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 419 ASN : amide:sc= -3.01! C(o=-2.7!,f=-5.4!) USER MOD Set 1.2: B 421 LYS NZ :NH3+ -165:sc= 0.274 (180deg=0) USER MOD Set 2.1: B 387 TYR OH : rot -147:sc= -3.35! USER MOD Set 2.2: B 404 CYS SG : rot 57:sc= -7.65! USER MOD Set 3.1: B 380 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: B 444 GLN : amide:sc= -0.86 K(o=-0.86,f=-0.21) USER MOD Single : B 368 MET CE :methyl 168:sc= -0.199 (180deg=-0.837) USER MOD Single : B 369 ASN : amide:sc= -0.0323 X(o=-0.032,f=-0.33) USER MOD Single : B 371 LYS NZ :NH3+ 156:sc= -0.07 (180deg=-0.376) USER MOD Single : B 373 GLN : amide:sc= -8.48! C(o=-8.5!,f=-14!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 180:sc= 0 USER MOD Single : B 382 SER OG : rot 58:sc= 1.1 USER MOD Single : B 386 HIS : no HD1:sc=-0.00569 X(o=-0.0057,f=-0.005) 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 180:sc= -0.079 USER MOD Single : B 399 ASN : amide:sc= -5.22! C(o=-5.2!,f=-7.7!) USER MOD Single : B 400 SER OG : rot 180:sc= -0.23 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 44:sc= -3.89! USER MOD Single : B 430 ASN : amide:sc= -2.75! C(o=-2.8!,f=-11!) 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 -136:sc= -4.91! (180deg=-9.85!) USER MOD Single : B 441 TYR OH : rot 150:sc= -1.43! USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1069 N ASP B 367 -4.628 3.726 -15.516 1.00 0.00 N ATOM 1070 CA ASP B 367 -3.287 3.577 -14.977 1.00 0.00 C ATOM 1071 C ASP B 367 -2.289 4.185 -15.949 1.00 0.00 C ATOM 1072 O ASP B 367 -1.686 5.223 -15.676 1.00 0.00 O ATOM 1073 CB ASP B 367 -2.965 2.098 -14.742 1.00 0.00 C ATOM 1074 CG ASP B 367 -3.704 1.185 -15.701 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -3.491 1.313 -16.924 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -4.495 0.341 -15.229 1.00 0.00 O ATOM 0 HA ASP B 367 -3.224 4.094 -14.020 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -1.892 1.941 -14.850 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -3.225 1.831 -13.718 1.00 0.00 H new ATOM 1081 N MET B 368 -2.129 3.526 -17.091 1.00 0.00 N ATOM 1082 CA MET B 368 -1.217 3.995 -18.122 1.00 0.00 C ATOM 1083 C MET B 368 -1.222 5.520 -18.187 1.00 0.00 C ATOM 1084 O MET B 368 -0.167 6.145 -18.298 1.00 0.00 O ATOM 1085 CB MET B 368 -1.602 3.408 -19.483 1.00 0.00 C ATOM 1086 CG MET B 368 -0.582 3.686 -20.574 1.00 0.00 C ATOM 1087 SD MET B 368 -1.322 4.422 -22.044 1.00 0.00 S ATOM 1088 CE MET B 368 -1.850 6.008 -21.403 1.00 0.00 C ATOM 0 H MET B 368 -2.621 2.664 -17.324 1.00 0.00 H new ATOM 0 HA MET B 368 -0.211 3.660 -17.868 1.00 0.00 H new ATOM 0 HB2 MET B 368 -1.729 2.330 -19.382 1.00 0.00 H new ATOM 0 HB3 MET B 368 -2.566 3.816 -19.786 1.00 0.00 H new ATOM 0 HG2 MET B 368 0.187 4.354 -20.186 1.00 0.00 H new ATOM 0 HG3 MET B 368 -0.086 2.755 -20.849 1.00 0.00 H new ATOM 0 HE1 MET B 368 -2.131 6.660 -22.230 1.00 0.00 H new ATOM 0 HE2 MET B 368 -2.707 5.867 -20.745 1.00 0.00 H new ATOM 0 HE3 MET B 368 -1.034 6.464 -20.843 1.00 0.00 H new ATOM 1098 N ASN B 369 -2.413 6.118 -18.111 1.00 0.00 N ATOM 1099 CA ASN B 369 -2.531 7.571 -18.157 1.00 0.00 C ATOM 1100 C ASN B 369 -1.854 8.204 -16.949 1.00 0.00 C ATOM 1101 O ASN B 369 -1.139 9.199 -17.075 1.00 0.00 O ATOM 1102 CB ASN B 369 -3.999 7.989 -18.210 1.00 0.00 C ATOM 1103 CG ASN B 369 -4.463 8.270 -19.625 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -3.805 8.992 -20.375 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -5.602 7.703 -19.998 1.00 0.00 N ATOM 0 H ASN B 369 -3.299 5.622 -18.018 1.00 0.00 H new ATOM 0 HA ASN B 369 -2.033 7.922 -19.061 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -4.615 7.201 -17.777 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -4.144 8.879 -17.598 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -5.965 7.858 -20.939 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -6.115 7.112 -19.344 1.00 0.00 H new ATOM 1112 N ALA B 370 -2.075 7.615 -15.778 1.00 0.00 N ATOM 1113 CA ALA B 370 -1.478 8.115 -14.549 1.00 0.00 C ATOM 1114 C ALA B 370 0.036 7.960 -14.592 1.00 0.00 C ATOM 1115 O ALA B 370 0.762 8.937 -14.776 1.00 0.00 O ATOM 1116 CB ALA B 370 -2.047 7.400 -13.333 1.00 0.00 C ATOM 0 H ALA B 370 -2.664 6.791 -15.656 1.00 0.00 H new ATOM 0 HA ALA B 370 -1.721 9.174 -14.464 1.00 0.00 H new ATOM 0 HB1 ALA B 370 -1.583 7.794 -12.429 1.00 0.00 H new ATOM 0 HB2 ALA B 370 -3.124 7.561 -13.287 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -1.842 6.332 -13.410 1.00 0.00 H new ATOM 1122 N LYS B 371 0.507 6.725 -14.421 1.00 0.00 N ATOM 1123 CA LYS B 371 1.939 6.440 -14.444 1.00 0.00 C ATOM 1124 C LYS B 371 2.652 7.359 -15.428 1.00 0.00 C ATOM 1125 O LYS B 371 3.695 7.939 -15.117 1.00 0.00 O ATOM 1126 CB LYS B 371 2.185 4.980 -14.833 1.00 0.00 C ATOM 1127 CG LYS B 371 1.302 3.990 -14.090 1.00 0.00 C ATOM 1128 CD LYS B 371 0.281 3.350 -15.018 1.00 0.00 C ATOM 1129 CE LYS B 371 0.713 1.957 -15.452 1.00 0.00 C ATOM 1130 NZ LYS B 371 0.737 1.000 -14.311 1.00 0.00 N ATOM 0 H LYS B 371 -0.083 5.907 -14.265 1.00 0.00 H new ATOM 0 HA LYS B 371 2.337 6.616 -13.445 1.00 0.00 H new ATOM 0 HB2 LYS B 371 2.020 4.867 -15.904 1.00 0.00 H new ATOM 0 HB3 LYS B 371 3.230 4.734 -14.643 1.00 0.00 H new ATOM 0 HG2 LYS B 371 1.922 3.215 -13.639 1.00 0.00 H new ATOM 0 HG3 LYS B 371 0.787 4.500 -13.276 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -0.683 3.292 -14.514 1.00 0.00 H new ATOM 0 HD3 LYS B 371 0.143 3.979 -15.897 1.00 0.00 H new ATOM 0 HE2 LYS B 371 0.032 1.589 -16.220 1.00 0.00 H new ATOM 0 HE3 LYS B 371 1.704 2.009 -15.903 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 0.631 0.030 -14.670 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 1.642 1.085 -13.806 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -0.045 1.216 -13.660 1.00 0.00 H new ATOM 1144 N ARG B 372 2.075 7.491 -16.619 1.00 0.00 N ATOM 1145 CA ARG B 372 2.642 8.340 -17.659 1.00 0.00 C ATOM 1146 C ARG B 372 2.726 9.791 -17.195 1.00 0.00 C ATOM 1147 O ARG B 372 3.742 10.457 -17.388 1.00 0.00 O ATOM 1148 CB ARG B 372 1.792 8.251 -18.928 1.00 0.00 C ATOM 1149 CG ARG B 372 2.529 8.668 -20.191 1.00 0.00 C ATOM 1150 CD ARG B 372 1.575 8.842 -21.359 1.00 0.00 C ATOM 1151 NE ARG B 372 1.284 10.248 -21.624 1.00 0.00 N ATOM 1152 CZ ARG B 372 2.079 11.043 -22.331 1.00 0.00 C ATOM 1153 NH1 ARG B 372 3.212 10.573 -22.837 1.00 0.00 N ATOM 1154 NH2 ARG B 372 1.743 12.310 -22.535 1.00 0.00 N ATOM 0 H ARG B 372 1.212 7.018 -16.887 1.00 0.00 H new ATOM 0 HA ARG B 372 3.651 7.988 -17.873 1.00 0.00 H new ATOM 0 HB2 ARG B 372 1.439 7.227 -19.046 1.00 0.00 H new ATOM 0 HB3 ARG B 372 0.910 8.881 -18.808 1.00 0.00 H new ATOM 0 HG2 ARG B 372 3.061 9.602 -20.012 1.00 0.00 H new ATOM 0 HG3 ARG B 372 3.279 7.917 -20.441 1.00 0.00 H new ATOM 0 HD2 ARG B 372 2.007 8.387 -22.250 1.00 0.00 H new ATOM 0 HD3 ARG B 372 0.645 8.313 -21.150 1.00 0.00 H new ATOM 0 HE ARG B 372 0.423 10.641 -21.245 1.00 0.00 H new ATOM 0 HH11 ARG B 372 3.474 9.599 -22.683 1.00 0.00 H new ATOM 0 HH12 ARG B 372 3.821 11.185 -23.380 1.00 0.00 H new ATOM 0 HH21 ARG B 372 0.873 12.675 -22.149 1.00 0.00 H new ATOM 0 HH22 ARG B 372 2.355 12.919 -23.078 1.00 0.00 H new ATOM 1168 N GLN B 373 1.645 10.279 -16.594 1.00 0.00 N ATOM 1169 CA GLN B 373 1.588 11.657 -16.117 1.00 0.00 C ATOM 1170 C GLN B 373 2.664 11.946 -15.075 1.00 0.00 C ATOM 1171 O GLN B 373 3.416 12.913 -15.196 1.00 0.00 O ATOM 1172 CB GLN B 373 0.212 11.960 -15.519 1.00 0.00 C ATOM 1173 CG GLN B 373 -0.207 13.409 -15.702 1.00 0.00 C ATOM 1174 CD GLN B 373 0.597 14.361 -14.836 1.00 0.00 C ATOM 1175 OE1 GLN B 373 1.044 15.410 -15.300 1.00 0.00 O ATOM 1176 NE2 GLN B 373 0.788 13.998 -13.572 1.00 0.00 N ATOM 0 H GLN B 373 0.796 9.740 -16.426 1.00 0.00 H new ATOM 0 HA GLN B 373 1.766 12.300 -16.979 1.00 0.00 H new ATOM 0 HB2 GLN B 373 -0.531 11.311 -15.983 1.00 0.00 H new ATOM 0 HB3 GLN B 373 0.223 11.722 -14.455 1.00 0.00 H new ATOM 0 HG2 GLN B 373 -0.089 13.688 -16.749 1.00 0.00 H new ATOM 0 HG3 GLN B 373 -1.265 13.511 -15.462 1.00 0.00 H new ATOM 0 HE21 GLN B 373 0.399 13.119 -13.229 1.00 0.00 H new ATOM 0 HE22 GLN B 373 1.323 14.598 -12.944 1.00 0.00 H new ATOM 1185 N LEU B 374 2.708 11.120 -14.042 1.00 0.00 N ATOM 1186 CA LEU B 374 3.664 11.295 -12.952 1.00 0.00 C ATOM 1187 C LEU B 374 5.111 11.317 -13.434 1.00 0.00 C ATOM 1188 O LEU B 374 5.814 12.313 -13.266 1.00 0.00 O ATOM 1189 CB LEU B 374 3.498 10.183 -11.915 1.00 0.00 C ATOM 1190 CG LEU B 374 2.108 9.552 -11.854 1.00 0.00 C ATOM 1191 CD1 LEU B 374 1.965 8.697 -10.606 1.00 0.00 C ATOM 1192 CD2 LEU B 374 1.038 10.633 -11.894 1.00 0.00 C ATOM 0 H LEU B 374 2.090 10.316 -13.932 1.00 0.00 H new ATOM 0 HA LEU B 374 3.448 12.265 -12.504 1.00 0.00 H new ATOM 0 HB2 LEU B 374 4.226 9.400 -12.126 1.00 0.00 H new ATOM 0 HB3 LEU B 374 3.740 10.586 -10.932 1.00 0.00 H new ATOM 0 HG LEU B 374 1.979 8.907 -12.723 1.00 0.00 H new ATOM 0 HD11 LEU B 374 0.969 8.256 -10.579 1.00 0.00 H new ATOM 0 HD12 LEU B 374 2.713 7.904 -10.621 1.00 0.00 H new ATOM 0 HD13 LEU B 374 2.111 9.317 -9.721 1.00 0.00 H new ATOM 0 HD21 LEU B 374 0.052 10.171 -11.850 1.00 0.00 H new ATOM 0 HD22 LEU B 374 1.164 11.301 -11.042 1.00 0.00 H new ATOM 0 HD23 LEU B 374 1.131 11.203 -12.819 1.00 0.00 H new ATOM 1204 N TYR B 375 5.565 10.200 -13.988 1.00 0.00 N ATOM 1205 CA TYR B 375 6.947 10.077 -14.439 1.00 0.00 C ATOM 1206 C TYR B 375 7.210 10.762 -15.783 1.00 0.00 C ATOM 1207 O TYR B 375 8.157 11.537 -15.912 1.00 0.00 O ATOM 1208 CB TYR B 375 7.332 8.601 -14.526 1.00 0.00 C ATOM 1209 CG TYR B 375 7.777 8.014 -13.204 1.00 0.00 C ATOM 1210 CD1 TYR B 375 7.033 8.212 -12.045 1.00 0.00 C ATOM 1211 CD2 TYR B 375 8.941 7.264 -13.115 1.00 0.00 C ATOM 1212 CE1 TYR B 375 7.440 7.676 -10.837 1.00 0.00 C ATOM 1213 CE2 TYR B 375 9.354 6.725 -11.912 1.00 0.00 C ATOM 1214 CZ TYR B 375 8.600 6.934 -10.777 1.00 0.00 C ATOM 1215 OH TYR B 375 9.008 6.398 -9.577 1.00 0.00 O ATOM 0 H TYR B 375 4.997 9.366 -14.136 1.00 0.00 H new ATOM 0 HA TYR B 375 7.564 10.589 -13.701 1.00 0.00 H new ATOM 0 HB2 TYR B 375 6.480 8.033 -14.898 1.00 0.00 H new ATOM 0 HB3 TYR B 375 8.135 8.485 -15.254 1.00 0.00 H new ATOM 0 HD1 TYR B 375 6.124 8.793 -12.090 1.00 0.00 H new ATOM 0 HD2 TYR B 375 9.535 7.099 -14.002 1.00 0.00 H new ATOM 0 HE1 TYR B 375 6.852 7.838 -9.946 1.00 0.00 H new ATOM 0 HE2 TYR B 375 10.262 6.143 -11.861 1.00 0.00 H new ATOM 0 HH TYR B 375 9.843 5.903 -9.707 1.00 0.00 H new ATOM 1225 N SER B 376 6.402 10.447 -16.786 1.00 0.00 N ATOM 1226 CA SER B 376 6.591 11.010 -18.123 1.00 0.00 C ATOM 1227 C SER B 376 6.284 12.506 -18.187 1.00 0.00 C ATOM 1228 O SER B 376 6.847 13.220 -19.019 1.00 0.00 O ATOM 1229 CB SER B 376 5.722 10.267 -19.139 1.00 0.00 C ATOM 1230 OG SER B 376 6.313 10.291 -20.428 1.00 0.00 O ATOM 0 H SER B 376 5.611 9.808 -16.704 1.00 0.00 H new ATOM 0 HA SER B 376 7.646 10.883 -18.367 1.00 0.00 H new ATOM 0 HB2 SER B 376 5.583 9.235 -18.818 1.00 0.00 H new ATOM 0 HB3 SER B 376 4.733 10.724 -19.180 1.00 0.00 H new ATOM 0 HG SER B 376 5.740 9.808 -21.060 1.00 0.00 H new ATOM 1236 N LEU B 377 5.382 12.981 -17.336 1.00 0.00 N ATOM 1237 CA LEU B 377 5.009 14.393 -17.350 1.00 0.00 C ATOM 1238 C LEU B 377 5.656 15.181 -16.214 1.00 0.00 C ATOM 1239 O LEU B 377 5.992 16.353 -16.384 1.00 0.00 O ATOM 1240 CB LEU B 377 3.490 14.538 -17.277 1.00 0.00 C ATOM 1241 CG LEU B 377 2.849 15.208 -18.492 1.00 0.00 C ATOM 1242 CD1 LEU B 377 2.941 14.305 -19.712 1.00 0.00 C ATOM 1243 CD2 LEU B 377 1.401 15.570 -18.203 1.00 0.00 C ATOM 0 H LEU B 377 4.900 12.418 -16.635 1.00 0.00 H new ATOM 0 HA LEU B 377 5.378 14.809 -18.288 1.00 0.00 H new ATOM 0 HB2 LEU B 377 3.051 13.548 -17.152 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.237 15.114 -16.387 1.00 0.00 H new ATOM 0 HG LEU B 377 3.396 16.127 -18.703 1.00 0.00 H new ATOM 0 HD11 LEU B 377 2.479 14.800 -20.566 1.00 0.00 H new ATOM 0 HD12 LEU B 377 3.988 14.099 -19.934 1.00 0.00 H new ATOM 0 HD13 LEU B 377 2.422 13.368 -19.511 1.00 0.00 H new ATOM 0 HD21 LEU B 377 0.963 16.046 -19.080 1.00 0.00 H new ATOM 0 HD22 LEU B 377 0.841 14.666 -17.963 1.00 0.00 H new ATOM 0 HD23 LEU B 377 1.360 16.258 -17.359 1.00 0.00 H new ATOM 1255 N ILE B 378 5.810 14.556 -15.052 1.00 0.00 N ATOM 1256 CA ILE B 378 6.397 15.246 -13.908 1.00 0.00 C ATOM 1257 C ILE B 378 7.416 14.384 -13.171 1.00 0.00 C ATOM 1258 O ILE B 378 7.509 14.432 -11.945 1.00 0.00 O ATOM 1259 CB ILE B 378 5.304 15.692 -12.921 1.00 0.00 C ATOM 1260 CG1 ILE B 378 4.087 16.204 -13.690 1.00 0.00 C ATOM 1261 CG2 ILE B 378 5.838 16.767 -11.988 1.00 0.00 C ATOM 1262 CD1 ILE B 378 4.367 17.454 -14.497 1.00 0.00 C ATOM 0 H ILE B 378 5.541 13.588 -14.878 1.00 0.00 H new ATOM 0 HA ILE B 378 6.915 16.119 -14.306 1.00 0.00 H new ATOM 0 HB ILE B 378 5.002 14.836 -12.317 1.00 0.00 H new ATOM 0 HG12 ILE B 378 3.734 15.420 -14.360 1.00 0.00 H new ATOM 0 HG13 ILE B 378 3.281 16.409 -12.985 1.00 0.00 H new ATOM 0 HG21 ILE B 378 5.053 17.071 -11.296 1.00 0.00 H new ATOM 0 HG22 ILE B 378 6.684 16.373 -11.425 1.00 0.00 H new ATOM 0 HG23 ILE B 378 6.161 17.629 -12.573 1.00 0.00 H new ATOM 0 HD11 ILE B 378 3.460 17.762 -15.017 1.00 0.00 H new ATOM 0 HD12 ILE B 378 4.692 18.253 -13.830 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.151 17.249 -15.226 1.00 0.00 H new ATOM 1274 N GLY B 379 8.185 13.605 -13.923 1.00 0.00 N ATOM 1275 CA GLY B 379 9.191 12.753 -13.311 1.00 0.00 C ATOM 1276 C GLY B 379 10.592 13.040 -13.818 1.00 0.00 C ATOM 1277 O GLY B 379 11.100 12.333 -14.687 1.00 0.00 O ATOM 0 H GLY B 379 8.132 13.547 -14.940 1.00 0.00 H new ATOM 0 HA2 GLY B 379 9.166 12.888 -12.230 1.00 0.00 H new ATOM 0 HA3 GLY B 379 8.945 11.709 -13.507 1.00 0.00 H new ATOM 1281 N TYR B 380 11.222 14.074 -13.269 1.00 0.00 N ATOM 1282 CA TYR B 380 12.576 14.437 -13.672 1.00 0.00 C ATOM 1283 C TYR B 380 13.586 14.026 -12.608 1.00 0.00 C ATOM 1284 O TYR B 380 13.215 13.555 -11.533 1.00 0.00 O ATOM 1285 CB TYR B 380 12.678 15.939 -13.935 1.00 0.00 C ATOM 1286 CG TYR B 380 12.281 16.796 -12.755 1.00 0.00 C ATOM 1287 CD1 TYR B 380 13.170 17.042 -11.717 1.00 0.00 C ATOM 1288 CD2 TYR B 380 11.019 17.367 -12.690 1.00 0.00 C ATOM 1289 CE1 TYR B 380 12.808 17.834 -10.644 1.00 0.00 C ATOM 1290 CE2 TYR B 380 10.651 18.162 -11.622 1.00 0.00 C ATOM 1291 CZ TYR B 380 11.549 18.392 -10.602 1.00 0.00 C ATOM 1292 OH TYR B 380 11.185 19.185 -9.538 1.00 0.00 O ATOM 0 H TYR B 380 10.819 14.672 -12.548 1.00 0.00 H new ATOM 0 HA TYR B 380 12.804 13.903 -14.595 1.00 0.00 H new ATOM 0 HB2 TYR B 380 13.703 16.180 -14.218 1.00 0.00 H new ATOM 0 HB3 TYR B 380 12.045 16.193 -14.785 1.00 0.00 H new ATOM 0 HD1 TYR B 380 14.159 16.608 -11.749 1.00 0.00 H new ATOM 0 HD2 TYR B 380 10.313 17.187 -13.487 1.00 0.00 H new ATOM 0 HE1 TYR B 380 13.509 18.015 -9.842 1.00 0.00 H new ATOM 0 HE2 TYR B 380 9.665 18.601 -11.586 1.00 0.00 H new ATOM 0 HH TYR B 380 10.266 19.500 -9.664 1.00 0.00 H new ATOM 1302 N ALA B 381 14.865 14.202 -12.918 1.00 0.00 N ATOM 1303 CA ALA B 381 15.931 13.846 -11.992 1.00 0.00 C ATOM 1304 C ALA B 381 16.122 14.925 -10.932 1.00 0.00 C ATOM 1305 O ALA B 381 17.005 15.775 -11.051 1.00 0.00 O ATOM 1306 CB ALA B 381 17.235 13.601 -12.736 1.00 0.00 C ATOM 0 H ALA B 381 15.188 14.589 -13.804 1.00 0.00 H new ATOM 0 HA ALA B 381 15.639 12.923 -11.491 1.00 0.00 H new ATOM 0 HB1 ALA B 381 18.016 13.337 -12.023 1.00 0.00 H new ATOM 0 HB2 ALA B 381 17.101 12.785 -13.447 1.00 0.00 H new ATOM 0 HB3 ALA B 381 17.524 14.505 -13.272 1.00 0.00 H new ATOM 1312 N SER B 382 15.290 14.883 -9.896 1.00 0.00 N ATOM 1313 CA SER B 382 15.372 15.856 -8.813 1.00 0.00 C ATOM 1314 C SER B 382 14.073 15.905 -8.018 1.00 0.00 C ATOM 1315 O SER B 382 14.081 16.172 -6.816 1.00 0.00 O ATOM 1316 CB SER B 382 15.700 17.244 -9.367 1.00 0.00 C ATOM 1317 OG SER B 382 17.091 17.509 -9.294 1.00 0.00 O ATOM 0 H SER B 382 14.553 14.187 -9.784 1.00 0.00 H new ATOM 0 HA SER B 382 16.172 15.543 -8.142 1.00 0.00 H new ATOM 0 HB2 SER B 382 15.368 17.313 -10.403 1.00 0.00 H new ATOM 0 HB3 SER B 382 15.153 18.001 -8.806 1.00 0.00 H new ATOM 0 HG SER B 382 17.582 16.820 -9.789 1.00 0.00 H new ATOM 1323 N LEU B 383 12.957 15.643 -8.690 1.00 0.00 N ATOM 1324 CA LEU B 383 11.656 15.656 -8.033 1.00 0.00 C ATOM 1325 C LEU B 383 11.662 14.733 -6.821 1.00 0.00 C ATOM 1326 O LEU B 383 11.347 15.150 -5.707 1.00 0.00 O ATOM 1327 CB LEU B 383 10.558 15.230 -9.010 1.00 0.00 C ATOM 1328 CG LEU B 383 9.222 15.955 -8.836 1.00 0.00 C ATOM 1329 CD1 LEU B 383 8.818 16.655 -10.123 1.00 0.00 C ATOM 1330 CD2 LEU B 383 8.137 14.983 -8.399 1.00 0.00 C ATOM 0 H LEU B 383 12.927 15.420 -9.685 1.00 0.00 H new ATOM 0 HA LEU B 383 11.452 16.673 -7.699 1.00 0.00 H new ATOM 0 HB2 LEU B 383 10.914 15.394 -10.027 1.00 0.00 H new ATOM 0 HB3 LEU B 383 10.390 14.159 -8.900 1.00 0.00 H new ATOM 0 HG LEU B 383 9.345 16.709 -8.058 1.00 0.00 H new ATOM 0 HD11 LEU B 383 7.865 17.164 -9.977 1.00 0.00 H new ATOM 0 HD12 LEU B 383 9.581 17.384 -10.396 1.00 0.00 H new ATOM 0 HD13 LEU B 383 8.718 15.919 -10.921 1.00 0.00 H new ATOM 0 HD21 LEU B 383 7.195 15.518 -8.281 1.00 0.00 H new ATOM 0 HD22 LEU B 383 8.020 14.205 -9.153 1.00 0.00 H new ATOM 0 HD23 LEU B 383 8.417 14.528 -7.449 1.00 0.00 H new ATOM 1342 N ARG B 384 12.026 13.475 -7.048 1.00 0.00 N ATOM 1343 CA ARG B 384 12.079 12.485 -5.977 1.00 0.00 C ATOM 1344 C ARG B 384 10.682 12.004 -5.593 1.00 0.00 C ATOM 1345 O ARG B 384 10.359 11.914 -4.409 1.00 0.00 O ATOM 1346 CB ARG B 384 12.780 13.067 -4.748 1.00 0.00 C ATOM 1347 CG ARG B 384 13.257 12.014 -3.760 1.00 0.00 C ATOM 1348 CD ARG B 384 14.765 11.829 -3.825 1.00 0.00 C ATOM 1349 NE ARG B 384 15.214 10.701 -3.013 1.00 0.00 N ATOM 1350 CZ ARG B 384 16.432 10.174 -3.088 1.00 0.00 C ATOM 1351 NH1 ARG B 384 17.323 10.672 -3.935 1.00 0.00 N ATOM 1352 NH2 ARG B 384 16.761 9.147 -2.316 1.00 0.00 N ATOM 0 H ARG B 384 12.289 13.116 -7.966 1.00 0.00 H new ATOM 0 HA ARG B 384 12.646 11.630 -6.346 1.00 0.00 H new ATOM 0 HB2 ARG B 384 13.635 13.659 -5.075 1.00 0.00 H new ATOM 0 HB3 ARG B 384 12.097 13.747 -4.239 1.00 0.00 H new ATOM 0 HG2 ARG B 384 12.969 12.305 -2.750 1.00 0.00 H new ATOM 0 HG3 ARG B 384 12.764 11.065 -3.972 1.00 0.00 H new ATOM 0 HD2 ARG B 384 15.067 11.673 -4.861 1.00 0.00 H new ATOM 0 HD3 ARG B 384 15.257 12.740 -3.484 1.00 0.00 H new ATOM 0 HE ARG B 384 14.555 10.294 -2.350 1.00 0.00 H new ATOM 0 HH11 ARG B 384 17.074 11.461 -4.531 1.00 0.00 H new ATOM 0 HH12 ARG B 384 18.257 10.265 -3.990 1.00 0.00 H new ATOM 0 HH21 ARG B 384 16.079 8.760 -1.664 1.00 0.00 H new ATOM 0 HH22 ARG B 384 17.696 8.744 -2.375 1.00 0.00 H new ATOM 1366 N LEU B 385 9.856 11.688 -6.591 1.00 0.00 N ATOM 1367 CA LEU B 385 8.506 11.209 -6.327 1.00 0.00 C ATOM 1368 C LEU B 385 8.515 10.284 -5.122 1.00 0.00 C ATOM 1369 O LEU B 385 9.449 9.504 -4.937 1.00 0.00 O ATOM 1370 CB LEU B 385 7.936 10.485 -7.546 1.00 0.00 C ATOM 1371 CG LEU B 385 6.851 11.253 -8.300 1.00 0.00 C ATOM 1372 CD1 LEU B 385 6.490 10.530 -9.585 1.00 0.00 C ATOM 1373 CD2 LEU B 385 5.616 11.430 -7.429 1.00 0.00 C ATOM 0 H LEU B 385 10.098 11.755 -7.580 1.00 0.00 H new ATOM 0 HA LEU B 385 7.869 12.068 -6.115 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.752 10.266 -8.235 1.00 0.00 H new ATOM 0 HB3 LEU B 385 7.526 9.528 -7.223 1.00 0.00 H new ATOM 0 HG LEU B 385 7.240 12.240 -8.551 1.00 0.00 H new ATOM 0 HD11 LEU B 385 5.716 11.088 -10.112 1.00 0.00 H new ATOM 0 HD12 LEU B 385 7.374 10.450 -10.218 1.00 0.00 H new ATOM 0 HD13 LEU B 385 6.121 9.532 -9.349 1.00 0.00 H new ATOM 0 HD21 LEU B 385 4.855 11.979 -7.984 1.00 0.00 H new ATOM 0 HD22 LEU B 385 5.225 10.452 -7.148 1.00 0.00 H new ATOM 0 HD23 LEU B 385 5.882 11.986 -6.530 1.00 0.00 H new ATOM 1385 N HIS B 386 7.499 10.397 -4.280 1.00 0.00 N ATOM 1386 CA HIS B 386 7.445 9.581 -3.072 1.00 0.00 C ATOM 1387 C HIS B 386 6.047 9.069 -2.727 1.00 0.00 C ATOM 1388 O HIS B 386 5.317 9.701 -1.959 1.00 0.00 O ATOM 1389 CB HIS B 386 7.992 10.376 -1.887 1.00 0.00 C ATOM 1390 CG HIS B 386 8.985 9.617 -1.069 1.00 0.00 C ATOM 1391 ND1 HIS B 386 10.166 10.167 -0.619 1.00 0.00 N ATOM 1392 CD2 HIS B 386 8.971 8.340 -0.618 1.00 0.00 C ATOM 1393 CE1 HIS B 386 10.834 9.263 0.073 1.00 0.00 C ATOM 1394 NE2 HIS B 386 10.131 8.146 0.089 1.00 0.00 N ATOM 0 H HIS B 386 6.712 11.034 -4.405 1.00 0.00 H new ATOM 0 HA HIS B 386 8.058 8.703 -3.276 1.00 0.00 H new ATOM 0 HB2 HIS B 386 8.459 11.289 -2.256 1.00 0.00 H new ATOM 0 HB3 HIS B 386 7.162 10.679 -1.248 1.00 0.00 H new ATOM 0 HD2 HIS B 386 8.192 7.610 -0.784 1.00 0.00 H new ATOM 0 HE1 HIS B 386 11.793 9.412 0.546 1.00 0.00 H new ATOM 0 HE2 HIS B 386 10.405 7.279 0.552 1.00 0.00 H new ATOM 1403 N TYR B 387 5.696 7.901 -3.256 1.00 0.00 N ATOM 1404 CA TYR B 387 4.409 7.286 -2.952 1.00 0.00 C ATOM 1405 C TYR B 387 4.549 6.351 -1.760 1.00 0.00 C ATOM 1406 O TYR B 387 5.356 5.421 -1.782 1.00 0.00 O ATOM 1407 CB TYR B 387 3.878 6.509 -4.150 1.00 0.00 C ATOM 1408 CG TYR B 387 3.267 7.406 -5.183 1.00 0.00 C ATOM 1409 CD1 TYR B 387 4.073 8.132 -6.038 1.00 0.00 C ATOM 1410 CD2 TYR B 387 1.890 7.544 -5.292 1.00 0.00 C ATOM 1411 CE1 TYR B 387 3.534 8.972 -6.979 1.00 0.00 C ATOM 1412 CE2 TYR B 387 1.335 8.388 -6.230 1.00 0.00 C ATOM 1413 CZ TYR B 387 2.161 9.102 -7.075 1.00 0.00 C ATOM 1414 OH TYR B 387 1.617 9.947 -8.014 1.00 0.00 O ATOM 0 H TYR B 387 6.282 7.363 -3.895 1.00 0.00 H new ATOM 0 HA TYR B 387 3.702 8.080 -2.713 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.691 5.940 -4.601 1.00 0.00 H new ATOM 0 HB3 TYR B 387 3.134 5.788 -3.812 1.00 0.00 H new ATOM 0 HD1 TYR B 387 5.146 8.037 -5.964 1.00 0.00 H new ATOM 0 HD2 TYR B 387 1.245 6.982 -4.633 1.00 0.00 H new ATOM 0 HE1 TYR B 387 4.179 9.529 -7.642 1.00 0.00 H new ATOM 0 HE2 TYR B 387 0.262 8.490 -6.303 1.00 0.00 H new ATOM 0 HH TYR B 387 0.787 10.333 -7.665 1.00 0.00 H new ATOM 1424 N VAL B 388 3.764 6.599 -0.722 1.00 0.00 N ATOM 1425 CA VAL B 388 3.806 5.771 0.475 1.00 0.00 C ATOM 1426 C VAL B 388 2.485 5.035 0.658 1.00 0.00 C ATOM 1427 O VAL B 388 1.434 5.655 0.822 1.00 0.00 O ATOM 1428 CB VAL B 388 4.110 6.607 1.740 1.00 0.00 C ATOM 1429 CG1 VAL B 388 5.283 6.013 2.505 1.00 0.00 C ATOM 1430 CG2 VAL B 388 4.389 8.059 1.378 1.00 0.00 C ATOM 0 H VAL B 388 3.092 7.365 -0.684 1.00 0.00 H new ATOM 0 HA VAL B 388 4.612 5.050 0.341 1.00 0.00 H new ATOM 0 HB VAL B 388 3.230 6.581 2.382 1.00 0.00 H new ATOM 0 HG11 VAL B 388 5.482 6.615 3.392 1.00 0.00 H new ATOM 0 HG12 VAL B 388 5.043 4.993 2.805 1.00 0.00 H new ATOM 0 HG13 VAL B 388 6.167 6.004 1.867 1.00 0.00 H new ATOM 0 HG21 VAL B 388 4.600 8.626 2.285 1.00 0.00 H new ATOM 0 HG22 VAL B 388 5.249 8.109 0.711 1.00 0.00 H new ATOM 0 HG23 VAL B 388 3.518 8.483 0.879 1.00 0.00 H new ATOM 1440 N THR B 389 2.545 3.709 0.628 1.00 0.00 N ATOM 1441 CA THR B 389 1.352 2.893 0.792 1.00 0.00 C ATOM 1442 C THR B 389 1.035 2.697 2.265 1.00 0.00 C ATOM 1443 O THR B 389 1.754 1.996 2.977 1.00 0.00 O ATOM 1444 CB THR B 389 1.506 1.514 0.123 1.00 0.00 C ATOM 1445 OG1 THR B 389 1.428 1.613 -1.304 1.00 0.00 O ATOM 1446 CG2 THR B 389 0.423 0.553 0.602 1.00 0.00 C ATOM 0 H THR B 389 3.406 3.179 0.492 1.00 0.00 H new ATOM 0 HA THR B 389 0.534 3.425 0.306 1.00 0.00 H new ATOM 0 HB THR B 389 2.488 1.134 0.404 1.00 0.00 H new ATOM 0 HG1 THR B 389 1.531 0.722 -1.700 1.00 0.00 H new ATOM 0 HG21 THR B 389 0.553 -0.414 0.115 1.00 0.00 H new ATOM 0 HG22 THR B 389 0.499 0.429 1.682 1.00 0.00 H new ATOM 0 HG23 THR B 389 -0.558 0.956 0.351 1.00 0.00 H new ATOM 1454 N VAL B 390 -0.044 3.316 2.716 1.00 0.00 N ATOM 1455 CA VAL B 390 -0.450 3.202 4.105 1.00 0.00 C ATOM 1456 C VAL B 390 -1.797 2.506 4.228 1.00 0.00 C ATOM 1457 O VAL B 390 -2.644 2.598 3.337 1.00 0.00 O ATOM 1458 CB VAL B 390 -0.524 4.581 4.788 1.00 0.00 C ATOM 1459 CG1 VAL B 390 0.848 5.234 4.805 1.00 0.00 C ATOM 1460 CG2 VAL B 390 -1.537 5.474 4.092 1.00 0.00 C ATOM 0 H VAL B 390 -0.652 3.900 2.142 1.00 0.00 H new ATOM 0 HA VAL B 390 0.309 2.603 4.607 1.00 0.00 H new ATOM 0 HB VAL B 390 -0.853 4.439 5.818 1.00 0.00 H new ATOM 0 HG11 VAL B 390 0.782 6.208 5.290 1.00 0.00 H new ATOM 0 HG12 VAL B 390 1.545 4.601 5.354 1.00 0.00 H new ATOM 0 HG13 VAL B 390 1.203 5.362 3.782 1.00 0.00 H new ATOM 0 HG21 VAL B 390 -1.572 6.442 4.591 1.00 0.00 H new ATOM 0 HG22 VAL B 390 -1.245 5.613 3.051 1.00 0.00 H new ATOM 0 HG23 VAL B 390 -2.522 5.008 4.134 1.00 0.00 H new ATOM 1470 N LYS B 391 -1.981 1.810 5.343 1.00 0.00 N ATOM 1471 CA LYS B 391 -3.217 1.090 5.611 1.00 0.00 C ATOM 1472 C LYS B 391 -3.159 -0.325 5.051 1.00 0.00 C ATOM 1473 O LYS B 391 -3.993 -0.710 4.230 1.00 0.00 O ATOM 1474 CB LYS B 391 -4.404 1.843 5.017 1.00 0.00 C ATOM 1475 CG LYS B 391 -5.652 1.800 5.881 1.00 0.00 C ATOM 1476 CD LYS B 391 -5.894 0.408 6.440 1.00 0.00 C ATOM 1477 CE LYS B 391 -7.054 0.397 7.421 1.00 0.00 C ATOM 1478 NZ LYS B 391 -6.655 -0.150 8.747 1.00 0.00 N ATOM 0 H LYS B 391 -1.282 1.730 6.082 1.00 0.00 H new ATOM 0 HA LYS B 391 -3.343 1.022 6.692 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -4.120 2.883 4.858 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -4.636 1.423 4.039 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -5.552 2.511 6.702 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -6.515 2.112 5.292 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -6.101 -0.283 5.623 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -4.992 0.052 6.938 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -7.433 1.411 7.546 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -7.869 -0.200 7.012 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -7.474 -0.140 9.387 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -6.317 -1.127 8.632 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -5.895 0.435 9.149 1.00 0.00 H new ATOM 1492 N LYS B 392 -2.176 -1.101 5.503 1.00 0.00 N ATOM 1493 CA LYS B 392 -2.028 -2.477 5.046 1.00 0.00 C ATOM 1494 C LYS B 392 -3.402 -3.118 4.882 1.00 0.00 C ATOM 1495 O LYS B 392 -4.316 -2.845 5.659 1.00 0.00 O ATOM 1496 CB LYS B 392 -1.179 -3.280 6.033 1.00 0.00 C ATOM 1497 CG LYS B 392 0.288 -3.365 5.638 1.00 0.00 C ATOM 1498 CD LYS B 392 1.203 -3.016 6.802 1.00 0.00 C ATOM 1499 CE LYS B 392 1.920 -1.695 6.570 1.00 0.00 C ATOM 1500 NZ LYS B 392 3.398 -1.834 6.701 1.00 0.00 N ATOM 0 H LYS B 392 -1.475 -0.801 6.181 1.00 0.00 H new ATOM 0 HA LYS B 392 -1.521 -2.476 4.081 1.00 0.00 H new ATOM 0 HB2 LYS B 392 -1.256 -2.825 7.021 1.00 0.00 H new ATOM 0 HB3 LYS B 392 -1.585 -4.288 6.114 1.00 0.00 H new ATOM 0 HG2 LYS B 392 0.513 -4.372 5.287 1.00 0.00 H new ATOM 0 HG3 LYS B 392 0.481 -2.687 4.807 1.00 0.00 H new ATOM 0 HD2 LYS B 392 0.619 -2.958 7.721 1.00 0.00 H new ATOM 0 HD3 LYS B 392 1.937 -3.810 6.940 1.00 0.00 H new ATOM 0 HE2 LYS B 392 1.677 -1.320 5.576 1.00 0.00 H new ATOM 0 HE3 LYS B 392 1.560 -0.956 7.286 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 3.849 -0.912 6.536 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 3.632 -2.167 7.658 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 3.746 -2.520 6.001 1.00 0.00 H new ATOM 1514 N PRO B 393 -3.577 -3.964 3.855 1.00 0.00 N ATOM 1515 CA PRO B 393 -4.858 -4.615 3.593 1.00 0.00 C ATOM 1516 C PRO B 393 -5.200 -5.687 4.615 1.00 0.00 C ATOM 1517 O PRO B 393 -4.330 -6.216 5.306 1.00 0.00 O ATOM 1518 CB PRO B 393 -4.692 -5.248 2.211 1.00 0.00 C ATOM 1519 CG PRO B 393 -3.388 -4.744 1.677 1.00 0.00 C ATOM 1520 CD PRO B 393 -2.562 -4.339 2.865 1.00 0.00 C ATOM 0 HA PRO B 393 -5.673 -3.893 3.649 1.00 0.00 H new ATOM 0 HB2 PRO B 393 -4.691 -6.336 2.278 1.00 0.00 H new ATOM 0 HB3 PRO B 393 -5.516 -4.970 1.554 1.00 0.00 H new ATOM 0 HG2 PRO B 393 -2.882 -5.517 1.099 1.00 0.00 H new ATOM 0 HG3 PRO B 393 -3.545 -3.898 1.008 1.00 0.00 H new ATOM 0 HD2 PRO B 393 -1.935 -5.157 3.219 1.00 0.00 H new ATOM 0 HD3 PRO B 393 -1.898 -3.507 2.631 1.00 0.00 H new ATOM 1528 N THR B 394 -6.485 -5.988 4.696 1.00 0.00 N ATOM 1529 CA THR B 394 -6.986 -6.989 5.629 1.00 0.00 C ATOM 1530 C THR B 394 -7.886 -8.000 4.928 1.00 0.00 C ATOM 1531 O THR B 394 -8.407 -7.737 3.845 1.00 0.00 O ATOM 1532 CB THR B 394 -7.775 -6.331 6.777 1.00 0.00 C ATOM 1533 OG1 THR B 394 -8.792 -5.453 6.276 1.00 0.00 O ATOM 1534 CG2 THR B 394 -6.850 -5.529 7.678 1.00 0.00 C ATOM 0 H THR B 394 -7.207 -5.551 4.123 1.00 0.00 H new ATOM 0 HA THR B 394 -6.117 -7.506 6.036 1.00 0.00 H new ATOM 0 HB THR B 394 -8.240 -7.137 7.344 1.00 0.00 H new ATOM 0 HG1 THR B 394 -9.277 -5.052 7.027 1.00 0.00 H new ATOM 0 HG21 THR B 394 -7.429 -5.074 8.481 1.00 0.00 H new ATOM 0 HG22 THR B 394 -6.095 -6.189 8.104 1.00 0.00 H new ATOM 0 HG23 THR B 394 -6.362 -4.748 7.095 1.00 0.00 H new ATOM 1542 N ALA B 395 -8.079 -9.153 5.565 1.00 0.00 N ATOM 1543 CA ALA B 395 -8.930 -10.198 5.009 1.00 0.00 C ATOM 1544 C ALA B 395 -10.390 -9.956 5.383 1.00 0.00 C ATOM 1545 O ALA B 395 -11.241 -10.831 5.221 1.00 0.00 O ATOM 1546 CB ALA B 395 -8.488 -11.573 5.474 1.00 0.00 C ATOM 0 H ALA B 395 -7.658 -9.385 6.464 1.00 0.00 H new ATOM 0 HA ALA B 395 -8.835 -10.162 3.924 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -9.142 -12.331 5.043 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -7.462 -11.753 5.153 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -8.542 -11.624 6.561 1.00 0.00 H new ATOM 1552 N VAL B 396 -10.669 -8.748 5.858 1.00 0.00 N ATOM 1553 CA VAL B 396 -12.019 -8.350 6.225 1.00 0.00 C ATOM 1554 C VAL B 396 -12.299 -6.940 5.720 1.00 0.00 C ATOM 1555 O VAL B 396 -13.310 -6.326 6.063 1.00 0.00 O ATOM 1556 CB VAL B 396 -12.236 -8.404 7.750 1.00 0.00 C ATOM 1557 CG1 VAL B 396 -11.747 -9.729 8.310 1.00 0.00 C ATOM 1558 CG2 VAL B 396 -11.538 -7.237 8.431 1.00 0.00 C ATOM 0 H VAL B 396 -9.968 -8.021 5.999 1.00 0.00 H new ATOM 0 HA VAL B 396 -12.709 -9.055 5.761 1.00 0.00 H new ATOM 0 HB VAL B 396 -13.304 -8.323 7.951 1.00 0.00 H new ATOM 0 HG11 VAL B 396 -11.908 -9.750 9.388 1.00 0.00 H new ATOM 0 HG12 VAL B 396 -12.298 -10.546 7.845 1.00 0.00 H new ATOM 0 HG13 VAL B 396 -10.684 -9.843 8.100 1.00 0.00 H new ATOM 0 HG21 VAL B 396 -11.703 -7.292 9.507 1.00 0.00 H new ATOM 0 HG22 VAL B 396 -10.469 -7.282 8.225 1.00 0.00 H new ATOM 0 HG23 VAL B 396 -11.942 -6.299 8.050 1.00 0.00 H new ATOM 1568 N ASP B 397 -11.377 -6.439 4.906 1.00 0.00 N ATOM 1569 CA ASP B 397 -11.474 -5.103 4.337 1.00 0.00 C ATOM 1570 C ASP B 397 -10.148 -4.722 3.684 1.00 0.00 C ATOM 1571 O ASP B 397 -9.484 -3.774 4.102 1.00 0.00 O ATOM 1572 CB ASP B 397 -11.844 -4.086 5.418 1.00 0.00 C ATOM 1573 CG ASP B 397 -13.077 -3.280 5.057 1.00 0.00 C ATOM 1574 OD1 ASP B 397 -13.775 -3.662 4.094 1.00 0.00 O ATOM 1575 OD2 ASP B 397 -13.346 -2.268 5.737 1.00 0.00 O ATOM 0 H ASP B 397 -10.541 -6.950 4.623 1.00 0.00 H new ATOM 0 HA ASP B 397 -12.258 -5.099 3.580 1.00 0.00 H new ATOM 0 HB2 ASP B 397 -12.017 -4.607 6.359 1.00 0.00 H new ATOM 0 HB3 ASP B 397 -11.005 -3.409 5.578 1.00 0.00 H new ATOM 1580 N PRO B 398 -9.752 -5.473 2.646 1.00 0.00 N ATOM 1581 CA PRO B 398 -8.507 -5.248 1.909 1.00 0.00 C ATOM 1582 C PRO B 398 -8.243 -3.773 1.645 1.00 0.00 C ATOM 1583 O PRO B 398 -7.096 -3.325 1.645 1.00 0.00 O ATOM 1584 CB PRO B 398 -8.731 -5.995 0.583 1.00 0.00 C ATOM 1585 CG PRO B 398 -10.125 -6.542 0.642 1.00 0.00 C ATOM 1586 CD PRO B 398 -10.488 -6.609 2.096 1.00 0.00 C ATOM 0 HA PRO B 398 -7.640 -5.596 2.470 1.00 0.00 H new ATOM 0 HB2 PRO B 398 -8.612 -5.323 -0.267 1.00 0.00 H new ATOM 0 HB3 PRO B 398 -8.003 -6.797 0.460 1.00 0.00 H new ATOM 0 HG2 PRO B 398 -10.818 -5.901 0.097 1.00 0.00 H new ATOM 0 HG3 PRO B 398 -10.175 -7.529 0.182 1.00 0.00 H new ATOM 0 HD2 PRO B 398 -11.562 -6.514 2.253 1.00 0.00 H new ATOM 0 HD3 PRO B 398 -10.182 -7.552 2.550 1.00 0.00 H new ATOM 1594 N ASN B 399 -9.316 -3.034 1.402 1.00 0.00 N ATOM 1595 CA ASN B 399 -9.236 -1.608 1.108 1.00 0.00 C ATOM 1596 C ASN B 399 -8.029 -0.954 1.771 1.00 0.00 C ATOM 1597 O ASN B 399 -7.884 -0.977 2.993 1.00 0.00 O ATOM 1598 CB ASN B 399 -10.521 -0.904 1.545 1.00 0.00 C ATOM 1599 CG ASN B 399 -10.795 -1.067 3.024 1.00 0.00 C ATOM 1600 OD1 ASN B 399 -11.660 -1.844 3.428 1.00 0.00 O ATOM 1601 ND2 ASN B 399 -10.055 -0.332 3.842 1.00 0.00 N ATOM 0 H ASN B 399 -10.266 -3.404 1.403 1.00 0.00 H new ATOM 0 HA ASN B 399 -9.115 -1.505 0.030 1.00 0.00 H new ATOM 0 HB2 ASN B 399 -10.450 0.157 1.307 1.00 0.00 H new ATOM 0 HB3 ASN B 399 -11.361 -1.303 0.977 1.00 0.00 H new ATOM 0 HD21 ASN B 399 -10.191 -0.398 4.851 1.00 0.00 H new ATOM 0 HD22 ASN B 399 -9.349 0.299 3.463 1.00 0.00 H new ATOM 1608 N SER B 400 -7.170 -0.365 0.947 1.00 0.00 N ATOM 1609 CA SER B 400 -5.973 0.312 1.433 1.00 0.00 C ATOM 1610 C SER B 400 -5.859 1.694 0.797 1.00 0.00 C ATOM 1611 O SER B 400 -6.506 1.976 -0.211 1.00 0.00 O ATOM 1612 CB SER B 400 -4.724 -0.513 1.120 1.00 0.00 C ATOM 1613 OG SER B 400 -3.595 0.323 0.928 1.00 0.00 O ATOM 0 H SER B 400 -7.281 -0.343 -0.067 1.00 0.00 H new ATOM 0 HA SER B 400 -6.053 0.423 2.514 1.00 0.00 H new ATOM 0 HB2 SER B 400 -4.530 -1.209 1.936 1.00 0.00 H new ATOM 0 HB3 SER B 400 -4.894 -1.111 0.225 1.00 0.00 H new ATOM 0 HG SER B 400 -2.809 -0.229 0.731 1.00 0.00 H new ATOM 1619 N ILE B 401 -5.045 2.555 1.393 1.00 0.00 N ATOM 1620 CA ILE B 401 -4.868 3.904 0.882 1.00 0.00 C ATOM 1621 C ILE B 401 -3.408 4.177 0.513 1.00 0.00 C ATOM 1622 O ILE B 401 -2.494 3.534 1.028 1.00 0.00 O ATOM 1623 CB ILE B 401 -5.356 4.938 1.911 1.00 0.00 C ATOM 1624 CG1 ILE B 401 -5.194 6.356 1.369 1.00 0.00 C ATOM 1625 CG2 ILE B 401 -4.612 4.774 3.225 1.00 0.00 C ATOM 1626 CD1 ILE B 401 -3.828 6.944 1.633 1.00 0.00 C ATOM 0 H ILE B 401 -4.499 2.343 2.228 1.00 0.00 H new ATOM 0 HA ILE B 401 -5.467 3.994 -0.024 1.00 0.00 H new ATOM 0 HB ILE B 401 -6.416 4.765 2.095 1.00 0.00 H new ATOM 0 HG12 ILE B 401 -5.378 6.350 0.295 1.00 0.00 H new ATOM 0 HG13 ILE B 401 -5.951 6.998 1.819 1.00 0.00 H new ATOM 0 HG21 ILE B 401 -4.970 5.514 3.941 1.00 0.00 H new ATOM 0 HG22 ILE B 401 -4.787 3.773 3.620 1.00 0.00 H new ATOM 0 HG23 ILE B 401 -3.544 4.917 3.059 1.00 0.00 H new ATOM 0 HD11 ILE B 401 -3.780 7.952 1.222 1.00 0.00 H new ATOM 0 HD12 ILE B 401 -3.649 6.981 2.708 1.00 0.00 H new ATOM 0 HD13 ILE B 401 -3.067 6.323 1.160 1.00 0.00 H new ATOM 1638 N VAL B 402 -3.201 5.134 -0.392 1.00 0.00 N ATOM 1639 CA VAL B 402 -1.861 5.499 -0.849 1.00 0.00 C ATOM 1640 C VAL B 402 -1.624 6.996 -0.692 1.00 0.00 C ATOM 1641 O VAL B 402 -2.510 7.801 -0.978 1.00 0.00 O ATOM 1642 CB VAL B 402 -1.648 5.127 -2.334 1.00 0.00 C ATOM 1643 CG1 VAL B 402 -0.278 4.505 -2.546 1.00 0.00 C ATOM 1644 CG2 VAL B 402 -2.745 4.190 -2.821 1.00 0.00 C ATOM 0 H VAL B 402 -3.950 5.673 -0.825 1.00 0.00 H new ATOM 0 HA VAL B 402 -1.156 4.942 -0.232 1.00 0.00 H new ATOM 0 HB VAL B 402 -1.699 6.044 -2.921 1.00 0.00 H new ATOM 0 HG11 VAL B 402 -0.152 4.252 -3.599 1.00 0.00 H new ATOM 0 HG12 VAL B 402 0.494 5.215 -2.249 1.00 0.00 H new ATOM 0 HG13 VAL B 402 -0.191 3.601 -1.943 1.00 0.00 H new ATOM 0 HG21 VAL B 402 -2.574 3.942 -3.869 1.00 0.00 H new ATOM 0 HG22 VAL B 402 -2.734 3.277 -2.226 1.00 0.00 H new ATOM 0 HG23 VAL B 402 -3.714 4.679 -2.718 1.00 0.00 H new ATOM 1654 N GLU B 403 -0.425 7.372 -0.262 1.00 0.00 N ATOM 1655 CA GLU B 403 -0.086 8.780 -0.096 1.00 0.00 C ATOM 1656 C GLU B 403 0.772 9.261 -1.256 1.00 0.00 C ATOM 1657 O GLU B 403 1.873 8.758 -1.480 1.00 0.00 O ATOM 1658 CB GLU B 403 0.654 8.997 1.226 1.00 0.00 C ATOM 1659 CG GLU B 403 -0.261 9.377 2.380 1.00 0.00 C ATOM 1660 CD GLU B 403 0.483 10.052 3.515 1.00 0.00 C ATOM 1661 OE1 GLU B 403 1.355 10.901 3.234 1.00 0.00 O ATOM 1662 OE2 GLU B 403 0.190 9.734 4.687 1.00 0.00 O ATOM 0 H GLU B 403 0.326 6.724 -0.023 1.00 0.00 H new ATOM 0 HA GLU B 403 -1.011 9.356 -0.081 1.00 0.00 H new ATOM 0 HB2 GLU B 403 1.193 8.086 1.485 1.00 0.00 H new ATOM 0 HB3 GLU B 403 1.400 9.781 1.091 1.00 0.00 H new ATOM 0 HG2 GLU B 403 -1.042 10.044 2.015 1.00 0.00 H new ATOM 0 HG3 GLU B 403 -0.756 8.482 2.756 1.00 0.00 H new ATOM 1669 N CYS B 404 0.267 10.252 -1.975 1.00 0.00 N ATOM 1670 CA CYS B 404 0.992 10.827 -3.096 1.00 0.00 C ATOM 1671 C CYS B 404 1.804 12.007 -2.599 1.00 0.00 C ATOM 1672 O CYS B 404 1.282 13.113 -2.470 1.00 0.00 O ATOM 1673 CB CYS B 404 0.023 11.271 -4.195 1.00 0.00 C ATOM 1674 SG CYS B 404 0.780 11.431 -5.830 1.00 0.00 S ATOM 0 H CYS B 404 -0.645 10.675 -1.801 1.00 0.00 H new ATOM 0 HA CYS B 404 1.658 10.076 -3.522 1.00 0.00 H new ATOM 0 HB2 CYS B 404 -0.795 10.553 -4.254 1.00 0.00 H new ATOM 0 HB3 CYS B 404 -0.414 12.229 -3.914 1.00 0.00 H new ATOM 0 HG CYS B 404 1.322 10.299 -6.170 1.00 0.00 H new ATOM 1680 N ARG B 405 3.071 11.757 -2.289 1.00 0.00 N ATOM 1681 CA ARG B 405 3.939 12.802 -1.770 1.00 0.00 C ATOM 1682 C ARG B 405 5.250 12.875 -2.546 1.00 0.00 C ATOM 1683 O ARG B 405 5.616 11.942 -3.256 1.00 0.00 O ATOM 1684 CB ARG B 405 4.210 12.550 -0.286 1.00 0.00 C ATOM 1685 CG ARG B 405 5.355 13.369 0.286 1.00 0.00 C ATOM 1686 CD ARG B 405 5.404 13.263 1.801 1.00 0.00 C ATOM 1687 NE ARG B 405 5.983 11.996 2.242 1.00 0.00 N ATOM 1688 CZ ARG B 405 6.178 11.678 3.519 1.00 0.00 C ATOM 1689 NH1 ARG B 405 5.855 12.537 4.474 1.00 0.00 N ATOM 1690 NH2 ARG B 405 6.697 10.500 3.839 1.00 0.00 N ATOM 0 H ARG B 405 3.516 10.845 -2.388 1.00 0.00 H new ATOM 0 HA ARG B 405 3.434 13.761 -1.890 1.00 0.00 H new ATOM 0 HB2 ARG B 405 3.304 12.768 0.279 1.00 0.00 H new ATOM 0 HB3 ARG B 405 4.428 11.492 -0.143 1.00 0.00 H new ATOM 0 HG2 ARG B 405 6.299 13.024 -0.136 1.00 0.00 H new ATOM 0 HG3 ARG B 405 5.239 14.413 -0.004 1.00 0.00 H new ATOM 0 HD2 ARG B 405 5.990 14.089 2.204 1.00 0.00 H new ATOM 0 HD3 ARG B 405 4.396 13.361 2.204 1.00 0.00 H new ATOM 0 HE ARG B 405 6.253 11.317 1.530 1.00 0.00 H new ATOM 0 HH11 ARG B 405 5.456 13.444 4.231 1.00 0.00 H new ATOM 0 HH12 ARG B 405 6.005 12.292 5.453 1.00 0.00 H new ATOM 0 HH21 ARG B 405 6.947 9.837 3.106 1.00 0.00 H new ATOM 0 HH22 ARG B 405 6.846 10.257 4.818 1.00 0.00 H new ATOM 1704 N VAL B 406 5.944 13.999 -2.407 1.00 0.00 N ATOM 1705 CA VAL B 406 7.209 14.214 -3.092 1.00 0.00 C ATOM 1706 C VAL B 406 8.209 14.907 -2.186 1.00 0.00 C ATOM 1707 O VAL B 406 7.841 15.742 -1.358 1.00 0.00 O ATOM 1708 CB VAL B 406 7.022 15.048 -4.363 1.00 0.00 C ATOM 1709 CG1 VAL B 406 6.766 14.126 -5.531 1.00 0.00 C ATOM 1710 CG2 VAL B 406 5.887 16.046 -4.191 1.00 0.00 C ATOM 0 H VAL B 406 5.647 14.779 -1.821 1.00 0.00 H new ATOM 0 HA VAL B 406 7.592 13.231 -3.367 1.00 0.00 H new ATOM 0 HB VAL B 406 7.930 15.619 -4.557 1.00 0.00 H new ATOM 0 HG11 VAL B 406 6.632 14.716 -6.438 1.00 0.00 H new ATOM 0 HG12 VAL B 406 7.615 13.454 -5.657 1.00 0.00 H new ATOM 0 HG13 VAL B 406 5.866 13.541 -5.343 1.00 0.00 H new ATOM 0 HG21 VAL B 406 5.772 16.627 -5.106 1.00 0.00 H new ATOM 0 HG22 VAL B 406 4.961 15.511 -3.982 1.00 0.00 H new ATOM 0 HG23 VAL B 406 6.114 16.716 -3.362 1.00 0.00 H new ATOM 1720 N GLY B 407 9.476 14.540 -2.331 1.00 0.00 N ATOM 1721 CA GLY B 407 10.505 15.123 -1.497 1.00 0.00 C ATOM 1722 C GLY B 407 10.195 14.933 -0.028 1.00 0.00 C ATOM 1723 O GLY B 407 10.797 15.574 0.833 1.00 0.00 O ATOM 0 H GLY B 407 9.807 13.853 -3.008 1.00 0.00 H new ATOM 0 HA2 GLY B 407 11.467 14.666 -1.730 1.00 0.00 H new ATOM 0 HA3 GLY B 407 10.595 16.187 -1.717 1.00 0.00 H new ATOM 1727 N ASP B 408 9.240 14.049 0.257 1.00 0.00 N ATOM 1728 CA ASP B 408 8.837 13.776 1.627 1.00 0.00 C ATOM 1729 C ASP B 408 8.378 15.057 2.307 1.00 0.00 C ATOM 1730 O ASP B 408 8.404 15.164 3.533 1.00 0.00 O ATOM 1731 CB ASP B 408 9.996 13.153 2.408 1.00 0.00 C ATOM 1732 CG ASP B 408 9.552 12.548 3.725 1.00 0.00 C ATOM 1733 OD1 ASP B 408 9.501 13.287 4.731 1.00 0.00 O ATOM 1734 OD2 ASP B 408 9.255 11.336 3.752 1.00 0.00 O ATOM 0 H ASP B 408 8.733 13.512 -0.446 1.00 0.00 H new ATOM 0 HA ASP B 408 8.006 13.070 1.610 1.00 0.00 H new ATOM 0 HB2 ASP B 408 10.467 12.382 1.799 1.00 0.00 H new ATOM 0 HB3 ASP B 408 10.752 13.915 2.599 1.00 0.00 H new ATOM 1739 N GLY B 409 7.967 16.032 1.502 1.00 0.00 N ATOM 1740 CA GLY B 409 7.523 17.295 2.054 1.00 0.00 C ATOM 1741 C GLY B 409 6.308 17.876 1.350 1.00 0.00 C ATOM 1742 O GLY B 409 5.823 18.941 1.729 1.00 0.00 O ATOM 0 H GLY B 409 7.934 15.969 0.484 1.00 0.00 H new ATOM 0 HA2 GLY B 409 7.289 17.158 3.110 1.00 0.00 H new ATOM 0 HA3 GLY B 409 8.341 18.013 2.000 1.00 0.00 H new ATOM 1746 N THR B 410 5.811 17.188 0.326 1.00 0.00 N ATOM 1747 CA THR B 410 4.648 17.670 -0.414 1.00 0.00 C ATOM 1748 C THR B 410 3.732 16.526 -0.835 1.00 0.00 C ATOM 1749 O THR B 410 4.125 15.668 -1.614 1.00 0.00 O ATOM 1750 CB THR B 410 5.065 18.454 -1.672 1.00 0.00 C ATOM 1751 OG1 THR B 410 5.684 19.701 -1.332 1.00 0.00 O ATOM 1752 CG2 THR B 410 3.858 18.742 -2.554 1.00 0.00 C ATOM 0 H THR B 410 6.191 16.303 -0.008 1.00 0.00 H new ATOM 0 HA THR B 410 4.108 18.331 0.264 1.00 0.00 H new ATOM 0 HB THR B 410 5.780 17.831 -2.210 1.00 0.00 H new ATOM 0 HG1 THR B 410 5.939 20.174 -2.152 1.00 0.00 H new ATOM 0 HG21 THR B 410 4.176 19.297 -3.437 1.00 0.00 H new ATOM 0 HG22 THR B 410 3.400 17.802 -2.862 1.00 0.00 H new ATOM 0 HG23 THR B 410 3.132 19.334 -1.996 1.00 0.00 H new ATOM 1760 N VAL B 411 2.501 16.537 -0.336 1.00 0.00 N ATOM 1761 CA VAL B 411 1.525 15.509 -0.682 1.00 0.00 C ATOM 1762 C VAL B 411 0.636 15.978 -1.825 1.00 0.00 C ATOM 1763 O VAL B 411 -0.223 16.839 -1.638 1.00 0.00 O ATOM 1764 CB VAL B 411 0.634 15.150 0.521 1.00 0.00 C ATOM 1765 CG1 VAL B 411 -0.481 14.206 0.095 1.00 0.00 C ATOM 1766 CG2 VAL B 411 1.466 14.533 1.633 1.00 0.00 C ATOM 0 H VAL B 411 2.155 17.247 0.310 1.00 0.00 H new ATOM 0 HA VAL B 411 2.085 14.625 -0.986 1.00 0.00 H new ATOM 0 HB VAL B 411 0.180 16.065 0.901 1.00 0.00 H new ATOM 0 HG11 VAL B 411 -1.101 13.963 0.958 1.00 0.00 H new ATOM 0 HG12 VAL B 411 -1.093 14.687 -0.668 1.00 0.00 H new ATOM 0 HG13 VAL B 411 -0.048 13.291 -0.310 1.00 0.00 H new ATOM 0 HG21 VAL B 411 0.821 14.285 2.476 1.00 0.00 H new ATOM 0 HG22 VAL B 411 1.948 13.627 1.267 1.00 0.00 H new ATOM 0 HG23 VAL B 411 2.227 15.244 1.955 1.00 0.00 H new ATOM 1776 N LEU B 412 0.825 15.397 -3.005 1.00 0.00 N ATOM 1777 CA LEU B 412 0.010 15.757 -4.154 1.00 0.00 C ATOM 1778 C LEU B 412 -1.437 15.399 -3.871 1.00 0.00 C ATOM 1779 O LEU B 412 -2.357 16.119 -4.259 1.00 0.00 O ATOM 1780 CB LEU B 412 0.490 15.036 -5.417 1.00 0.00 C ATOM 1781 CG LEU B 412 1.964 15.243 -5.769 1.00 0.00 C ATOM 1782 CD1 LEU B 412 2.462 16.579 -5.234 1.00 0.00 C ATOM 1783 CD2 LEU B 412 2.808 14.101 -5.225 1.00 0.00 C ATOM 0 H LEU B 412 1.529 14.682 -3.188 1.00 0.00 H new ATOM 0 HA LEU B 412 0.100 16.830 -4.325 1.00 0.00 H new ATOM 0 HB2 LEU B 412 0.309 13.968 -5.296 1.00 0.00 H new ATOM 0 HB3 LEU B 412 -0.117 15.369 -6.258 1.00 0.00 H new ATOM 0 HG LEU B 412 2.058 15.253 -6.855 1.00 0.00 H new ATOM 0 HD11 LEU B 412 3.513 16.707 -5.495 1.00 0.00 H new ATOM 0 HD12 LEU B 412 1.878 17.388 -5.674 1.00 0.00 H new ATOM 0 HD13 LEU B 412 2.352 16.600 -4.150 1.00 0.00 H new ATOM 0 HD21 LEU B 412 3.854 14.265 -5.485 1.00 0.00 H new ATOM 0 HD22 LEU B 412 2.706 14.058 -4.141 1.00 0.00 H new ATOM 0 HD23 LEU B 412 2.470 13.160 -5.659 1.00 0.00 H new ATOM 1795 N GLY B 413 -1.629 14.277 -3.186 1.00 0.00 N ATOM 1796 CA GLY B 413 -2.966 13.832 -2.852 1.00 0.00 C ATOM 1797 C GLY B 413 -2.966 12.479 -2.174 1.00 0.00 C ATOM 1798 O GLY B 413 -2.107 12.195 -1.337 1.00 0.00 O ATOM 0 H GLY B 413 -0.880 13.668 -2.856 1.00 0.00 H new ATOM 0 HA2 GLY B 413 -3.438 14.565 -2.197 1.00 0.00 H new ATOM 0 HA3 GLY B 413 -3.568 13.782 -3.760 1.00 0.00 H new ATOM 1802 N THR B 414 -3.930 11.644 -2.534 1.00 0.00 N ATOM 1803 CA THR B 414 -4.045 10.314 -1.955 1.00 0.00 C ATOM 1804 C THR B 414 -5.075 9.482 -2.708 1.00 0.00 C ATOM 1805 O THR B 414 -5.834 10.008 -3.521 1.00 0.00 O ATOM 1806 CB THR B 414 -4.441 10.393 -0.474 1.00 0.00 C ATOM 1807 OG1 THR B 414 -4.729 9.098 0.064 1.00 0.00 O ATOM 1808 CG2 THR B 414 -5.666 11.271 -0.288 1.00 0.00 C ATOM 0 H THR B 414 -4.646 11.865 -3.226 1.00 0.00 H new ATOM 0 HA THR B 414 -3.069 9.836 -2.038 1.00 0.00 H new ATOM 0 HB THR B 414 -3.590 10.822 0.055 1.00 0.00 H new ATOM 0 HG1 THR B 414 -4.046 8.461 -0.233 1.00 0.00 H new ATOM 0 HG21 THR B 414 -5.927 11.312 0.769 1.00 0.00 H new ATOM 0 HG22 THR B 414 -5.450 12.277 -0.647 1.00 0.00 H new ATOM 0 HG23 THR B 414 -6.501 10.855 -0.852 1.00 0.00 H new ATOM 1816 N GLY B 415 -5.105 8.181 -2.432 1.00 0.00 N ATOM 1817 CA GLY B 415 -6.054 7.310 -3.096 1.00 0.00 C ATOM 1818 C GLY B 415 -6.278 6.016 -2.340 1.00 0.00 C ATOM 1819 O GLY B 415 -5.327 5.350 -1.938 1.00 0.00 O ATOM 0 H GLY B 415 -4.491 7.717 -1.763 1.00 0.00 H new ATOM 0 HA2 GLY B 415 -7.005 7.831 -3.208 1.00 0.00 H new ATOM 0 HA3 GLY B 415 -5.694 7.084 -4.100 1.00 0.00 H new ATOM 1823 N VAL B 416 -7.541 5.657 -2.153 1.00 0.00 N ATOM 1824 CA VAL B 416 -7.899 4.436 -1.447 1.00 0.00 C ATOM 1825 C VAL B 416 -8.684 3.509 -2.366 1.00 0.00 C ATOM 1826 O VAL B 416 -9.445 3.972 -3.217 1.00 0.00 O ATOM 1827 CB VAL B 416 -8.743 4.739 -0.192 1.00 0.00 C ATOM 1828 CG1 VAL B 416 -10.122 5.248 -0.586 1.00 0.00 C ATOM 1829 CG2 VAL B 416 -8.856 3.506 0.691 1.00 0.00 C ATOM 0 H VAL B 416 -8.339 6.199 -2.483 1.00 0.00 H new ATOM 0 HA VAL B 416 -6.973 3.952 -1.135 1.00 0.00 H new ATOM 0 HB VAL B 416 -8.240 5.520 0.379 1.00 0.00 H new ATOM 0 HG11 VAL B 416 -10.703 5.456 0.312 1.00 0.00 H new ATOM 0 HG12 VAL B 416 -10.019 6.161 -1.172 1.00 0.00 H new ATOM 0 HG13 VAL B 416 -10.633 4.491 -1.181 1.00 0.00 H new ATOM 0 HG21 VAL B 416 -9.455 3.742 1.570 1.00 0.00 H new ATOM 0 HG22 VAL B 416 -9.333 2.701 0.132 1.00 0.00 H new ATOM 0 HG23 VAL B 416 -7.861 3.190 1.004 1.00 0.00 H new ATOM 1839 N GLY B 417 -8.502 2.204 -2.204 1.00 0.00 N ATOM 1840 CA GLY B 417 -9.211 1.262 -3.047 1.00 0.00 C ATOM 1841 C GLY B 417 -9.396 -0.095 -2.394 1.00 0.00 C ATOM 1842 O GLY B 417 -8.523 -0.563 -1.665 1.00 0.00 O ATOM 0 H GLY B 417 -7.882 1.785 -1.511 1.00 0.00 H new ATOM 0 HA2 GLY B 417 -10.188 1.673 -3.300 1.00 0.00 H new ATOM 0 HA3 GLY B 417 -8.665 1.138 -3.982 1.00 0.00 H new ATOM 1846 N ARG B 418 -10.540 -0.727 -2.661 1.00 0.00 N ATOM 1847 CA ARG B 418 -10.855 -2.041 -2.094 1.00 0.00 C ATOM 1848 C ARG B 418 -9.788 -3.077 -2.443 1.00 0.00 C ATOM 1849 O ARG B 418 -9.329 -3.826 -1.580 1.00 0.00 O ATOM 1850 CB ARG B 418 -12.220 -2.520 -2.594 1.00 0.00 C ATOM 1851 CG ARG B 418 -12.394 -2.399 -4.099 1.00 0.00 C ATOM 1852 CD ARG B 418 -13.826 -2.041 -4.469 1.00 0.00 C ATOM 1853 NE ARG B 418 -14.749 -3.146 -4.233 1.00 0.00 N ATOM 1854 CZ ARG B 418 -16.072 -3.027 -4.302 1.00 0.00 C ATOM 1855 NH1 ARG B 418 -16.618 -1.857 -4.604 1.00 0.00 N ATOM 1856 NH2 ARG B 418 -16.849 -4.076 -4.073 1.00 0.00 N ATOM 0 H ARG B 418 -11.267 -0.349 -3.269 1.00 0.00 H new ATOM 0 HA ARG B 418 -10.880 -1.932 -1.010 1.00 0.00 H new ATOM 0 HB2 ARG B 418 -12.359 -3.561 -2.303 1.00 0.00 H new ATOM 0 HB3 ARG B 418 -13.002 -1.944 -2.099 1.00 0.00 H new ATOM 0 HG2 ARG B 418 -11.716 -1.637 -4.484 1.00 0.00 H new ATOM 0 HG3 ARG B 418 -12.119 -3.340 -4.575 1.00 0.00 H new ATOM 0 HD2 ARG B 418 -14.143 -1.174 -3.889 1.00 0.00 H new ATOM 0 HD3 ARG B 418 -13.867 -1.754 -5.520 1.00 0.00 H new ATOM 0 HE ARG B 418 -14.358 -4.060 -4.003 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -16.023 -1.048 -4.784 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -17.633 -1.766 -4.657 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -16.433 -4.978 -3.843 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -17.863 -3.981 -4.127 1.00 0.00 H new ATOM 1870 N ASN B 419 -9.387 -3.101 -3.707 1.00 0.00 N ATOM 1871 CA ASN B 419 -8.364 -4.028 -4.174 1.00 0.00 C ATOM 1872 C ASN B 419 -7.025 -3.302 -4.250 1.00 0.00 C ATOM 1873 O ASN B 419 -6.154 -3.655 -5.038 1.00 0.00 O ATOM 1874 CB ASN B 419 -8.781 -4.614 -5.535 1.00 0.00 C ATOM 1875 CG ASN B 419 -7.946 -4.129 -6.710 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -6.889 -4.685 -7.005 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -8.420 -3.088 -7.386 1.00 0.00 N ATOM 0 H ASN B 419 -9.757 -2.485 -4.431 1.00 0.00 H new ATOM 0 HA ASN B 419 -8.256 -4.859 -3.477 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -8.717 -5.701 -5.484 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -9.826 -4.364 -5.720 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -7.903 -2.720 -8.184 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -9.301 -2.657 -7.107 1.00 0.00 H new ATOM 1884 N ILE B 420 -6.882 -2.309 -3.378 1.00 0.00 N ATOM 1885 CA ILE B 420 -5.673 -1.486 -3.258 1.00 0.00 C ATOM 1886 C ILE B 420 -5.174 -0.898 -4.584 1.00 0.00 C ATOM 1887 O ILE B 420 -4.834 0.278 -4.635 1.00 0.00 O ATOM 1888 CB ILE B 420 -4.525 -2.232 -2.556 1.00 0.00 C ATOM 1889 CG1 ILE B 420 -3.632 -2.967 -3.561 1.00 0.00 C ATOM 1890 CG2 ILE B 420 -5.077 -3.194 -1.513 1.00 0.00 C ATOM 1891 CD1 ILE B 420 -2.642 -2.060 -4.260 1.00 0.00 C ATOM 0 H ILE B 420 -7.615 -2.045 -2.720 1.00 0.00 H new ATOM 0 HA ILE B 420 -5.987 -0.647 -2.637 1.00 0.00 H new ATOM 0 HB ILE B 420 -3.904 -1.492 -2.052 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -3.087 -3.756 -3.043 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -4.261 -3.451 -4.308 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -4.253 -3.714 -1.025 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -5.645 -2.637 -0.769 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -5.729 -3.921 -1.997 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -2.042 -2.645 -4.957 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -3.181 -1.286 -4.806 1.00 0.00 H new ATOM 0 HD13 ILE B 420 -1.989 -1.595 -3.521 1.00 0.00 H new ATOM 1903 N LYS B 421 -5.112 -1.686 -5.653 1.00 0.00 N ATOM 1904 CA LYS B 421 -4.646 -1.157 -6.923 1.00 0.00 C ATOM 1905 C LYS B 421 -5.303 0.179 -7.177 1.00 0.00 C ATOM 1906 O LYS B 421 -4.626 1.193 -7.339 1.00 0.00 O ATOM 1907 CB LYS B 421 -4.939 -2.118 -8.067 1.00 0.00 C ATOM 1908 CG LYS B 421 -3.674 -2.665 -8.687 1.00 0.00 C ATOM 1909 CD LYS B 421 -2.903 -3.497 -7.681 1.00 0.00 C ATOM 1910 CE LYS B 421 -3.150 -4.980 -7.888 1.00 0.00 C ATOM 1911 NZ LYS B 421 -3.880 -5.590 -6.742 1.00 0.00 N ATOM 0 H LYS B 421 -5.373 -2.672 -5.664 1.00 0.00 H new ATOM 0 HA LYS B 421 -3.565 -1.031 -6.871 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -5.549 -2.944 -7.700 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -5.524 -1.605 -8.830 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -3.923 -3.274 -9.556 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -3.051 -1.843 -9.041 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -1.837 -3.287 -7.773 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -3.198 -3.215 -6.670 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -3.724 -5.128 -8.803 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -2.197 -5.491 -8.024 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -3.807 -6.626 -6.796 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -3.462 -5.260 -5.849 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -4.881 -5.311 -6.780 1.00 0.00 H new ATOM 1925 N ILE B 422 -6.632 0.188 -7.175 1.00 0.00 N ATOM 1926 CA ILE B 422 -7.365 1.432 -7.364 1.00 0.00 C ATOM 1927 C ILE B 422 -6.679 2.510 -6.560 1.00 0.00 C ATOM 1928 O ILE B 422 -6.626 3.665 -6.961 1.00 0.00 O ATOM 1929 CB ILE B 422 -8.834 1.360 -6.897 1.00 0.00 C ATOM 1930 CG1 ILE B 422 -9.279 -0.084 -6.699 1.00 0.00 C ATOM 1931 CG2 ILE B 422 -9.736 2.081 -7.883 1.00 0.00 C ATOM 1932 CD1 ILE B 422 -8.756 -0.687 -5.417 1.00 0.00 C ATOM 0 H ILE B 422 -7.215 -0.639 -7.047 1.00 0.00 H new ATOM 0 HA ILE B 422 -7.371 1.639 -8.434 1.00 0.00 H new ATOM 0 HB ILE B 422 -8.911 1.860 -5.932 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -10.368 -0.127 -6.697 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -8.938 -0.684 -7.543 1.00 0.00 H new ATOM 0 HG21 ILE B 422 -10.769 2.022 -7.541 1.00 0.00 H new ATOM 0 HG22 ILE B 422 -9.436 3.127 -7.953 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -9.651 1.613 -8.864 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -9.105 -1.716 -5.330 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -7.666 -0.673 -5.426 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -9.119 -0.108 -4.568 1.00 0.00 H new ATOM 1944 N ALA B 423 -6.129 2.099 -5.421 1.00 0.00 N ATOM 1945 CA ALA B 423 -5.412 3.012 -4.553 1.00 0.00 C ATOM 1946 C ALA B 423 -4.127 3.468 -5.233 1.00 0.00 C ATOM 1947 O ALA B 423 -3.846 4.664 -5.298 1.00 0.00 O ATOM 1948 CB ALA B 423 -5.118 2.366 -3.209 1.00 0.00 C ATOM 0 H ALA B 423 -6.169 1.138 -5.082 1.00 0.00 H new ATOM 0 HA ALA B 423 -6.038 3.885 -4.367 1.00 0.00 H new ATOM 0 HB1 ALA B 423 -4.579 3.071 -2.576 1.00 0.00 H new ATOM 0 HB2 ALA B 423 -6.055 2.088 -2.726 1.00 0.00 H new ATOM 0 HB3 ALA B 423 -4.508 1.475 -3.359 1.00 0.00 H new ATOM 1954 N GLY B 424 -3.356 2.515 -5.766 1.00 0.00 N ATOM 1955 CA GLY B 424 -2.131 2.877 -6.452 1.00 0.00 C ATOM 1956 C GLY B 424 -2.410 3.769 -7.646 1.00 0.00 C ATOM 1957 O GLY B 424 -1.926 4.903 -7.720 1.00 0.00 O ATOM 0 H GLY B 424 -3.558 1.516 -5.734 1.00 0.00 H new ATOM 0 HA2 GLY B 424 -1.463 3.390 -5.761 1.00 0.00 H new ATOM 0 HA3 GLY B 424 -1.616 1.975 -6.782 1.00 0.00 H new ATOM 1961 N ILE B 425 -3.213 3.259 -8.574 1.00 0.00 N ATOM 1962 CA ILE B 425 -3.580 4.013 -9.764 1.00 0.00 C ATOM 1963 C ILE B 425 -4.217 5.343 -9.378 1.00 0.00 C ATOM 1964 O ILE B 425 -3.961 6.372 -10.002 1.00 0.00 O ATOM 1965 CB ILE B 425 -4.562 3.222 -10.650 1.00 0.00 C ATOM 1966 CG1 ILE B 425 -3.870 1.999 -11.260 1.00 0.00 C ATOM 1967 CG2 ILE B 425 -5.125 4.118 -11.742 1.00 0.00 C ATOM 1968 CD1 ILE B 425 -3.695 0.854 -10.286 1.00 0.00 C ATOM 0 H ILE B 425 -3.622 2.326 -8.523 1.00 0.00 H new ATOM 0 HA ILE B 425 -2.665 4.194 -10.329 1.00 0.00 H new ATOM 0 HB ILE B 425 -5.387 2.873 -10.029 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -4.450 1.652 -12.115 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -2.892 2.296 -11.638 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -5.817 3.547 -12.361 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -5.652 4.957 -11.288 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -4.310 4.493 -12.361 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -3.198 0.023 -10.787 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -3.089 1.184 -9.442 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -4.672 0.530 -9.927 1.00 0.00 H new ATOM 1980 N ARG B 426 -5.044 5.312 -8.334 1.00 0.00 N ATOM 1981 CA ARG B 426 -5.713 6.514 -7.850 1.00 0.00 C ATOM 1982 C ARG B 426 -4.688 7.539 -7.384 1.00 0.00 C ATOM 1983 O ARG B 426 -4.707 8.690 -7.821 1.00 0.00 O ATOM 1984 CB ARG B 426 -6.675 6.174 -6.710 1.00 0.00 C ATOM 1985 CG ARG B 426 -7.163 7.390 -5.941 1.00 0.00 C ATOM 1986 CD ARG B 426 -8.147 8.210 -6.758 1.00 0.00 C ATOM 1987 NE ARG B 426 -9.006 9.035 -5.912 1.00 0.00 N ATOM 1988 CZ ARG B 426 -10.223 9.440 -6.266 1.00 0.00 C ATOM 1989 NH1 ARG B 426 -10.724 9.094 -7.445 1.00 0.00 N ATOM 1990 NH2 ARG B 426 -10.941 10.190 -5.442 1.00 0.00 N ATOM 0 H ARG B 426 -5.265 4.466 -7.808 1.00 0.00 H new ATOM 0 HA ARG B 426 -6.288 6.941 -8.672 1.00 0.00 H new ATOM 0 HB2 ARG B 426 -7.535 5.644 -7.118 1.00 0.00 H new ATOM 0 HB3 ARG B 426 -6.179 5.493 -6.019 1.00 0.00 H new ATOM 0 HG2 ARG B 426 -7.638 7.069 -5.014 1.00 0.00 H new ATOM 0 HG3 ARG B 426 -6.312 8.012 -5.664 1.00 0.00 H new ATOM 0 HD2 ARG B 426 -7.599 8.849 -7.451 1.00 0.00 H new ATOM 0 HD3 ARG B 426 -8.764 7.542 -7.360 1.00 0.00 H new ATOM 0 HE ARG B 426 -8.653 9.317 -4.998 1.00 0.00 H new ATOM 0 HH11 ARG B 426 -10.176 8.516 -8.082 1.00 0.00 H new ATOM 0 HH12 ARG B 426 -11.657 9.406 -7.714 1.00 0.00 H new ATOM 0 HH21 ARG B 426 -10.561 10.458 -4.534 1.00 0.00 H new ATOM 0 HH22 ARG B 426 -11.874 10.499 -5.716 1.00 0.00 H new ATOM 2004 N ALA B 427 -3.777 7.116 -6.508 1.00 0.00 N ATOM 2005 CA ALA B 427 -2.742 8.011 -6.019 1.00 0.00 C ATOM 2006 C ALA B 427 -2.146 8.776 -7.189 1.00 0.00 C ATOM 2007 O ALA B 427 -1.916 9.985 -7.113 1.00 0.00 O ATOM 2008 CB ALA B 427 -1.663 7.246 -5.267 1.00 0.00 C ATOM 0 H ALA B 427 -3.738 6.170 -6.129 1.00 0.00 H new ATOM 0 HA ALA B 427 -3.188 8.716 -5.317 1.00 0.00 H new ATOM 0 HB1 ALA B 427 -0.903 7.942 -4.913 1.00 0.00 H new ATOM 0 HB2 ALA B 427 -2.108 6.732 -4.415 1.00 0.00 H new ATOM 0 HB3 ALA B 427 -1.204 6.515 -5.933 1.00 0.00 H new ATOM 2014 N ALA B 428 -1.923 8.064 -8.289 1.00 0.00 N ATOM 2015 CA ALA B 428 -1.387 8.681 -9.491 1.00 0.00 C ATOM 2016 C ALA B 428 -2.338 9.769 -9.972 1.00 0.00 C ATOM 2017 O ALA B 428 -1.964 10.941 -10.085 1.00 0.00 O ATOM 2018 CB ALA B 428 -1.164 7.646 -10.582 1.00 0.00 C ATOM 0 H ALA B 428 -2.105 7.064 -8.370 1.00 0.00 H new ATOM 0 HA ALA B 428 -0.421 9.127 -9.255 1.00 0.00 H new ATOM 0 HB1 ALA B 428 -0.763 8.134 -11.470 1.00 0.00 H new ATOM 0 HB2 ALA B 428 -0.458 6.894 -10.231 1.00 0.00 H new ATOM 0 HB3 ALA B 428 -2.112 7.167 -10.828 1.00 0.00 H new ATOM 2024 N GLU B 429 -3.581 9.372 -10.242 1.00 0.00 N ATOM 2025 CA GLU B 429 -4.603 10.306 -10.693 1.00 0.00 C ATOM 2026 C GLU B 429 -4.706 11.488 -9.738 1.00 0.00 C ATOM 2027 O GLU B 429 -5.256 12.530 -10.083 1.00 0.00 O ATOM 2028 CB GLU B 429 -5.958 9.604 -10.806 1.00 0.00 C ATOM 2029 CG GLU B 429 -6.780 10.058 -12.001 1.00 0.00 C ATOM 2030 CD GLU B 429 -7.761 11.160 -11.647 1.00 0.00 C ATOM 2031 OE1 GLU B 429 -8.312 11.126 -10.527 1.00 0.00 O ATOM 2032 OE2 GLU B 429 -7.976 12.056 -12.489 1.00 0.00 O ATOM 0 H GLU B 429 -3.902 8.408 -10.155 1.00 0.00 H new ATOM 0 HA GLU B 429 -4.316 10.676 -11.677 1.00 0.00 H new ATOM 0 HB2 GLU B 429 -5.796 8.528 -10.874 1.00 0.00 H new ATOM 0 HB3 GLU B 429 -6.528 9.783 -9.894 1.00 0.00 H new ATOM 0 HG2 GLU B 429 -6.110 10.410 -12.786 1.00 0.00 H new ATOM 0 HG3 GLU B 429 -7.326 9.206 -12.407 1.00 0.00 H new ATOM 2039 N ASN B 430 -4.164 11.327 -8.535 1.00 0.00 N ATOM 2040 CA ASN B 430 -4.183 12.392 -7.545 1.00 0.00 C ATOM 2041 C ASN B 430 -3.057 13.383 -7.835 1.00 0.00 C ATOM 2042 O ASN B 430 -3.227 14.593 -7.689 1.00 0.00 O ATOM 2043 CB ASN B 430 -4.037 11.819 -6.135 1.00 0.00 C ATOM 2044 CG ASN B 430 -5.371 11.675 -5.430 1.00 0.00 C ATOM 2045 OD1 ASN B 430 -5.619 12.313 -4.406 1.00 0.00 O ATOM 2046 ND2 ASN B 430 -6.241 10.833 -5.977 1.00 0.00 N ATOM 0 H ASN B 430 -3.707 10.469 -8.225 1.00 0.00 H new ATOM 0 HA ASN B 430 -5.140 12.911 -7.603 1.00 0.00 H new ATOM 0 HB2 ASN B 430 -3.551 10.845 -6.190 1.00 0.00 H new ATOM 0 HB3 ASN B 430 -3.387 12.467 -5.548 1.00 0.00 H new ATOM 0 HD21 ASN B 430 -7.156 10.695 -5.548 1.00 0.00 H new ATOM 0 HD22 ASN B 430 -5.994 10.325 -6.826 1.00 0.00 H new ATOM 2053 N ALA B 431 -1.903 12.854 -8.245 1.00 0.00 N ATOM 2054 CA ALA B 431 -0.746 13.685 -8.553 1.00 0.00 C ATOM 2055 C ALA B 431 -1.043 14.620 -9.715 1.00 0.00 C ATOM 2056 O ALA B 431 -0.734 15.811 -9.664 1.00 0.00 O ATOM 2057 CB ALA B 431 0.471 12.827 -8.866 1.00 0.00 C ATOM 0 H ALA B 431 -1.748 11.854 -8.370 1.00 0.00 H new ATOM 0 HA ALA B 431 -0.526 14.288 -7.672 1.00 0.00 H new ATOM 0 HB1 ALA B 431 1.321 13.470 -9.093 1.00 0.00 H new ATOM 0 HB2 ALA B 431 0.708 12.203 -8.004 1.00 0.00 H new ATOM 0 HB3 ALA B 431 0.257 12.192 -9.726 1.00 0.00 H new ATOM 2063 N LEU B 432 -1.655 14.076 -10.758 1.00 0.00 N ATOM 2064 CA LEU B 432 -2.003 14.875 -11.928 1.00 0.00 C ATOM 2065 C LEU B 432 -3.323 15.608 -11.709 1.00 0.00 C ATOM 2066 O LEU B 432 -3.813 16.312 -12.592 1.00 0.00 O ATOM 2067 CB LEU B 432 -2.077 13.996 -13.177 1.00 0.00 C ATOM 2068 CG LEU B 432 -3.470 13.485 -13.554 1.00 0.00 C ATOM 2069 CD1 LEU B 432 -3.353 12.287 -14.471 1.00 0.00 C ATOM 2070 CD2 LEU B 432 -4.270 13.109 -12.321 1.00 0.00 C ATOM 0 H LEU B 432 -1.920 13.093 -10.820 1.00 0.00 H new ATOM 0 HA LEU B 432 -1.221 15.619 -12.077 1.00 0.00 H new ATOM 0 HB2 LEU B 432 -1.678 14.561 -14.019 1.00 0.00 H new ATOM 0 HB3 LEU B 432 -1.423 13.136 -13.032 1.00 0.00 H new ATOM 0 HG LEU B 432 -3.994 14.289 -14.070 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -4.349 11.931 -14.733 1.00 0.00 H new ATOM 0 HD12 LEU B 432 -2.820 12.573 -15.377 1.00 0.00 H new ATOM 0 HD13 LEU B 432 -2.806 11.493 -13.964 1.00 0.00 H new ATOM 0 HD21 LEU B 432 -5.254 12.750 -12.621 1.00 0.00 H new ATOM 0 HD22 LEU B 432 -3.748 12.323 -11.774 1.00 0.00 H new ATOM 0 HD23 LEU B 432 -4.383 13.983 -11.680 1.00 0.00 H new ATOM 2082 N ARG B 433 -3.890 15.432 -10.519 1.00 0.00 N ATOM 2083 CA ARG B 433 -5.154 16.070 -10.166 1.00 0.00 C ATOM 2084 C ARG B 433 -4.947 17.532 -9.787 1.00 0.00 C ATOM 2085 O ARG B 433 -5.876 18.199 -9.331 1.00 0.00 O ATOM 2086 CB ARG B 433 -5.821 15.335 -9.002 1.00 0.00 C ATOM 2087 CG ARG B 433 -7.337 15.435 -9.009 1.00 0.00 C ATOM 2088 CD ARG B 433 -7.947 14.749 -7.798 1.00 0.00 C ATOM 2089 NE ARG B 433 -8.651 15.691 -6.932 1.00 0.00 N ATOM 2090 CZ ARG B 433 -9.783 16.296 -7.274 1.00 0.00 C ATOM 2091 NH1 ARG B 433 -10.333 16.054 -8.456 1.00 0.00 N ATOM 2092 NH2 ARG B 433 -10.366 17.142 -6.436 1.00 0.00 N ATOM 0 H ARG B 433 -3.493 14.851 -9.781 1.00 0.00 H new ATOM 0 HA ARG B 433 -5.800 16.023 -11.043 1.00 0.00 H new ATOM 0 HB2 ARG B 433 -5.534 14.284 -9.035 1.00 0.00 H new ATOM 0 HB3 ARG B 433 -5.443 15.739 -8.063 1.00 0.00 H new ATOM 0 HG2 ARG B 433 -7.633 16.484 -9.022 1.00 0.00 H new ATOM 0 HG3 ARG B 433 -7.728 14.982 -9.920 1.00 0.00 H new ATOM 0 HD2 ARG B 433 -8.639 13.975 -8.130 1.00 0.00 H new ATOM 0 HD3 ARG B 433 -7.161 14.251 -7.229 1.00 0.00 H new ATOM 0 HE ARG B 433 -8.252 15.895 -6.016 1.00 0.00 H new ATOM 0 HH11 ARG B 433 -9.887 15.403 -9.102 1.00 0.00 H new ATOM 0 HH12 ARG B 433 -11.202 16.518 -8.719 1.00 0.00 H new ATOM 0 HH21 ARG B 433 -9.945 17.330 -5.526 1.00 0.00 H new ATOM 0 HH22 ARG B 433 -11.235 17.605 -6.701 1.00 0.00 H new ATOM 2106 N ASP B 434 -3.728 18.027 -9.968 1.00 0.00 N ATOM 2107 CA ASP B 434 -3.418 19.412 -9.632 1.00 0.00 C ATOM 2108 C ASP B 434 -2.709 20.118 -10.783 1.00 0.00 C ATOM 2109 O ASP B 434 -1.481 20.210 -10.808 1.00 0.00 O ATOM 2110 CB ASP B 434 -2.555 19.470 -8.373 1.00 0.00 C ATOM 2111 CG ASP B 434 -3.315 19.061 -7.128 1.00 0.00 C ATOM 2112 OD1 ASP B 434 -4.548 19.258 -7.093 1.00 0.00 O ATOM 2113 OD2 ASP B 434 -2.678 18.545 -6.185 1.00 0.00 O ATOM 0 H ASP B 434 -2.943 17.494 -10.343 1.00 0.00 H new ATOM 0 HA ASP B 434 -4.360 19.929 -9.447 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -1.691 18.817 -8.498 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -2.173 20.483 -8.245 1.00 0.00 H new ATOM 2118 N LYS B 435 -3.490 20.621 -11.732 1.00 0.00 N ATOM 2119 CA LYS B 435 -2.936 21.326 -12.883 1.00 0.00 C ATOM 2120 C LYS B 435 -1.912 22.365 -12.432 1.00 0.00 C ATOM 2121 O LYS B 435 -0.773 22.373 -12.896 1.00 0.00 O ATOM 2122 CB LYS B 435 -4.056 22.000 -13.688 1.00 0.00 C ATOM 2123 CG LYS B 435 -4.310 23.451 -13.303 1.00 0.00 C ATOM 2124 CD LYS B 435 -5.251 24.132 -14.279 1.00 0.00 C ATOM 2125 CE LYS B 435 -4.540 24.501 -15.571 1.00 0.00 C ATOM 2126 NZ LYS B 435 -5.428 24.345 -16.755 1.00 0.00 N ATOM 0 H LYS B 435 -4.508 20.554 -11.728 1.00 0.00 H new ATOM 0 HA LYS B 435 -2.435 20.599 -13.522 1.00 0.00 H new ATOM 0 HB2 LYS B 435 -3.805 21.955 -14.748 1.00 0.00 H new ATOM 0 HB3 LYS B 435 -4.977 21.433 -13.554 1.00 0.00 H new ATOM 0 HG2 LYS B 435 -4.733 23.493 -12.299 1.00 0.00 H new ATOM 0 HG3 LYS B 435 -3.364 23.991 -13.273 1.00 0.00 H new ATOM 0 HD2 LYS B 435 -6.089 23.471 -14.499 1.00 0.00 H new ATOM 0 HD3 LYS B 435 -5.665 25.030 -13.821 1.00 0.00 H new ATOM 0 HE2 LYS B 435 -4.191 25.532 -15.512 1.00 0.00 H new ATOM 0 HE3 LYS B 435 -3.658 23.872 -15.693 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 -4.907 24.606 -17.616 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 -5.741 23.356 -16.826 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 -6.257 24.964 -16.651 1.00 0.00 H new ATOM 2140 N LYS B 436 -2.333 23.239 -11.522 1.00 0.00 N ATOM 2141 CA LYS B 436 -1.459 24.283 -11.002 1.00 0.00 C ATOM 2142 C LYS B 436 -0.174 23.679 -10.450 1.00 0.00 C ATOM 2143 O LYS B 436 0.918 24.200 -10.680 1.00 0.00 O ATOM 2144 CB LYS B 436 -2.178 25.083 -9.915 1.00 0.00 C ATOM 2145 CG LYS B 436 -3.577 25.528 -10.314 1.00 0.00 C ATOM 2146 CD LYS B 436 -3.610 27.004 -10.675 1.00 0.00 C ATOM 2147 CE LYS B 436 -3.202 27.231 -12.120 1.00 0.00 C ATOM 2148 NZ LYS B 436 -3.745 28.511 -12.655 1.00 0.00 N ATOM 0 H LYS B 436 -3.275 23.244 -11.130 1.00 0.00 H new ATOM 0 HA LYS B 436 -1.201 24.956 -11.820 1.00 0.00 H new ATOM 0 HB2 LYS B 436 -2.242 24.477 -9.011 1.00 0.00 H new ATOM 0 HB3 LYS B 436 -1.582 25.962 -9.668 1.00 0.00 H new ATOM 0 HG2 LYS B 436 -3.920 24.937 -11.163 1.00 0.00 H new ATOM 0 HG3 LYS B 436 -4.269 25.337 -9.493 1.00 0.00 H new ATOM 0 HD2 LYS B 436 -4.614 27.397 -10.513 1.00 0.00 H new ATOM 0 HD3 LYS B 436 -2.941 27.556 -10.015 1.00 0.00 H new ATOM 0 HE2 LYS B 436 -2.115 27.239 -12.193 1.00 0.00 H new ATOM 0 HE3 LYS B 436 -3.557 26.402 -12.732 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 -3.444 28.629 -13.644 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 -4.784 28.494 -12.609 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 -3.386 29.305 -12.087 1.00 0.00 H new ATOM 2162 N MET B 437 -0.309 22.567 -9.733 1.00 0.00 N ATOM 2163 CA MET B 437 0.844 21.882 -9.164 1.00 0.00 C ATOM 2164 C MET B 437 1.656 21.230 -10.274 1.00 0.00 C ATOM 2165 O MET B 437 2.884 21.174 -10.212 1.00 0.00 O ATOM 2166 CB MET B 437 0.394 20.828 -8.154 1.00 0.00 C ATOM 2167 CG MET B 437 1.505 19.894 -7.706 1.00 0.00 C ATOM 2168 SD MET B 437 0.921 18.211 -7.436 1.00 0.00 S ATOM 2169 CE MET B 437 1.806 17.334 -8.722 1.00 0.00 C ATOM 0 H MET B 437 -1.205 22.123 -9.533 1.00 0.00 H new ATOM 0 HA MET B 437 1.467 22.612 -8.647 1.00 0.00 H new ATOM 0 HB2 MET B 437 -0.021 21.330 -7.280 1.00 0.00 H new ATOM 0 HB3 MET B 437 -0.410 20.237 -8.593 1.00 0.00 H new ATOM 0 HG2 MET B 437 2.294 19.886 -8.458 1.00 0.00 H new ATOM 0 HG3 MET B 437 1.946 20.275 -6.785 1.00 0.00 H new ATOM 0 HE1 MET B 437 1.130 16.638 -9.219 1.00 0.00 H new ATOM 0 HE2 MET B 437 2.192 18.048 -9.450 1.00 0.00 H new ATOM 0 HE3 MET B 437 2.636 16.782 -8.281 1.00 0.00 H new ATOM 2179 N LEU B 438 0.959 20.755 -11.302 1.00 0.00 N ATOM 2180 CA LEU B 438 1.614 20.129 -12.440 1.00 0.00 C ATOM 2181 C LEU B 438 2.451 21.166 -13.175 1.00 0.00 C ATOM 2182 O LEU B 438 3.679 21.077 -13.218 1.00 0.00 O ATOM 2183 CB LEU B 438 0.583 19.519 -13.390 1.00 0.00 C ATOM 2184 CG LEU B 438 -0.098 18.248 -12.883 1.00 0.00 C ATOM 2185 CD1 LEU B 438 -0.655 17.444 -14.048 1.00 0.00 C ATOM 2186 CD2 LEU B 438 0.881 17.411 -12.074 1.00 0.00 C ATOM 0 H LEU B 438 -0.058 20.793 -11.368 1.00 0.00 H new ATOM 0 HA LEU B 438 2.259 19.328 -12.078 1.00 0.00 H new ATOM 0 HB2 LEU B 438 -0.184 20.266 -13.596 1.00 0.00 H new ATOM 0 HB3 LEU B 438 1.073 19.296 -14.338 1.00 0.00 H new ATOM 0 HG LEU B 438 -0.927 18.532 -12.234 1.00 0.00 H new ATOM 0 HD11 LEU B 438 -1.137 16.542 -13.670 1.00 0.00 H new ATOM 0 HD12 LEU B 438 -1.385 18.046 -14.589 1.00 0.00 H new ATOM 0 HD13 LEU B 438 0.157 17.167 -14.720 1.00 0.00 H new ATOM 0 HD21 LEU B 438 0.382 16.509 -11.719 1.00 0.00 H new ATOM 0 HD22 LEU B 438 1.728 17.134 -12.701 1.00 0.00 H new ATOM 0 HD23 LEU B 438 1.235 17.989 -11.221 1.00 0.00 H new ATOM 2198 N ASP B 439 1.777 22.169 -13.728 1.00 0.00 N ATOM 2199 CA ASP B 439 2.464 23.238 -14.431 1.00 0.00 C ATOM 2200 C ASP B 439 3.508 23.847 -13.506 1.00 0.00 C ATOM 2201 O ASP B 439 4.528 24.376 -13.952 1.00 0.00 O ATOM 2202 CB ASP B 439 1.470 24.307 -14.893 1.00 0.00 C ATOM 2203 CG ASP B 439 2.089 25.297 -15.860 1.00 0.00 C ATOM 2204 OD1 ASP B 439 3.126 24.962 -16.470 1.00 0.00 O ATOM 2205 OD2 ASP B 439 1.534 26.407 -16.009 1.00 0.00 O ATOM 0 H ASP B 439 0.761 22.261 -13.702 1.00 0.00 H new ATOM 0 HA ASP B 439 2.953 22.832 -15.317 1.00 0.00 H new ATOM 0 HB2 ASP B 439 0.617 23.824 -15.369 1.00 0.00 H new ATOM 0 HB3 ASP B 439 1.088 24.843 -14.024 1.00 0.00 H new ATOM 2210 N PHE B 440 3.246 23.744 -12.204 1.00 0.00 N ATOM 2211 CA PHE B 440 4.164 24.263 -11.203 1.00 0.00 C ATOM 2212 C PHE B 440 5.500 23.543 -11.317 1.00 0.00 C ATOM 2213 O PHE B 440 6.562 24.166 -11.278 1.00 0.00 O ATOM 2214 CB PHE B 440 3.581 24.093 -9.793 1.00 0.00 C ATOM 2215 CG PHE B 440 4.628 23.936 -8.724 1.00 0.00 C ATOM 2216 CD1 PHE B 440 5.489 24.979 -8.424 1.00 0.00 C ATOM 2217 CD2 PHE B 440 4.756 22.744 -8.030 1.00 0.00 C ATOM 2218 CE1 PHE B 440 6.459 24.837 -7.449 1.00 0.00 C ATOM 2219 CE2 PHE B 440 5.725 22.595 -7.055 1.00 0.00 C ATOM 2220 CZ PHE B 440 6.577 23.643 -6.763 1.00 0.00 C ATOM 0 H PHE B 440 2.407 23.307 -11.823 1.00 0.00 H new ATOM 0 HA PHE B 440 4.315 25.328 -11.379 1.00 0.00 H new ATOM 0 HB2 PHE B 440 2.961 24.958 -9.558 1.00 0.00 H new ATOM 0 HB3 PHE B 440 2.928 23.220 -9.782 1.00 0.00 H new ATOM 0 HD1 PHE B 440 5.402 25.914 -8.958 1.00 0.00 H new ATOM 0 HD2 PHE B 440 4.092 21.922 -8.253 1.00 0.00 H new ATOM 0 HE1 PHE B 440 7.124 25.658 -7.224 1.00 0.00 H new ATOM 0 HE2 PHE B 440 5.816 21.660 -6.522 1.00 0.00 H new ATOM 0 HZ PHE B 440 7.333 23.529 -6.000 1.00 0.00 H new ATOM 2230 N TYR B 441 5.438 22.226 -11.472 1.00 0.00 N ATOM 2231 CA TYR B 441 6.641 21.422 -11.606 1.00 0.00 C ATOM 2232 C TYR B 441 7.307 21.695 -12.942 1.00 0.00 C ATOM 2233 O TYR B 441 8.520 21.564 -13.080 1.00 0.00 O ATOM 2234 CB TYR B 441 6.314 19.941 -11.453 1.00 0.00 C ATOM 2235 CG TYR B 441 6.071 19.555 -10.017 1.00 0.00 C ATOM 2236 CD1 TYR B 441 7.117 19.528 -9.106 1.00 0.00 C ATOM 2237 CD2 TYR B 441 4.798 19.238 -9.568 1.00 0.00 C ATOM 2238 CE1 TYR B 441 6.903 19.193 -7.786 1.00 0.00 C ATOM 2239 CE2 TYR B 441 4.573 18.900 -8.249 1.00 0.00 C ATOM 2240 CZ TYR B 441 5.629 18.878 -7.360 1.00 0.00 C ATOM 2241 OH TYR B 441 5.409 18.543 -6.043 1.00 0.00 O ATOM 0 H TYR B 441 4.568 21.695 -11.508 1.00 0.00 H new ATOM 0 HA TYR B 441 7.337 21.697 -10.813 1.00 0.00 H new ATOM 0 HB2 TYR B 441 5.431 19.703 -12.045 1.00 0.00 H new ATOM 0 HB3 TYR B 441 7.135 19.347 -11.853 1.00 0.00 H new ATOM 0 HD1 TYR B 441 8.115 19.773 -9.436 1.00 0.00 H new ATOM 0 HD2 TYR B 441 3.970 19.256 -10.261 1.00 0.00 H new ATOM 0 HE1 TYR B 441 7.728 19.177 -7.089 1.00 0.00 H new ATOM 0 HE2 TYR B 441 3.576 18.654 -7.914 1.00 0.00 H new ATOM 0 HH TYR B 441 4.502 18.810 -5.785 1.00 0.00 H new ATOM 2251 N ALA B 442 6.506 22.106 -13.918 1.00 0.00 N ATOM 2252 CA ALA B 442 7.035 22.433 -15.232 1.00 0.00 C ATOM 2253 C ALA B 442 8.051 23.558 -15.093 1.00 0.00 C ATOM 2254 O ALA B 442 9.172 23.474 -15.603 1.00 0.00 O ATOM 2255 CB ALA B 442 5.925 22.836 -16.192 1.00 0.00 C ATOM 0 H ALA B 442 5.497 22.219 -13.824 1.00 0.00 H new ATOM 0 HA ALA B 442 7.519 21.548 -15.646 1.00 0.00 H new ATOM 0 HB1 ALA B 442 6.354 23.074 -17.165 1.00 0.00 H new ATOM 0 HB2 ALA B 442 5.219 22.012 -16.298 1.00 0.00 H new ATOM 0 HB3 ALA B 442 5.405 23.711 -15.801 1.00 0.00 H new ATOM 2261 N LYS B 443 7.653 24.604 -14.372 1.00 0.00 N ATOM 2262 CA LYS B 443 8.526 25.742 -14.133 1.00 0.00 C ATOM 2263 C LYS B 443 9.744 25.298 -13.329 1.00 0.00 C ATOM 2264 O LYS B 443 10.871 25.697 -13.622 1.00 0.00 O ATOM 2265 CB LYS B 443 7.767 26.848 -13.394 1.00 0.00 C ATOM 2266 CG LYS B 443 8.660 27.776 -12.587 1.00 0.00 C ATOM 2267 CD LYS B 443 7.918 29.035 -12.166 1.00 0.00 C ATOM 2268 CE LYS B 443 8.001 30.116 -13.232 1.00 0.00 C ATOM 2269 NZ LYS B 443 7.188 31.313 -12.876 1.00 0.00 N ATOM 0 H LYS B 443 6.730 24.683 -13.945 1.00 0.00 H new ATOM 0 HA LYS B 443 8.863 26.140 -15.090 1.00 0.00 H new ATOM 0 HB2 LYS B 443 7.208 27.439 -14.120 1.00 0.00 H new ATOM 0 HB3 LYS B 443 7.038 26.390 -12.726 1.00 0.00 H new ATOM 0 HG2 LYS B 443 9.024 27.254 -11.702 1.00 0.00 H new ATOM 0 HG3 LYS B 443 9.534 28.048 -13.179 1.00 0.00 H new ATOM 0 HD2 LYS B 443 6.873 28.794 -11.972 1.00 0.00 H new ATOM 0 HD3 LYS B 443 8.338 29.410 -11.233 1.00 0.00 H new ATOM 0 HE2 LYS B 443 9.041 30.412 -13.369 1.00 0.00 H new ATOM 0 HE3 LYS B 443 7.656 29.713 -14.184 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 7.272 32.026 -13.629 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 6.191 31.037 -12.770 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 7.533 31.713 -11.980 1.00 0.00 H new ATOM 2283 N GLN B 444 9.513 24.450 -12.325 1.00 0.00 N ATOM 2284 CA GLN B 444 10.596 23.936 -11.502 1.00 0.00 C ATOM 2285 C GLN B 444 11.556 23.123 -12.361 1.00 0.00 C ATOM 2286 O GLN B 444 12.768 23.129 -12.141 1.00 0.00 O ATOM 2287 CB GLN B 444 10.036 23.067 -10.373 1.00 0.00 C ATOM 2288 CG GLN B 444 9.804 23.827 -9.079 1.00 0.00 C ATOM 2289 CD GLN B 444 10.577 23.227 -7.926 1.00 0.00 C ATOM 2290 OE1 GLN B 444 11.095 23.938 -7.066 1.00 0.00 O ATOM 2291 NE2 GLN B 444 10.659 21.903 -7.909 1.00 0.00 N ATOM 0 H GLN B 444 8.587 24.109 -12.067 1.00 0.00 H new ATOM 0 HA GLN B 444 11.135 24.775 -11.062 1.00 0.00 H new ATOM 0 HB2 GLN B 444 9.094 22.625 -10.699 1.00 0.00 H new ATOM 0 HB3 GLN B 444 10.725 22.244 -10.183 1.00 0.00 H new ATOM 0 HG2 GLN B 444 10.099 24.868 -9.211 1.00 0.00 H new ATOM 0 HG3 GLN B 444 8.740 23.825 -8.843 1.00 0.00 H new ATOM 0 HE21 GLN B 444 10.213 21.355 -8.644 1.00 0.00 H new ATOM 0 HE22 GLN B 444 11.168 21.433 -7.160 1.00 0.00 H new ATOM 2300 N ARG B 445 10.998 22.437 -13.354 1.00 0.00 N ATOM 2301 CA ARG B 445 11.789 21.629 -14.270 1.00 0.00 C ATOM 2302 C ARG B 445 12.840 22.492 -14.950 1.00 0.00 C ATOM 2303 O ARG B 445 14.039 22.228 -14.851 1.00 0.00 O ATOM 2304 CB ARG B 445 10.885 20.984 -15.324 1.00 0.00 C ATOM 2305 CG ARG B 445 11.054 19.478 -15.442 1.00 0.00 C ATOM 2306 CD ARG B 445 12.491 19.050 -15.183 1.00 0.00 C ATOM 2307 NE ARG B 445 12.996 18.159 -16.225 1.00 0.00 N ATOM 2308 CZ ARG B 445 13.721 18.564 -17.264 1.00 0.00 C ATOM 2309 NH1 ARG B 445 14.026 19.846 -17.417 1.00 0.00 N ATOM 2310 NH2 ARG B 445 14.142 17.680 -18.158 1.00 0.00 N ATOM 0 H ARG B 445 9.996 22.426 -13.543 1.00 0.00 H new ATOM 0 HA ARG B 445 12.286 20.842 -13.702 1.00 0.00 H new ATOM 0 HB2 ARG B 445 9.846 21.205 -15.081 1.00 0.00 H new ATOM 0 HB3 ARG B 445 11.090 21.440 -16.293 1.00 0.00 H new ATOM 0 HG2 ARG B 445 10.393 18.981 -14.732 1.00 0.00 H new ATOM 0 HG3 ARG B 445 10.752 19.155 -16.438 1.00 0.00 H new ATOM 0 HD2 ARG B 445 13.127 19.933 -15.123 1.00 0.00 H new ATOM 0 HD3 ARG B 445 12.551 18.548 -14.217 1.00 0.00 H new ATOM 0 HE ARG B 445 12.779 17.165 -16.151 1.00 0.00 H new ATOM 0 HH11 ARG B 445 13.704 20.532 -16.734 1.00 0.00 H new ATOM 0 HH12 ARG B 445 14.583 20.146 -18.217 1.00 0.00 H new ATOM 0 HH21 ARG B 445 13.910 16.693 -18.048 1.00 0.00 H new ATOM 0 HH22 ARG B 445 14.698 17.987 -18.956 1.00 0.00 H new