00 0.00 H new ATOM 0 HB2 ARG B 418 -13.017 -3.620 -2.854 1.00 0.00 H new ATOM 0 HB3 ARG B 418 -13.694 -2.124 -2.241 1.00 0.00 H new ATOM 0 HG2 ARG B 418 -13.860 -1.173 -4.321 1.00 0.00 H new ATOM 0 HG3 ARG B 418 -12.405 -1.945 -4.919 1.00 0.00 H new ATOM 0 HD2 ARG B 418 -14.553 -2.771 -5.972 1.00 0.00 H new ATOM 0 HD3 ARG B 418 -13.535 -4.027 -5.297 1.00 0.00 H new ATOM 0 HE ARG B 418 -15.488 -3.087 -3.361 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -15.013 -5.141 -6.191 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -16.340 -6.229 -5.770 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -17.188 -4.496 -2.821 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -17.566 -5.865 -3.871 1.00 0.00 H new ATOM 1870 N ASN B 419 -10.166 -3.084 -4.223 1.00 0.00 N ATOM 1871 CA ASN B 419 -9.164 -3.999 -4.756 1.00 0.00 C ATOM 1872 C ASN B 419 -7.831 -3.279 -4.871 1.00 0.00 C ATOM 1873 O ASN B 419 -7.018 -3.588 -5.737 1.00 0.00 O ATOM 1874 CB ASN B 419 -9.585 -4.538 -6.123 1.00 0.00 C ATOM 1875 CG ASN B 419 -10.408 -3.542 -6.916 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -11.353 -2.949 -6.400 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -10.053 -3.353 -8.182 1.00 0.00 N ATOM 0 H ASN B 419 -10.559 -2.441 -4.911 1.00 0.00 H new ATOM 0 HA ASN B 419 -9.068 -4.844 -4.074 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -8.695 -4.804 -6.694 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -10.162 -5.453 -5.986 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -10.571 -2.695 -8.764 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -9.262 -3.866 -8.572 1.00 0.00 H new ATOM 1884 N ILE B 420 -7.626 -2.348 -3.943 1.00 0.00 N ATOM 1885 CA ILE B 420 -6.404 -1.543 -3.828 1.00 0.00 C ATOM 1886 C ILE B 420 -5.894 -0.916 -5.138 1.00 0.00 C ATOM 1887 O ILE B 420 -5.501 0.249 -5.135 1.00 0.00 O ATOM 1888 CB ILE B 420 -5.268 -2.339 -3.164 1.00 0.00 C ATOM 1889 CG1 ILE B 420 -4.422 -3.078 -4.207 1.00 0.00 C ATOM 1890 CG2 ILE B 420 -5.839 -3.312 -2.142 1.00 0.00 C ATOM 1891 CD1 ILE B 420 -3.278 -2.246 -4.752 1.00 0.00 C ATOM 0 H ILE B 420 -8.320 -2.124 -3.230 1.00 0.00 H new ATOM 0 HA ILE B 420 -6.705 -0.707 -3.197 1.00 0.00 H new ATOM 0 HB ILE B 420 -4.613 -1.635 -2.650 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -4.020 -3.987 -3.760 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -5.064 -3.386 -5.033 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -5.026 -3.871 -1.678 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -6.382 -2.758 -1.376 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -6.518 -4.005 -2.639 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -2.721 -2.829 -5.485 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -3.675 -1.349 -5.228 1.00 0.00 H new ATOM 0 HD13 ILE B 420 -2.615 -1.960 -3.936 1.00 0.00 H new ATOM 1903 N LYS B 421 -5.871 -1.657 -6.246 1.00 0.00 N ATOM 1904 CA LYS B 421 -5.379 -1.100 -7.497 1.00 0.00 C ATOM 1905 C LYS B 421 -6.022 0.252 -7.719 1.00 0.00 C ATOM 1906 O LYS B 421 -5.346 1.229 -8.042 1.00 0.00 O ATOM 1907 CB LYS B 421 -5.650 -2.052 -8.669 1.00 0.00 C ATOM 1908 CG LYS B 421 -6.070 -1.365 -9.958 1.00 0.00 C ATOM 1909 CD LYS B 421 -7.501 -0.872 -9.876 1.00 0.00 C ATOM 1910 CE LYS B 421 -8.243 -1.083 -11.187 1.00 0.00 C ATOM 1911 NZ LYS B 421 -9.704 -0.838 -11.045 1.00 0.00 N ATOM 0 H LYS B 421 -6.182 -2.627 -6.300 1.00 0.00 H new ATOM 0 HA LYS B 421 -4.298 -0.973 -7.438 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -4.750 -2.636 -8.861 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -6.430 -2.755 -8.376 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -5.404 -0.526 -10.159 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -5.969 -2.059 -10.792 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -8.021 -1.396 -9.074 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -7.507 0.188 -9.620 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -7.835 -0.415 -11.946 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -8.078 -2.102 -11.537 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -10.173 -0.993 -11.961 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -10.099 -1.492 -10.339 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -9.863 0.142 -10.736 1.00 0.00 H new ATOM 1925 N ILE B 422 -7.329 0.313 -7.503 1.00 0.00 N ATOM 1926 CA ILE B 422 -8.036 1.572 -7.642 1.00 0.00 C ATOM 1927 C ILE B 422 -7.279 2.604 -6.851 1.00 0.00 C ATOM 1928 O ILE B 422 -7.091 3.728 -7.292 1.00 0.00 O ATOM 1929 CB ILE B 422 -9.486 1.531 -7.117 1.00 0.00 C ATOM 1930 CG1 ILE B 422 -9.981 0.095 -6.980 1.00 0.00 C ATOM 1931 CG2 ILE B 422 -10.398 2.335 -8.031 1.00 0.00 C ATOM 1932 CD1 ILE B 422 -9.500 -0.573 -5.712 1.00 0.00 C ATOM 0 H ILE B 422 -7.910 -0.481 -7.236 1.00 0.00 H new ATOM 0 HA ILE B 422 -8.092 1.803 -8.706 1.00 0.00 H new ATOM 0 HB ILE B 422 -9.504 1.981 -6.125 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -11.071 0.088 -6.998 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -9.645 -0.484 -7.840 1.00 0.00 H new ATOM 0 HG21 ILE B 422 -11.419 2.299 -7.650 1.00 0.00 H new ATOM 0 HG22 ILE B 422 -10.059 3.371 -8.063 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -10.370 1.913 -9.036 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -9.884 -1.592 -5.670 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -8.410 -0.595 -5.703 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -9.859 -0.014 -4.848 1.00 0.00 H new ATOM 1944 N ALA B 423 -6.813 2.182 -5.680 1.00 0.00 N ATOM 1945 CA ALA B 423 -6.035 3.044 -4.819 1.00 0.00 C ATOM 1946 C ALA B 423 -4.752 3.446 -5.529 1.00 0.00 C ATOM 1947 O ALA B 423 -4.379 4.619 -5.545 1.00 0.00 O ATOM 1948 CB ALA B 423 -5.733 2.347 -3.501 1.00 0.00 C ATOM 0 H ALA B 423 -6.965 1.243 -5.311 1.00 0.00 H new ATOM 0 HA ALA B 423 -6.609 3.943 -4.596 1.00 0.00 H new ATOM 0 HB1 ALA B 423 -5.147 3.010 -2.865 1.00 0.00 H new ATOM 0 HB2 ALA B 423 -6.668 2.096 -3.000 1.00 0.00 H new ATOM 0 HB3 ALA B 423 -5.168 1.435 -3.693 1.00 0.00 H new ATOM 1954 N GLY B 424 -4.085 2.465 -6.135 1.00 0.00 N ATOM 1955 CA GLY B 424 -2.861 2.748 -6.859 1.00 0.00 C ATOM 1956 C GLY B 424 -3.098 3.719 -7.997 1.00 0.00 C ATOM 1957 O GLY B 424 -2.672 4.879 -7.940 1.00 0.00 O ATOM 0 H GLY B 424 -4.370 1.486 -6.136 1.00 0.00 H new ATOM 0 HA2 GLY B 424 -2.120 3.162 -6.175 1.00 0.00 H new ATOM 0 HA3 GLY B 424 -2.447 1.819 -7.252 1.00 0.00 H new ATOM 1961 N ILE B 425 -3.794 3.255 -9.030 1.00 0.00 N ATOM 1962 CA ILE B 425 -4.094 4.107 -10.172 1.00 0.00 C ATOM 1963 C ILE B 425 -4.707 5.424 -9.704 1.00 0.00 C ATOM 1964 O ILE B 425 -4.485 6.472 -10.311 1.00 0.00 O ATOM 1965 CB ILE B 425 -5.049 3.410 -11.168 1.00 0.00 C ATOM 1966 CG1 ILE B 425 -4.294 2.356 -11.984 1.00 0.00 C ATOM 1967 CG2 ILE B 425 -5.696 4.431 -12.096 1.00 0.00 C ATOM 1968 CD1 ILE B 425 -3.159 1.699 -11.231 1.00 0.00 C ATOM 0 H ILE B 425 -4.157 2.304 -9.099 1.00 0.00 H new ATOM 0 HA ILE B 425 -3.155 4.307 -10.688 1.00 0.00 H new ATOM 0 HB ILE B 425 -5.835 2.914 -10.598 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -4.997 1.588 -12.306 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -3.897 2.823 -12.885 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -6.364 3.920 -12.789 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -6.265 5.150 -11.506 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -4.922 4.954 -12.657 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -2.673 0.965 -11.874 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -2.434 2.456 -10.932 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -3.551 1.201 -10.344 1.00 0.00 H new ATOM 1980 N ARG B 426 -5.475 5.366 -8.617 1.00 0.00 N ATOM 1981 CA ARG B 426 -6.109 6.561 -8.070 1.00 0.00 C ATOM 1982 C ARG B 426 -5.057 7.552 -7.593 1.00 0.00 C ATOM 1983 O ARG B 426 -5.012 8.689 -8.062 1.00 0.00 O ATOM 1984 CB ARG B 426 -7.054 6.206 -6.921 1.00 0.00 C ATOM 1985 CG ARG B 426 -7.591 7.420 -6.184 1.00 0.00 C ATOM 1986 CD ARG B 426 -8.647 8.138 -7.004 1.00 0.00 C ATOM 1987 NE ARG B 426 -9.774 8.575 -6.186 1.00 0.00 N ATOM 1988 CZ ARG B 426 -10.855 7.833 -5.955 1.00 0.00 C ATOM 1989 NH1 ARG B 426 -10.950 6.616 -6.471 1.00 0.00 N ATOM 1990 NH2 ARG B 426 -11.839 8.310 -5.206 1.00 0.00 N ATOM 0 H ARG B 426 -5.672 4.508 -8.101 1.00 0.00 H new ATOM 0 HA ARG B 426 -6.695 7.022 -8.865 1.00 0.00 H new ATOM 0 HB2 ARG B 426 -7.891 5.629 -7.314 1.00 0.00 H new ATOM 0 HB3 ARG B 426 -6.529 5.564 -6.214 1.00 0.00 H new ATOM 0 HG2 ARG B 426 -8.017 7.110 -5.230 1.00 0.00 H new ATOM 0 HG3 ARG B 426 -6.773 8.105 -5.961 1.00 0.00 H new ATOM 0 HD2 ARG B 426 -8.199 9.002 -7.494 1.00 0.00 H new ATOM 0 HD3 ARG B 426 -9.006 7.475 -7.791 1.00 0.00 H new ATOM 0 HE ARG B 426 -9.731 9.504 -5.767 1.00 0.00 H new ATOM 0 HH11 ARG B 426 -10.194 6.246 -7.047 1.00 0.00 H new ATOM 0 HH12 ARG B 426 -11.779 6.050 -6.292 1.00 0.00 H new ATOM 0 HH21 ARG B 426 -11.768 9.246 -4.806 1.00 0.00 H new ATOM 0 HH22 ARG B 426 -12.667 7.741 -5.029 1.00 0.00 H new ATOM 2004 N ALA B 427 -4.198 7.119 -6.670 1.00 0.00 N ATOM 2005 CA ALA B 427 -3.151 7.995 -6.171 1.00 0.00 C ATOM 2006 C ALA B 427 -2.530 8.750 -7.336 1.00 0.00 C ATOM 2007 O ALA B 427 -2.246 9.945 -7.240 1.00 0.00 O ATOM 2008 CB ALA B 427 -2.095 7.217 -5.402 1.00 0.00 C ATOM 0 H ALA B 427 -4.209 6.184 -6.262 1.00 0.00 H new ATOM 0 HA ALA B 427 -3.592 8.708 -5.475 1.00 0.00 H new ATOM 0 HB1 ALA B 427 -1.327 7.903 -5.043 1.00 0.00 H new ATOM 0 HB2 ALA B 427 -2.559 6.715 -4.553 1.00 0.00 H new ATOM 0 HB3 ALA B 427 -1.640 6.475 -6.058 1.00 0.00 H new ATOM 2014 N ALA B 428 -2.354 8.048 -8.456 1.00 0.00 N ATOM 2015 CA ALA B 428 -1.804 8.667 -9.655 1.00 0.00 C ATOM 2016 C ALA B 428 -2.714 9.807 -10.097 1.00 0.00 C ATOM 2017 O ALA B 428 -2.304 10.975 -10.141 1.00 0.00 O ATOM 2018 CB ALA B 428 -1.645 7.648 -10.774 1.00 0.00 C ATOM 0 H ALA B 428 -2.583 7.059 -8.555 1.00 0.00 H new ATOM 0 HA ALA B 428 -0.814 9.061 -9.425 1.00 0.00 H new ATOM 0 HB1 ALA B 428 -1.233 8.138 -11.656 1.00 0.00 H new ATOM 0 HB2 ALA B 428 -0.971 6.855 -10.451 1.00 0.00 H new ATOM 0 HB3 ALA B 428 -2.618 7.220 -11.018 1.00 0.00 H new ATOM 2024 N GLU B 429 -3.964 9.459 -10.401 1.00 0.00 N ATOM 2025 CA GLU B 429 -4.954 10.441 -10.814 1.00 0.00 C ATOM 2026 C GLU B 429 -4.941 11.637 -9.865 1.00 0.00 C ATOM 2027 O GLU B 429 -5.390 12.724 -10.217 1.00 0.00 O ATOM 2028 CB GLU B 429 -6.349 9.814 -10.844 1.00 0.00 C ATOM 2029 CG GLU B 429 -6.557 8.839 -11.992 1.00 0.00 C ATOM 2030 CD GLU B 429 -8.020 8.515 -12.220 1.00 0.00 C ATOM 2031 OE1 GLU B 429 -8.777 9.427 -12.615 1.00 0.00 O ATOM 2032 OE2 GLU B 429 -8.411 7.348 -12.002 1.00 0.00 O ATOM 0 H GLU B 429 -4.311 8.501 -10.367 1.00 0.00 H new ATOM 0 HA GLU B 429 -4.702 10.783 -11.818 1.00 0.00 H new ATOM 0 HB2 GLU B 429 -6.524 9.295 -9.902 1.00 0.00 H new ATOM 0 HB3 GLU B 429 -7.093 10.608 -10.914 1.00 0.00 H new ATOM 0 HG2 GLU B 429 -6.135 9.261 -12.904 1.00 0.00 H new ATOM 0 HG3 GLU B 429 -6.012 7.918 -11.785 1.00 0.00 H new ATOM 2039 N ASN B 430 -4.420 11.420 -8.657 1.00 0.00 N ATOM 2040 CA ASN B 430 -4.335 12.472 -7.653 1.00 0.00 C ATOM 2041 C ASN B 430 -3.114 13.359 -7.900 1.00 0.00 C ATOM 2042 O ASN B 430 -3.161 14.568 -7.674 1.00 0.00 O ATOM 2043 CB ASN B 430 -4.255 11.856 -6.255 1.00 0.00 C ATOM 2044 CG ASN B 430 -5.591 11.870 -5.536 1.00 0.00 C ATOM 2045 OD1 ASN B 430 -5.843 12.725 -4.687 1.00 0.00 O ATOM 2046 ND2 ASN B 430 -6.455 10.918 -5.869 1.00 0.00 N ATOM 0 H ASN B 430 -4.050 10.520 -8.353 1.00 0.00 H new ATOM 0 HA ASN B 430 -5.231 13.088 -7.724 1.00 0.00 H new ATOM 0 HB2 ASN B 430 -3.899 10.829 -6.334 1.00 0.00 H new ATOM 0 HB3 ASN B 430 -3.521 12.402 -5.662 1.00 0.00 H new ATOM 0 HD21 ASN B 430 -7.368 10.876 -5.416 1.00 0.00 H new ATOM 0 HD22 ASN B 430 -6.206 10.229 -6.578 1.00 0.00 H new ATOM 2053 N ALA B 431 -2.019 12.746 -8.350 1.00 0.00 N ATOM 2054 CA ALA B 431 -0.782 13.476 -8.612 1.00 0.00 C ATOM 2055 C ALA B 431 -0.971 14.496 -9.729 1.00 0.00 C ATOM 2056 O ALA B 431 -0.436 15.603 -9.670 1.00 0.00 O ATOM 2057 CB ALA B 431 0.347 12.518 -8.963 1.00 0.00 C ATOM 0 H ALA B 431 -1.965 11.745 -8.540 1.00 0.00 H new ATOM 0 HA ALA B 431 -0.515 14.011 -7.701 1.00 0.00 H new ATOM 0 HB1 ALA B 431 1.259 13.084 -9.154 1.00 0.00 H new ATOM 0 HB2 ALA B 431 0.513 11.832 -8.133 1.00 0.00 H new ATOM 0 HB3 ALA B 431 0.079 11.951 -9.854 1.00 0.00 H new ATOM 2063 N LEU B 432 -1.741 14.116 -10.739 1.00 0.00 N ATOM 2064 CA LEU B 432 -1.997 15.016 -11.861 1.00 0.00 C ATOM 2065 C LEU B 432 -3.291 15.799 -11.650 1.00 0.00 C ATOM 2066 O LEU B 432 -3.792 16.444 -12.571 1.00 0.00 O ATOM 2067 CB LEU B 432 -2.033 14.257 -13.194 1.00 0.00 C ATOM 2068 CG LEU B 432 -2.962 13.045 -13.248 1.00 0.00 C ATOM 2069 CD1 LEU B 432 -2.258 11.817 -12.693 1.00 0.00 C ATOM 2070 CD2 LEU B 432 -4.246 13.329 -12.489 1.00 0.00 C ATOM 0 H LEU B 432 -2.195 13.205 -10.808 1.00 0.00 H new ATOM 0 HA LEU B 432 -1.171 15.726 -11.905 1.00 0.00 H new ATOM 0 HB2 LEU B 432 -2.330 14.953 -13.978 1.00 0.00 H new ATOM 0 HB3 LEU B 432 -1.021 13.926 -13.428 1.00 0.00 H new ATOM 0 HG LEU B 432 -3.222 12.846 -14.288 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -2.931 10.961 -12.737 1.00 0.00 H new ATOM 0 HD12 LEU B 432 -1.367 11.609 -13.286 1.00 0.00 H new ATOM 0 HD13 LEU B 432 -1.971 11.999 -11.658 1.00 0.00 H new ATOM 0 HD21 LEU B 432 -4.897 12.456 -12.537 1.00 0.00 H new ATOM 0 HD22 LEU B 432 -4.012 13.551 -11.448 1.00 0.00 H new ATOM 0 HD23 LEU B 432 -4.752 14.184 -12.937 1.00 0.00 H new ATOM 2082 N ARG B 433 -3.827 15.734 -10.432 1.00 0.00 N ATOM 2083 CA ARG B 433 -5.065 16.434 -10.104 1.00 0.00 C ATOM 2084 C ARG B 433 -4.779 17.815 -9.525 1.00 0.00 C ATOM 2085 O ARG B 433 -5.696 18.523 -9.108 1.00 0.00 O ATOM 2086 CB ARG B 433 -5.892 15.618 -9.107 1.00 0.00 C ATOM 2087 CG ARG B 433 -7.345 16.060 -9.016 1.00 0.00 C ATOM 2088 CD ARG B 433 -8.021 15.495 -7.776 1.00 0.00 C ATOM 2089 NE ARG B 433 -8.441 16.544 -6.851 1.00 0.00 N ATOM 2090 CZ ARG B 433 -9.641 17.121 -6.880 1.00 0.00 C ATOM 2091 NH1 ARG B 433 -10.529 16.769 -7.800 1.00 0.00 N ATOM 2092 NH2 ARG B 433 -9.952 18.054 -5.988 1.00 0.00 N ATOM 0 H ARG B 433 -3.424 15.205 -9.659 1.00 0.00 H new ATOM 0 HA ARG B 433 -5.632 16.556 -11.027 1.00 0.00 H new ATOM 0 HB2 ARG B 433 -5.858 14.567 -9.394 1.00 0.00 H new ATOM 0 HB3 ARG B 433 -5.435 15.694 -8.120 1.00 0.00 H new ATOM 0 HG2 ARG B 433 -7.395 17.149 -8.995 1.00 0.00 H new ATOM 0 HG3 ARG B 433 -7.883 15.733 -9.906 1.00 0.00 H new ATOM 0 HD2 ARG B 433 -8.889 14.906 -8.074 1.00 0.00 H new ATOM 0 HD3 ARG B 433 -7.335 14.817 -7.267 1.00 0.00 H new ATOM 0 HE ARG B 433 -7.777 16.853 -6.141 1.00 0.00 H new ATOM 0 HH11 ARG B 433 -10.294 16.054 -8.489 1.00 0.00 H new ATOM 0 HH12 ARG B 433 -11.447 17.213 -7.819 1.00 0.00 H new ATOM 0 HH21 ARG B 433 -9.272 18.329 -5.280 1.00 0.00 H new ATOM 0 HH22 ARG B 433 -10.871 18.495 -6.011 1.00 0.00 H new ATOM 2106 N ASP B 434 -3.507 18.194 -9.500 1.00 0.00 N ATOM 2107 CA ASP B 434 -3.114 19.492 -8.968 1.00 0.00 C ATOM 2108 C ASP B 434 -2.427 20.332 -10.039 1.00 0.00 C ATOM 2109 O ASP B 434 -1.215 20.246 -10.232 1.00 0.00 O ATOM 2110 CB ASP B 434 -2.192 19.317 -7.764 1.00 0.00 C ATOM 2111 CG ASP B 434 -2.956 19.019 -6.488 1.00 0.00 C ATOM 2112 OD1 ASP B 434 -4.135 18.615 -6.583 1.00 0.00 O ATOM 2113 OD2 ASP B 434 -2.379 19.192 -5.396 1.00 0.00 O ATOM 0 H ASP B 434 -2.733 17.623 -9.841 1.00 0.00 H new ATOM 0 HA ASP B 434 -4.015 20.014 -8.648 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -1.491 18.506 -7.962 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -1.602 20.223 -7.627 1.00 0.00 H new ATOM 2118 N LYS B 435 -3.221 21.135 -10.737 1.00 0.00 N ATOM 2119 CA LYS B 435 -2.710 21.994 -11.801 1.00 0.00 C ATOM 2120 C LYS B 435 -1.603 22.917 -11.292 1.00 0.00 C ATOM 2121 O LYS B 435 -0.560 23.058 -11.928 1.00 0.00 O ATOM 2122 CB LYS B 435 -3.850 22.822 -12.411 1.00 0.00 C ATOM 2123 CG LYS B 435 -4.016 24.202 -11.787 1.00 0.00 C ATOM 2124 CD LYS B 435 -5.305 24.870 -12.232 1.00 0.00 C ATOM 2125 CE LYS B 435 -5.092 25.723 -13.472 1.00 0.00 C ATOM 2126 NZ LYS B 435 -6.251 25.647 -14.403 1.00 0.00 N ATOM 0 H LYS B 435 -4.227 21.210 -10.585 1.00 0.00 H new ATOM 0 HA LYS B 435 -2.283 21.351 -12.571 1.00 0.00 H new ATOM 0 HB2 LYS B 435 -3.670 22.937 -13.480 1.00 0.00 H new ATOM 0 HB3 LYS B 435 -4.784 22.271 -12.303 1.00 0.00 H new ATOM 0 HG2 LYS B 435 -4.009 24.113 -10.701 1.00 0.00 H new ATOM 0 HG3 LYS B 435 -3.168 24.829 -12.061 1.00 0.00 H new ATOM 0 HD2 LYS B 435 -6.058 24.109 -12.438 1.00 0.00 H new ATOM 0 HD3 LYS B 435 -5.692 25.491 -11.424 1.00 0.00 H new ATOM 0 HE2 LYS B 435 -4.931 26.760 -13.176 1.00 0.00 H new ATOM 0 HE3 LYS B 435 -4.190 25.395 -13.988 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 -6.067 26.242 -15.236 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 -6.389 24.662 -14.705 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 -7.108 25.984 -13.919 1.00 0.00 H new ATOM 2140 N LYS B 436 -1.839 23.548 -10.145 1.00 0.00 N ATOM 2141 CA LYS B 436 -0.858 24.456 -9.566 1.00 0.00 C ATOM 2142 C LYS B 436 0.439 23.720 -9.266 1.00 0.00 C ATOM 2143 O LYS B 436 1.530 24.229 -9.524 1.00 0.00 O ATOM 2144 CB LYS B 436 -1.408 25.091 -8.287 1.00 0.00 C ATOM 2145 CG LYS B 436 -2.865 25.512 -8.393 1.00 0.00 C ATOM 2146 CD LYS B 436 -3.042 26.985 -8.055 1.00 0.00 C ATOM 2147 CE LYS B 436 -2.381 27.876 -9.094 1.00 0.00 C ATOM 2148 NZ LYS B 436 -3.346 28.833 -9.700 1.00 0.00 N ATOM 0 H LYS B 436 -2.697 23.447 -9.602 1.00 0.00 H new ATOM 0 HA LYS B 436 -0.653 25.245 -10.290 1.00 0.00 H new ATOM 0 HB2 LYS B 436 -1.302 24.383 -7.465 1.00 0.00 H new ATOM 0 HB3 LYS B 436 -0.804 25.963 -8.036 1.00 0.00 H new ATOM 0 HG2 LYS B 436 -3.228 25.323 -9.403 1.00 0.00 H new ATOM 0 HG3 LYS B 436 -3.470 24.907 -7.718 1.00 0.00 H new ATOM 0 HD2 LYS B 436 -4.104 27.221 -7.994 1.00 0.00 H new ATOM 0 HD3 LYS B 436 -2.614 27.189 -7.074 1.00 0.00 H new ATOM 0 HE2 LYS B 436 -1.564 28.429 -8.631 1.00 0.00 H new ATOM 0 HE3 LYS B 436 -1.943 27.257 -9.877 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 -2.856 29.422 -10.403 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 -4.113 28.306 -10.164 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 -3.745 29.441 -8.957 1.00 0.00 H new ATOM 2162 N MET B 437 0.310 22.514 -8.729 1.00 0.00 N ATOM 2163 CA MET B 437 1.470 21.698 -8.404 1.00 0.00 C ATOM 2164 C MET B 437 2.126 21.186 -9.680 1.00 0.00 C ATOM 2165 O MET B 437 3.344 21.264 -9.840 1.00 0.00 O ATOM 2166 CB MET B 437 1.054 20.529 -7.511 1.00 0.00 C ATOM 2167 CG MET B 437 2.112 19.449 -7.376 1.00 0.00 C ATOM 2168 SD MET B 437 1.413 17.791 -7.467 1.00 0.00 S ATOM 2169 CE MET B 437 2.349 17.108 -8.829 1.00 0.00 C ATOM 0 H MET B 437 -0.587 22.080 -8.510 1.00 0.00 H new ATOM 0 HA MET B 437 2.193 22.309 -7.864 1.00 0.00 H new ATOM 0 HB2 MET B 437 0.811 20.911 -6.520 1.00 0.00 H new ATOM 0 HB3 MET B 437 0.144 20.084 -7.913 1.00 0.00 H new ATOM 0 HG2 MET B 437 2.855 19.571 -8.164 1.00 0.00 H new ATOM 0 HG3 MET B 437 2.632 19.570 -6.426 1.00 0.00 H new ATOM 0 HE1 MET B 437 1.770 16.319 -9.309 1.00 0.00 H new ATOM 0 HE2 MET B 437 2.562 17.893 -9.554 1.00 0.00 H new ATOM 0 HE3 MET B 437 3.286 16.695 -8.456 1.00 0.00 H new ATOM 2179 N LEU B 438 1.308 20.674 -10.595 1.00 0.00 N ATOM 2180 CA LEU B 438 1.810 20.165 -11.864 1.00 0.00 C ATOM 2181 C LEU B 438 2.601 21.247 -12.586 1.00 0.00 C ATOM 2182 O LEU B 438 3.813 21.129 -12.767 1.00 0.00 O ATOM 2183 CB LEU B 438 0.653 19.694 -12.744 1.00 0.00 C ATOM 2184 CG LEU B 438 0.023 18.362 -12.339 1.00 0.00 C ATOM 2185 CD1 LEU B 438 -1.186 18.067 -13.211 1.00 0.00 C ATOM 2186 CD2 LEU B 438 1.042 17.236 -12.437 1.00 0.00 C ATOM 0 H LEU B 438 0.297 20.601 -10.480 1.00 0.00 H new ATOM 0 HA LEU B 438 2.466 19.318 -11.662 1.00 0.00 H new ATOM 0 HB2 LEU B 438 -0.122 20.460 -12.737 1.00 0.00 H new ATOM 0 HB3 LEU B 438 1.010 19.611 -13.771 1.00 0.00 H new ATOM 0 HG LEU B 438 -0.306 18.434 -11.302 1.00 0.00 H new ATOM 0 HD11 LEU B 438 -1.626 17.115 -12.913 1.00 0.00 H new ATOM 0 HD12 LEU B 438 -1.923 18.861 -13.092 1.00 0.00 H new ATOM 0 HD13 LEU B 438 -0.877 18.013 -14.255 1.00 0.00 H new ATOM 0 HD21 LEU B 438 0.575 16.296 -12.145 1.00 0.00 H new ATOM 0 HD22 LEU B 438 1.401 17.159 -13.463 1.00 0.00 H new ATOM 0 HD23 LEU B 438 1.881 17.446 -11.774 1.00 0.00 H new ATOM 2198 N ASP B 439 1.909 22.310 -12.981 1.00 0.00 N ATOM 2199 CA ASP B 439 2.551 23.422 -13.668 1.00 0.00 C ATOM 2200 C ASP B 439 3.765 23.888 -12.880 1.00 0.00 C ATOM 2201 O ASP B 439 4.789 24.269 -13.452 1.00 0.00 O ATOM 2202 CB ASP B 439 1.567 24.582 -13.836 1.00 0.00 C ATOM 2203 CG ASP B 439 2.217 25.806 -14.451 1.00 0.00 C ATOM 2204 OD1 ASP B 439 2.235 25.907 -15.696 1.00 0.00 O ATOM 2205 OD2 ASP B 439 2.707 26.665 -13.687 1.00 0.00 O ATOM 0 H ASP B 439 0.906 22.424 -12.837 1.00 0.00 H new ATOM 0 HA ASP B 439 2.871 23.085 -14.654 1.00 0.00 H new ATOM 0 HB2 ASP B 439 0.735 24.262 -14.463 1.00 0.00 H new ATOM 0 HB3 ASP B 439 1.150 24.845 -12.864 1.00 0.00 H new ATOM 2210 N PHE B 440 3.641 23.847 -11.557 1.00 0.00 N ATOM 2211 CA PHE B 440 4.726 24.256 -10.680 1.00 0.00 C ATOM 2212 C PHE B 440 5.995 23.497 -11.046 1.00 0.00 C ATOM 2213 O PHE B 440 7.080 24.073 -11.142 1.00 0.00 O ATOM 2214 CB PHE B 440 4.340 24.014 -9.213 1.00 0.00 C ATOM 2215 CG PHE B 440 5.489 23.613 -8.331 1.00 0.00 C ATOM 2216 CD1 PHE B 440 6.433 24.545 -7.935 1.00 0.00 C ATOM 2217 CD2 PHE B 440 5.623 22.303 -7.903 1.00 0.00 C ATOM 2218 CE1 PHE B 440 7.491 24.178 -7.126 1.00 0.00 C ATOM 2219 CE2 PHE B 440 6.679 21.929 -7.094 1.00 0.00 C ATOM 2220 CZ PHE B 440 7.615 22.868 -6.706 1.00 0.00 C ATOM 0 H PHE B 440 2.800 23.535 -11.072 1.00 0.00 H new ATOM 0 HA PHE B 440 4.913 25.322 -10.807 1.00 0.00 H new ATOM 0 HB2 PHE B 440 3.890 24.922 -8.813 1.00 0.00 H new ATOM 0 HB3 PHE B 440 3.578 23.236 -9.173 1.00 0.00 H new ATOM 0 HD1 PHE B 440 6.341 25.570 -8.262 1.00 0.00 H new ATOM 0 HD2 PHE B 440 4.894 21.565 -8.205 1.00 0.00 H new ATOM 0 HE1 PHE B 440 8.220 24.914 -6.822 1.00 0.00 H new ATOM 0 HE2 PHE B 440 6.772 20.904 -6.766 1.00 0.00 H new ATOM 0 HZ PHE B 440 8.442 22.578 -6.075 1.00 0.00 H new ATOM 2230 N TYR B 441 5.841 22.198 -11.265 1.00 0.00 N ATOM 2231 CA TYR B 441 6.960 21.354 -11.638 1.00 0.00 C ATOM 2232 C TYR B 441 7.499 21.755 -12.999 1.00 0.00 C ATOM 2233 O TYR B 441 8.697 21.955 -13.161 1.00 0.00 O ATOM 2234 CB TYR B 441 6.541 19.888 -11.641 1.00 0.00 C ATOM 2235 CG TYR B 441 6.497 19.296 -10.256 1.00 0.00 C ATOM 2236 CD1 TYR B 441 7.663 18.900 -9.615 1.00 0.00 C ATOM 2237 CD2 TYR B 441 5.294 19.151 -9.581 1.00 0.00 C ATOM 2238 CE1 TYR B 441 7.631 18.374 -8.341 1.00 0.00 C ATOM 2239 CE2 TYR B 441 5.252 18.624 -8.307 1.00 0.00 C ATOM 2240 CZ TYR B 441 6.422 18.236 -7.690 1.00 0.00 C ATOM 2241 OH TYR B 441 6.385 17.712 -6.419 1.00 0.00 O ATOM 0 H TYR B 441 4.949 21.708 -11.190 1.00 0.00 H new ATOM 0 HA TYR B 441 7.753 21.486 -10.902 1.00 0.00 H new ATOM 0 HB2 TYR B 441 5.558 19.796 -12.103 1.00 0.00 H new ATOM 0 HB3 TYR B 441 7.237 19.316 -12.255 1.00 0.00 H new ATOM 0 HD1 TYR B 441 8.610 19.006 -10.123 1.00 0.00 H new ATOM 0 HD2 TYR B 441 4.376 19.456 -10.061 1.00 0.00 H new ATOM 0 HE1 TYR B 441 8.547 18.072 -7.855 1.00 0.00 H new ATOM 0 HE2 TYR B 441 4.307 18.516 -7.795 1.00 0.00 H new ATOM 0 HH TYR B 441 5.858 18.299 -5.838 1.00 0.00 H new ATOM 2251 N ALA B 442 6.607 21.889 -13.975 1.00 0.00 N ATOM 2252 CA ALA B 442 7.016 22.288 -15.315 1.00 0.00 C ATOM 2253 C ALA B 442 8.103 23.353 -15.225 1.00 0.00 C ATOM 2254 O ALA B 442 9.171 23.225 -15.830 1.00 0.00 O ATOM 2255 CB ALA B 442 5.834 22.800 -16.125 1.00 0.00 C ATOM 0 H ALA B 442 5.606 21.729 -13.864 1.00 0.00 H new ATOM 0 HA ALA B 442 7.412 21.412 -15.829 1.00 0.00 H new ATOM 0 HB1 ALA B 442 6.173 23.090 -17.120 1.00 0.00 H new ATOM 0 HB2 ALA B 442 5.084 22.014 -16.212 1.00 0.00 H new ATOM 0 HB3 ALA B 442 5.397 23.664 -15.625 1.00 0.00 H new ATOM 2261 N LYS B 443 7.831 24.393 -14.443 1.00 0.00 N ATOM 2262 CA LYS B 443 8.792 25.470 -14.246 1.00 0.00 C ATOM 2263 C LYS B 443 10.047 24.931 -13.564 1.00 0.00 C ATOM 2264 O LYS B 443 11.166 25.327 -13.893 1.00 0.00 O ATOM 2265 CB LYS B 443 8.169 26.591 -13.409 1.00 0.00 C ATOM 2266 CG LYS B 443 9.187 27.443 -12.665 1.00 0.00 C ATOM 2267 CD LYS B 443 9.279 27.049 -11.200 1.00 0.00 C ATOM 2268 CE LYS B 443 9.758 28.207 -10.338 1.00 0.00 C ATOM 2269 NZ LYS B 443 8.668 28.757 -9.488 1.00 0.00 N ATOM 0 H LYS B 443 6.954 24.512 -13.936 1.00 0.00 H new ATOM 0 HA LYS B 443 9.069 25.878 -15.218 1.00 0.00 H new ATOM 0 HB2 LYS B 443 7.579 27.234 -14.062 1.00 0.00 H new ATOM 0 HB3 LYS B 443 7.480 26.152 -12.687 1.00 0.00 H new ATOM 0 HG2 LYS B 443 10.165 27.335 -13.134 1.00 0.00 H new ATOM 0 HG3 LYS B 443 8.910 28.494 -12.743 1.00 0.00 H new ATOM 0 HD2 LYS B 443 8.302 26.714 -10.851 1.00 0.00 H new ATOM 0 HD3 LYS B 443 9.962 26.207 -11.091 1.00 0.00 H new ATOM 0 HE2 LYS B 443 10.578 27.872 -9.703 1.00 0.00 H new ATOM 0 HE3 LYS B 443 10.152 28.996 -10.978 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 9.037 29.544 -8.917 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 7.896 29.101 -10.094 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 8.309 28.011 -8.859 1.00 0.00 H new ATOM 2283 N GLN B 444 9.848 24.018 -12.615 1.00 0.00 N ATOM 2284 CA GLN B 444 10.957 23.408 -11.883 1.00 0.00 C ATOM 2285 C GLN B 444 11.840 22.580 -12.815 1.00 0.00 C ATOM 2286 O GLN B 444 13.061 22.546 -12.661 1.00 0.00 O ATOM 2287 CB GLN B 444 10.418 22.529 -10.750 1.00 0.00 C ATOM 2288 CG GLN B 444 10.113 23.294 -9.476 1.00 0.00 C ATOM 2289 CD GLN B 444 10.420 22.484 -8.235 1.00 0.00 C ATOM 2290 OE1 GLN B 444 10.717 23.036 -7.176 1.00 0.00 O ATOM 2291 NE2 GLN B 444 10.348 21.164 -8.362 1.00 0.00 N ATOM 0 H GLN B 444 8.926 23.683 -12.334 1.00 0.00 H new ATOM 0 HA GLN B 444 11.566 24.207 -11.459 1.00 0.00 H new ATOM 0 HB2 GLN B 444 9.510 22.030 -11.090 1.00 0.00 H new ATOM 0 HB3 GLN B 444 11.147 21.749 -10.529 1.00 0.00 H new ATOM 0 HG2 GLN B 444 10.695 24.215 -9.459 1.00 0.00 H new ATOM 0 HG3 GLN B 444 9.061 23.581 -9.470 1.00 0.00 H new ATOM 0 HE21 GLN B 444 10.098 20.751 -9.260 1.00 0.00 H new ATOM 0 HE22 GLN B 444 10.543 20.563 -7.561 1.00 0.00 H new ATOM 2300 N ARG B 445 11.214 21.912 -13.783 1.00 0.00 N ATOM 2301 CA ARG B 445 11.937 21.086 -14.742 1.00 0.00 C ATOM 2302 C ARG B 445 12.889 21.937 -15.570 1.00 0.00 C ATOM 2303 O ARG B 445 14.077 21.633 -15.678 1.00 0.00 O ATOM 2304 CB ARG B 445 10.956 20.358 -15.665 1.00 0.00 C ATOM 2305 CG ARG B 445 10.926 18.853 -15.458 1.00 0.00 C ATOM 2306 CD ARG B 445 12.312 18.242 -15.596 1.00 0.00 C ATOM 2307 NE ARG B 445 12.408 17.351 -16.750 1.00 0.00 N ATOM 2308 CZ ARG B 445 12.897 17.711 -17.938 1.00 0.00 C ATOM 2309 NH1 ARG B 445 13.321 18.951 -18.147 1.00 0.00 N ATOM 2310 NH2 ARG B 445 12.955 16.825 -18.923 1.00 0.00 N ATOM 0 H ARG B 445 10.204 21.929 -13.922 1.00 0.00 H new ATOM 0 HA ARG B 445 12.517 20.348 -14.187 1.00 0.00 H new ATOM 0 HB2 ARG B 445 9.955 20.758 -15.505 1.00 0.00 H new ATOM 0 HB3 ARG B 445 11.221 20.568 -16.701 1.00 0.00 H new ATOM 0 HG2 ARG B 445 10.526 18.629 -14.469 1.00 0.00 H new ATOM 0 HG3 ARG B 445 10.253 18.398 -16.185 1.00 0.00 H new ATOM 0 HD2 ARG B 445 13.051 19.038 -15.691 1.00 0.00 H new ATOM 0 HD3 ARG B 445 12.555 17.688 -14.689 1.00 0.00 H new ATOM 0 HE ARG B 445 12.080 16.391 -16.640 1.00 0.00 H new ATOM 0 HH11 ARG B 445 13.275 19.639 -17.396 1.00 0.00 H new ATOM 0 HH12 ARG B 445 13.693 19.216 -19.059 1.00 0.00 H new ATOM 0 HH21 ARG B 445 12.626 15.871 -18.771 1.00 0.00 H new ATOM 0 HH22 ARG B 445 13.328 17.097 -19.832 1.00 0.00 H new