USER MOD reduce.3.24.130724 H: found=0, std=0, add=642, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 643 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 387 TYR OH : rot -29:sc= -3.59! USER MOD Set 1.2: B 404 CYS SG : rot 69:sc= -9.9! USER MOD Set 2.1: B 380 TYR OH : rot 112:sc= -4.05! USER MOD Set 2.2: B 444 GLN : amide:sc= -4.76! C(o=-8.8!,f=-11!) USER MOD Set 3.1: B 368 MET CE :methyl -129:sc= -0.804 (180deg=-0.644) USER MOD Set 3.2: B 369 ASN : amide:sc= -0.716 K(o=-1.5,f=-0.51) USER MOD Single : B 371 LYS NZ :NH3+ 144:sc= -2.11! (180deg=-4.66!) USER MOD Single : B 373 GLN : amide:sc= -6.79! C(o=-6.8!,f=-7.2!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot -170:sc= 0 USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS : no HE2:sc= -1.3 X(o=-1.3,f=-1.6) 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 -50:sc= -1.01 USER MOD Single : B 399 ASN : amide:sc= -0.185 K(o=-0.19,f=-1.8!) USER MOD Single : B 400 SER OG : rot -59:sc= 1.22 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 180:sc= -0.221 USER MOD Single : B 419 ASN : amide:sc= -4.28! K(o=-4.3!,f=-2.3) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -8.59! C(o=-8.6!,f=-13!) USER MOD Single : B 435 LYS NZ :NH3+ 158:sc= -0.0249 (180deg=-0.217) USER MOD Single : B 436 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.944) USER MOD Single : B 437 MET CE :methyl -178:sc= -4.76! (180deg=-4.81!) USER MOD Single : B 441 TYR OH : rot 130:sc= -0.35 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1069 N ASP B 367 -4.601 4.215 -15.697 1.00 0.00 N ATOM 1070 CA ASP B 367 -3.218 4.029 -15.283 1.00 0.00 C ATOM 1071 C ASP B 367 -2.287 4.640 -16.322 1.00 0.00 C ATOM 1072 O ASP B 367 -1.560 5.592 -16.038 1.00 0.00 O ATOM 1073 CB ASP B 367 -2.906 2.542 -15.104 1.00 0.00 C ATOM 1074 CG ASP B 367 -3.560 1.681 -16.167 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -3.022 1.617 -17.292 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -4.610 1.073 -15.872 1.00 0.00 O ATOM 0 HA ASP B 367 -3.066 4.528 -14.326 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -1.827 2.394 -15.134 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -3.245 2.219 -14.120 1.00 0.00 H new ATOM 1081 N MET B 368 -2.328 4.089 -17.531 1.00 0.00 N ATOM 1082 CA MET B 368 -1.501 4.583 -18.623 1.00 0.00 C ATOM 1083 C MET B 368 -1.369 6.099 -18.544 1.00 0.00 C ATOM 1084 O MET B 368 -0.261 6.636 -18.542 1.00 0.00 O ATOM 1085 CB MET B 368 -2.102 4.180 -19.971 1.00 0.00 C ATOM 1086 CG MET B 368 -1.070 4.018 -21.075 1.00 0.00 C ATOM 1087 SD MET B 368 -1.622 4.706 -22.647 1.00 0.00 S ATOM 1088 CE MET B 368 -1.743 6.445 -22.237 1.00 0.00 C ATOM 0 H MET B 368 -2.926 3.300 -17.778 1.00 0.00 H new ATOM 0 HA MET B 368 -0.510 4.138 -18.533 1.00 0.00 H new ATOM 0 HB2 MET B 368 -2.644 3.242 -19.852 1.00 0.00 H new ATOM 0 HB3 MET B 368 -2.830 4.932 -20.274 1.00 0.00 H new ATOM 0 HG2 MET B 368 -0.143 4.506 -20.775 1.00 0.00 H new ATOM 0 HG3 MET B 368 -0.846 2.959 -21.205 1.00 0.00 H new ATOM 0 HE1 MET B 368 -2.721 6.822 -22.536 1.00 0.00 H new ATOM 0 HE2 MET B 368 -1.617 6.575 -21.162 1.00 0.00 H new ATOM 0 HE3 MET B 368 -0.965 6.998 -22.763 1.00 0.00 H new ATOM 1098 N ASN B 369 -2.507 6.784 -18.463 1.00 0.00 N ATOM 1099 CA ASN B 369 -2.509 8.238 -18.369 1.00 0.00 C ATOM 1100 C ASN B 369 -1.787 8.683 -17.105 1.00 0.00 C ATOM 1101 O ASN B 369 -1.006 9.635 -17.124 1.00 0.00 O ATOM 1102 CB ASN B 369 -3.940 8.776 -18.368 1.00 0.00 C ATOM 1103 CG ASN B 369 -4.466 9.032 -19.768 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -5.206 9.987 -19.999 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -4.085 8.176 -20.709 1.00 0.00 N ATOM 0 H ASN B 369 -3.433 6.357 -18.461 1.00 0.00 H new ATOM 0 HA ASN B 369 -1.987 8.639 -19.238 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -4.592 8.063 -17.863 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -3.976 9.702 -17.795 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -4.407 8.297 -21.669 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -3.470 7.398 -20.472 1.00 0.00 H new ATOM 1112 N ALA B 370 -2.045 7.977 -16.008 1.00 0.00 N ATOM 1113 CA ALA B 370 -1.411 8.289 -14.737 1.00 0.00 C ATOM 1114 C ALA B 370 0.087 8.042 -14.830 1.00 0.00 C ATOM 1115 O ALA B 370 0.854 8.974 -15.072 1.00 0.00 O ATOM 1116 CB ALA B 370 -2.018 7.472 -13.607 1.00 0.00 C ATOM 0 H ALA B 370 -2.689 7.186 -15.976 1.00 0.00 H new ATOM 0 HA ALA B 370 -1.584 9.342 -14.516 1.00 0.00 H new ATOM 0 HB1 ALA B 370 -1.525 7.726 -12.669 1.00 0.00 H new ATOM 0 HB2 ALA B 370 -3.082 7.694 -13.529 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -1.883 6.410 -13.812 1.00 0.00 H new ATOM 1122 N LYS B 371 0.495 6.783 -14.638 1.00 0.00 N ATOM 1123 CA LYS B 371 1.906 6.404 -14.704 1.00 0.00 C ATOM 1124 C LYS B 371 2.686 7.353 -15.605 1.00 0.00 C ATOM 1125 O LYS B 371 3.731 7.884 -15.217 1.00 0.00 O ATOM 1126 CB LYS B 371 2.050 4.967 -15.217 1.00 0.00 C ATOM 1127 CG LYS B 371 1.011 4.575 -16.259 1.00 0.00 C ATOM 1128 CD LYS B 371 1.651 3.864 -17.444 1.00 0.00 C ATOM 1129 CE LYS B 371 1.262 2.393 -17.498 1.00 0.00 C ATOM 1130 NZ LYS B 371 0.388 2.092 -18.665 1.00 0.00 N ATOM 0 H LYS B 371 -0.137 6.008 -14.435 1.00 0.00 H new ATOM 0 HA LYS B 371 2.316 6.468 -13.696 1.00 0.00 H new ATOM 0 HB2 LYS B 371 3.044 4.843 -15.646 1.00 0.00 H new ATOM 0 HB3 LYS B 371 1.979 4.282 -14.372 1.00 0.00 H new ATOM 0 HG2 LYS B 371 0.264 3.925 -15.803 1.00 0.00 H new ATOM 0 HG3 LYS B 371 0.488 5.466 -16.607 1.00 0.00 H new ATOM 0 HD2 LYS B 371 1.348 4.354 -18.369 1.00 0.00 H new ATOM 0 HD3 LYS B 371 2.735 3.951 -17.378 1.00 0.00 H new ATOM 0 HE2 LYS B 371 2.162 1.781 -17.552 1.00 0.00 H new ATOM 0 HE3 LYS B 371 0.746 2.120 -16.578 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 0.619 1.149 -19.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -0.608 2.112 -18.367 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 0.542 2.804 -19.407 1.00 0.00 H new ATOM 1144 N ARG B 372 2.160 7.576 -16.806 1.00 0.00 N ATOM 1145 CA ARG B 372 2.794 8.474 -17.755 1.00 0.00 C ATOM 1146 C ARG B 372 3.029 9.839 -17.118 1.00 0.00 C ATOM 1147 O ARG B 372 4.164 10.280 -16.978 1.00 0.00 O ATOM 1148 CB ARG B 372 1.929 8.620 -19.009 1.00 0.00 C ATOM 1149 CG ARG B 372 2.685 9.173 -20.205 1.00 0.00 C ATOM 1150 CD ARG B 372 1.773 9.341 -21.409 1.00 0.00 C ATOM 1151 NE ARG B 372 0.481 9.908 -21.038 1.00 0.00 N ATOM 1152 CZ ARG B 372 0.306 11.183 -20.705 1.00 0.00 C ATOM 1153 NH1 ARG B 372 1.332 12.023 -20.728 1.00 0.00 N ATOM 1154 NH2 ARG B 372 -0.896 11.620 -20.355 1.00 0.00 N ATOM 0 H ARG B 372 1.298 7.146 -17.141 1.00 0.00 H new ATOM 0 HA ARG B 372 3.757 8.051 -18.041 1.00 0.00 H new ATOM 0 HB2 ARG B 372 1.514 7.646 -19.270 1.00 0.00 H new ATOM 0 HB3 ARG B 372 1.087 9.276 -18.786 1.00 0.00 H new ATOM 0 HG2 ARG B 372 3.127 10.135 -19.945 1.00 0.00 H new ATOM 0 HG3 ARG B 372 3.506 8.503 -20.460 1.00 0.00 H new ATOM 0 HD2 ARG B 372 2.256 9.987 -22.143 1.00 0.00 H new ATOM 0 HD3 ARG B 372 1.621 8.373 -21.887 1.00 0.00 H new ATOM 0 HE ARG B 372 -0.332 9.293 -21.034 1.00 0.00 H new ATOM 0 HH11 ARG B 372 2.257 11.691 -21.001 1.00 0.00 H new ATOM 0 HH12 ARG B 372 1.196 13.001 -20.472 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -1.688 10.978 -20.341 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -1.028 12.599 -20.100 1.00 0.00 H new ATOM 1168 N GLN B 373 1.949 10.502 -16.726 1.00 0.00 N ATOM 1169 CA GLN B 373 2.054 11.815 -16.101 1.00 0.00 C ATOM 1170 C GLN B 373 3.114 11.817 -15.001 1.00 0.00 C ATOM 1171 O GLN B 373 4.026 12.645 -14.993 1.00 0.00 O ATOM 1172 CB GLN B 373 0.704 12.243 -15.516 1.00 0.00 C ATOM 1173 CG GLN B 373 0.458 13.742 -15.605 1.00 0.00 C ATOM 1174 CD GLN B 373 1.410 14.562 -14.748 1.00 0.00 C ATOM 1175 OE1 GLN B 373 1.708 15.713 -15.068 1.00 0.00 O ATOM 1176 NE2 GLN B 373 1.891 13.984 -13.652 1.00 0.00 N ATOM 0 H GLN B 373 0.995 10.155 -16.829 1.00 0.00 H new ATOM 0 HA GLN B 373 2.351 12.525 -16.872 1.00 0.00 H new ATOM 0 HB2 GLN B 373 -0.094 11.719 -16.041 1.00 0.00 H new ATOM 0 HB3 GLN B 373 0.654 11.935 -14.472 1.00 0.00 H new ATOM 0 HG2 GLN B 373 0.553 14.057 -16.644 1.00 0.00 H new ATOM 0 HG3 GLN B 373 -0.567 13.953 -15.300 1.00 0.00 H new ATOM 0 HE21 GLN B 373 1.621 13.028 -13.419 1.00 0.00 H new ATOM 0 HE22 GLN B 373 2.530 14.496 -13.044 1.00 0.00 H new ATOM 1185 N LEU B 374 2.966 10.893 -14.065 1.00 0.00 N ATOM 1186 CA LEU B 374 3.876 10.779 -12.932 1.00 0.00 C ATOM 1187 C LEU B 374 5.345 10.933 -13.315 1.00 0.00 C ATOM 1188 O LEU B 374 5.999 11.892 -12.904 1.00 0.00 O ATOM 1189 CB LEU B 374 3.671 9.438 -12.228 1.00 0.00 C ATOM 1190 CG LEU B 374 2.214 9.018 -12.047 1.00 0.00 C ATOM 1191 CD1 LEU B 374 2.111 7.851 -11.076 1.00 0.00 C ATOM 1192 CD2 LEU B 374 1.379 10.194 -11.562 1.00 0.00 C ATOM 0 H LEU B 374 2.215 10.202 -14.067 1.00 0.00 H new ATOM 0 HA LEU B 374 3.635 11.604 -12.261 1.00 0.00 H new ATOM 0 HB2 LEU B 374 4.188 8.664 -12.796 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.144 9.484 -11.247 1.00 0.00 H new ATOM 0 HG LEU B 374 1.825 8.694 -13.012 1.00 0.00 H new ATOM 0 HD11 LEU B 374 1.065 7.566 -10.960 1.00 0.00 H new ATOM 0 HD12 LEU B 374 2.677 7.004 -11.464 1.00 0.00 H new ATOM 0 HD13 LEU B 374 2.516 8.146 -10.108 1.00 0.00 H new ATOM 0 HD21 LEU B 374 0.343 9.878 -11.438 1.00 0.00 H new ATOM 0 HD22 LEU B 374 1.768 10.547 -10.607 1.00 0.00 H new ATOM 0 HD23 LEU B 374 1.427 11.001 -12.293 1.00 0.00 H new ATOM 1204 N TYR B 375 5.879 9.969 -14.059 1.00 0.00 N ATOM 1205 CA TYR B 375 7.291 10.007 -14.429 1.00 0.00 C ATOM 1206 C TYR B 375 7.534 10.671 -15.776 1.00 0.00 C ATOM 1207 O TYR B 375 8.408 11.529 -15.901 1.00 0.00 O ATOM 1208 CB TYR B 375 7.873 8.594 -14.427 1.00 0.00 C ATOM 1209 CG TYR B 375 8.448 8.189 -13.089 1.00 0.00 C ATOM 1210 CD1 TYR B 375 8.042 8.821 -11.920 1.00 0.00 C ATOM 1211 CD2 TYR B 375 9.398 7.179 -12.994 1.00 0.00 C ATOM 1212 CE1 TYR B 375 8.565 8.458 -10.694 1.00 0.00 C ATOM 1213 CE2 TYR B 375 9.926 6.811 -11.770 1.00 0.00 C ATOM 1214 CZ TYR B 375 9.506 7.454 -10.624 1.00 0.00 C ATOM 1215 OH TYR B 375 10.030 7.091 -9.405 1.00 0.00 O ATOM 0 H TYR B 375 5.365 9.163 -14.414 1.00 0.00 H new ATOM 0 HA TYR B 375 7.797 10.617 -13.681 1.00 0.00 H new ATOM 0 HB2 TYR B 375 7.093 7.886 -14.709 1.00 0.00 H new ATOM 0 HB3 TYR B 375 8.653 8.528 -15.185 1.00 0.00 H new ATOM 0 HD1 TYR B 375 7.305 9.609 -11.971 1.00 0.00 H new ATOM 0 HD2 TYR B 375 9.729 6.674 -13.890 1.00 0.00 H new ATOM 0 HE1 TYR B 375 8.238 8.959 -9.795 1.00 0.00 H new ATOM 0 HE2 TYR B 375 10.663 6.024 -11.712 1.00 0.00 H new ATOM 0 HH TYR B 375 10.679 6.368 -9.530 1.00 0.00 H new ATOM 1225 N SER B 376 6.775 10.275 -16.784 1.00 0.00 N ATOM 1226 CA SER B 376 6.934 10.839 -18.116 1.00 0.00 C ATOM 1227 C SER B 376 6.684 12.346 -18.115 1.00 0.00 C ATOM 1228 O SER B 376 7.007 13.031 -19.085 1.00 0.00 O ATOM 1229 CB SER B 376 5.980 10.154 -19.096 1.00 0.00 C ATOM 1230 OG SER B 376 6.064 8.744 -18.990 1.00 0.00 O ATOM 0 H SER B 376 6.044 9.567 -16.707 1.00 0.00 H new ATOM 0 HA SER B 376 7.963 10.666 -18.432 1.00 0.00 H new ATOM 0 HB2 SER B 376 4.958 10.476 -18.898 1.00 0.00 H new ATOM 0 HB3 SER B 376 6.219 10.460 -20.115 1.00 0.00 H new ATOM 0 HG SER B 376 5.568 8.330 -19.727 1.00 0.00 H new ATOM 1236 N LEU B 377 6.099 12.861 -17.035 1.00 0.00 N ATOM 1237 CA LEU B 377 5.803 14.285 -16.945 1.00 0.00 C ATOM 1238 C LEU B 377 6.400 14.922 -15.691 1.00 0.00 C ATOM 1239 O LEU B 377 6.706 16.116 -15.686 1.00 0.00 O ATOM 1240 CB LEU B 377 4.290 14.496 -16.954 1.00 0.00 C ATOM 1241 CG LEU B 377 3.732 15.164 -18.209 1.00 0.00 C ATOM 1242 CD1 LEU B 377 3.641 14.163 -19.351 1.00 0.00 C ATOM 1243 CD2 LEU B 377 2.369 15.771 -17.924 1.00 0.00 C ATOM 0 H LEU B 377 5.823 12.317 -16.218 1.00 0.00 H new ATOM 0 HA LEU B 377 6.258 14.769 -17.809 1.00 0.00 H new ATOM 0 HB2 LEU B 377 3.804 13.528 -16.831 1.00 0.00 H new ATOM 0 HB3 LEU B 377 4.019 15.101 -16.089 1.00 0.00 H new ATOM 0 HG LEU B 377 4.411 15.963 -18.506 1.00 0.00 H new ATOM 0 HD11 LEU B 377 3.241 14.657 -20.237 1.00 0.00 H new ATOM 0 HD12 LEU B 377 4.634 13.771 -19.571 1.00 0.00 H new ATOM 0 HD13 LEU B 377 2.982 13.343 -19.065 1.00 0.00 H new ATOM 0 HD21 LEU B 377 1.985 16.243 -18.828 1.00 0.00 H new ATOM 0 HD22 LEU B 377 1.682 14.988 -17.603 1.00 0.00 H new ATOM 0 HD23 LEU B 377 2.461 16.518 -17.136 1.00 0.00 H new ATOM 1255 N ILE B 378 6.547 14.141 -14.622 1.00 0.00 N ATOM 1256 CA ILE B 378 7.084 14.676 -13.373 1.00 0.00 C ATOM 1257 C ILE B 378 7.985 13.681 -12.647 1.00 0.00 C ATOM 1258 O ILE B 378 7.890 13.519 -11.430 1.00 0.00 O ATOM 1259 CB ILE B 378 5.944 15.102 -12.433 1.00 0.00 C ATOM 1260 CG1 ILE B 378 4.865 15.827 -13.232 1.00 0.00 C ATOM 1261 CG2 ILE B 378 6.472 15.989 -11.317 1.00 0.00 C ATOM 1262 CD1 ILE B 378 5.280 17.209 -13.690 1.00 0.00 C ATOM 0 H ILE B 378 6.306 13.150 -14.595 1.00 0.00 H new ATOM 0 HA ILE B 378 7.689 15.541 -13.644 1.00 0.00 H new ATOM 0 HB ILE B 378 5.510 14.212 -11.977 1.00 0.00 H new ATOM 0 HG12 ILE B 378 4.604 15.227 -14.104 1.00 0.00 H new ATOM 0 HG13 ILE B 378 3.966 15.910 -12.622 1.00 0.00 H new ATOM 0 HG21 ILE B 378 5.650 16.279 -10.663 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.219 15.443 -10.740 1.00 0.00 H new ATOM 0 HG23 ILE B 378 6.927 16.882 -11.746 1.00 0.00 H new ATOM 0 HD11 ILE B 378 4.465 17.666 -14.252 1.00 0.00 H new ATOM 0 HD12 ILE B 378 5.513 17.825 -12.822 1.00 0.00 H new ATOM 0 HD13 ILE B 378 6.161 17.132 -14.327 1.00 0.00 H new ATOM 1274 N GLY B 379 8.863 13.020 -13.393 1.00 0.00 N ATOM 1275 CA GLY B 379 9.772 12.059 -12.792 1.00 0.00 C ATOM 1276 C GLY B 379 11.151 12.084 -13.422 1.00 0.00 C ATOM 1277 O GLY B 379 11.508 11.187 -14.186 1.00 0.00 O ATOM 0 H GLY B 379 8.962 13.131 -14.402 1.00 0.00 H new ATOM 0 HA2 GLY B 379 9.861 12.267 -11.726 1.00 0.00 H new ATOM 0 HA3 GLY B 379 9.351 11.058 -12.888 1.00 0.00 H new ATOM 1281 N TYR B 380 11.928 13.112 -13.100 1.00 0.00 N ATOM 1282 CA TYR B 380 13.277 13.247 -13.639 1.00 0.00 C ATOM 1283 C TYR B 380 14.316 12.792 -12.619 1.00 0.00 C ATOM 1284 O TYR B 380 14.866 11.696 -12.727 1.00 0.00 O ATOM 1285 CB TYR B 380 13.543 14.696 -14.048 1.00 0.00 C ATOM 1286 CG TYR B 380 12.604 15.689 -13.404 1.00 0.00 C ATOM 1287 CD1 TYR B 380 11.264 15.744 -13.768 1.00 0.00 C ATOM 1288 CD2 TYR B 380 13.055 16.569 -12.429 1.00 0.00 C ATOM 1289 CE1 TYR B 380 10.402 16.649 -13.179 1.00 0.00 C ATOM 1290 CE2 TYR B 380 12.198 17.475 -11.835 1.00 0.00 C ATOM 1291 CZ TYR B 380 10.873 17.511 -12.213 1.00 0.00 C ATOM 1292 OH TYR B 380 10.015 18.409 -11.625 1.00 0.00 O ATOM 0 H TYR B 380 11.648 13.863 -12.469 1.00 0.00 H new ATOM 0 HA TYR B 380 13.357 12.610 -14.520 1.00 0.00 H new ATOM 0 HB2 TYR B 380 14.569 14.956 -13.786 1.00 0.00 H new ATOM 0 HB3 TYR B 380 13.460 14.780 -15.132 1.00 0.00 H new ATOM 0 HD1 TYR B 380 10.890 15.069 -14.523 1.00 0.00 H new ATOM 0 HD2 TYR B 380 14.093 16.545 -12.130 1.00 0.00 H new ATOM 0 HE1 TYR B 380 9.364 16.681 -13.475 1.00 0.00 H new ATOM 0 HE2 TYR B 380 12.565 18.152 -11.078 1.00 0.00 H new ATOM 0 HH TYR B 380 9.882 18.166 -10.685 1.00 0.00 H new ATOM 1302 N ALA B 381 14.576 13.637 -11.627 1.00 0.00 N ATOM 1303 CA ALA B 381 15.545 13.317 -10.586 1.00 0.00 C ATOM 1304 C ALA B 381 15.872 14.547 -9.747 1.00 0.00 C ATOM 1305 O ALA B 381 16.881 15.216 -9.970 1.00 0.00 O ATOM 1306 CB ALA B 381 16.817 12.735 -11.183 1.00 0.00 C ATOM 0 H ALA B 381 14.129 14.548 -11.522 1.00 0.00 H new ATOM 0 HA ALA B 381 15.095 12.566 -9.937 1.00 0.00 H new ATOM 0 HB1 ALA B 381 17.522 12.506 -10.384 1.00 0.00 H new ATOM 0 HB2 ALA B 381 16.578 11.823 -11.729 1.00 0.00 H new ATOM 0 HB3 ALA B 381 17.264 13.459 -11.864 1.00 0.00 H new ATOM 1312 N SER B 382 15.010 14.838 -8.778 1.00 0.00 N ATOM 1313 CA SER B 382 15.203 15.986 -7.899 1.00 0.00 C ATOM 1314 C SER B 382 14.027 16.131 -6.939 1.00 0.00 C ATOM 1315 O SER B 382 14.161 15.901 -5.736 1.00 0.00 O ATOM 1316 CB SER B 382 15.362 17.265 -8.721 1.00 0.00 C ATOM 1317 OG SER B 382 15.331 18.413 -7.891 1.00 0.00 O ATOM 0 H SER B 382 14.170 14.294 -8.581 1.00 0.00 H new ATOM 0 HA SER B 382 16.111 15.822 -7.319 1.00 0.00 H new ATOM 0 HB2 SER B 382 16.304 17.234 -9.269 1.00 0.00 H new ATOM 0 HB3 SER B 382 14.565 17.326 -9.461 1.00 0.00 H new ATOM 0 HG SER B 382 15.436 19.217 -8.441 1.00 0.00 H new ATOM 1323 N LEU B 383 12.873 16.505 -7.481 1.00 0.00 N ATOM 1324 CA LEU B 383 11.669 16.673 -6.677 1.00 0.00 C ATOM 1325 C LEU B 383 11.536 15.547 -5.659 1.00 0.00 C ATOM 1326 O LEU B 383 10.940 15.723 -4.597 1.00 0.00 O ATOM 1327 CB LEU B 383 10.427 16.706 -7.573 1.00 0.00 C ATOM 1328 CG LEU B 383 10.175 15.435 -8.392 1.00 0.00 C ATOM 1329 CD1 LEU B 383 8.827 15.507 -9.092 1.00 0.00 C ATOM 1330 CD2 LEU B 383 11.286 15.220 -9.408 1.00 0.00 C ATOM 0 H LEU B 383 12.746 16.698 -8.475 1.00 0.00 H new ATOM 0 HA LEU B 383 11.751 17.620 -6.144 1.00 0.00 H new ATOM 0 HB2 LEU B 383 9.554 16.895 -6.948 1.00 0.00 H new ATOM 0 HB3 LEU B 383 10.517 17.548 -8.259 1.00 0.00 H new ATOM 0 HG LEU B 383 10.165 14.587 -7.707 1.00 0.00 H new ATOM 0 HD11 LEU B 383 8.667 14.596 -9.668 1.00 0.00 H new ATOM 0 HD12 LEU B 383 8.036 15.610 -8.349 1.00 0.00 H new ATOM 0 HD13 LEU B 383 8.810 16.367 -9.762 1.00 0.00 H new ATOM 0 HD21 LEU B 383 11.087 14.313 -9.978 1.00 0.00 H new ATOM 0 HD22 LEU B 383 11.329 16.072 -10.086 1.00 0.00 H new ATOM 0 HD23 LEU B 383 12.239 15.121 -8.889 1.00 0.00 H new ATOM 1342 N ARG B 384 12.088 14.388 -5.997 1.00 0.00 N ATOM 1343 CA ARG B 384 12.027 13.229 -5.116 1.00 0.00 C ATOM 1344 C ARG B 384 10.584 12.789 -4.902 1.00 0.00 C ATOM 1345 O ARG B 384 10.129 12.651 -3.767 1.00 0.00 O ATOM 1346 CB ARG B 384 12.680 13.544 -3.770 1.00 0.00 C ATOM 1347 CG ARG B 384 13.333 12.336 -3.119 1.00 0.00 C ATOM 1348 CD ARG B 384 14.847 12.457 -3.115 1.00 0.00 C ATOM 1349 NE ARG B 384 15.500 11.158 -3.261 1.00 0.00 N ATOM 1350 CZ ARG B 384 16.794 11.010 -3.527 1.00 0.00 C ATOM 1351 NH1 ARG B 384 17.568 12.076 -3.672 1.00 0.00 N ATOM 1352 NH2 ARG B 384 17.314 9.796 -3.645 1.00 0.00 N ATOM 0 H ARG B 384 12.583 14.226 -6.874 1.00 0.00 H new ATOM 0 HA ARG B 384 12.573 12.415 -5.592 1.00 0.00 H new ATOM 0 HB2 ARG B 384 13.431 14.321 -3.912 1.00 0.00 H new ATOM 0 HB3 ARG B 384 11.926 13.948 -3.095 1.00 0.00 H new ATOM 0 HG2 ARG B 384 12.972 12.233 -2.096 1.00 0.00 H new ATOM 0 HG3 ARG B 384 13.041 11.431 -3.652 1.00 0.00 H new ATOM 0 HD2 ARG B 384 15.160 13.114 -3.927 1.00 0.00 H new ATOM 0 HD3 ARG B 384 15.171 12.923 -2.185 1.00 0.00 H new ATOM 0 HE ARG B 384 14.931 10.318 -3.153 1.00 0.00 H new ATOM 0 HH11 ARG B 384 17.171 13.011 -3.579 1.00 0.00 H new ATOM 0 HH12 ARG B 384 18.561 11.961 -3.876 1.00 0.00 H new ATOM 0 HH21 ARG B 384 16.721 8.974 -3.532 1.00 0.00 H new ATOM 0 HH22 ARG B 384 18.307 9.684 -3.849 1.00 0.00 H new ATOM 1366 N LEU B 385 9.869 12.569 -6.000 1.00 0.00 N ATOM 1367 CA LEU B 385 8.478 12.142 -5.934 1.00 0.00 C ATOM 1368 C LEU B 385 8.386 10.665 -5.582 1.00 0.00 C ATOM 1369 O LEU B 385 9.020 9.825 -6.221 1.00 0.00 O ATOM 1370 CB LEU B 385 7.780 12.404 -7.268 1.00 0.00 C ATOM 1371 CG LEU B 385 6.253 12.398 -7.214 1.00 0.00 C ATOM 1372 CD1 LEU B 385 5.680 13.058 -8.457 1.00 0.00 C ATOM 1373 CD2 LEU B 385 5.728 10.977 -7.073 1.00 0.00 C ATOM 0 H LEU B 385 10.231 12.680 -6.947 1.00 0.00 H new ATOM 0 HA LEU B 385 7.980 12.718 -5.153 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.111 13.370 -7.649 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.105 11.650 -7.985 1.00 0.00 H new ATOM 0 HG LEU B 385 5.935 12.967 -6.341 1.00 0.00 H new ATOM 0 HD11 LEU B 385 4.591 13.047 -8.406 1.00 0.00 H new ATOM 0 HD12 LEU B 385 6.030 14.089 -8.516 1.00 0.00 H new ATOM 0 HD13 LEU B 385 6.007 12.513 -9.342 1.00 0.00 H new ATOM 0 HD21 LEU B 385 4.639 10.994 -7.036 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.053 10.383 -7.927 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.115 10.535 -6.155 1.00 0.00 H new ATOM 1385 N HIS B 386 7.602 10.354 -4.558 1.00 0.00 N ATOM 1386 CA HIS B 386 7.445 8.968 -4.126 1.00 0.00 C ATOM 1387 C HIS B 386 6.092 8.715 -3.466 1.00 0.00 C ATOM 1388 O HIS B 386 5.580 9.542 -2.706 1.00 0.00 O ATOM 1389 CB HIS B 386 8.571 8.588 -3.163 1.00 0.00 C ATOM 1390 CG HIS B 386 8.485 9.276 -1.836 1.00 0.00 C ATOM 1391 ND1 HIS B 386 9.297 10.333 -1.481 1.00 0.00 N ATOM 1392 CD2 HIS B 386 7.679 9.050 -0.771 1.00 0.00 C ATOM 1393 CE1 HIS B 386 8.995 10.726 -0.256 1.00 0.00 C ATOM 1394 NE2 HIS B 386 8.017 9.964 0.196 1.00 0.00 N ATOM 0 H HIS B 386 7.069 11.033 -4.015 1.00 0.00 H new ATOM 0 HA HIS B 386 7.495 8.345 -5.019 1.00 0.00 H new ATOM 0 HB2 HIS B 386 8.554 7.510 -3.005 1.00 0.00 H new ATOM 0 HB3 HIS B 386 9.529 8.827 -3.625 1.00 0.00 H new ATOM 0 HD1 HIS B 386 10.018 10.747 -2.072 1.00 0.00 H new ATOM 0 HD2 HIS B 386 6.913 8.292 -0.697 1.00 0.00 H new ATOM 0 HE1 HIS B 386 9.468 11.533 0.283 1.00 0.00 H new ATOM 1403 N TYR B 387 5.520 7.553 -3.761 1.00 0.00 N ATOM 1404 CA TYR B 387 4.237 7.168 -3.196 1.00 0.00 C ATOM 1405 C TYR B 387 4.426 6.379 -1.913 1.00 0.00 C ATOM 1406 O TYR B 387 5.494 5.823 -1.661 1.00 0.00 O ATOM 1407 CB TYR B 387 3.446 6.323 -4.189 1.00 0.00 C ATOM 1408 CG TYR B 387 2.865 7.129 -5.314 1.00 0.00 C ATOM 1409 CD1 TYR B 387 3.675 7.601 -6.333 1.00 0.00 C ATOM 1410 CD2 TYR B 387 1.511 7.425 -5.352 1.00 0.00 C ATOM 1411 CE1 TYR B 387 3.154 8.347 -7.365 1.00 0.00 C ATOM 1412 CE2 TYR B 387 0.976 8.171 -6.379 1.00 0.00 C ATOM 1413 CZ TYR B 387 1.805 8.632 -7.387 1.00 0.00 C ATOM 1414 OH TYR B 387 1.286 9.378 -8.416 1.00 0.00 O ATOM 0 H TYR B 387 5.928 6.861 -4.390 1.00 0.00 H new ATOM 0 HA TYR B 387 3.685 8.082 -2.976 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.097 5.552 -4.601 1.00 0.00 H new ATOM 0 HB3 TYR B 387 2.640 5.812 -3.662 1.00 0.00 H new ATOM 0 HD1 TYR B 387 4.732 7.380 -6.317 1.00 0.00 H new ATOM 0 HD2 TYR B 387 0.866 7.065 -4.564 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.798 8.707 -8.154 1.00 0.00 H new ATOM 0 HE2 TYR B 387 -0.081 8.394 -6.398 1.00 0.00 H new ATOM 0 HH TYR B 387 1.973 9.988 -8.756 1.00 0.00 H new ATOM 1424 N VAL B 388 3.372 6.322 -1.117 1.00 0.00 N ATOM 1425 CA VAL B 388 3.405 5.586 0.131 1.00 0.00 C ATOM 1426 C VAL B 388 2.121 4.793 0.304 1.00 0.00 C ATOM 1427 O VAL B 388 1.030 5.283 0.010 1.00 0.00 O ATOM 1428 CB VAL B 388 3.606 6.516 1.341 1.00 0.00 C ATOM 1429 CG1 VAL B 388 5.034 6.417 1.849 1.00 0.00 C ATOM 1430 CG2 VAL B 388 3.262 7.951 0.983 1.00 0.00 C ATOM 0 H VAL B 388 2.482 6.778 -1.315 1.00 0.00 H new ATOM 0 HA VAL B 388 4.255 4.906 0.086 1.00 0.00 H new ATOM 0 HB VAL B 388 2.932 6.197 2.136 1.00 0.00 H new ATOM 0 HG11 VAL B 388 5.163 7.080 2.705 1.00 0.00 H new ATOM 0 HG12 VAL B 388 5.243 5.390 2.150 1.00 0.00 H new ATOM 0 HG13 VAL B 388 5.723 6.710 1.057 1.00 0.00 H new ATOM 0 HG21 VAL B 388 3.412 8.589 1.854 1.00 0.00 H new ATOM 0 HG22 VAL B 388 3.906 8.288 0.171 1.00 0.00 H new ATOM 0 HG23 VAL B 388 2.220 8.007 0.667 1.00 0.00 H new ATOM 1440 N THR B 389 2.256 3.563 0.775 1.00 0.00 N ATOM 1441 CA THR B 389 1.102 2.704 0.980 1.00 0.00 C ATOM 1442 C THR B 389 0.694 2.691 2.448 1.00 0.00 C ATOM 1443 O THR B 389 1.431 2.199 3.303 1.00 0.00 O ATOM 1444 CB THR B 389 1.376 1.265 0.472 1.00 0.00 C ATOM 1445 OG1 THR B 389 0.299 0.789 -0.344 1.00 0.00 O ATOM 1446 CG2 THR B 389 1.581 0.276 1.616 1.00 0.00 C ATOM 0 H THR B 389 3.150 3.139 1.022 1.00 0.00 H new ATOM 0 HA THR B 389 0.275 3.110 0.398 1.00 0.00 H new ATOM 0 HB THR B 389 2.293 1.325 -0.114 1.00 0.00 H new ATOM 0 HG1 THR B 389 0.499 -0.120 -0.652 1.00 0.00 H new ATOM 0 HG21 THR B 389 1.769 -0.717 1.209 1.00 0.00 H new ATOM 0 HG22 THR B 389 2.433 0.589 2.219 1.00 0.00 H new ATOM 0 HG23 THR B 389 0.687 0.249 2.238 1.00 0.00 H new ATOM 1454 N VAL B 390 -0.478 3.235 2.735 1.00 0.00 N ATOM 1455 CA VAL B 390 -0.969 3.281 4.101 1.00 0.00 C ATOM 1456 C VAL B 390 -2.319 2.590 4.230 1.00 0.00 C ATOM 1457 O VAL B 390 -3.138 2.600 3.306 1.00 0.00 O ATOM 1458 CB VAL B 390 -1.089 4.728 4.617 1.00 0.00 C ATOM 1459 CG1 VAL B 390 0.260 5.429 4.576 1.00 0.00 C ATOM 1460 CG2 VAL B 390 -2.123 5.496 3.813 1.00 0.00 C ATOM 0 H VAL B 390 -1.103 3.649 2.044 1.00 0.00 H new ATOM 0 HA VAL B 390 -0.236 2.751 4.710 1.00 0.00 H new ATOM 0 HB VAL B 390 -1.420 4.696 5.655 1.00 0.00 H new ATOM 0 HG11 VAL B 390 0.151 6.449 4.945 1.00 0.00 H new ATOM 0 HG12 VAL B 390 0.969 4.890 5.204 1.00 0.00 H new ATOM 0 HG13 VAL B 390 0.627 5.451 3.550 1.00 0.00 H new ATOM 0 HG21 VAL B 390 -2.194 6.516 4.191 1.00 0.00 H new ATOM 0 HG22 VAL B 390 -1.826 5.518 2.765 1.00 0.00 H new ATOM 0 HG23 VAL B 390 -3.092 5.006 3.905 1.00 0.00 H new ATOM 1470 N LYS B 391 -2.540 1.988 5.388 1.00 0.00 N ATOM 1471 CA LYS B 391 -3.783 1.290 5.662 1.00 0.00 C ATOM 1472 C LYS B 391 -3.775 -0.100 5.042 1.00 0.00 C ATOM 1473 O LYS B 391 -4.662 -0.444 4.262 1.00 0.00 O ATOM 1474 CB LYS B 391 -4.965 2.094 5.127 1.00 0.00 C ATOM 1475 CG LYS B 391 -6.272 1.806 5.845 1.00 0.00 C ATOM 1476 CD LYS B 391 -6.749 0.388 5.583 1.00 0.00 C ATOM 1477 CE LYS B 391 -8.109 0.132 6.211 1.00 0.00 C ATOM 1478 NZ LYS B 391 -8.588 -1.254 5.949 1.00 0.00 N ATOM 0 H LYS B 391 -1.869 1.970 6.156 1.00 0.00 H new ATOM 0 HA LYS B 391 -3.882 1.182 6.742 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -4.739 3.157 5.213 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -5.089 1.880 4.065 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -6.140 1.955 6.917 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -7.033 2.514 5.516 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -6.805 0.215 4.508 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -6.024 -0.321 5.983 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -8.050 0.299 7.287 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -8.832 0.847 5.817 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -9.518 -1.390 6.393 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -8.669 -1.405 4.923 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -7.912 -1.936 6.347 1.00 0.00 H new ATOM 1492 N LYS B 392 -2.767 -0.893 5.396 1.00 0.00 N ATOM 1493 CA LYS B 392 -2.646 -2.250 4.876 1.00 0.00 C ATOM 1494 C LYS B 392 -4.020 -2.876 4.683 1.00 0.00 C ATOM 1495 O LYS B 392 -4.929 -2.654 5.483 1.00 0.00 O ATOM 1496 CB LYS B 392 -1.810 -3.107 5.829 1.00 0.00 C ATOM 1497 CG LYS B 392 -0.475 -2.481 6.194 1.00 0.00 C ATOM 1498 CD LYS B 392 0.689 -3.260 5.604 1.00 0.00 C ATOM 1499 CE LYS B 392 1.680 -2.337 4.913 1.00 0.00 C ATOM 1500 NZ LYS B 392 2.168 -2.911 3.629 1.00 0.00 N ATOM 0 H LYS B 392 -2.024 -0.619 6.039 1.00 0.00 H new ATOM 0 HA LYS B 392 -2.147 -2.204 3.908 1.00 0.00 H new ATOM 0 HB2 LYS B 392 -2.381 -3.284 6.741 1.00 0.00 H new ATOM 0 HB3 LYS B 392 -1.633 -4.079 5.370 1.00 0.00 H new ATOM 0 HG2 LYS B 392 -0.445 -1.452 5.834 1.00 0.00 H new ATOM 0 HG3 LYS B 392 -0.375 -2.443 7.279 1.00 0.00 H new ATOM 0 HD2 LYS B 392 1.196 -3.814 6.394 1.00 0.00 H new ATOM 0 HD3 LYS B 392 0.314 -3.993 4.890 1.00 0.00 H new ATOM 0 HE2 LYS B 392 1.208 -1.373 4.724 1.00 0.00 H new ATOM 0 HE3 LYS B 392 2.527 -2.153 5.574 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 2.841 -2.252 3.188 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 2.641 -3.819 3.812 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 1.363 -3.063 2.989 1.00 0.00 H new ATOM 1514 N PRO B 393 -4.193 -3.667 3.617 1.00 0.00 N ATOM 1515 CA PRO B 393 -5.467 -4.320 3.331 1.00 0.00 C ATOM 1516 C PRO B 393 -5.826 -5.348 4.391 1.00 0.00 C ATOM 1517 O PRO B 393 -4.976 -5.774 5.173 1.00 0.00 O ATOM 1518 CB PRO B 393 -5.251 -5.013 1.984 1.00 0.00 C ATOM 1519 CG PRO B 393 -3.974 -4.457 1.439 1.00 0.00 C ATOM 1520 CD PRO B 393 -3.168 -3.990 2.618 1.00 0.00 C ATOM 0 HA PRO B 393 -6.286 -3.601 3.317 1.00 0.00 H new ATOM 0 HB2 PRO B 393 -5.186 -6.094 2.107 1.00 0.00 H new ATOM 0 HB3 PRO B 393 -6.083 -4.819 1.307 1.00 0.00 H new ATOM 0 HG2 PRO B 393 -3.431 -5.216 0.875 1.00 0.00 H new ATOM 0 HG3 PRO B 393 -4.172 -3.632 0.755 1.00 0.00 H new ATOM 0 HD2 PRO B 393 -2.489 -4.765 2.974 1.00 0.00 H new ATOM 0 HD3 PRO B 393 -2.559 -3.121 2.371 1.00 0.00 H new ATOM 1528 N THR B 394 -7.090 -5.732 4.418 1.00 0.00 N ATOM 1529 CA THR B 394 -7.563 -6.703 5.395 1.00 0.00 C ATOM 1530 C THR B 394 -8.401 -7.795 4.748 1.00 0.00 C ATOM 1531 O THR B 394 -8.950 -7.613 3.660 1.00 0.00 O ATOM 1532 CB THR B 394 -8.400 -6.027 6.497 1.00 0.00 C ATOM 1533 OG1 THR B 394 -9.406 -5.172 5.939 1.00 0.00 O ATOM 1534 CG2 THR B 394 -7.517 -5.197 7.418 1.00 0.00 C ATOM 0 H THR B 394 -7.807 -5.389 3.778 1.00 0.00 H new ATOM 0 HA THR B 394 -6.673 -7.152 5.835 1.00 0.00 H new ATOM 0 HB THR B 394 -8.879 -6.825 7.064 1.00 0.00 H new ATOM 0 HG1 THR B 394 -8.999 -4.578 5.274 1.00 0.00 H new ATOM 0 HG21 THR B 394 -8.132 -4.730 8.188 1.00 0.00 H new ATOM 0 HG22 THR B 394 -6.774 -5.842 7.888 1.00 0.00 H new ATOM 0 HG23 THR B 394 -7.012 -4.424 6.839 1.00 0.00 H new ATOM 1542 N ALA B 395 -8.510 -8.926 5.438 1.00 0.00 N ATOM 1543 CA ALA B 395 -9.298 -10.048 4.951 1.00 0.00 C ATOM 1544 C ALA B 395 -10.774 -9.843 5.271 1.00 0.00 C ATOM 1545 O ALA B 395 -11.602 -10.727 5.043 1.00 0.00 O ATOM 1546 CB ALA B 395 -8.808 -11.351 5.545 1.00 0.00 C ATOM 0 H ALA B 395 -8.060 -9.088 6.339 1.00 0.00 H new ATOM 0 HA ALA B 395 -9.179 -10.100 3.869 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -9.413 -12.174 5.165 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -7.766 -11.508 5.267 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -8.892 -11.310 6.631 1.00 0.00 H new ATOM 1552 N VAL B 396 -11.096 -8.656 5.769 1.00 0.00 N ATOM 1553 CA VAL B 396 -12.468 -8.293 6.093 1.00 0.00 C ATOM 1554 C VAL B 396 -12.829 -6.961 5.448 1.00 0.00 C ATOM 1555 O VAL B 396 -14.001 -6.597 5.343 1.00 0.00 O ATOM 1556 CB VAL B 396 -12.697 -8.204 7.615 1.00 0.00 C ATOM 1557 CG1 VAL B 396 -12.583 -9.578 8.255 1.00 0.00 C ATOM 1558 CG2 VAL B 396 -11.715 -7.229 8.248 1.00 0.00 C ATOM 0 H VAL B 396 -10.415 -7.920 5.959 1.00 0.00 H new ATOM 0 HA VAL B 396 -13.111 -9.081 5.699 1.00 0.00 H new ATOM 0 HB VAL B 396 -13.706 -7.831 7.789 1.00 0.00 H new ATOM 0 HG11 VAL B 396 -12.748 -9.494 9.329 1.00 0.00 H new ATOM 0 HG12 VAL B 396 -13.331 -10.243 7.824 1.00 0.00 H new ATOM 0 HG13 VAL B 396 -11.588 -9.984 8.071 1.00 0.00 H new ATOM 0 HG21 VAL B 396 -11.892 -7.180 9.322 1.00 0.00 H new ATOM 0 HG22 VAL B 396 -10.696 -7.568 8.064 1.00 0.00 H new ATOM 0 HG23 VAL B 396 -11.853 -6.240 7.812 1.00 0.00 H new ATOM 1568 N ASP B 397 -11.800 -6.250 5.022 1.00 0.00 N ATOM 1569 CA ASP B 397 -11.943 -4.949 4.378 1.00 0.00 C ATOM 1570 C ASP B 397 -10.690 -4.644 3.558 1.00 0.00 C ATOM 1571 O ASP B 397 -9.934 -3.725 3.869 1.00 0.00 O ATOM 1572 CB ASP B 397 -12.161 -3.856 5.426 1.00 0.00 C ATOM 1573 CG ASP B 397 -12.958 -4.346 6.620 1.00 0.00 C ATOM 1574 OD1 ASP B 397 -14.178 -4.561 6.470 1.00 0.00 O ATOM 1575 OD2 ASP B 397 -12.361 -4.514 7.704 1.00 0.00 O ATOM 0 H ASP B 397 -10.832 -6.559 5.112 1.00 0.00 H new ATOM 0 HA ASP B 397 -12.810 -4.974 3.718 1.00 0.00 H new ATOM 0 HB2 ASP B 397 -11.194 -3.485 5.766 1.00 0.00 H new ATOM 0 HB3 ASP B 397 -12.681 -3.015 4.967 1.00 0.00 H new ATOM 1580 N PRO B 398 -10.455 -5.442 2.507 1.00 0.00 N ATOM 1581 CA PRO B 398 -9.287 -5.306 1.629 1.00 0.00 C ATOM 1582 C PRO B 398 -8.925 -3.862 1.293 1.00 0.00 C ATOM 1583 O PRO B 398 -7.746 -3.512 1.228 1.00 0.00 O ATOM 1584 CB PRO B 398 -9.736 -6.043 0.371 1.00 0.00 C ATOM 1585 CG PRO B 398 -10.639 -7.118 0.870 1.00 0.00 C ATOM 1586 CD PRO B 398 -11.316 -6.569 2.101 1.00 0.00 C ATOM 0 HA PRO B 398 -8.386 -5.697 2.101 1.00 0.00 H new ATOM 0 HB2 PRO B 398 -10.256 -5.375 -0.316 1.00 0.00 H new ATOM 0 HB3 PRO B 398 -8.886 -6.458 -0.170 1.00 0.00 H new ATOM 0 HG2 PRO B 398 -11.373 -7.391 0.112 1.00 0.00 H new ATOM 0 HG3 PRO B 398 -10.075 -8.020 1.107 1.00 0.00 H new ATOM 0 HD2 PRO B 398 -12.332 -6.238 1.884 1.00 0.00 H new ATOM 0 HD3 PRO B 398 -11.387 -7.321 2.887 1.00 0.00 H new ATOM 1594 N ASN B 399 -9.934 -3.035 1.051 1.00 0.00 N ATOM 1595 CA ASN B 399 -9.719 -1.641 0.692 1.00 0.00 C ATOM 1596 C ASN B 399 -8.490 -1.068 1.388 1.00 0.00 C ATOM 1597 O ASN B 399 -8.232 -1.353 2.557 1.00 0.00 O ATOM 1598 CB ASN B 399 -10.956 -0.810 1.031 1.00 0.00 C ATOM 1599 CG ASN B 399 -11.297 -0.872 2.501 1.00 0.00 C ATOM 1600 OD1 ASN B 399 -12.078 -1.717 2.935 1.00 0.00 O ATOM 1601 ND2 ASN B 399 -10.709 0.028 3.275 1.00 0.00 N ATOM 0 H ASN B 399 -10.915 -3.309 1.098 1.00 0.00 H new ATOM 0 HA ASN B 399 -9.544 -1.597 -0.383 1.00 0.00 H new ATOM 0 HB2 ASN B 399 -10.786 0.227 0.742 1.00 0.00 H new ATOM 0 HB3 ASN B 399 -11.804 -1.168 0.447 1.00 0.00 H new ATOM 0 HD21 ASN B 399 -10.897 0.040 4.277 1.00 0.00 H new ATOM 0 HD22 ASN B 399 -10.068 0.709 2.869 1.00 0.00 H new ATOM 1608 N SER B 400 -7.740 -0.252 0.656 1.00 0.00 N ATOM 1609 CA SER B 400 -6.533 0.376 1.187 1.00 0.00 C ATOM 1610 C SER B 400 -6.386 1.795 0.643 1.00 0.00 C ATOM 1611 O SER B 400 -7.030 2.158 -0.342 1.00 0.00 O ATOM 1612 CB SER B 400 -5.300 -0.455 0.829 1.00 0.00 C ATOM 1613 OG SER B 400 -5.059 -1.454 1.805 1.00 0.00 O ATOM 0 H SER B 400 -7.947 -0.008 -0.312 1.00 0.00 H new ATOM 0 HA SER B 400 -6.620 0.426 2.272 1.00 0.00 H new ATOM 0 HB2 SER B 400 -5.442 -0.921 -0.146 1.00 0.00 H new ATOM 0 HB3 SER B 400 -4.430 0.196 0.747 1.00 0.00 H new ATOM 0 HG SER B 400 -4.920 -1.031 2.678 1.00 0.00 H new ATOM 1619 N ILE B 401 -5.549 2.601 1.291 1.00 0.00 N ATOM 1620 CA ILE B 401 -5.344 3.976 0.870 1.00 0.00 C ATOM 1621 C ILE B 401 -3.874 4.263 0.592 1.00 0.00 C ATOM 1622 O ILE B 401 -2.987 3.800 1.309 1.00 0.00 O ATOM 1623 CB ILE B 401 -5.860 4.948 1.943 1.00 0.00 C ATOM 1624 CG1 ILE B 401 -5.559 6.400 1.563 1.00 0.00 C ATOM 1625 CG2 ILE B 401 -5.250 4.615 3.291 1.00 0.00 C ATOM 1626 CD1 ILE B 401 -6.786 7.183 1.148 1.00 0.00 C ATOM 0 H ILE B 401 -5.005 2.323 2.107 1.00 0.00 H new ATOM 0 HA ILE B 401 -5.904 4.120 -0.054 1.00 0.00 H new ATOM 0 HB ILE B 401 -6.942 4.836 2.010 1.00 0.00 H new ATOM 0 HG12 ILE B 401 -5.089 6.899 2.411 1.00 0.00 H new ATOM 0 HG13 ILE B 401 -4.837 6.411 0.746 1.00 0.00 H new ATOM 0 HG21 ILE B 401 -5.624 5.311 4.042 1.00 0.00 H new ATOM 0 HG22 ILE B 401 -5.522 3.598 3.572 1.00 0.00 H new ATOM 0 HG23 ILE B 401 -4.165 4.697 3.229 1.00 0.00 H new ATOM 0 HD11 ILE B 401 -6.498 8.203 0.893 1.00 0.00 H new ATOM 0 HD12 ILE B 401 -7.245 6.708 0.281 1.00 0.00 H new ATOM 0 HD13 ILE B 401 -7.500 7.203 1.971 1.00 0.00 H new ATOM 1638 N VAL B 402 -3.631 5.041 -0.454 1.00 0.00 N ATOM 1639 CA VAL B 402 -2.280 5.414 -0.840 1.00 0.00 C ATOM 1640 C VAL B 402 -1.986 6.842 -0.403 1.00 0.00 C ATOM 1641 O VAL B 402 -2.856 7.521 0.146 1.00 0.00 O ATOM 1642 CB VAL B 402 -2.063 5.286 -2.363 1.00 0.00 C ATOM 1643 CG1 VAL B 402 -0.691 4.701 -2.660 1.00 0.00 C ATOM 1644 CG2 VAL B 402 -3.159 4.431 -2.983 1.00 0.00 C ATOM 0 H VAL B 402 -4.360 5.428 -1.054 1.00 0.00 H new ATOM 0 HA VAL B 402 -1.596 4.727 -0.342 1.00 0.00 H new ATOM 0 HB VAL B 402 -2.111 6.281 -2.805 1.00 0.00 H new ATOM 0 HG11 VAL B 402 -0.556 4.618 -3.738 1.00 0.00 H new ATOM 0 HG12 VAL B 402 0.079 5.352 -2.247 1.00 0.00 H new ATOM 0 HG13 VAL B 402 -0.611 3.713 -2.208 1.00 0.00 H new ATOM 0 HG21 VAL B 402 -2.993 4.350 -4.057 1.00 0.00 H new ATOM 0 HG22 VAL B 402 -3.141 3.437 -2.537 1.00 0.00 H new ATOM 0 HG23 VAL B 402 -4.129 4.894 -2.800 1.00 0.00 H new ATOM 1654 N GLU B 403 -0.776 7.306 -0.682 1.00 0.00 N ATOM 1655 CA GLU B 403 -0.380 8.665 -0.337 1.00 0.00 C ATOM 1656 C GLU B 403 0.646 9.189 -1.328 1.00 0.00 C ATOM 1657 O GLU B 403 1.801 8.766 -1.328 1.00 0.00 O ATOM 1658 CB GLU B 403 0.182 8.715 1.086 1.00 0.00 C ATOM 1659 CG GLU B 403 -0.764 9.342 2.097 1.00 0.00 C ATOM 1660 CD GLU B 403 -0.345 10.745 2.495 1.00 0.00 C ATOM 1661 OE1 GLU B 403 0.868 11.038 2.450 1.00 0.00 O ATOM 1662 OE2 GLU B 403 -1.231 11.549 2.852 1.00 0.00 O ATOM 0 H GLU B 403 -0.050 6.761 -1.147 1.00 0.00 H new ATOM 0 HA GLU B 403 -1.263 9.302 -0.384 1.00 0.00 H new ATOM 0 HB2 GLU B 403 0.423 7.702 1.407 1.00 0.00 H new ATOM 0 HB3 GLU B 403 1.116 9.277 1.078 1.00 0.00 H new ATOM 0 HG2 GLU B 403 -1.770 9.372 1.678 1.00 0.00 H new ATOM 0 HG3 GLU B 403 -0.808 8.714 2.987 1.00 0.00 H new ATOM 1669 N CYS B 404 0.221 10.121 -2.167 1.00 0.00 N ATOM 1670 CA CYS B 404 1.110 10.710 -3.150 1.00 0.00 C ATOM 1671 C CYS B 404 1.918 11.811 -2.492 1.00 0.00 C ATOM 1672 O CYS B 404 1.362 12.806 -2.038 1.00 0.00 O ATOM 1673 CB CYS B 404 0.313 11.266 -4.330 1.00 0.00 C ATOM 1674 SG CYS B 404 1.202 11.217 -5.903 1.00 0.00 S ATOM 0 H CYS B 404 -0.732 10.484 -2.185 1.00 0.00 H new ATOM 0 HA CYS B 404 1.784 9.943 -3.531 1.00 0.00 H new ATOM 0 HB2 CYS B 404 -0.613 10.699 -4.429 1.00 0.00 H new ATOM 0 HB3 CYS B 404 0.034 12.297 -4.114 1.00 0.00 H new ATOM 0 HG CYS B 404 1.344 9.982 -6.283 1.00 0.00 H new ATOM 1680 N ARG B 405 3.228 11.639 -2.442 1.00 0.00 N ATOM 1681 CA ARG B 405 4.075 12.641 -1.828 1.00 0.00 C ATOM 1682 C ARG B 405 5.471 12.634 -2.432 1.00 0.00 C ATOM 1683 O ARG B 405 5.806 11.767 -3.233 1.00 0.00 O ATOM 1684 CB ARG B 405 4.133 12.422 -0.312 1.00 0.00 C ATOM 1685 CG ARG B 405 5.344 11.630 0.157 1.00 0.00 C ATOM 1686 CD ARG B 405 5.301 11.389 1.657 1.00 0.00 C ATOM 1687 NE ARG B 405 5.829 12.524 2.410 1.00 0.00 N ATOM 1688 CZ ARG B 405 5.428 12.850 3.636 1.00 0.00 C ATOM 1689 NH1 ARG B 405 4.504 12.125 4.252 1.00 0.00 N ATOM 1690 NH2 ARG B 405 5.953 13.902 4.250 1.00 0.00 N ATOM 0 H ARG B 405 3.720 10.827 -2.814 1.00 0.00 H new ATOM 0 HA ARG B 405 3.642 13.622 -2.024 1.00 0.00 H new ATOM 0 HB2 ARG B 405 4.133 13.392 0.184 1.00 0.00 H new ATOM 0 HB3 ARG B 405 3.228 11.902 0.004 1.00 0.00 H new ATOM 0 HG2 ARG B 405 5.381 10.674 -0.366 1.00 0.00 H new ATOM 0 HG3 ARG B 405 6.256 12.169 -0.101 1.00 0.00 H new ATOM 0 HD2 ARG B 405 4.273 11.197 1.964 1.00 0.00 H new ATOM 0 HD3 ARG B 405 5.877 10.495 1.897 1.00 0.00 H new ATOM 0 HE ARG B 405 6.547 13.100 1.970 1.00 0.00 H new ATOM 0 HH11 ARG B 405 4.098 11.314 3.786 1.00 0.00 H new ATOM 0 HH12 ARG B 405 4.200 12.379 5.192 1.00 0.00 H new ATOM 0 HH21 ARG B 405 6.665 14.463 3.782 1.00 0.00 H new ATOM 0 HH22 ARG B 405 5.644 14.150 5.190 1.00 0.00 H new ATOM 1704 N VAL B 406 6.275 13.615 -2.052 1.00 0.00 N ATOM 1705 CA VAL B 406 7.632 13.726 -2.565 1.00 0.00 C ATOM 1706 C VAL B 406 8.596 14.143 -1.464 1.00 0.00 C ATOM 1707 O VAL B 406 8.275 15.000 -0.640 1.00 0.00 O ATOM 1708 CB VAL B 406 7.702 14.742 -3.715 1.00 0.00 C ATOM 1709 CG1 VAL B 406 6.573 14.505 -4.702 1.00 0.00 C ATOM 1710 CG2 VAL B 406 7.644 16.155 -3.171 1.00 0.00 C ATOM 0 H VAL B 406 6.012 14.345 -1.391 1.00 0.00 H new ATOM 0 HA VAL B 406 7.922 12.744 -2.939 1.00 0.00 H new ATOM 0 HB VAL B 406 8.649 14.610 -4.239 1.00 0.00 H new ATOM 0 HG11 VAL B 406 6.637 15.233 -5.510 1.00 0.00 H new ATOM 0 HG12 VAL B 406 6.654 13.499 -5.113 1.00 0.00 H new ATOM 0 HG13 VAL B 406 5.616 14.612 -4.192 1.00 0.00 H new ATOM 0 HG21 VAL B 406 7.695 16.865 -3.996 1.00 0.00 H new ATOM 0 HG22 VAL B 406 6.710 16.297 -2.627 1.00 0.00 H new ATOM 0 HG23 VAL B 406 8.485 16.321 -2.498 1.00 0.00 H new ATOM 1720 N GLY B 407 9.771 13.520 -1.448 1.00 0.00 N ATOM 1721 CA GLY B 407 10.769 13.819 -0.437 1.00 0.00 C ATOM 1722 C GLY B 407 10.797 15.280 -0.035 1.00 0.00 C ATOM 1723 O GLY B 407 11.007 15.603 1.134 1.00 0.00 O ATOM 0 H GLY B 407 10.051 12.808 -2.123 1.00 0.00 H new ATOM 0 HA2 GLY B 407 10.575 13.210 0.446 1.00 0.00 H new ATOM 0 HA3 GLY B 407 11.752 13.534 -0.811 1.00 0.00 H new ATOM 1727 N ASP B 408 10.582 16.167 -1.000 1.00 0.00 N ATOM 1728 CA ASP B 408 10.584 17.600 -0.731 1.00 0.00 C ATOM 1729 C ASP B 408 9.583 17.935 0.367 1.00 0.00 C ATOM 1730 O ASP B 408 9.634 19.008 0.966 1.00 0.00 O ATOM 1731 CB ASP B 408 10.242 18.377 -2.004 1.00 0.00 C ATOM 1732 CG ASP B 408 10.726 19.813 -1.955 1.00 0.00 C ATOM 1733 OD1 ASP B 408 11.922 20.047 -2.229 1.00 0.00 O ATOM 1734 OD2 ASP B 408 9.909 20.706 -1.643 1.00 0.00 O ATOM 0 H ASP B 408 10.404 15.920 -1.974 1.00 0.00 H new ATOM 0 HA ASP B 408 11.581 17.888 -0.397 1.00 0.00 H new ATOM 0 HB2 ASP B 408 10.688 17.876 -2.863 1.00 0.00 H new ATOM 0 HB3 ASP B 408 9.162 18.366 -2.154 1.00 0.00 H new ATOM 1739 N GLY B 409 8.667 17.006 0.616 1.00 0.00 N ATOM 1740 CA GLY B 409 7.655 17.207 1.628 1.00 0.00 C ATOM 1741 C GLY B 409 6.369 17.734 1.033 1.00 0.00 C ATOM 1742 O GLY B 409 5.776 18.682 1.547 1.00 0.00 O ATOM 0 H GLY B 409 8.610 16.112 0.129 1.00 0.00 H new ATOM 0 HA2 GLY B 409 7.460 16.265 2.140 1.00 0.00 H new ATOM 0 HA3 GLY B 409 8.023 17.907 2.378 1.00 0.00 H new ATOM 1746 N THR B 410 5.947 17.123 -0.069 1.00 0.00 N ATOM 1747 CA THR B 410 4.731 17.541 -0.758 1.00 0.00 C ATOM 1748 C THR B 410 3.826 16.355 -1.076 1.00 0.00 C ATOM 1749 O THR B 410 4.167 15.519 -1.908 1.00 0.00 O ATOM 1750 CB THR B 410 5.075 18.275 -2.068 1.00 0.00 C ATOM 1751 OG1 THR B 410 5.721 19.526 -1.809 1.00 0.00 O ATOM 1752 CG2 THR B 410 3.828 18.545 -2.896 1.00 0.00 C ATOM 0 H THR B 410 6.429 16.337 -0.504 1.00 0.00 H new ATOM 0 HA THR B 410 4.200 18.215 -0.086 1.00 0.00 H new ATOM 0 HB THR B 410 5.748 17.621 -2.622 1.00 0.00 H new ATOM 0 HG1 THR B 410 5.929 19.969 -2.658 1.00 0.00 H new ATOM 0 HG21 THR B 410 4.106 19.064 -3.813 1.00 0.00 H new ATOM 0 HG22 THR B 410 3.345 17.600 -3.145 1.00 0.00 H new ATOM 0 HG23 THR B 410 3.138 19.165 -2.323 1.00 0.00 H new ATOM 1760 N VAL B 411 2.664 16.306 -0.422 1.00 0.00 N ATOM 1761 CA VAL B 411 1.686 15.238 -0.641 1.00 0.00 C ATOM 1762 C VAL B 411 0.805 15.562 -1.841 1.00 0.00 C ATOM 1763 O VAL B 411 -0.270 16.145 -1.694 1.00 0.00 O ATOM 1764 CB VAL B 411 0.789 15.042 0.596 1.00 0.00 C ATOM 1765 CG1 VAL B 411 -0.124 13.836 0.426 1.00 0.00 C ATOM 1766 CG2 VAL B 411 1.638 14.898 1.846 1.00 0.00 C ATOM 0 H VAL B 411 2.376 16.999 0.269 1.00 0.00 H new ATOM 0 HA VAL B 411 2.242 14.319 -0.827 1.00 0.00 H new ATOM 0 HB VAL B 411 0.159 15.925 0.702 1.00 0.00 H new ATOM 0 HG11 VAL B 411 -0.745 13.722 1.314 1.00 0.00 H new ATOM 0 HG12 VAL B 411 -0.761 13.982 -0.446 1.00 0.00 H new ATOM 0 HG13 VAL B 411 0.480 12.939 0.288 1.00 0.00 H new ATOM 0 HG21 VAL B 411 0.990 14.760 2.712 1.00 0.00 H new ATOM 0 HG22 VAL B 411 2.294 14.034 1.743 1.00 0.00 H new ATOM 0 HG23 VAL B 411 2.240 15.796 1.982 1.00 0.00 H new ATOM 1776 N LEU B 412 1.267 15.190 -3.031 1.00 0.00 N ATOM 1777 CA LEU B 412 0.519 15.454 -4.254 1.00 0.00 C ATOM 1778 C LEU B 412 -0.950 15.077 -4.088 1.00 0.00 C ATOM 1779 O LEU B 412 -1.811 15.590 -4.802 1.00 0.00 O ATOM 1780 CB LEU B 412 1.122 14.690 -5.437 1.00 0.00 C ATOM 1781 CG LEU B 412 2.609 14.955 -5.731 1.00 0.00 C ATOM 1782 CD1 LEU B 412 3.177 16.045 -4.829 1.00 0.00 C ATOM 1783 CD2 LEU B 412 3.413 13.674 -5.580 1.00 0.00 C ATOM 0 H LEU B 412 2.154 14.706 -3.174 1.00 0.00 H new ATOM 0 HA LEU B 412 0.584 16.523 -4.456 1.00 0.00 H new ATOM 0 HB2 LEU B 412 0.994 13.623 -5.257 1.00 0.00 H new ATOM 0 HB3 LEU B 412 0.548 14.934 -6.331 1.00 0.00 H new ATOM 0 HG LEU B 412 2.685 15.305 -6.760 1.00 0.00 H new ATOM 0 HD11 LEU B 412 4.229 16.203 -5.067 1.00 0.00 H new ATOM 0 HD12 LEU B 412 2.626 16.972 -4.987 1.00 0.00 H new ATOM 0 HD13 LEU B 412 3.083 15.740 -3.787 1.00 0.00 H new ATOM 0 HD21 LEU B 412 4.463 13.876 -5.791 1.00 0.00 H new ATOM 0 HD22 LEU B 412 3.313 13.300 -4.561 1.00 0.00 H new ATOM 0 HD23 LEU B 412 3.040 12.926 -6.279 1.00 0.00 H new ATOM 1795 N GLY B 413 -1.234 14.183 -3.146 1.00 0.00 N ATOM 1796 CA GLY B 413 -2.607 13.775 -2.923 1.00 0.00 C ATOM 1797 C GLY B 413 -2.732 12.504 -2.104 1.00 0.00 C ATOM 1798 O GLY B 413 -1.847 12.168 -1.315 1.00 0.00 O ATOM 0 H GLY B 413 -0.545 13.738 -2.539 1.00 0.00 H new ATOM 0 HA2 GLY B 413 -3.139 14.579 -2.415 1.00 0.00 H new ATOM 0 HA3 GLY B 413 -3.095 13.627 -3.886 1.00 0.00 H new ATOM 1802 N THR B 414 -3.843 11.801 -2.296 1.00 0.00 N ATOM 1803 CA THR B 414 -4.111 10.559 -1.576 1.00 0.00 C ATOM 1804 C THR B 414 -5.084 9.686 -2.362 1.00 0.00 C ATOM 1805 O THR B 414 -5.866 10.193 -3.166 1.00 0.00 O ATOM 1806 CB THR B 414 -4.700 10.839 -0.179 1.00 0.00 C ATOM 1807 OG1 THR B 414 -4.048 11.949 0.449 1.00 0.00 O ATOM 1808 CG2 THR B 414 -4.560 9.623 0.724 1.00 0.00 C ATOM 0 H THR B 414 -4.578 12.072 -2.949 1.00 0.00 H new ATOM 0 HA THR B 414 -3.161 10.037 -1.460 1.00 0.00 H new ATOM 0 HB THR B 414 -5.755 11.073 -0.322 1.00 0.00 H new ATOM 0 HG1 THR B 414 -4.443 12.104 1.332 1.00 0.00 H new ATOM 0 HG21 THR B 414 -4.983 9.846 1.703 1.00 0.00 H new ATOM 0 HG22 THR B 414 -5.091 8.779 0.283 1.00 0.00 H new ATOM 0 HG23 THR B 414 -3.505 9.371 0.833 1.00 0.00 H new ATOM 1816 N GLY B 415 -5.031 8.375 -2.138 1.00 0.00 N ATOM 1817 CA GLY B 415 -5.924 7.483 -2.863 1.00 0.00 C ATOM 1818 C GLY B 415 -6.492 6.359 -2.018 1.00 0.00 C ATOM 1819 O GLY B 415 -5.956 6.028 -0.969 1.00 0.00 O ATOM 0 H GLY B 415 -4.398 7.920 -1.480 1.00 0.00 H new ATOM 0 HA2 GLY B 415 -6.748 8.066 -3.275 1.00 0.00 H new ATOM 0 HA3 GLY B 415 -5.385 7.053 -3.707 1.00 0.00 H new ATOM 1823 N VAL B 416 -7.584 5.768 -2.488 1.00 0.00 N ATOM 1824 CA VAL B 416 -8.230 4.669 -1.784 1.00 0.00 C ATOM 1825 C VAL B 416 -8.843 3.689 -2.781 1.00 0.00 C ATOM 1826 O VAL B 416 -9.316 4.093 -3.843 1.00 0.00 O ATOM 1827 CB VAL B 416 -9.322 5.180 -0.820 1.00 0.00 C ATOM 1828 CG1 VAL B 416 -10.649 5.375 -1.544 1.00 0.00 C ATOM 1829 CG2 VAL B 416 -9.482 4.230 0.360 1.00 0.00 C ATOM 0 H VAL B 416 -8.042 6.034 -3.359 1.00 0.00 H new ATOM 0 HA VAL B 416 -7.466 4.160 -1.196 1.00 0.00 H new ATOM 0 HB VAL B 416 -9.007 6.151 -0.438 1.00 0.00 H new ATOM 0 HG11 VAL B 416 -11.398 5.735 -0.839 1.00 0.00 H new ATOM 0 HG12 VAL B 416 -10.523 6.104 -2.344 1.00 0.00 H new ATOM 0 HG13 VAL B 416 -10.976 4.425 -1.967 1.00 0.00 H new ATOM 0 HG21 VAL B 416 -10.256 4.607 1.028 1.00 0.00 H new ATOM 0 HG22 VAL B 416 -9.766 3.243 -0.004 1.00 0.00 H new ATOM 0 HG23 VAL B 416 -8.538 4.160 0.901 1.00 0.00 H new ATOM 1839 N GLY B 417 -8.827 2.406 -2.446 1.00 0.00 N ATOM 1840 CA GLY B 417 -9.385 1.413 -3.345 1.00 0.00 C ATOM 1841 C GLY B 417 -9.693 0.094 -2.663 1.00 0.00 C ATOM 1842 O GLY B 417 -8.864 -0.442 -1.931 1.00 0.00 O ATOM 0 H GLY B 417 -8.442 2.037 -1.577 1.00 0.00 H new ATOM 0 HA2 GLY B 417 -10.299 1.807 -3.789 1.00 0.00 H new ATOM 0 HA3 GLY B 417 -8.685 1.237 -4.161 1.00 0.00 H new ATOM 1846 N ARG B 418 -10.891 -0.427 -2.919 1.00 0.00 N ATOM 1847 CA ARG B 418 -11.325 -1.697 -2.340 1.00 0.00 C ATOM 1848 C ARG B 418 -10.319 -2.803 -2.639 1.00 0.00 C ATOM 1849 O ARG B 418 -9.834 -3.480 -1.732 1.00 0.00 O ATOM 1850 CB ARG B 418 -12.707 -2.070 -2.888 1.00 0.00 C ATOM 1851 CG ARG B 418 -13.046 -3.553 -2.788 1.00 0.00 C ATOM 1852 CD ARG B 418 -14.102 -3.943 -3.807 1.00 0.00 C ATOM 1853 NE ARG B 418 -15.445 -3.568 -3.373 1.00 0.00 N ATOM 1854 CZ ARG B 418 -16.550 -4.190 -3.772 1.00 0.00 C ATOM 1855 NH1 ARG B 418 -16.474 -5.208 -4.619 1.00 0.00 N ATOM 1856 NH2 ARG B 418 -17.732 -3.794 -3.321 1.00 0.00 N ATOM 0 H ARG B 418 -11.582 0.013 -3.527 1.00 0.00 H new ATOM 0 HA ARG B 418 -11.388 -1.583 -1.258 1.00 0.00 H new ATOM 0 HB2 ARG B 418 -13.464 -1.500 -2.349 1.00 0.00 H new ATOM 0 HB3 ARG B 418 -12.764 -1.767 -3.933 1.00 0.00 H new ATOM 0 HG2 ARG B 418 -12.146 -4.146 -2.948 1.00 0.00 H new ATOM 0 HG3 ARG B 418 -13.404 -3.780 -1.784 1.00 0.00 H new ATOM 0 HD2 ARG B 418 -13.881 -3.462 -4.760 1.00 0.00 H new ATOM 0 HD3 ARG B 418 -14.063 -5.019 -3.976 1.00 0.00 H new ATOM 0 HE ARG B 418 -15.541 -2.784 -2.727 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -15.566 -5.516 -4.966 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -17.324 -5.683 -4.923 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -17.793 -3.013 -2.668 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -18.580 -4.271 -3.627 1.00 0.00 H new ATOM 1870 N ASN B 419 -10.004 -2.969 -3.916 1.00 0.00 N ATOM 1871 CA ASN B 419 -9.046 -3.979 -4.342 1.00 0.00 C ATOM 1872 C ASN B 419 -7.625 -3.484 -4.111 1.00 0.00 C ATOM 1873 O ASN B 419 -6.678 -4.267 -4.136 1.00 0.00 O ATOM 1874 CB ASN B 419 -9.240 -4.327 -5.821 1.00 0.00 C ATOM 1875 CG ASN B 419 -10.582 -3.874 -6.360 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -11.628 -4.388 -5.966 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -10.556 -2.906 -7.271 1.00 0.00 N ATOM 0 H ASN B 419 -10.399 -2.416 -4.676 1.00 0.00 H new ATOM 0 HA ASN B 419 -9.215 -4.878 -3.750 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -8.444 -3.865 -6.406 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -9.147 -5.405 -5.951 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -11.427 -2.560 -7.673 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -9.665 -2.509 -7.568 1.00 0.00 H new ATOM 1884 N ILE B 420 -7.493 -2.173 -3.900 1.00 0.00 N ATOM 1885 CA ILE B 420 -6.208 -1.521 -3.671 1.00 0.00 C ATOM 1886 C ILE B 420 -5.611 -0.991 -4.968 1.00 0.00 C ATOM 1887 O ILE B 420 -5.101 0.130 -5.002 1.00 0.00 O ATOM 1888 CB ILE B 420 -5.177 -2.408 -2.946 1.00 0.00 C ATOM 1889 CG1 ILE B 420 -4.333 -3.208 -3.943 1.00 0.00 C ATOM 1890 CG2 ILE B 420 -5.860 -3.322 -1.936 1.00 0.00 C ATOM 1891 CD1 ILE B 420 -3.101 -2.463 -4.415 1.00 0.00 C ATOM 0 H ILE B 420 -8.285 -1.530 -3.884 1.00 0.00 H new ATOM 0 HA ILE B 420 -6.431 -0.687 -3.005 1.00 0.00 H new ATOM 0 HB ILE B 420 -4.499 -1.754 -2.397 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -4.027 -4.146 -3.480 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -4.948 -3.464 -4.806 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -5.111 -3.938 -1.438 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -6.385 -2.718 -1.195 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -6.574 -3.965 -2.451 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -2.547 -3.085 -5.119 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -3.401 -1.538 -4.907 1.00 0.00 H new ATOM 0 HD13 ILE B 420 -2.467 -2.230 -3.560 1.00 0.00 H new ATOM 1903 N LYS B 421 -5.683 -1.773 -6.042 1.00 0.00 N ATOM 1904 CA LYS B 421 -5.150 -1.312 -7.312 1.00 0.00 C ATOM 1905 C LYS B 421 -5.755 0.042 -7.610 1.00 0.00 C ATOM 1906 O LYS B 421 -5.051 0.989 -7.959 1.00 0.00 O ATOM 1907 CB LYS B 421 -5.444 -2.310 -8.437 1.00 0.00 C ATOM 1908 CG LYS B 421 -5.753 -1.667 -9.780 1.00 0.00 C ATOM 1909 CD LYS B 421 -7.155 -1.085 -9.808 1.00 0.00 C ATOM 1910 CE LYS B 421 -7.799 -1.250 -11.175 1.00 0.00 C ATOM 1911 NZ LYS B 421 -9.191 -0.720 -11.201 1.00 0.00 N ATOM 0 H LYS B 421 -6.095 -2.706 -6.057 1.00 0.00 H new ATOM 0 HA LYS B 421 -4.065 -1.229 -7.248 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -4.586 -2.972 -8.553 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -6.289 -2.933 -8.143 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -5.027 -0.880 -9.984 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -5.650 -2.409 -10.572 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -7.769 -1.576 -9.053 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -7.116 -0.027 -9.548 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -7.199 -0.732 -11.924 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -7.807 -2.305 -11.447 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -9.595 -0.851 -12.150 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -9.770 -1.231 -10.505 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -9.181 0.293 -10.966 1.00 0.00 H new ATOM 1925 N ILE B 422 -7.064 0.138 -7.422 1.00 0.00 N ATOM 1926 CA ILE B 422 -7.744 1.402 -7.627 1.00 0.00 C ATOM 1927 C ILE B 422 -7.026 2.442 -6.806 1.00 0.00 C ATOM 1928 O ILE B 422 -6.869 3.578 -7.228 1.00 0.00 O ATOM 1929 CB ILE B 422 -9.227 1.389 -7.200 1.00 0.00 C ATOM 1930 CG1 ILE B 422 -9.739 -0.035 -7.031 1.00 0.00 C ATOM 1931 CG2 ILE B 422 -10.075 2.147 -8.207 1.00 0.00 C ATOM 1932 CD1 ILE B 422 -9.369 -0.633 -5.695 1.00 0.00 C ATOM 0 H ILE B 422 -7.666 -0.633 -7.132 1.00 0.00 H new ATOM 0 HA ILE B 422 -7.727 1.613 -8.696 1.00 0.00 H new ATOM 0 HB ILE B 422 -9.304 1.888 -6.234 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -10.824 -0.042 -7.140 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -9.335 -0.659 -7.828 1.00 0.00 H new ATOM 0 HG21 ILE B 422 -11.118 2.128 -7.891 1.00 0.00 H new ATOM 0 HG22 ILE B 422 -9.732 3.180 -8.267 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -9.984 1.677 -9.186 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -9.760 -1.648 -5.630 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -8.284 -0.655 -5.594 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -9.796 -0.028 -4.895 1.00 0.00 H new ATOM 1944 N ALA B 423 -6.564 2.022 -5.630 1.00 0.00 N ATOM 1945 CA ALA B 423 -5.829 2.901 -4.746 1.00 0.00 C ATOM 1946 C ALA B 423 -4.498 3.265 -5.382 1.00 0.00 C ATOM 1947 O ALA B 423 -4.092 4.427 -5.375 1.00 0.00 O ATOM 1948 CB ALA B 423 -5.623 2.247 -3.392 1.00 0.00 C ATOM 0 H ALA B 423 -6.690 1.075 -5.274 1.00 0.00 H new ATOM 0 HA ALA B 423 -6.404 3.813 -4.589 1.00 0.00 H new ATOM 0 HB1 ALA B 423 -5.069 2.924 -2.742 1.00 0.00 H new ATOM 0 HB2 ALA B 423 -6.592 2.025 -2.944 1.00 0.00 H new ATOM 0 HB3 ALA B 423 -5.061 1.322 -3.517 1.00 0.00 H new ATOM 1954 N GLY B 424 -3.833 2.268 -5.962 1.00 0.00 N ATOM 1955 CA GLY B 424 -2.570 2.521 -6.624 1.00 0.00 C ATOM 1956 C GLY B 424 -2.751 3.441 -7.812 1.00 0.00 C ATOM 1957 O GLY B 424 -2.256 4.572 -7.819 1.00 0.00 O ATOM 0 H GLY B 424 -4.146 1.297 -5.984 1.00 0.00 H new ATOM 0 HA2 GLY B 424 -1.869 2.967 -5.918 1.00 0.00 H new ATOM 0 HA3 GLY B 424 -2.134 1.578 -6.954 1.00 0.00 H new ATOM 1961 N ILE B 425 -3.481 2.963 -8.817 1.00 0.00 N ATOM 1962 CA ILE B 425 -3.743 3.762 -10.007 1.00 0.00 C ATOM 1963 C ILE B 425 -4.325 5.120 -9.621 1.00 0.00 C ATOM 1964 O ILE B 425 -3.946 6.152 -10.179 1.00 0.00 O ATOM 1965 CB ILE B 425 -4.711 3.044 -10.967 1.00 0.00 C ATOM 1966 CG1 ILE B 425 -4.142 1.681 -11.371 1.00 0.00 C ATOM 1967 CG2 ILE B 425 -4.970 3.900 -12.197 1.00 0.00 C ATOM 1968 CD1 ILE B 425 -5.178 0.736 -11.940 1.00 0.00 C ATOM 0 H ILE B 425 -3.898 2.032 -8.830 1.00 0.00 H new ATOM 0 HA ILE B 425 -2.792 3.905 -10.519 1.00 0.00 H new ATOM 0 HB ILE B 425 -5.659 2.885 -10.453 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -3.354 1.830 -12.109 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -3.679 1.217 -10.500 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -5.656 3.379 -12.865 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -5.411 4.849 -11.893 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -4.029 4.086 -12.715 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -4.703 -0.209 -12.204 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -5.954 0.557 -11.196 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -5.624 1.179 -12.831 1.00 0.00 H new ATOM 1980 N ARG B 426 -5.236 5.114 -8.650 1.00 0.00 N ATOM 1981 CA ARG B 426 -5.854 6.349 -8.178 1.00 0.00 C ATOM 1982 C ARG B 426 -4.779 7.307 -7.692 1.00 0.00 C ATOM 1983 O ARG B 426 -4.677 8.437 -8.172 1.00 0.00 O ATOM 1984 CB ARG B 426 -6.844 6.062 -7.048 1.00 0.00 C ATOM 1985 CG ARG B 426 -7.310 7.307 -6.313 1.00 0.00 C ATOM 1986 CD ARG B 426 -8.090 8.233 -7.232 1.00 0.00 C ATOM 1987 NE ARG B 426 -9.038 9.062 -6.493 1.00 0.00 N ATOM 1988 CZ ARG B 426 -10.113 8.579 -5.881 1.00 0.00 C ATOM 1989 NH1 ARG B 426 -10.383 7.281 -5.938 1.00 0.00 N ATOM 1990 NH2 ARG B 426 -10.919 9.392 -5.212 1.00 0.00 N ATOM 0 H ARG B 426 -5.561 4.271 -8.177 1.00 0.00 H new ATOM 0 HA ARG B 426 -6.398 6.803 -9.006 1.00 0.00 H new ATOM 0 HB2 ARG B 426 -7.712 5.548 -7.460 1.00 0.00 H new ATOM 0 HB3 ARG B 426 -6.379 5.382 -6.334 1.00 0.00 H new ATOM 0 HG2 ARG B 426 -7.935 7.020 -5.467 1.00 0.00 H new ATOM 0 HG3 ARG B 426 -6.448 7.836 -5.907 1.00 0.00 H new ATOM 0 HD2 ARG B 426 -7.396 8.873 -7.777 1.00 0.00 H new ATOM 0 HD3 ARG B 426 -8.627 7.641 -7.973 1.00 0.00 H new ATOM 0 HE ARG B 426 -8.865 10.066 -6.444 1.00 0.00 H new ATOM 0 HH11 ARG B 426 -9.765 6.654 -6.452 1.00 0.00 H new ATOM 0 HH12 ARG B 426 -11.209 6.911 -5.468 1.00 0.00 H new ATOM 0 HH21 ARG B 426 -10.714 10.390 -5.167 1.00 0.00 H new ATOM 0 HH22 ARG B 426 -11.744 9.019 -4.743 1.00 0.00 H new ATOM 2004 N ALA B 427 -3.964 6.841 -6.749 1.00 0.00 N ATOM 2005 CA ALA B 427 -2.882 7.657 -6.222 1.00 0.00 C ATOM 2006 C ALA B 427 -2.226 8.414 -7.364 1.00 0.00 C ATOM 2007 O ALA B 427 -1.971 9.616 -7.271 1.00 0.00 O ATOM 2008 CB ALA B 427 -1.859 6.804 -5.488 1.00 0.00 C ATOM 0 H ALA B 427 -4.034 5.910 -6.339 1.00 0.00 H new ATOM 0 HA ALA B 427 -3.292 8.367 -5.503 1.00 0.00 H new ATOM 0 HB1 ALA B 427 -1.062 7.441 -5.105 1.00 0.00 H new ATOM 0 HB2 ALA B 427 -2.343 6.289 -4.658 1.00 0.00 H new ATOM 0 HB3 ALA B 427 -1.438 6.069 -6.174 1.00 0.00 H new ATOM 2014 N ALA B 428 -1.980 7.703 -8.458 1.00 0.00 N ATOM 2015 CA ALA B 428 -1.385 8.313 -9.635 1.00 0.00 C ATOM 2016 C ALA B 428 -2.194 9.540 -10.041 1.00 0.00 C ATOM 2017 O ALA B 428 -1.696 10.671 -10.007 1.00 0.00 O ATOM 2018 CB ALA B 428 -1.310 7.320 -10.783 1.00 0.00 C ATOM 0 H ALA B 428 -2.183 6.708 -8.552 1.00 0.00 H new ATOM 0 HA ALA B 428 -0.367 8.620 -9.393 1.00 0.00 H new ATOM 0 HB1 ALA B 428 -0.861 7.801 -11.652 1.00 0.00 H new ATOM 0 HB2 ALA B 428 -0.701 6.466 -10.486 1.00 0.00 H new ATOM 0 HB3 ALA B 428 -2.314 6.979 -11.036 1.00 0.00 H new ATOM 2024 N GLU B 429 -3.453 9.307 -10.404 1.00 0.00 N ATOM 2025 CA GLU B 429 -4.347 10.388 -10.798 1.00 0.00 C ATOM 2026 C GLU B 429 -4.288 11.522 -9.781 1.00 0.00 C ATOM 2027 O GLU B 429 -4.447 12.694 -10.127 1.00 0.00 O ATOM 2028 CB GLU B 429 -5.781 9.870 -10.919 1.00 0.00 C ATOM 2029 CG GLU B 429 -6.293 9.818 -12.351 1.00 0.00 C ATOM 2030 CD GLU B 429 -7.422 10.797 -12.604 1.00 0.00 C ATOM 2031 OE1 GLU B 429 -7.243 11.998 -12.312 1.00 0.00 O ATOM 2032 OE2 GLU B 429 -8.485 10.362 -13.093 1.00 0.00 O ATOM 0 H GLU B 429 -3.875 8.379 -10.433 1.00 0.00 H new ATOM 0 HA GLU B 429 -4.025 10.768 -11.767 1.00 0.00 H new ATOM 0 HB2 GLU B 429 -5.835 8.871 -10.487 1.00 0.00 H new ATOM 0 HB3 GLU B 429 -6.440 10.508 -10.330 1.00 0.00 H new ATOM 0 HG2 GLU B 429 -5.471 10.033 -13.034 1.00 0.00 H new ATOM 0 HG3 GLU B 429 -6.637 8.808 -12.573 1.00 0.00 H new ATOM 2039 N ASN B 430 -4.054 11.160 -8.522 1.00 0.00 N ATOM 2040 CA ASN B 430 -3.966 12.138 -7.445 1.00 0.00 C ATOM 2041 C ASN B 430 -2.729 13.015 -7.610 1.00 0.00 C ATOM 2042 O ASN B 430 -2.737 14.187 -7.232 1.00 0.00 O ATOM 2043 CB ASN B 430 -3.939 11.431 -6.087 1.00 0.00 C ATOM 2044 CG ASN B 430 -5.107 10.478 -5.912 1.00 0.00 C ATOM 2045 OD1 ASN B 430 -5.011 9.482 -5.198 1.00 0.00 O ATOM 2046 ND2 ASN B 430 -6.219 10.782 -6.567 1.00 0.00 N ATOM 0 H ASN B 430 -3.922 10.194 -8.224 1.00 0.00 H new ATOM 0 HA ASN B 430 -4.847 12.778 -7.491 1.00 0.00 H new ATOM 0 HB2 ASN B 430 -3.004 10.880 -5.985 1.00 0.00 H new ATOM 0 HB3 ASN B 430 -3.958 12.176 -5.291 1.00 0.00 H new ATOM 0 HD21 ASN B 430 -7.038 10.179 -6.489 1.00 0.00 H new ATOM 0 HD22 ASN B 430 -6.255 11.619 -7.149 1.00 0.00 H new ATOM 2053 N ALA B 431 -1.664 12.446 -8.177 1.00 0.00 N ATOM 2054 CA ALA B 431 -0.431 13.193 -8.381 1.00 0.00 C ATOM 2055 C ALA B 431 -0.609 14.232 -9.475 1.00 0.00 C ATOM 2056 O ALA B 431 -0.254 15.398 -9.300 1.00 0.00 O ATOM 2057 CB ALA B 431 0.724 12.267 -8.722 1.00 0.00 C ATOM 0 H ALA B 431 -1.634 11.479 -8.499 1.00 0.00 H new ATOM 0 HA ALA B 431 -0.194 13.702 -7.447 1.00 0.00 H new ATOM 0 HB1 ALA B 431 1.630 12.855 -8.868 1.00 0.00 H new ATOM 0 HB2 ALA B 431 0.877 11.561 -7.906 1.00 0.00 H new ATOM 0 HB3 ALA B 431 0.494 11.720 -9.637 1.00 0.00 H new ATOM 2063 N LEU B 432 -1.171 13.809 -10.603 1.00 0.00 N ATOM 2064 CA LEU B 432 -1.397 14.730 -11.711 1.00 0.00 C ATOM 2065 C LEU B 432 -2.765 15.385 -11.597 1.00 0.00 C ATOM 2066 O LEU B 432 -3.260 15.988 -12.549 1.00 0.00 O ATOM 2067 CB LEU B 432 -1.235 14.034 -13.075 1.00 0.00 C ATOM 2068 CG LEU B 432 -2.197 12.878 -13.393 1.00 0.00 C ATOM 2069 CD1 LEU B 432 -1.815 11.630 -12.620 1.00 0.00 C ATOM 2070 CD2 LEU B 432 -3.641 13.259 -13.107 1.00 0.00 C ATOM 0 H LEU B 432 -1.474 12.850 -10.773 1.00 0.00 H new ATOM 0 HA LEU B 432 -0.636 15.508 -11.650 1.00 0.00 H new ATOM 0 HB2 LEU B 432 -1.344 14.788 -13.854 1.00 0.00 H new ATOM 0 HB3 LEU B 432 -0.216 13.653 -13.141 1.00 0.00 H new ATOM 0 HG LEU B 432 -2.112 12.666 -14.459 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -2.510 10.826 -12.861 1.00 0.00 H new ATOM 0 HD12 LEU B 432 -0.803 11.329 -12.892 1.00 0.00 H new ATOM 0 HD13 LEU B 432 -1.857 11.837 -11.551 1.00 0.00 H new ATOM 0 HD21 LEU B 432 -4.293 12.418 -13.343 1.00 0.00 H new ATOM 0 HD22 LEU B 432 -3.748 13.516 -12.053 1.00 0.00 H new ATOM 0 HD23 LEU B 432 -3.919 14.117 -13.719 1.00 0.00 H new ATOM 2082 N ARG B 433 -3.371 15.263 -10.422 1.00 0.00 N ATOM 2083 CA ARG B 433 -4.681 15.844 -10.175 1.00 0.00 C ATOM 2084 C ARG B 433 -4.544 17.296 -9.732 1.00 0.00 C ATOM 2085 O ARG B 433 -5.534 17.956 -9.416 1.00 0.00 O ATOM 2086 CB ARG B 433 -5.426 15.030 -9.111 1.00 0.00 C ATOM 2087 CG ARG B 433 -6.483 15.819 -8.352 1.00 0.00 C ATOM 2088 CD ARG B 433 -7.337 14.908 -7.485 1.00 0.00 C ATOM 2089 NE ARG B 433 -8.642 15.494 -7.196 1.00 0.00 N ATOM 2090 CZ ARG B 433 -8.813 16.580 -6.448 1.00 0.00 C ATOM 2091 NH1 ARG B 433 -7.762 17.191 -5.915 1.00 0.00 N ATOM 2092 NH2 ARG B 433 -10.032 17.053 -6.234 1.00 0.00 N ATOM 0 H ARG B 433 -2.974 14.766 -9.625 1.00 0.00 H new ATOM 0 HA ARG B 433 -5.255 15.819 -11.101 1.00 0.00 H new ATOM 0 HB2 ARG B 433 -5.901 14.174 -9.591 1.00 0.00 H new ATOM 0 HB3 ARG B 433 -4.702 14.635 -8.399 1.00 0.00 H new ATOM 0 HG2 ARG B 433 -6.000 16.571 -7.728 1.00 0.00 H new ATOM 0 HG3 ARG B 433 -7.119 16.352 -9.059 1.00 0.00 H new ATOM 0 HD2 ARG B 433 -7.473 13.951 -7.989 1.00 0.00 H new ATOM 0 HD3 ARG B 433 -6.816 14.705 -6.550 1.00 0.00 H new ATOM 0 HE ARG B 433 -9.469 15.045 -7.590 1.00 0.00 H new ATOM 0 HH11 ARG B 433 -6.823 16.827 -6.079 1.00 0.00 H new ATOM 0 HH12 ARG B 433 -7.893 18.024 -5.341 1.00 0.00 H new ATOM 0 HH21 ARG B 433 -10.840 16.584 -6.643 1.00 0.00 H new ATOM 0 HH22 ARG B 433 -10.162 17.886 -5.660 1.00 0.00 H new ATOM 2106 N ASP B 434 -3.309 17.792 -9.713 1.00 0.00 N ATOM 2107 CA ASP B 434 -3.051 19.166 -9.312 1.00 0.00 C ATOM 2108 C ASP B 434 -2.247 19.902 -10.373 1.00 0.00 C ATOM 2109 O ASP B 434 -1.017 19.871 -10.374 1.00 0.00 O ATOM 2110 CB ASP B 434 -2.311 19.201 -7.980 1.00 0.00 C ATOM 2111 CG ASP B 434 -2.552 20.491 -7.220 1.00 0.00 C ATOM 2112 OD1 ASP B 434 -3.678 20.678 -6.709 1.00 0.00 O ATOM 2113 OD2 ASP B 434 -1.618 21.315 -7.136 1.00 0.00 O ATOM 0 H ASP B 434 -2.476 17.262 -9.970 1.00 0.00 H new ATOM 0 HA ASP B 434 -4.011 19.669 -9.198 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -2.629 18.357 -7.368 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -1.242 19.081 -8.158 1.00 0.00 H new ATOM 2118 N LYS B 435 -2.958 20.564 -11.272 1.00 0.00 N ATOM 2119 CA LYS B 435 -2.325 21.316 -12.348 1.00 0.00 C ATOM 2120 C LYS B 435 -1.344 22.339 -11.785 1.00 0.00 C ATOM 2121 O LYS B 435 -0.320 22.637 -12.399 1.00 0.00 O ATOM 2122 CB LYS B 435 -3.384 22.019 -13.200 1.00 0.00 C ATOM 2123 CG LYS B 435 -4.040 23.201 -12.504 1.00 0.00 C ATOM 2124 CD LYS B 435 -5.349 22.807 -11.841 1.00 0.00 C ATOM 2125 CE LYS B 435 -6.416 23.870 -12.045 1.00 0.00 C ATOM 2126 NZ LYS B 435 -6.844 23.955 -13.468 1.00 0.00 N ATOM 0 H LYS B 435 -3.977 20.597 -11.279 1.00 0.00 H new ATOM 0 HA LYS B 435 -1.774 20.616 -12.976 1.00 0.00 H new ATOM 0 HB2 LYS B 435 -2.923 22.363 -14.126 1.00 0.00 H new ATOM 0 HB3 LYS B 435 -4.153 21.298 -13.476 1.00 0.00 H new ATOM 0 HG2 LYS B 435 -3.360 23.605 -11.754 1.00 0.00 H new ATOM 0 HG3 LYS B 435 -4.223 23.994 -13.229 1.00 0.00 H new ATOM 0 HD2 LYS B 435 -5.695 21.858 -12.251 1.00 0.00 H new ATOM 0 HD3 LYS B 435 -5.186 22.653 -10.774 1.00 0.00 H new ATOM 0 HE2 LYS B 435 -7.279 23.644 -11.418 1.00 0.00 H new ATOM 0 HE3 LYS B 435 -6.032 24.838 -11.722 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 -7.788 24.388 -13.521 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 -6.166 24.536 -14.000 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 -6.878 23.000 -13.878 1.00 0.00 H new ATOM 2140 N LYS B 436 -1.665 22.873 -10.609 1.00 0.00 N ATOM 2141 CA LYS B 436 -0.811 23.861 -9.960 1.00 0.00 C ATOM 2142 C LYS B 436 0.508 23.230 -9.536 1.00 0.00 C ATOM 2143 O LYS B 436 1.579 23.651 -9.973 1.00 0.00 O ATOM 2144 CB LYS B 436 -1.515 24.462 -8.741 1.00 0.00 C ATOM 2145 CG LYS B 436 -2.884 25.043 -9.053 1.00 0.00 C ATOM 2146 CD LYS B 436 -3.740 25.154 -7.800 1.00 0.00 C ATOM 2147 CE LYS B 436 -4.403 23.831 -7.457 1.00 0.00 C ATOM 2148 NZ LYS B 436 -5.650 23.614 -8.240 1.00 0.00 N ATOM 0 H LYS B 436 -2.509 22.638 -10.088 1.00 0.00 H new ATOM 0 HA LYS B 436 -0.607 24.657 -10.677 1.00 0.00 H new ATOM 0 HB2 LYS B 436 -1.622 23.691 -7.978 1.00 0.00 H new ATOM 0 HB3 LYS B 436 -0.885 25.245 -8.318 1.00 0.00 H new ATOM 0 HG2 LYS B 436 -2.768 26.028 -9.505 1.00 0.00 H new ATOM 0 HG3 LYS B 436 -3.389 24.414 -9.786 1.00 0.00 H new ATOM 0 HD2 LYS B 436 -3.121 25.479 -6.964 1.00 0.00 H new ATOM 0 HD3 LYS B 436 -4.504 25.917 -7.947 1.00 0.00 H new ATOM 0 HE2 LYS B 436 -3.706 23.015 -7.651 1.00 0.00 H new ATOM 0 HE3 LYS B 436 -4.634 23.807 -6.392 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 -5.812 22.594 -8.359 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 -6.455 24.036 -7.735 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 -5.555 24.061 -9.174 1.00 0.00 H new ATOM 2162 N MET B 437 0.423 22.207 -8.691 1.00 0.00 N ATOM 2163 CA MET B 437 1.611 21.508 -8.222 1.00 0.00 C ATOM 2164 C MET B 437 2.413 21.010 -9.412 1.00 0.00 C ATOM 2165 O MET B 437 3.609 21.275 -9.526 1.00 0.00 O ATOM 2166 CB MET B 437 1.221 20.339 -7.318 1.00 0.00 C ATOM 2167 CG MET B 437 2.354 19.360 -7.052 1.00 0.00 C ATOM 2168 SD MET B 437 1.773 17.661 -6.897 1.00 0.00 S ATOM 2169 CE MET B 437 2.321 16.970 -8.456 1.00 0.00 C ATOM 0 H MET B 437 -0.455 21.845 -8.319 1.00 0.00 H new ATOM 0 HA MET B 437 2.223 22.199 -7.642 1.00 0.00 H new ATOM 0 HB2 MET B 437 0.863 20.732 -6.367 1.00 0.00 H new ATOM 0 HB3 MET B 437 0.389 19.802 -7.774 1.00 0.00 H new ATOM 0 HG2 MET B 437 3.080 19.420 -7.863 1.00 0.00 H new ATOM 0 HG3 MET B 437 2.872 19.649 -6.138 1.00 0.00 H new ATOM 0 HE1 MET B 437 2.003 15.930 -8.525 1.00 0.00 H new ATOM 0 HE2 MET B 437 1.886 17.538 -9.279 1.00 0.00 H new ATOM 0 HE3 MET B 437 3.408 17.022 -8.515 1.00 0.00 H new ATOM 2179 N LEU B 438 1.738 20.304 -10.311 1.00 0.00 N ATOM 2180 CA LEU B 438 2.382 19.794 -11.508 1.00 0.00 C ATOM 2181 C LEU B 438 3.070 20.937 -12.234 1.00 0.00 C ATOM 2182 O LEU B 438 4.297 20.981 -12.341 1.00 0.00 O ATOM 2183 CB LEU B 438 1.354 19.151 -12.439 1.00 0.00 C ATOM 2184 CG LEU B 438 0.654 17.906 -11.896 1.00 0.00 C ATOM 2185 CD1 LEU B 438 -0.442 17.467 -12.853 1.00 0.00 C ATOM 2186 CD2 LEU B 438 1.656 16.782 -11.675 1.00 0.00 C ATOM 0 H LEU B 438 0.748 20.074 -10.231 1.00 0.00 H new ATOM 0 HA LEU B 438 3.114 19.040 -11.218 1.00 0.00 H new ATOM 0 HB2 LEU B 438 0.595 19.895 -12.681 1.00 0.00 H new ATOM 0 HB3 LEU B 438 1.851 18.887 -13.372 1.00 0.00 H new ATOM 0 HG LEU B 438 0.201 18.149 -10.935 1.00 0.00 H new ATOM 0 HD11 LEU B 438 -0.936 16.579 -12.458 1.00 0.00 H new ATOM 0 HD12 LEU B 438 -1.172 18.269 -12.963 1.00 0.00 H new ATOM 0 HD13 LEU B 438 -0.006 17.238 -13.825 1.00 0.00 H new ATOM 0 HD21 LEU B 438 1.139 15.904 -11.288 1.00 0.00 H new ATOM 0 HD22 LEU B 438 2.137 16.532 -12.621 1.00 0.00 H new ATOM 0 HD23 LEU B 438 2.411 17.104 -10.958 1.00 0.00 H new ATOM 2198 N ASP B 439 2.259 21.866 -12.727 1.00 0.00 N ATOM 2199 CA ASP B 439 2.766 23.028 -13.445 1.00 0.00 C ATOM 2200 C ASP B 439 3.996 23.588 -12.745 1.00 0.00 C ATOM 2201 O ASP B 439 4.949 24.025 -13.393 1.00 0.00 O ATOM 2202 CB ASP B 439 1.682 24.104 -13.542 1.00 0.00 C ATOM 2203 CG ASP B 439 2.219 25.418 -14.075 1.00 0.00 C ATOM 2204 OD1 ASP B 439 2.777 25.422 -15.192 1.00 0.00 O ATOM 2205 OD2 ASP B 439 2.082 26.443 -13.373 1.00 0.00 O ATOM 0 H ASP B 439 1.243 21.836 -12.642 1.00 0.00 H new ATOM 0 HA ASP B 439 3.047 22.718 -14.452 1.00 0.00 H new ATOM 0 HB2 ASP B 439 0.881 23.752 -14.192 1.00 0.00 H new ATOM 0 HB3 ASP B 439 1.245 24.266 -12.557 1.00 0.00 H new ATOM 2210 N PHE B 440 3.974 23.560 -11.416 1.00 0.00 N ATOM 2211 CA PHE B 440 5.095 24.055 -10.633 1.00 0.00 C ATOM 2212 C PHE B 440 6.327 23.202 -10.907 1.00 0.00 C ATOM 2213 O PHE B 440 7.432 23.720 -11.078 1.00 0.00 O ATOM 2214 CB PHE B 440 4.752 24.043 -9.137 1.00 0.00 C ATOM 2215 CG PHE B 440 5.943 23.863 -8.239 1.00 0.00 C ATOM 2216 CD1 PHE B 440 6.581 22.637 -8.159 1.00 0.00 C ATOM 2217 CD2 PHE B 440 6.423 24.917 -7.479 1.00 0.00 C ATOM 2218 CE1 PHE B 440 7.677 22.463 -7.335 1.00 0.00 C ATOM 2219 CE2 PHE B 440 7.519 24.750 -6.653 1.00 0.00 C ATOM 2220 CZ PHE B 440 8.147 23.522 -6.580 1.00 0.00 C ATOM 0 H PHE B 440 3.195 23.201 -10.863 1.00 0.00 H new ATOM 0 HA PHE B 440 5.305 25.084 -10.924 1.00 0.00 H new ATOM 0 HB2 PHE B 440 4.255 24.979 -8.881 1.00 0.00 H new ATOM 0 HB3 PHE B 440 4.040 23.241 -8.944 1.00 0.00 H new ATOM 0 HD1 PHE B 440 6.218 21.807 -8.747 1.00 0.00 H new ATOM 0 HD2 PHE B 440 5.936 25.879 -7.532 1.00 0.00 H new ATOM 0 HE1 PHE B 440 8.166 21.501 -7.281 1.00 0.00 H new ATOM 0 HE2 PHE B 440 7.884 25.579 -6.065 1.00 0.00 H new ATOM 0 HZ PHE B 440 9.003 23.389 -5.935 1.00 0.00 H new ATOM 2230 N TYR B 441 6.124 21.891 -10.960 1.00 0.00 N ATOM 2231 CA TYR B 441 7.212 20.966 -11.227 1.00 0.00 C ATOM 2232 C TYR B 441 7.640 21.063 -12.681 1.00 0.00 C ATOM 2233 O TYR B 441 8.824 20.960 -12.990 1.00 0.00 O ATOM 2234 CB TYR B 441 6.801 19.535 -10.874 1.00 0.00 C ATOM 2235 CG TYR B 441 6.787 19.281 -9.386 1.00 0.00 C ATOM 2236 CD1 TYR B 441 7.971 19.236 -8.666 1.00 0.00 C ATOM 2237 CD2 TYR B 441 5.593 19.106 -8.699 1.00 0.00 C ATOM 2238 CE1 TYR B 441 7.973 19.022 -7.307 1.00 0.00 C ATOM 2239 CE2 TYR B 441 5.584 18.892 -7.334 1.00 0.00 C ATOM 2240 CZ TYR B 441 6.778 18.852 -6.641 1.00 0.00 C ATOM 2241 OH TYR B 441 6.775 18.638 -5.282 1.00 0.00 O ATOM 0 H TYR B 441 5.216 21.448 -10.821 1.00 0.00 H new ATOM 0 HA TYR B 441 8.062 21.237 -10.600 1.00 0.00 H new ATOM 0 HB2 TYR B 441 5.810 19.335 -11.281 1.00 0.00 H new ATOM 0 HB3 TYR B 441 7.488 18.836 -11.351 1.00 0.00 H new ATOM 0 HD1 TYR B 441 8.910 19.372 -9.182 1.00 0.00 H new ATOM 0 HD2 TYR B 441 4.658 19.138 -9.239 1.00 0.00 H new ATOM 0 HE1 TYR B 441 8.906 18.987 -6.765 1.00 0.00 H new ATOM 0 HE2 TYR B 441 4.648 18.757 -6.812 1.00 0.00 H new ATOM 0 HH TYR B 441 6.144 19.254 -4.855 1.00 0.00 H new ATOM 2251 N ALA B 442 6.680 21.285 -13.574 1.00 0.00 N ATOM 2252 CA ALA B 442 6.994 21.424 -14.986 1.00 0.00 C ATOM 2253 C ALA B 442 8.094 22.462 -15.152 1.00 0.00 C ATOM 2254 O ALA B 442 9.097 22.224 -15.827 1.00 0.00 O ATOM 2255 CB ALA B 442 5.762 21.813 -15.792 1.00 0.00 C ATOM 0 H ALA B 442 5.690 21.371 -13.345 1.00 0.00 H new ATOM 0 HA ALA B 442 7.339 20.463 -15.367 1.00 0.00 H new ATOM 0 HB1 ALA B 442 6.031 21.909 -16.844 1.00 0.00 H new ATOM 0 HB2 ALA B 442 4.997 21.044 -15.682 1.00 0.00 H new ATOM 0 HB3 ALA B 442 5.375 22.765 -15.428 1.00 0.00 H new ATOM 2261 N LYS B 443 7.910 23.606 -14.501 1.00 0.00 N ATOM 2262 CA LYS B 443 8.898 24.673 -14.545 1.00 0.00 C ATOM 2263 C LYS B 443 10.183 24.210 -13.865 1.00 0.00 C ATOM 2264 O LYS B 443 11.285 24.513 -14.322 1.00 0.00 O ATOM 2265 CB LYS B 443 8.356 25.933 -13.859 1.00 0.00 C ATOM 2266 CG LYS B 443 9.433 26.817 -13.246 1.00 0.00 C ATOM 2267 CD LYS B 443 9.468 26.682 -11.732 1.00 0.00 C ATOM 2268 CE LYS B 443 10.867 26.359 -11.234 1.00 0.00 C ATOM 2269 NZ LYS B 443 11.636 27.591 -10.903 1.00 0.00 N ATOM 0 H LYS B 443 7.086 23.816 -13.938 1.00 0.00 H new ATOM 0 HA LYS B 443 9.113 24.916 -15.586 1.00 0.00 H new ATOM 0 HB2 LYS B 443 7.793 26.517 -14.587 1.00 0.00 H new ATOM 0 HB3 LYS B 443 7.656 25.636 -13.078 1.00 0.00 H new ATOM 0 HG2 LYS B 443 10.405 26.548 -13.659 1.00 0.00 H new ATOM 0 HG3 LYS B 443 9.249 27.857 -13.516 1.00 0.00 H new ATOM 0 HD2 LYS B 443 9.123 27.609 -11.275 1.00 0.00 H new ATOM 0 HD3 LYS B 443 8.779 25.897 -11.420 1.00 0.00 H new ATOM 0 HE2 LYS B 443 10.800 25.724 -10.351 1.00 0.00 H new ATOM 0 HE3 LYS B 443 11.401 25.791 -11.995 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 12.585 27.328 -10.567 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 11.722 28.185 -11.752 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 11.139 28.121 -10.158 1.00 0.00 H new ATOM 2283 N GLN B 444 10.028 23.463 -12.773 1.00 0.00 N ATOM 2284 CA GLN B 444 11.171 22.944 -12.030 1.00 0.00 C ATOM 2285 C GLN B 444 11.953 21.951 -12.889 1.00 0.00 C ATOM 2286 O GLN B 444 13.136 21.701 -12.656 1.00 0.00 O ATOM 2287 CB GLN B 444 10.693 22.277 -10.723 1.00 0.00 C ATOM 2288 CG GLN B 444 10.593 20.758 -10.784 1.00 0.00 C ATOM 2289 CD GLN B 444 11.699 20.087 -10.004 1.00 0.00 C ATOM 2290 OE1 GLN B 444 11.525 18.996 -9.463 1.00 0.00 O ATOM 2291 NE2 GLN B 444 12.844 20.747 -9.942 1.00 0.00 N ATOM 0 H GLN B 444 9.121 23.205 -12.384 1.00 0.00 H new ATOM 0 HA GLN B 444 11.833 23.771 -11.774 1.00 0.00 H new ATOM 0 HB2 GLN B 444 11.377 22.551 -9.920 1.00 0.00 H new ATOM 0 HB3 GLN B 444 9.716 22.682 -10.461 1.00 0.00 H new ATOM 0 HG2 GLN B 444 9.627 20.442 -10.389 1.00 0.00 H new ATOM 0 HG3 GLN B 444 10.634 20.433 -11.824 1.00 0.00 H new ATOM 0 HE21 GLN B 444 12.938 21.649 -10.408 1.00 0.00 H new ATOM 0 HE22 GLN B 444 13.632 20.353 -9.428 1.00 0.00 H new ATOM 2300 N ARG B 445 11.266 21.381 -13.873 1.00 0.00 N ATOM 2301 CA ARG B 445 11.862 20.401 -14.772 1.00 0.00 C ATOM 2302 C ARG B 445 12.548 21.082 -15.951 1.00 0.00 C ATOM 2303 O ARG B 445 13.509 20.554 -16.511 1.00 0.00 O ATOM 2304 CB ARG B 445 10.781 19.439 -15.270 1.00 0.00 C ATOM 2305 CG ARG B 445 11.211 18.588 -16.452 1.00 0.00 C ATOM 2306 CD ARG B 445 12.444 17.762 -16.126 1.00 0.00 C ATOM 2307 NE ARG B 445 12.518 16.549 -16.934 1.00 0.00 N ATOM 2308 CZ ARG B 445 13.650 15.899 -17.183 1.00 0.00 C ATOM 2309 NH1 ARG B 445 14.796 16.348 -16.691 1.00 0.00 N ATOM 2310 NH2 ARG B 445 13.637 14.802 -17.927 1.00 0.00 N ATOM 0 H ARG B 445 10.286 21.584 -14.069 1.00 0.00 H new ATOM 0 HA ARG B 445 12.620 19.842 -14.223 1.00 0.00 H new ATOM 0 HB2 ARG B 445 10.487 18.783 -14.451 1.00 0.00 H new ATOM 0 HB3 ARG B 445 9.898 20.014 -15.551 1.00 0.00 H new ATOM 0 HG2 ARG B 445 10.395 17.926 -16.741 1.00 0.00 H new ATOM 0 HG3 ARG B 445 11.418 19.231 -17.308 1.00 0.00 H new ATOM 0 HD2 ARG B 445 13.338 18.363 -16.292 1.00 0.00 H new ATOM 0 HD3 ARG B 445 12.432 17.494 -15.070 1.00 0.00 H new ATOM 0 HE ARG B 445 11.653 16.180 -17.329 1.00 0.00 H new ATOM 0 HH11 ARG B 445 14.810 17.193 -16.120 1.00 0.00 H new ATOM 0 HH12 ARG B 445 15.664 15.848 -16.883 1.00 0.00 H new ATOM 0 HH21 ARG B 445 12.757 14.456 -18.309 1.00 0.00 H new ATOM 0 HH22 ARG B 445 14.507 14.304 -18.117 1.00 0.00 H new