USER MOD reduce.3.24.130724 H: found=0, std=0, add=663, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 664 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 410 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 441 TYR OH : rot 30:sc= -1.83 USER MOD Set 2.1: B 380 TYR OH : rot 34:sc= 0.375 USER MOD Set 2.2: B 444 GLN : amide:sc= -3.41! X(o=-3!,f=-2.8) USER MOD Single : B 368 MET CE :methyl 167:sc= -0.45 (180deg=-1.2) USER MOD Single : B 369 ASN : amide:sc= -0.531 X(o=-0.53,f=-0.96) USER MOD Single : B 371 LYS NZ :NH3+ -176:sc= -0.78! (180deg=-0.957!) USER MOD Single : B 373 GLN : amide:sc= -4.91! K(o=-4.9!,f=-1.4) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 55:sc= 1.04 USER MOD Single : B 382 SER OG : rot 31:sc= 0.221! USER MOD Single : B 386 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : B 387 TYR OH : rot 180:sc= 0 USER MOD Single : B 389 THR OG1 : rot 60:sc= -0.657 USER MOD Single : B 391 LYS NZ :NH3+ -157:sc= -1.42 (180deg=-2.11!) USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot 180:sc= 0 USER MOD Single : B 399 ASN : amide:sc= -2.08! X(o=-2.1!,f=-1.7) USER MOD Single : B 400 SER OG : rot 180:sc= 0 USER MOD Single : B 404 CYS SG : rot 38:sc= -8.92! USER MOD Single : B 414 THR OG1 : rot 36:sc= -0.691 USER MOD Single : B 419 ASN : amide:sc= -1.58! C(o=-1.6!,f=-2.8!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -11.3! C(o=-11!,f=-26!) USER MOD Single : B 435 LYS NZ :NH3+ -112:sc= -1.27 (180deg=-3.64!) USER MOD Single : B 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 437 MET CE :methyl 179:sc= -4.14 (180deg=-4.22) USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1050 N LEU B 366 2.058 1.403 11.355 1.00 0.00 N ATOM 1051 CA LEU B 366 0.690 1.615 10.899 1.00 0.00 C ATOM 1052 C LEU B 366 0.659 2.095 9.452 1.00 0.00 C ATOM 1053 O LEU B 366 1.201 3.150 9.125 1.00 0.00 O ATOM 1054 CB LEU B 366 -0.019 2.628 11.798 1.00 0.00 C ATOM 1055 CG LEU B 366 -1.446 2.247 12.197 1.00 0.00 C ATOM 1056 CD1 LEU B 366 -1.486 1.767 13.638 1.00 0.00 C ATOM 1057 CD2 LEU B 366 -2.387 3.425 11.998 1.00 0.00 C ATOM 0 HA LEU B 366 0.168 0.660 10.954 1.00 0.00 H new ATOM 0 HB2 LEU B 366 0.572 2.764 12.704 1.00 0.00 H new ATOM 0 HB3 LEU B 366 -0.045 3.590 11.287 1.00 0.00 H new ATOM 0 HG LEU B 366 -1.778 1.431 11.555 1.00 0.00 H new ATOM 0 HD11 LEU B 366 -2.509 1.500 13.904 1.00 0.00 H new ATOM 0 HD12 LEU B 366 -0.843 0.894 13.749 1.00 0.00 H new ATOM 0 HD13 LEU B 366 -1.135 2.562 14.296 1.00 0.00 H new ATOM 0 HD21 LEU B 366 -3.398 3.136 12.287 1.00 0.00 H new ATOM 0 HD22 LEU B 366 -2.058 4.261 12.615 1.00 0.00 H new ATOM 0 HD23 LEU B 366 -2.380 3.723 10.950 1.00 0.00 H new ATOM 1069 N ASP B 367 0.008 1.319 8.593 1.00 0.00 N ATOM 1070 CA ASP B 367 -0.105 1.675 7.184 1.00 0.00 C ATOM 1071 C ASP B 367 -0.777 3.035 7.044 1.00 0.00 C ATOM 1072 O ASP B 367 -0.166 3.999 6.582 1.00 0.00 O ATOM 1073 CB ASP B 367 -0.909 0.613 6.428 1.00 0.00 C ATOM 1074 CG ASP B 367 -0.695 -0.781 6.986 1.00 0.00 C ATOM 1075 OD1 ASP B 367 0.255 -0.965 7.775 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -1.478 -1.689 6.633 1.00 0.00 O ATOM 0 H ASP B 367 -0.448 0.442 8.846 1.00 0.00 H new ATOM 0 HA ASP B 367 0.896 1.726 6.755 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -1.969 0.862 6.476 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -0.625 0.628 5.376 1.00 0.00 H new ATOM 1081 N MET B 368 -2.040 3.097 7.451 1.00 0.00 N ATOM 1082 CA MET B 368 -2.812 4.332 7.384 1.00 0.00 C ATOM 1083 C MET B 368 -1.921 5.544 7.625 1.00 0.00 C ATOM 1084 O MET B 368 -1.965 6.521 6.874 1.00 0.00 O ATOM 1085 CB MET B 368 -3.941 4.302 8.416 1.00 0.00 C ATOM 1086 CG MET B 368 -5.027 5.334 8.163 1.00 0.00 C ATOM 1087 SD MET B 368 -5.378 6.337 9.619 1.00 0.00 S ATOM 1088 CE MET B 368 -3.792 7.130 9.867 1.00 0.00 C ATOM 0 H MET B 368 -2.553 2.302 7.833 1.00 0.00 H new ATOM 0 HA MET B 368 -3.240 4.413 6.385 1.00 0.00 H new ATOM 0 HB2 MET B 368 -4.390 3.309 8.421 1.00 0.00 H new ATOM 0 HB3 MET B 368 -3.519 4.467 9.408 1.00 0.00 H new ATOM 0 HG2 MET B 368 -4.722 5.984 7.343 1.00 0.00 H new ATOM 0 HG3 MET B 368 -5.939 4.827 7.846 1.00 0.00 H new ATOM 0 HE1 MET B 368 -3.902 7.949 10.578 1.00 0.00 H new ATOM 0 HE2 MET B 368 -3.079 6.404 10.257 1.00 0.00 H new ATOM 0 HE3 MET B 368 -3.428 7.521 8.917 1.00 0.00 H new ATOM 1098 N ASN B 369 -1.111 5.479 8.678 1.00 0.00 N ATOM 1099 CA ASN B 369 -0.211 6.576 9.012 1.00 0.00 C ATOM 1100 C ASN B 369 0.788 6.817 7.889 1.00 0.00 C ATOM 1101 O ASN B 369 1.017 7.960 7.490 1.00 0.00 O ATOM 1102 CB ASN B 369 0.531 6.291 10.315 1.00 0.00 C ATOM 1103 CG ASN B 369 -0.226 6.782 11.534 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -0.841 7.848 11.510 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -0.184 6.004 12.609 1.00 0.00 N ATOM 0 H ASN B 369 -1.060 4.681 9.312 1.00 0.00 H new ATOM 0 HA ASN B 369 -0.815 7.474 9.142 1.00 0.00 H new ATOM 0 HB2 ASN B 369 0.701 5.218 10.405 1.00 0.00 H new ATOM 0 HB3 ASN B 369 1.511 6.768 10.283 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -0.674 6.282 13.459 1.00 0.00 H new ATOM 0 HD22 ASN B 369 0.338 5.128 12.585 1.00 0.00 H new ATOM 1112 N ALA B 370 1.376 5.742 7.367 1.00 0.00 N ATOM 1113 CA ALA B 370 2.337 5.859 6.278 1.00 0.00 C ATOM 1114 C ALA B 370 1.680 6.514 5.073 1.00 0.00 C ATOM 1115 O ALA B 370 2.007 7.642 4.723 1.00 0.00 O ATOM 1116 CB ALA B 370 2.903 4.501 5.897 1.00 0.00 C ATOM 0 H ALA B 370 1.204 4.787 7.680 1.00 0.00 H new ATOM 0 HA ALA B 370 3.163 6.483 6.618 1.00 0.00 H new ATOM 0 HB1 ALA B 370 3.617 4.620 5.082 1.00 0.00 H new ATOM 0 HB2 ALA B 370 3.406 4.062 6.759 1.00 0.00 H new ATOM 0 HB3 ALA B 370 2.093 3.846 5.577 1.00 0.00 H new ATOM 1122 N LYS B 371 0.761 5.792 4.435 1.00 0.00 N ATOM 1123 CA LYS B 371 0.057 6.306 3.264 1.00 0.00 C ATOM 1124 C LYS B 371 -0.139 7.816 3.372 1.00 0.00 C ATOM 1125 O LYS B 371 0.218 8.569 2.463 1.00 0.00 O ATOM 1126 CB LYS B 371 -1.310 5.629 3.112 1.00 0.00 C ATOM 1127 CG LYS B 371 -1.273 4.111 3.199 1.00 0.00 C ATOM 1128 CD LYS B 371 -2.352 3.589 4.136 1.00 0.00 C ATOM 1129 CE LYS B 371 -2.690 2.131 3.859 1.00 0.00 C ATOM 1130 NZ LYS B 371 -2.248 1.700 2.505 1.00 0.00 N ATOM 0 H LYS B 371 0.487 4.849 4.710 1.00 0.00 H new ATOM 0 HA LYS B 371 0.666 6.085 2.388 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -1.978 6.009 3.885 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -1.739 5.915 2.152 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -1.412 3.683 2.206 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -0.294 3.788 3.551 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -2.018 3.694 5.168 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -3.251 4.196 4.028 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -2.217 1.501 4.612 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -3.766 1.985 3.952 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -2.558 0.722 2.333 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -2.666 2.327 1.788 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -1.211 1.749 2.446 1.00 0.00 H new ATOM 1144 N ARG B 372 -0.709 8.247 4.495 1.00 0.00 N ATOM 1145 CA ARG B 372 -0.959 9.664 4.735 1.00 0.00 C ATOM 1146 C ARG B 372 0.339 10.469 4.675 1.00 0.00 C ATOM 1147 O ARG B 372 0.361 11.592 4.174 1.00 0.00 O ATOM 1148 CB ARG B 372 -1.639 9.858 6.093 1.00 0.00 C ATOM 1149 CG ARG B 372 -3.007 10.523 6.004 1.00 0.00 C ATOM 1150 CD ARG B 372 -3.810 10.004 4.823 1.00 0.00 C ATOM 1151 NE ARG B 372 -3.742 8.548 4.711 1.00 0.00 N ATOM 1152 CZ ARG B 372 -4.699 7.718 5.129 1.00 0.00 C ATOM 1153 NH1 ARG B 372 -5.810 8.188 5.686 1.00 0.00 N ATOM 1154 NH2 ARG B 372 -4.542 6.410 4.990 1.00 0.00 N ATOM 0 H ARG B 372 -1.006 7.633 5.253 1.00 0.00 H new ATOM 0 HA ARG B 372 -1.621 10.029 3.950 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -1.748 8.887 6.577 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -0.992 10.461 6.730 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -3.559 10.343 6.926 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -2.882 11.602 5.913 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -4.850 10.311 4.929 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -3.436 10.456 3.904 1.00 0.00 H new ATOM 0 HE ARG B 372 -2.909 8.141 4.286 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -5.938 9.194 5.798 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -6.535 7.543 6.002 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -3.692 6.041 4.565 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -5.271 5.772 5.308 1.00 0.00 H new ATOM 1168 N GLN B 373 1.419 9.881 5.182 1.00 0.00 N ATOM 1169 CA GLN B 373 2.723 10.534 5.180 1.00 0.00 C ATOM 1170 C GLN B 373 3.217 10.759 3.754 1.00 0.00 C ATOM 1171 O GLN B 373 3.364 11.892 3.293 1.00 0.00 O ATOM 1172 CB GLN B 373 3.746 9.687 5.948 1.00 0.00 C ATOM 1173 CG GLN B 373 4.373 10.423 7.120 1.00 0.00 C ATOM 1174 CD GLN B 373 5.038 11.720 6.702 1.00 0.00 C ATOM 1175 OE1 GLN B 373 4.897 12.746 7.367 1.00 0.00 O ATOM 1176 NE2 GLN B 373 5.769 11.678 5.595 1.00 0.00 N ATOM 0 H GLN B 373 1.416 8.951 5.600 1.00 0.00 H new ATOM 0 HA GLN B 373 2.614 11.501 5.671 1.00 0.00 H new ATOM 0 HB2 GLN B 373 3.258 8.783 6.314 1.00 0.00 H new ATOM 0 HB3 GLN B 373 4.533 9.370 5.263 1.00 0.00 H new ATOM 0 HG2 GLN B 373 3.605 10.635 7.864 1.00 0.00 H new ATOM 0 HG3 GLN B 373 5.110 9.778 7.598 1.00 0.00 H new ATOM 0 HE21 GLN B 373 5.858 10.805 5.075 1.00 0.00 H new ATOM 0 HE22 GLN B 373 6.242 12.519 5.264 1.00 0.00 H new ATOM 1185 N LEU B 374 3.481 9.660 3.070 1.00 0.00 N ATOM 1186 CA LEU B 374 3.976 9.698 1.704 1.00 0.00 C ATOM 1187 C LEU B 374 3.170 10.638 0.814 1.00 0.00 C ATOM 1188 O LEU B 374 3.687 11.646 0.331 1.00 0.00 O ATOM 1189 CB LEU B 374 3.955 8.293 1.103 1.00 0.00 C ATOM 1190 CG LEU B 374 5.204 7.460 1.374 1.00 0.00 C ATOM 1191 CD1 LEU B 374 6.437 8.154 0.820 1.00 0.00 C ATOM 1192 CD2 LEU B 374 5.360 7.213 2.864 1.00 0.00 C ATOM 0 H LEU B 374 3.359 8.719 3.443 1.00 0.00 H new ATOM 0 HA LEU B 374 4.997 10.078 1.747 1.00 0.00 H new ATOM 0 HB2 LEU B 374 3.088 7.759 1.493 1.00 0.00 H new ATOM 0 HB3 LEU B 374 3.819 8.377 0.025 1.00 0.00 H new ATOM 0 HG LEU B 374 5.095 6.499 0.872 1.00 0.00 H new ATOM 0 HD11 LEU B 374 7.319 7.546 1.022 1.00 0.00 H new ATOM 0 HD12 LEU B 374 6.327 8.287 -0.256 1.00 0.00 H new ATOM 0 HD13 LEU B 374 6.551 9.128 1.296 1.00 0.00 H new ATOM 0 HD21 LEU B 374 6.255 6.617 3.042 1.00 0.00 H new ATOM 0 HD22 LEU B 374 5.449 8.167 3.384 1.00 0.00 H new ATOM 0 HD23 LEU B 374 4.487 6.677 3.237 1.00 0.00 H new ATOM 1204 N TYR B 375 1.924 10.267 0.546 1.00 0.00 N ATOM 1205 CA TYR B 375 1.073 11.044 -0.349 1.00 0.00 C ATOM 1206 C TYR B 375 0.445 12.283 0.285 1.00 0.00 C ATOM 1207 O TYR B 375 0.373 13.329 -0.359 1.00 0.00 O ATOM 1208 CB TYR B 375 -0.027 10.155 -0.919 1.00 0.00 C ATOM 1209 CG TYR B 375 -0.145 10.244 -2.421 1.00 0.00 C ATOM 1210 CD1 TYR B 375 0.857 9.748 -3.244 1.00 0.00 C ATOM 1211 CD2 TYR B 375 -1.255 10.828 -3.016 1.00 0.00 C ATOM 1212 CE1 TYR B 375 0.755 9.829 -4.620 1.00 0.00 C ATOM 1213 CE2 TYR B 375 -1.366 10.913 -4.391 1.00 0.00 C ATOM 1214 CZ TYR B 375 -0.357 10.413 -5.188 1.00 0.00 C ATOM 1215 OH TYR B 375 -0.462 10.496 -6.559 1.00 0.00 O ATOM 0 H TYR B 375 1.480 9.435 0.934 1.00 0.00 H new ATOM 0 HA TYR B 375 1.733 11.409 -1.136 1.00 0.00 H new ATOM 0 HB2 TYR B 375 0.168 9.120 -0.637 1.00 0.00 H new ATOM 0 HB3 TYR B 375 -0.980 10.433 -0.469 1.00 0.00 H new ATOM 0 HD1 TYR B 375 1.730 9.291 -2.802 1.00 0.00 H new ATOM 0 HD2 TYR B 375 -2.045 11.222 -2.394 1.00 0.00 H new ATOM 0 HE1 TYR B 375 1.542 9.437 -5.247 1.00 0.00 H new ATOM 0 HE2 TYR B 375 -2.237 11.368 -4.839 1.00 0.00 H new ATOM 0 HH TYR B 375 -1.306 10.934 -6.797 1.00 0.00 H new ATOM 1225 N SER B 376 -0.052 12.181 1.513 1.00 0.00 N ATOM 1226 CA SER B 376 -0.709 13.321 2.144 1.00 0.00 C ATOM 1227 C SER B 376 0.248 14.184 2.968 1.00 0.00 C ATOM 1228 O SER B 376 -0.194 15.073 3.694 1.00 0.00 O ATOM 1229 CB SER B 376 -1.855 12.832 3.030 1.00 0.00 C ATOM 1230 OG SER B 376 -1.744 13.343 4.347 1.00 0.00 O ATOM 0 H SER B 376 -0.014 11.336 2.084 1.00 0.00 H new ATOM 0 HA SER B 376 -1.091 13.950 1.340 1.00 0.00 H new ATOM 0 HB2 SER B 376 -2.807 13.139 2.598 1.00 0.00 H new ATOM 0 HB3 SER B 376 -1.855 11.742 3.060 1.00 0.00 H new ATOM 0 HG SER B 376 -1.687 14.321 4.315 1.00 0.00 H new ATOM 1236 N LEU B 377 1.549 13.945 2.848 1.00 0.00 N ATOM 1237 CA LEU B 377 2.528 14.728 3.582 1.00 0.00 C ATOM 1238 C LEU B 377 3.755 15.021 2.725 1.00 0.00 C ATOM 1239 O LEU B 377 4.320 16.113 2.790 1.00 0.00 O ATOM 1240 CB LEU B 377 2.934 13.984 4.842 1.00 0.00 C ATOM 1241 CG LEU B 377 2.457 14.604 6.145 1.00 0.00 C ATOM 1242 CD1 LEU B 377 3.409 15.702 6.591 1.00 0.00 C ATOM 1243 CD2 LEU B 377 1.040 15.140 6.002 1.00 0.00 C ATOM 0 H LEU B 377 1.946 13.219 2.252 1.00 0.00 H new ATOM 0 HA LEU B 377 2.075 15.682 3.853 1.00 0.00 H new ATOM 0 HB2 LEU B 377 2.551 12.965 4.782 1.00 0.00 H new ATOM 0 HB3 LEU B 377 4.021 13.915 4.869 1.00 0.00 H new ATOM 0 HG LEU B 377 2.447 13.828 6.911 1.00 0.00 H new ATOM 0 HD11 LEU B 377 3.052 16.135 7.526 1.00 0.00 H new ATOM 0 HD12 LEU B 377 4.404 15.282 6.742 1.00 0.00 H new ATOM 0 HD13 LEU B 377 3.455 16.477 5.826 1.00 0.00 H new ATOM 0 HD21 LEU B 377 0.720 15.579 6.947 1.00 0.00 H new ATOM 0 HD22 LEU B 377 1.016 15.901 5.222 1.00 0.00 H new ATOM 0 HD23 LEU B 377 0.368 14.325 5.735 1.00 0.00 H new ATOM 1255 N ILE B 378 4.165 14.043 1.919 1.00 0.00 N ATOM 1256 CA ILE B 378 5.323 14.209 1.051 1.00 0.00 C ATOM 1257 C ILE B 378 4.944 13.997 -0.411 1.00 0.00 C ATOM 1258 O ILE B 378 5.733 13.483 -1.204 1.00 0.00 O ATOM 1259 CB ILE B 378 6.457 13.237 1.433 1.00 0.00 C ATOM 1260 CG1 ILE B 378 6.525 13.074 2.952 1.00 0.00 C ATOM 1261 CG2 ILE B 378 7.787 13.739 0.891 1.00 0.00 C ATOM 1262 CD1 ILE B 378 6.733 14.378 3.691 1.00 0.00 C ATOM 0 H ILE B 378 3.712 13.131 1.851 1.00 0.00 H new ATOM 0 HA ILE B 378 5.679 15.231 1.184 1.00 0.00 H new ATOM 0 HB ILE B 378 6.248 12.264 0.989 1.00 0.00 H new ATOM 0 HG12 ILE B 378 5.602 12.611 3.301 1.00 0.00 H new ATOM 0 HG13 ILE B 378 7.338 12.391 3.200 1.00 0.00 H new ATOM 0 HG21 ILE B 378 8.579 13.043 1.168 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.733 13.813 -0.195 1.00 0.00 H new ATOM 0 HG23 ILE B 378 8.004 14.721 1.311 1.00 0.00 H new ATOM 0 HD11 ILE B 378 6.771 14.186 4.763 1.00 0.00 H new ATOM 0 HD12 ILE B 378 7.670 14.833 3.370 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.908 15.056 3.473 1.00 0.00 H new ATOM 1274 N GLY B 379 3.728 14.407 -0.759 1.00 0.00 N ATOM 1275 CA GLY B 379 3.251 14.269 -2.124 1.00 0.00 C ATOM 1276 C GLY B 379 2.276 15.370 -2.497 1.00 0.00 C ATOM 1277 O GLY B 379 1.079 15.129 -2.649 1.00 0.00 O ATOM 0 H GLY B 379 3.061 14.835 -0.116 1.00 0.00 H new ATOM 0 HA2 GLY B 379 4.099 14.288 -2.808 1.00 0.00 H new ATOM 0 HA3 GLY B 379 2.767 13.300 -2.243 1.00 0.00 H new ATOM 1281 N TYR B 380 2.793 16.588 -2.624 1.00 0.00 N ATOM 1282 CA TYR B 380 1.963 17.742 -2.959 1.00 0.00 C ATOM 1283 C TYR B 380 1.301 17.585 -4.328 1.00 0.00 C ATOM 1284 O TYR B 380 0.074 17.589 -4.429 1.00 0.00 O ATOM 1285 CB TYR B 380 2.770 19.051 -2.894 1.00 0.00 C ATOM 1286 CG TYR B 380 4.198 18.960 -3.405 1.00 0.00 C ATOM 1287 CD1 TYR B 380 5.212 18.413 -2.625 1.00 0.00 C ATOM 1288 CD2 TYR B 380 4.531 19.438 -4.664 1.00 0.00 C ATOM 1289 CE1 TYR B 380 6.513 18.342 -3.088 1.00 0.00 C ATOM 1290 CE2 TYR B 380 5.829 19.372 -5.135 1.00 0.00 C ATOM 1291 CZ TYR B 380 6.816 18.822 -4.345 1.00 0.00 C ATOM 1292 OH TYR B 380 8.108 18.754 -4.812 1.00 0.00 O ATOM 0 H TYR B 380 3.783 16.802 -2.500 1.00 0.00 H new ATOM 0 HA TYR B 380 1.172 17.793 -2.211 1.00 0.00 H new ATOM 0 HB2 TYR B 380 2.243 19.812 -3.470 1.00 0.00 H new ATOM 0 HB3 TYR B 380 2.793 19.393 -1.859 1.00 0.00 H new ATOM 0 HD1 TYR B 380 4.979 18.037 -1.640 1.00 0.00 H new ATOM 0 HD2 TYR B 380 3.762 19.870 -5.288 1.00 0.00 H new ATOM 0 HE1 TYR B 380 7.287 17.913 -2.469 1.00 0.00 H new ATOM 0 HE2 TYR B 380 6.069 19.750 -6.118 1.00 0.00 H new ATOM 0 HH TYR B 380 8.538 17.943 -4.468 1.00 0.00 H new ATOM 1302 N ALA B 381 2.104 17.444 -5.381 1.00 0.00 N ATOM 1303 CA ALA B 381 1.560 17.286 -6.730 1.00 0.00 C ATOM 1304 C ALA B 381 2.653 17.381 -7.791 1.00 0.00 C ATOM 1305 O ALA B 381 2.556 16.769 -8.854 1.00 0.00 O ATOM 1306 CB ALA B 381 0.478 18.322 -6.999 1.00 0.00 C ATOM 0 H ALA B 381 3.123 17.436 -5.329 1.00 0.00 H new ATOM 0 HA ALA B 381 1.119 16.291 -6.789 1.00 0.00 H new ATOM 0 HB1 ALA B 381 0.087 18.187 -8.007 1.00 0.00 H new ATOM 0 HB2 ALA B 381 -0.330 18.200 -6.277 1.00 0.00 H new ATOM 0 HB3 ALA B 381 0.901 19.322 -6.905 1.00 0.00 H new ATOM 1312 N SER B 382 3.692 18.145 -7.487 1.00 0.00 N ATOM 1313 CA SER B 382 4.814 18.322 -8.400 1.00 0.00 C ATOM 1314 C SER B 382 6.057 17.632 -7.851 1.00 0.00 C ATOM 1315 O SER B 382 7.164 18.164 -7.924 1.00 0.00 O ATOM 1316 CB SER B 382 5.096 19.810 -8.620 1.00 0.00 C ATOM 1317 OG SER B 382 4.670 20.580 -7.509 1.00 0.00 O ATOM 0 H SER B 382 3.782 18.656 -6.609 1.00 0.00 H new ATOM 0 HA SER B 382 4.553 17.870 -9.357 1.00 0.00 H new ATOM 0 HB2 SER B 382 6.163 19.961 -8.783 1.00 0.00 H new ATOM 0 HB3 SER B 382 4.585 20.151 -9.520 1.00 0.00 H new ATOM 0 HG SER B 382 4.743 20.044 -6.692 1.00 0.00 H new ATOM 1323 N LEU B 383 5.858 16.443 -7.292 1.00 0.00 N ATOM 1324 CA LEU B 383 6.950 15.668 -6.716 1.00 0.00 C ATOM 1325 C LEU B 383 7.160 14.371 -7.488 1.00 0.00 C ATOM 1326 O LEU B 383 8.292 13.951 -7.723 1.00 0.00 O ATOM 1327 CB LEU B 383 6.651 15.359 -5.249 1.00 0.00 C ATOM 1328 CG LEU B 383 7.844 14.868 -4.432 1.00 0.00 C ATOM 1329 CD1 LEU B 383 7.568 15.016 -2.944 1.00 0.00 C ATOM 1330 CD2 LEU B 383 8.164 13.420 -4.777 1.00 0.00 C ATOM 0 H LEU B 383 4.945 15.993 -7.226 1.00 0.00 H new ATOM 0 HA LEU B 383 7.864 16.259 -6.782 1.00 0.00 H new ATOM 0 HB2 LEU B 383 6.254 16.259 -4.778 1.00 0.00 H new ATOM 0 HB3 LEU B 383 5.866 14.604 -5.206 1.00 0.00 H new ATOM 0 HG LEU B 383 8.710 15.481 -4.682 1.00 0.00 H new ATOM 0 HD11 LEU B 383 8.429 14.661 -2.377 1.00 0.00 H new ATOM 0 HD12 LEU B 383 7.387 16.065 -2.710 1.00 0.00 H new ATOM 0 HD13 LEU B 383 6.690 14.428 -2.677 1.00 0.00 H new ATOM 0 HD21 LEU B 383 9.017 13.085 -4.186 1.00 0.00 H new ATOM 0 HD22 LEU B 383 7.300 12.794 -4.555 1.00 0.00 H new ATOM 0 HD23 LEU B 383 8.405 13.343 -5.837 1.00 0.00 H new ATOM 1342 N ARG B 384 6.057 13.737 -7.874 1.00 0.00 N ATOM 1343 CA ARG B 384 6.113 12.483 -8.616 1.00 0.00 C ATOM 1344 C ARG B 384 6.716 11.370 -7.771 1.00 0.00 C ATOM 1345 O ARG B 384 7.785 10.854 -8.099 1.00 0.00 O ATOM 1346 CB ARG B 384 6.939 12.646 -9.897 1.00 0.00 C ATOM 1347 CG ARG B 384 7.079 11.364 -10.701 1.00 0.00 C ATOM 1348 CD ARG B 384 5.816 10.523 -10.636 1.00 0.00 C ATOM 1349 NE ARG B 384 5.615 9.747 -11.855 1.00 0.00 N ATOM 1350 CZ ARG B 384 4.832 8.677 -11.925 1.00 0.00 C ATOM 1351 NH1 ARG B 384 4.176 8.263 -10.850 1.00 0.00 N ATOM 1352 NH2 ARG B 384 4.701 8.021 -13.069 1.00 0.00 N ATOM 0 H ARG B 384 5.112 14.072 -7.685 1.00 0.00 H new ATOM 0 HA ARG B 384 5.089 12.215 -8.877 1.00 0.00 H new ATOM 0 HB2 ARG B 384 6.475 13.408 -10.523 1.00 0.00 H new ATOM 0 HB3 ARG B 384 7.932 13.010 -9.634 1.00 0.00 H new ATOM 0 HG2 ARG B 384 7.302 11.608 -11.740 1.00 0.00 H new ATOM 0 HG3 ARG B 384 7.922 10.786 -10.322 1.00 0.00 H new ATOM 0 HD2 ARG B 384 5.873 9.848 -9.782 1.00 0.00 H new ATOM 0 HD3 ARG B 384 4.956 11.172 -10.473 1.00 0.00 H new ATOM 0 HE ARG B 384 6.103 10.043 -12.700 1.00 0.00 H new ATOM 0 HH11 ARG B 384 4.273 8.767 -9.968 1.00 0.00 H new ATOM 0 HH12 ARG B 384 3.575 7.441 -10.905 1.00 0.00 H new ATOM 0 HH21 ARG B 384 5.202 8.338 -13.899 1.00 0.00 H new ATOM 0 HH22 ARG B 384 4.099 7.199 -13.120 1.00 0.00 H new ATOM 1366 N LEU B 385 6.030 10.971 -6.703 1.00 0.00 N ATOM 1367 CA LEU B 385 6.530 9.895 -5.875 1.00 0.00 C ATOM 1368 C LEU B 385 6.919 8.748 -6.786 1.00 0.00 C ATOM 1369 O LEU B 385 6.422 8.650 -7.907 1.00 0.00 O ATOM 1370 CB LEU B 385 5.474 9.447 -4.861 1.00 0.00 C ATOM 1371 CG LEU B 385 6.022 8.700 -3.643 1.00 0.00 C ATOM 1372 CD1 LEU B 385 5.989 9.591 -2.411 1.00 0.00 C ATOM 1373 CD2 LEU B 385 5.232 7.423 -3.402 1.00 0.00 C ATOM 0 H LEU B 385 5.143 11.373 -6.400 1.00 0.00 H new ATOM 0 HA LEU B 385 7.396 10.235 -5.307 1.00 0.00 H new ATOM 0 HB2 LEU B 385 4.929 10.325 -4.515 1.00 0.00 H new ATOM 0 HB3 LEU B 385 4.754 8.805 -5.369 1.00 0.00 H new ATOM 0 HG LEU B 385 7.059 8.430 -3.842 1.00 0.00 H new ATOM 0 HD11 LEU B 385 6.382 9.043 -1.555 1.00 0.00 H new ATOM 0 HD12 LEU B 385 6.599 10.477 -2.586 1.00 0.00 H new ATOM 0 HD13 LEU B 385 4.962 9.893 -2.208 1.00 0.00 H new ATOM 0 HD21 LEU B 385 5.635 6.904 -2.532 1.00 0.00 H new ATOM 0 HD22 LEU B 385 4.186 7.671 -3.224 1.00 0.00 H new ATOM 0 HD23 LEU B 385 5.308 6.777 -4.277 1.00 0.00 H new ATOM 1385 N HIS B 386 7.817 7.895 -6.335 1.00 0.00 N ATOM 1386 CA HIS B 386 8.248 6.793 -7.178 1.00 0.00 C ATOM 1387 C HIS B 386 8.737 5.583 -6.398 1.00 0.00 C ATOM 1388 O HIS B 386 9.901 5.503 -6.005 1.00 0.00 O ATOM 1389 CB HIS B 386 9.346 7.262 -8.126 1.00 0.00 C ATOM 1390 CG HIS B 386 9.216 6.682 -9.494 1.00 0.00 C ATOM 1391 ND1 HIS B 386 8.763 7.406 -10.574 1.00 0.00 N ATOM 1392 CD2 HIS B 386 9.456 5.430 -9.954 1.00 0.00 C ATOM 1393 CE1 HIS B 386 8.725 6.627 -11.636 1.00 0.00 C ATOM 1394 NE2 HIS B 386 9.142 5.424 -11.289 1.00 0.00 N ATOM 0 H HIS B 386 8.254 7.938 -5.414 1.00 0.00 H new ATOM 0 HA HIS B 386 7.367 6.474 -7.735 1.00 0.00 H new ATOM 0 HB2 HIS B 386 9.321 8.350 -8.194 1.00 0.00 H new ATOM 0 HB3 HIS B 386 10.317 6.991 -7.712 1.00 0.00 H new ATOM 0 HD2 HIS B 386 9.825 4.594 -9.378 1.00 0.00 H new ATOM 0 HE1 HIS B 386 8.406 6.923 -12.624 1.00 0.00 H new ATOM 0 HE2 HIS B 386 9.218 4.620 -11.912 1.00 0.00 H new ATOM 1403 N TYR B 387 7.859 4.609 -6.238 1.00 0.00 N ATOM 1404 CA TYR B 387 8.226 3.376 -5.579 1.00 0.00 C ATOM 1405 C TYR B 387 7.599 2.200 -6.298 1.00 0.00 C ATOM 1406 O TYR B 387 6.568 2.337 -6.956 1.00 0.00 O ATOM 1407 CB TYR B 387 7.909 3.393 -4.096 1.00 0.00 C ATOM 1408 CG TYR B 387 6.509 3.084 -3.669 1.00 0.00 C ATOM 1409 CD1 TYR B 387 5.398 3.446 -4.413 1.00 0.00 C ATOM 1410 CD2 TYR B 387 6.321 2.440 -2.463 1.00 0.00 C ATOM 1411 CE1 TYR B 387 4.126 3.159 -3.954 1.00 0.00 C ATOM 1412 CE2 TYR B 387 5.074 2.156 -1.995 1.00 0.00 C ATOM 1413 CZ TYR B 387 3.966 2.512 -2.740 1.00 0.00 C ATOM 1414 OH TYR B 387 2.703 2.229 -2.273 1.00 0.00 O ATOM 0 H TYR B 387 6.891 4.651 -6.555 1.00 0.00 H new ATOM 0 HA TYR B 387 9.309 3.268 -5.637 1.00 0.00 H new ATOM 0 HB2 TYR B 387 8.572 2.680 -3.606 1.00 0.00 H new ATOM 0 HB3 TYR B 387 8.164 4.381 -3.712 1.00 0.00 H new ATOM 0 HD1 TYR B 387 5.526 3.955 -5.357 1.00 0.00 H new ATOM 0 HD2 TYR B 387 7.182 2.155 -1.877 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.262 3.438 -4.539 1.00 0.00 H new ATOM 0 HE2 TYR B 387 4.952 1.655 -1.046 1.00 0.00 H new ATOM 0 HH TYR B 387 2.769 1.772 -1.409 1.00 0.00 H new ATOM 1424 N VAL B 388 8.256 1.058 -6.217 1.00 0.00 N ATOM 1425 CA VAL B 388 7.790 -0.127 -6.916 1.00 0.00 C ATOM 1426 C VAL B 388 8.054 -1.395 -6.115 1.00 0.00 C ATOM 1427 O VAL B 388 8.850 -1.394 -5.183 1.00 0.00 O ATOM 1428 CB VAL B 388 8.485 -0.241 -8.292 1.00 0.00 C ATOM 1429 CG1 VAL B 388 7.502 0.074 -9.409 1.00 0.00 C ATOM 1430 CG2 VAL B 388 9.693 0.692 -8.375 1.00 0.00 C ATOM 0 H VAL B 388 9.111 0.925 -5.677 1.00 0.00 H new ATOM 0 HA VAL B 388 6.713 -0.024 -7.050 1.00 0.00 H new ATOM 0 HB VAL B 388 8.837 -1.266 -8.409 1.00 0.00 H new ATOM 0 HG11 VAL B 388 8.006 -0.010 -10.372 1.00 0.00 H new ATOM 0 HG12 VAL B 388 6.671 -0.630 -9.372 1.00 0.00 H new ATOM 0 HG13 VAL B 388 7.124 1.089 -9.285 1.00 0.00 H new ATOM 0 HG21 VAL B 388 10.163 0.592 -9.353 1.00 0.00 H new ATOM 0 HG22 VAL B 388 9.367 1.722 -8.233 1.00 0.00 H new ATOM 0 HG23 VAL B 388 10.411 0.428 -7.598 1.00 0.00 H new ATOM 1440 N THR B 389 7.384 -2.477 -6.489 1.00 0.00 N ATOM 1441 CA THR B 389 7.559 -3.750 -5.804 1.00 0.00 C ATOM 1442 C THR B 389 8.438 -4.688 -6.618 1.00 0.00 C ATOM 1443 O THR B 389 8.212 -4.896 -7.811 1.00 0.00 O ATOM 1444 CB THR B 389 6.209 -4.440 -5.523 1.00 0.00 C ATOM 1445 OG1 THR B 389 5.535 -3.828 -4.414 1.00 0.00 O ATOM 1446 CG2 THR B 389 6.396 -5.923 -5.212 1.00 0.00 C ATOM 0 H THR B 389 6.717 -2.499 -7.260 1.00 0.00 H new ATOM 0 HA THR B 389 8.042 -3.531 -4.852 1.00 0.00 H new ATOM 0 HB THR B 389 5.609 -4.329 -6.426 1.00 0.00 H new ATOM 0 HG1 THR B 389 5.369 -2.883 -4.613 1.00 0.00 H new ATOM 0 HG21 THR B 389 5.425 -6.379 -5.019 1.00 0.00 H new ATOM 0 HG22 THR B 389 6.866 -6.417 -6.062 1.00 0.00 H new ATOM 0 HG23 THR B 389 7.030 -6.033 -4.332 1.00 0.00 H new ATOM 1454 N VAL B 390 9.440 -5.249 -5.962 1.00 0.00 N ATOM 1455 CA VAL B 390 10.359 -6.165 -6.611 1.00 0.00 C ATOM 1456 C VAL B 390 10.611 -7.393 -5.743 1.00 0.00 C ATOM 1457 O VAL B 390 10.338 -7.379 -4.544 1.00 0.00 O ATOM 1458 CB VAL B 390 11.696 -5.469 -6.918 1.00 0.00 C ATOM 1459 CG1 VAL B 390 11.544 -4.528 -8.100 1.00 0.00 C ATOM 1460 CG2 VAL B 390 12.193 -4.713 -5.697 1.00 0.00 C ATOM 0 H VAL B 390 9.637 -5.084 -4.975 1.00 0.00 H new ATOM 0 HA VAL B 390 9.900 -6.484 -7.547 1.00 0.00 H new ATOM 0 HB VAL B 390 12.432 -6.231 -7.175 1.00 0.00 H new ATOM 0 HG11 VAL B 390 12.499 -4.043 -8.304 1.00 0.00 H new ATOM 0 HG12 VAL B 390 11.229 -5.093 -8.977 1.00 0.00 H new ATOM 0 HG13 VAL B 390 10.795 -3.771 -7.868 1.00 0.00 H new ATOM 0 HG21 VAL B 390 13.140 -4.226 -5.931 1.00 0.00 H new ATOM 0 HG22 VAL B 390 11.459 -3.960 -5.412 1.00 0.00 H new ATOM 0 HG23 VAL B 390 12.338 -5.410 -4.871 1.00 0.00 H new ATOM 1470 N LYS B 391 11.131 -8.446 -6.373 1.00 0.00 N ATOM 1471 CA LYS B 391 11.441 -9.709 -5.703 1.00 0.00 C ATOM 1472 C LYS B 391 10.336 -10.738 -5.926 1.00 0.00 C ATOM 1473 O LYS B 391 10.129 -11.610 -5.085 1.00 0.00 O ATOM 1474 CB LYS B 391 11.667 -9.492 -4.208 1.00 0.00 C ATOM 1475 CG LYS B 391 12.263 -10.684 -3.456 1.00 0.00 C ATOM 1476 CD LYS B 391 12.861 -11.746 -4.378 1.00 0.00 C ATOM 1477 CE LYS B 391 14.333 -11.483 -4.653 1.00 0.00 C ATOM 1478 NZ LYS B 391 14.546 -10.846 -5.982 1.00 0.00 N ATOM 0 H LYS B 391 11.350 -8.447 -7.369 1.00 0.00 H new ATOM 0 HA LYS B 391 12.361 -10.096 -6.141 1.00 0.00 H new ATOM 0 HB2 LYS B 391 12.327 -8.635 -4.078 1.00 0.00 H new ATOM 0 HB3 LYS B 391 10.714 -9.233 -3.747 1.00 0.00 H new ATOM 0 HG2 LYS B 391 13.037 -10.326 -2.777 1.00 0.00 H new ATOM 0 HG3 LYS B 391 11.487 -11.142 -2.842 1.00 0.00 H new ATOM 0 HD2 LYS B 391 12.745 -12.730 -3.924 1.00 0.00 H new ATOM 0 HD3 LYS B 391 12.312 -11.763 -5.319 1.00 0.00 H new ATOM 0 HE2 LYS B 391 14.738 -10.839 -3.873 1.00 0.00 H new ATOM 0 HE3 LYS B 391 14.884 -12.423 -4.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 15.517 -11.031 -6.304 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 13.872 -11.242 -6.669 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 14.397 -9.820 -5.903 1.00 0.00 H new ATOM 1492 N LYS B 392 9.643 -10.614 -7.067 1.00 0.00 N ATOM 1493 CA LYS B 392 8.545 -11.517 -7.451 1.00 0.00 C ATOM 1494 C LYS B 392 8.288 -12.594 -6.400 1.00 0.00 C ATOM 1495 O LYS B 392 9.157 -13.418 -6.114 1.00 0.00 O ATOM 1496 CB LYS B 392 8.856 -12.175 -8.797 1.00 0.00 C ATOM 1497 CG LYS B 392 8.564 -11.281 -9.991 1.00 0.00 C ATOM 1498 CD LYS B 392 7.096 -11.339 -10.386 1.00 0.00 C ATOM 1499 CE LYS B 392 6.430 -9.980 -10.255 1.00 0.00 C ATOM 1500 NZ LYS B 392 6.250 -9.318 -11.577 1.00 0.00 N ATOM 0 H LYS B 392 9.828 -9.882 -7.753 1.00 0.00 H new ATOM 0 HA LYS B 392 7.642 -10.912 -7.532 1.00 0.00 H new ATOM 0 HB2 LYS B 392 9.907 -12.463 -8.817 1.00 0.00 H new ATOM 0 HB3 LYS B 392 8.273 -13.091 -8.888 1.00 0.00 H new ATOM 0 HG2 LYS B 392 8.837 -10.253 -9.752 1.00 0.00 H new ATOM 0 HG3 LYS B 392 9.181 -11.587 -10.836 1.00 0.00 H new ATOM 0 HD2 LYS B 392 7.008 -11.691 -11.414 1.00 0.00 H new ATOM 0 HD3 LYS B 392 6.577 -12.062 -9.757 1.00 0.00 H new ATOM 0 HE2 LYS B 392 5.460 -10.097 -9.773 1.00 0.00 H new ATOM 0 HE3 LYS B 392 7.032 -9.342 -9.609 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 5.792 -8.394 -11.443 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 7.178 -9.183 -12.027 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 5.654 -9.914 -12.186 1.00 0.00 H new ATOM 1514 N PRO B 393 7.086 -12.596 -5.805 1.00 0.00 N ATOM 1515 CA PRO B 393 6.723 -13.565 -4.771 1.00 0.00 C ATOM 1516 C PRO B 393 6.721 -15.006 -5.266 1.00 0.00 C ATOM 1517 O PRO B 393 6.614 -15.279 -6.461 1.00 0.00 O ATOM 1518 CB PRO B 393 5.309 -13.168 -4.353 1.00 0.00 C ATOM 1519 CG PRO B 393 5.090 -11.795 -4.898 1.00 0.00 C ATOM 1520 CD PRO B 393 5.998 -11.649 -6.087 1.00 0.00 C ATOM 0 HA PRO B 393 7.450 -13.540 -3.959 1.00 0.00 H new ATOM 0 HB2 PRO B 393 4.574 -13.868 -4.750 1.00 0.00 H new ATOM 0 HB3 PRO B 393 5.205 -13.178 -3.268 1.00 0.00 H new ATOM 0 HG2 PRO B 393 4.048 -11.656 -5.188 1.00 0.00 H new ATOM 0 HG3 PRO B 393 5.315 -11.040 -4.145 1.00 0.00 H new ATOM 0 HD2 PRO B 393 5.484 -11.893 -7.017 1.00 0.00 H new ATOM 0 HD3 PRO B 393 6.369 -10.629 -6.186 1.00 0.00 H new ATOM 1528 N THR B 394 6.846 -15.913 -4.313 1.00 0.00 N ATOM 1529 CA THR B 394 6.866 -17.345 -4.595 1.00 0.00 C ATOM 1530 C THR B 394 6.037 -18.115 -3.578 1.00 0.00 C ATOM 1531 O THR B 394 5.658 -17.573 -2.542 1.00 0.00 O ATOM 1532 CB THR B 394 8.305 -17.897 -4.584 1.00 0.00 C ATOM 1533 OG1 THR B 394 9.034 -17.429 -3.442 1.00 0.00 O ATOM 1534 CG2 THR B 394 9.057 -17.479 -5.837 1.00 0.00 C ATOM 0 H THR B 394 6.937 -15.683 -3.323 1.00 0.00 H new ATOM 0 HA THR B 394 6.437 -17.479 -5.588 1.00 0.00 H new ATOM 0 HB THR B 394 8.226 -18.983 -4.545 1.00 0.00 H new ATOM 0 HG1 THR B 394 9.942 -17.796 -3.461 1.00 0.00 H new ATOM 0 HG21 THR B 394 10.070 -17.881 -5.805 1.00 0.00 H new ATOM 0 HG22 THR B 394 8.541 -17.865 -6.716 1.00 0.00 H new ATOM 0 HG23 THR B 394 9.100 -16.391 -5.890 1.00 0.00 H new ATOM 1542 N ALA B 395 5.764 -19.388 -3.867 1.00 0.00 N ATOM 1543 CA ALA B 395 4.993 -20.223 -2.955 1.00 0.00 C ATOM 1544 C ALA B 395 5.926 -20.975 -2.013 1.00 0.00 C ATOM 1545 O ALA B 395 5.528 -21.931 -1.349 1.00 0.00 O ATOM 1546 CB ALA B 395 4.112 -21.195 -3.720 1.00 0.00 C ATOM 0 H ALA B 395 6.065 -19.858 -4.721 1.00 0.00 H new ATOM 0 HA ALA B 395 4.345 -19.576 -2.364 1.00 0.00 H new ATOM 0 HB1 ALA B 395 3.547 -21.806 -3.016 1.00 0.00 H new ATOM 0 HB2 ALA B 395 3.421 -20.639 -4.353 1.00 0.00 H new ATOM 0 HB3 ALA B 395 4.735 -21.839 -4.341 1.00 0.00 H new ATOM 1552 N VAL B 396 7.159 -20.493 -1.937 1.00 0.00 N ATOM 1553 CA VAL B 396 8.166 -21.063 -1.053 1.00 0.00 C ATOM 1554 C VAL B 396 8.744 -19.976 -0.154 1.00 0.00 C ATOM 1555 O VAL B 396 9.532 -20.241 0.753 1.00 0.00 O ATOM 1556 CB VAL B 396 9.308 -21.734 -1.837 1.00 0.00 C ATOM 1557 CG1 VAL B 396 8.760 -22.778 -2.797 1.00 0.00 C ATOM 1558 CG2 VAL B 396 10.128 -20.690 -2.581 1.00 0.00 C ATOM 0 H VAL B 396 7.489 -19.698 -2.485 1.00 0.00 H new ATOM 0 HA VAL B 396 7.675 -21.827 -0.451 1.00 0.00 H new ATOM 0 HB VAL B 396 9.963 -22.240 -1.127 1.00 0.00 H new ATOM 0 HG11 VAL B 396 9.584 -23.240 -3.341 1.00 0.00 H new ATOM 0 HG12 VAL B 396 8.222 -23.542 -2.235 1.00 0.00 H new ATOM 0 HG13 VAL B 396 8.081 -22.301 -3.504 1.00 0.00 H new ATOM 0 HG21 VAL B 396 10.931 -21.182 -3.130 1.00 0.00 H new ATOM 0 HG22 VAL B 396 9.486 -20.154 -3.280 1.00 0.00 H new ATOM 0 HG23 VAL B 396 10.555 -19.986 -1.867 1.00 0.00 H new ATOM 1568 N ASP B 397 8.335 -18.751 -0.438 1.00 0.00 N ATOM 1569 CA ASP B 397 8.772 -17.572 0.292 1.00 0.00 C ATOM 1570 C ASP B 397 8.109 -16.343 -0.320 1.00 0.00 C ATOM 1571 O ASP B 397 8.775 -15.390 -0.720 1.00 0.00 O ATOM 1572 CB ASP B 397 10.295 -17.438 0.229 1.00 0.00 C ATOM 1573 CG ASP B 397 10.989 -18.189 1.348 1.00 0.00 C ATOM 1574 OD1 ASP B 397 10.318 -18.520 2.347 1.00 0.00 O ATOM 1575 OD2 ASP B 397 12.206 -18.445 1.225 1.00 0.00 O ATOM 0 H ASP B 397 7.681 -18.544 -1.193 1.00 0.00 H new ATOM 0 HA ASP B 397 8.484 -17.664 1.339 1.00 0.00 H new ATOM 0 HB2 ASP B 397 10.650 -17.813 -0.731 1.00 0.00 H new ATOM 0 HB3 ASP B 397 10.566 -16.384 0.280 1.00 0.00 H new ATOM 1580 N PRO B 398 6.770 -16.376 -0.408 1.00 0.00 N ATOM 1581 CA PRO B 398 5.969 -15.300 -0.980 1.00 0.00 C ATOM 1582 C PRO B 398 6.570 -13.916 -0.775 1.00 0.00 C ATOM 1583 O PRO B 398 6.469 -13.051 -1.643 1.00 0.00 O ATOM 1584 CB PRO B 398 4.663 -15.436 -0.208 1.00 0.00 C ATOM 1585 CG PRO B 398 4.524 -16.901 0.054 1.00 0.00 C ATOM 1586 CD PRO B 398 5.919 -17.489 0.048 1.00 0.00 C ATOM 0 HA PRO B 398 5.878 -15.386 -2.063 1.00 0.00 H new ATOM 0 HB2 PRO B 398 4.693 -14.869 0.722 1.00 0.00 H new ATOM 0 HB3 PRO B 398 3.821 -15.056 -0.786 1.00 0.00 H new ATOM 0 HG2 PRO B 398 4.036 -17.076 1.013 1.00 0.00 H new ATOM 0 HG3 PRO B 398 3.904 -17.372 -0.709 1.00 0.00 H new ATOM 0 HD2 PRO B 398 6.211 -17.835 1.039 1.00 0.00 H new ATOM 0 HD3 PRO B 398 5.989 -18.346 -0.622 1.00 0.00 H new ATOM 1594 N ASN B 399 7.152 -13.701 0.393 1.00 0.00 N ATOM 1595 CA ASN B 399 7.728 -12.410 0.748 1.00 0.00 C ATOM 1596 C ASN B 399 8.212 -11.624 -0.474 1.00 0.00 C ATOM 1597 O ASN B 399 8.780 -12.181 -1.413 1.00 0.00 O ATOM 1598 CB ASN B 399 8.856 -12.584 1.779 1.00 0.00 C ATOM 1599 CG ASN B 399 10.246 -12.540 1.170 1.00 0.00 C ATOM 1600 OD1 ASN B 399 11.159 -11.924 1.719 1.00 0.00 O ATOM 1601 ND2 ASN B 399 10.409 -13.194 0.031 1.00 0.00 N ATOM 0 H ASN B 399 7.240 -14.411 1.120 1.00 0.00 H new ATOM 0 HA ASN B 399 6.932 -11.819 1.200 1.00 0.00 H new ATOM 0 HB2 ASN B 399 8.773 -11.800 2.532 1.00 0.00 H new ATOM 0 HB3 ASN B 399 8.723 -13.536 2.293 1.00 0.00 H new ATOM 0 HD21 ASN B 399 11.320 -13.201 -0.427 1.00 0.00 H new ATOM 0 HD22 ASN B 399 9.623 -13.691 -0.388 1.00 0.00 H new ATOM 1608 N SER B 400 7.965 -10.316 -0.441 1.00 0.00 N ATOM 1609 CA SER B 400 8.358 -9.422 -1.527 1.00 0.00 C ATOM 1610 C SER B 400 8.863 -8.088 -0.981 1.00 0.00 C ATOM 1611 O SER B 400 8.422 -7.630 0.075 1.00 0.00 O ATOM 1612 CB SER B 400 7.182 -9.187 -2.476 1.00 0.00 C ATOM 1613 OG SER B 400 7.605 -8.537 -3.662 1.00 0.00 O ATOM 0 H SER B 400 7.491 -9.850 0.332 1.00 0.00 H new ATOM 0 HA SER B 400 9.169 -9.898 -2.078 1.00 0.00 H new ATOM 0 HB2 SER B 400 6.717 -10.140 -2.726 1.00 0.00 H new ATOM 0 HB3 SER B 400 6.424 -8.583 -1.978 1.00 0.00 H new ATOM 0 HG SER B 400 6.835 -8.400 -4.252 1.00 0.00 H new ATOM 1619 N ILE B 401 9.797 -7.473 -1.701 1.00 0.00 N ATOM 1620 CA ILE B 401 10.371 -6.197 -1.284 1.00 0.00 C ATOM 1621 C ILE B 401 9.883 -5.042 -2.155 1.00 0.00 C ATOM 1622 O ILE B 401 9.463 -5.238 -3.294 1.00 0.00 O ATOM 1623 CB ILE B 401 11.908 -6.231 -1.319 1.00 0.00 C ATOM 1624 CG1 ILE B 401 12.484 -5.083 -0.489 1.00 0.00 C ATOM 1625 CG2 ILE B 401 12.399 -6.151 -2.752 1.00 0.00 C ATOM 1626 CD1 ILE B 401 13.910 -5.317 -0.038 1.00 0.00 C ATOM 0 H ILE B 401 10.173 -7.838 -2.576 1.00 0.00 H new ATOM 0 HA ILE B 401 10.037 -6.034 -0.259 1.00 0.00 H new ATOM 0 HB ILE B 401 12.249 -7.172 -0.887 1.00 0.00 H new ATOM 0 HG12 ILE B 401 12.443 -4.165 -1.076 1.00 0.00 H new ATOM 0 HG13 ILE B 401 11.855 -4.929 0.388 1.00 0.00 H new ATOM 0 HG21 ILE B 401 13.489 -6.176 -2.765 1.00 0.00 H new ATOM 0 HG22 ILE B 401 12.010 -6.998 -3.318 1.00 0.00 H new ATOM 0 HG23 ILE B 401 12.052 -5.222 -3.204 1.00 0.00 H new ATOM 0 HD11 ILE B 401 14.252 -4.462 0.545 1.00 0.00 H new ATOM 0 HD12 ILE B 401 13.954 -6.216 0.576 1.00 0.00 H new ATOM 0 HD13 ILE B 401 14.552 -5.441 -0.910 1.00 0.00 H new ATOM 1638 N VAL B 402 9.933 -3.839 -1.593 1.00 0.00 N ATOM 1639 CA VAL B 402 9.489 -2.633 -2.292 1.00 0.00 C ATOM 1640 C VAL B 402 10.555 -1.543 -2.266 1.00 0.00 C ATOM 1641 O VAL B 402 11.213 -1.328 -1.248 1.00 0.00 O ATOM 1642 CB VAL B 402 8.206 -2.055 -1.653 1.00 0.00 C ATOM 1643 CG1 VAL B 402 7.248 -1.545 -2.716 1.00 0.00 C ATOM 1644 CG2 VAL B 402 7.524 -3.083 -0.769 1.00 0.00 C ATOM 0 H VAL B 402 10.279 -3.670 -0.648 1.00 0.00 H new ATOM 0 HA VAL B 402 9.294 -2.933 -3.322 1.00 0.00 H new ATOM 0 HB VAL B 402 8.500 -1.212 -1.028 1.00 0.00 H new ATOM 0 HG11 VAL B 402 6.354 -1.144 -2.238 1.00 0.00 H new ATOM 0 HG12 VAL B 402 7.733 -0.760 -3.296 1.00 0.00 H new ATOM 0 HG13 VAL B 402 6.969 -2.365 -3.378 1.00 0.00 H new ATOM 0 HG21 VAL B 402 6.625 -2.648 -0.333 1.00 0.00 H new ATOM 0 HG22 VAL B 402 7.254 -3.954 -1.366 1.00 0.00 H new ATOM 0 HG23 VAL B 402 8.203 -3.386 0.028 1.00 0.00 H new ATOM 1654 N GLU B 403 10.688 -0.830 -3.382 1.00 0.00 N ATOM 1655 CA GLU B 403 11.637 0.272 -3.488 1.00 0.00 C ATOM 1656 C GLU B 403 10.889 1.588 -3.322 1.00 0.00 C ATOM 1657 O GLU B 403 10.359 2.135 -4.285 1.00 0.00 O ATOM 1658 CB GLU B 403 12.351 0.237 -4.840 1.00 0.00 C ATOM 1659 CG GLU B 403 12.227 -1.097 -5.559 1.00 0.00 C ATOM 1660 CD GLU B 403 13.233 -1.245 -6.683 1.00 0.00 C ATOM 1661 OE1 GLU B 403 14.308 -0.614 -6.605 1.00 0.00 O ATOM 1662 OE2 GLU B 403 12.944 -1.989 -7.643 1.00 0.00 O ATOM 0 H GLU B 403 10.146 -0.998 -4.230 1.00 0.00 H new ATOM 0 HA GLU B 403 12.389 0.177 -2.705 1.00 0.00 H new ATOM 0 HB2 GLU B 403 11.944 1.023 -5.477 1.00 0.00 H new ATOM 0 HB3 GLU B 403 13.407 0.463 -4.690 1.00 0.00 H new ATOM 0 HG2 GLU B 403 12.365 -1.907 -4.843 1.00 0.00 H new ATOM 0 HG3 GLU B 403 11.219 -1.197 -5.962 1.00 0.00 H new ATOM 1669 N CYS B 404 10.863 2.084 -2.090 1.00 0.00 N ATOM 1670 CA CYS B 404 10.179 3.335 -1.788 1.00 0.00 C ATOM 1671 C CYS B 404 11.070 4.521 -2.125 1.00 0.00 C ATOM 1672 O CYS B 404 11.979 4.884 -1.378 1.00 0.00 O ATOM 1673 CB CYS B 404 9.685 3.374 -0.331 1.00 0.00 C ATOM 1674 SG CYS B 404 10.874 4.011 0.873 1.00 0.00 S ATOM 0 H CYS B 404 11.307 1.640 -1.286 1.00 0.00 H new ATOM 0 HA CYS B 404 9.290 3.400 -2.415 1.00 0.00 H new ATOM 0 HB2 CYS B 404 8.785 3.987 -0.287 1.00 0.00 H new ATOM 0 HB3 CYS B 404 9.399 2.365 -0.035 1.00 0.00 H new ATOM 0 HG CYS B 404 11.546 4.989 0.343 1.00 0.00 H new ATOM 1680 N ARG B 405 10.824 5.106 -3.291 1.00 0.00 N ATOM 1681 CA ARG B 405 11.618 6.231 -3.748 1.00 0.00 C ATOM 1682 C ARG B 405 10.716 7.361 -4.252 1.00 0.00 C ATOM 1683 O ARG B 405 9.525 7.162 -4.471 1.00 0.00 O ATOM 1684 CB ARG B 405 12.591 5.743 -4.830 1.00 0.00 C ATOM 1685 CG ARG B 405 12.594 6.564 -6.108 1.00 0.00 C ATOM 1686 CD ARG B 405 13.790 6.216 -6.979 1.00 0.00 C ATOM 1687 NE ARG B 405 13.737 4.838 -7.459 1.00 0.00 N ATOM 1688 CZ ARG B 405 14.805 4.161 -7.864 1.00 0.00 C ATOM 1689 NH1 ARG B 405 16.001 4.733 -7.840 1.00 0.00 N ATOM 1690 NH2 ARG B 405 14.680 2.913 -8.293 1.00 0.00 N ATOM 0 H ARG B 405 10.084 4.819 -3.932 1.00 0.00 H new ATOM 0 HA ARG B 405 12.197 6.640 -2.920 1.00 0.00 H new ATOM 0 HB2 ARG B 405 13.599 5.739 -4.416 1.00 0.00 H new ATOM 0 HB3 ARG B 405 12.345 4.711 -5.080 1.00 0.00 H new ATOM 0 HG2 ARG B 405 11.672 6.384 -6.662 1.00 0.00 H new ATOM 0 HG3 ARG B 405 12.616 7.626 -5.862 1.00 0.00 H new ATOM 0 HD2 ARG B 405 13.827 6.895 -7.831 1.00 0.00 H new ATOM 0 HD3 ARG B 405 14.708 6.367 -6.411 1.00 0.00 H new ATOM 0 HE ARG B 405 12.831 4.370 -7.485 1.00 0.00 H new ATOM 0 HH11 ARG B 405 16.101 5.693 -7.510 1.00 0.00 H new ATOM 0 HH12 ARG B 405 16.821 4.213 -8.151 1.00 0.00 H new ATOM 0 HH21 ARG B 405 13.761 2.470 -8.313 1.00 0.00 H new ATOM 0 HH22 ARG B 405 15.502 2.396 -8.603 1.00 0.00 H new ATOM 1704 N VAL B 406 11.288 8.553 -4.400 1.00 0.00 N ATOM 1705 CA VAL B 406 10.529 9.713 -4.850 1.00 0.00 C ATOM 1706 C VAL B 406 11.250 10.471 -5.956 1.00 0.00 C ATOM 1707 O VAL B 406 12.422 10.828 -5.820 1.00 0.00 O ATOM 1708 CB VAL B 406 10.258 10.691 -3.696 1.00 0.00 C ATOM 1709 CG1 VAL B 406 9.048 10.247 -2.899 1.00 0.00 C ATOM 1710 CG2 VAL B 406 11.482 10.819 -2.803 1.00 0.00 C ATOM 0 H VAL B 406 12.274 8.739 -4.215 1.00 0.00 H new ATOM 0 HA VAL B 406 9.586 9.323 -5.234 1.00 0.00 H new ATOM 0 HB VAL B 406 10.045 11.674 -4.117 1.00 0.00 H new ATOM 0 HG11 VAL B 406 8.870 10.950 -2.086 1.00 0.00 H new ATOM 0 HG12 VAL B 406 8.174 10.217 -3.550 1.00 0.00 H new ATOM 0 HG13 VAL B 406 9.228 9.254 -2.487 1.00 0.00 H new ATOM 0 HG21 VAL B 406 11.270 11.516 -1.992 1.00 0.00 H new ATOM 0 HG22 VAL B 406 11.732 9.843 -2.387 1.00 0.00 H new ATOM 0 HG23 VAL B 406 12.323 11.190 -3.389 1.00 0.00 H new ATOM 1720 N GLY B 407 10.537 10.720 -7.049 1.00 0.00 N ATOM 1721 CA GLY B 407 11.112 11.446 -8.161 1.00 0.00 C ATOM 1722 C GLY B 407 11.993 10.580 -9.039 1.00 0.00 C ATOM 1723 O GLY B 407 12.675 11.083 -9.930 1.00 0.00 O ATOM 0 H GLY B 407 9.568 10.430 -7.183 1.00 0.00 H new ATOM 0 HA2 GLY B 407 10.310 11.870 -8.765 1.00 0.00 H new ATOM 0 HA3 GLY B 407 11.698 12.282 -7.779 1.00 0.00 H new ATOM 1727 N ASP B 408 11.980 9.275 -8.788 1.00 0.00 N ATOM 1728 CA ASP B 408 12.785 8.342 -9.565 1.00 0.00 C ATOM 1729 C ASP B 408 14.271 8.576 -9.314 1.00 0.00 C ATOM 1730 O ASP B 408 15.123 8.045 -10.026 1.00 0.00 O ATOM 1731 CB ASP B 408 12.470 8.485 -11.057 1.00 0.00 C ATOM 1732 CG ASP B 408 13.442 7.721 -11.934 1.00 0.00 C ATOM 1733 OD1 ASP B 408 13.744 6.553 -11.610 1.00 0.00 O ATOM 1734 OD2 ASP B 408 13.901 8.290 -12.947 1.00 0.00 O ATOM 0 H ASP B 408 11.421 8.841 -8.053 1.00 0.00 H new ATOM 0 HA ASP B 408 12.538 7.328 -9.249 1.00 0.00 H new ATOM 0 HB2 ASP B 408 11.458 8.128 -11.247 1.00 0.00 H new ATOM 0 HB3 ASP B 408 12.492 9.540 -11.330 1.00 0.00 H new ATOM 1739 N GLY B 409 14.575 9.375 -8.297 1.00 0.00 N ATOM 1740 CA GLY B 409 15.956 9.664 -7.978 1.00 0.00 C ATOM 1741 C GLY B 409 16.305 9.366 -6.532 1.00 0.00 C ATOM 1742 O GLY B 409 17.409 8.912 -6.236 1.00 0.00 O ATOM 0 H GLY B 409 13.890 9.826 -7.691 1.00 0.00 H new ATOM 0 HA2 GLY B 409 16.604 9.079 -8.630 1.00 0.00 H new ATOM 0 HA3 GLY B 409 16.159 10.715 -8.186 1.00 0.00 H new ATOM 1746 N THR B 410 15.373 9.636 -5.624 1.00 0.00 N ATOM 1747 CA THR B 410 15.612 9.406 -4.206 1.00 0.00 C ATOM 1748 C THR B 410 14.918 8.142 -3.706 1.00 0.00 C ATOM 1749 O THR B 410 13.766 7.883 -4.035 1.00 0.00 O ATOM 1750 CB THR B 410 15.130 10.597 -3.361 1.00 0.00 C ATOM 1751 OG1 THR B 410 15.814 11.804 -3.724 1.00 0.00 O ATOM 1752 CG2 THR B 410 15.363 10.334 -1.883 1.00 0.00 C ATOM 0 H THR B 410 14.451 10.012 -5.844 1.00 0.00 H new ATOM 0 HA THR B 410 16.690 9.286 -4.094 1.00 0.00 H new ATOM 0 HB THR B 410 14.064 10.717 -3.553 1.00 0.00 H new ATOM 0 HG1 THR B 410 15.486 12.544 -3.172 1.00 0.00 H new ATOM 0 HG21 THR B 410 15.015 11.188 -1.302 1.00 0.00 H new ATOM 0 HG22 THR B 410 14.814 9.442 -1.581 1.00 0.00 H new ATOM 0 HG23 THR B 410 16.427 10.182 -1.704 1.00 0.00 H new ATOM 1760 N VAL B 411 15.630 7.363 -2.900 1.00 0.00 N ATOM 1761 CA VAL B 411 15.078 6.132 -2.342 1.00 0.00 C ATOM 1762 C VAL B 411 15.075 6.184 -0.822 1.00 0.00 C ATOM 1763 O VAL B 411 15.955 5.622 -0.170 1.00 0.00 O ATOM 1764 CB VAL B 411 15.869 4.892 -2.804 1.00 0.00 C ATOM 1765 CG1 VAL B 411 15.397 3.645 -2.069 1.00 0.00 C ATOM 1766 CG2 VAL B 411 15.727 4.711 -4.302 1.00 0.00 C ATOM 0 H VAL B 411 16.590 7.561 -2.618 1.00 0.00 H new ATOM 0 HA VAL B 411 14.055 6.048 -2.707 1.00 0.00 H new ATOM 0 HB VAL B 411 16.922 5.046 -2.567 1.00 0.00 H new ATOM 0 HG11 VAL B 411 15.969 2.783 -2.411 1.00 0.00 H new ATOM 0 HG12 VAL B 411 15.545 3.777 -0.997 1.00 0.00 H new ATOM 0 HG13 VAL B 411 14.339 3.482 -2.272 1.00 0.00 H new ATOM 0 HG21 VAL B 411 16.290 3.832 -4.617 1.00 0.00 H new ATOM 0 HG22 VAL B 411 14.675 4.578 -4.554 1.00 0.00 H new ATOM 0 HG23 VAL B 411 16.114 5.592 -4.813 1.00 0.00 H new ATOM 1776 N LEU B 412 14.081 6.862 -0.259 1.00 0.00 N ATOM 1777 CA LEU B 412 13.977 6.972 1.186 1.00 0.00 C ATOM 1778 C LEU B 412 14.310 5.638 1.831 1.00 0.00 C ATOM 1779 O LEU B 412 14.955 5.585 2.878 1.00 0.00 O ATOM 1780 CB LEU B 412 12.569 7.407 1.597 1.00 0.00 C ATOM 1781 CG LEU B 412 11.955 8.522 0.750 1.00 0.00 C ATOM 1782 CD1 LEU B 412 13.040 9.416 0.170 1.00 0.00 C ATOM 1783 CD2 LEU B 412 11.096 7.933 -0.358 1.00 0.00 C ATOM 0 H LEU B 412 13.343 7.339 -0.778 1.00 0.00 H new ATOM 0 HA LEU B 412 14.686 7.727 1.525 1.00 0.00 H new ATOM 0 HB2 LEU B 412 11.912 6.538 1.556 1.00 0.00 H new ATOM 0 HB3 LEU B 412 12.597 7.736 2.636 1.00 0.00 H new ATOM 0 HG LEU B 412 11.320 9.132 1.392 1.00 0.00 H new ATOM 0 HD11 LEU B 412 12.581 10.203 -0.429 1.00 0.00 H new ATOM 0 HD12 LEU B 412 13.613 9.865 0.981 1.00 0.00 H new ATOM 0 HD13 LEU B 412 13.704 8.822 -0.458 1.00 0.00 H new ATOM 0 HD21 LEU B 412 10.666 8.739 -0.952 1.00 0.00 H new ATOM 0 HD22 LEU B 412 11.711 7.299 -0.997 1.00 0.00 H new ATOM 0 HD23 LEU B 412 10.295 7.338 0.080 1.00 0.00 H new ATOM 1795 N GLY B 413 13.863 4.557 1.197 1.00 0.00 N ATOM 1796 CA GLY B 413 14.124 3.236 1.729 1.00 0.00 C ATOM 1797 C GLY B 413 13.387 2.142 0.981 1.00 0.00 C ATOM 1798 O GLY B 413 12.828 2.373 -0.090 1.00 0.00 O ATOM 0 H GLY B 413 13.328 4.574 0.329 1.00 0.00 H new ATOM 0 HA2 GLY B 413 15.195 3.039 1.688 1.00 0.00 H new ATOM 0 HA3 GLY B 413 13.835 3.209 2.780 1.00 0.00 H new ATOM 1802 N THR B 414 13.414 0.943 1.544 1.00 0.00 N ATOM 1803 CA THR B 414 12.768 -0.210 0.921 1.00 0.00 C ATOM 1804 C THR B 414 12.185 -1.145 1.967 1.00 0.00 C ATOM 1805 O THR B 414 12.803 -1.396 3.001 1.00 0.00 O ATOM 1806 CB THR B 414 13.751 -1.000 0.037 1.00 0.00 C ATOM 1807 OG1 THR B 414 13.182 -2.243 -0.394 1.00 0.00 O ATOM 1808 CG2 THR B 414 15.040 -1.297 0.789 1.00 0.00 C ATOM 0 H THR B 414 13.875 0.740 2.431 1.00 0.00 H new ATOM 0 HA THR B 414 11.964 0.181 0.297 1.00 0.00 H new ATOM 0 HB THR B 414 13.964 -0.378 -0.832 1.00 0.00 H new ATOM 0 HG1 THR B 414 12.224 -2.123 -0.562 1.00 0.00 H new ATOM 0 HG21 THR B 414 15.718 -1.856 0.143 1.00 0.00 H new ATOM 0 HG22 THR B 414 15.512 -0.360 1.086 1.00 0.00 H new ATOM 0 HG23 THR B 414 14.815 -1.888 1.677 1.00 0.00 H new ATOM 1816 N GLY B 415 10.983 -1.646 1.703 1.00 0.00 N ATOM 1817 CA GLY B 415 10.337 -2.530 2.651 1.00 0.00 C ATOM 1818 C GLY B 415 10.077 -3.919 2.110 1.00 0.00 C ATOM 1819 O GLY B 415 9.556 -4.084 1.011 1.00 0.00 O ATOM 0 H GLY B 415 10.449 -1.457 0.855 1.00 0.00 H new ATOM 0 HA2 GLY B 415 10.959 -2.608 3.543 1.00 0.00 H new ATOM 0 HA3 GLY B 415 9.390 -2.087 2.960 1.00 0.00 H new ATOM 1823 N VAL B 416 10.417 -4.919 2.911 1.00 0.00 N ATOM 1824 CA VAL B 416 10.202 -6.306 2.548 1.00 0.00 C ATOM 1825 C VAL B 416 9.235 -6.940 3.534 1.00 0.00 C ATOM 1826 O VAL B 416 9.134 -6.497 4.679 1.00 0.00 O ATOM 1827 CB VAL B 416 11.516 -7.108 2.546 1.00 0.00 C ATOM 1828 CG1 VAL B 416 12.132 -7.122 3.937 1.00 0.00 C ATOM 1829 CG2 VAL B 416 11.281 -8.526 2.043 1.00 0.00 C ATOM 0 H VAL B 416 10.848 -4.789 3.826 1.00 0.00 H new ATOM 0 HA VAL B 416 9.791 -6.327 1.539 1.00 0.00 H new ATOM 0 HB VAL B 416 12.216 -6.621 1.867 1.00 0.00 H new ATOM 0 HG11 VAL B 416 13.060 -7.693 3.918 1.00 0.00 H new ATOM 0 HG12 VAL B 416 12.341 -6.100 4.253 1.00 0.00 H new ATOM 0 HG13 VAL B 416 11.437 -7.583 4.638 1.00 0.00 H new ATOM 0 HG21 VAL B 416 12.223 -9.075 2.050 1.00 0.00 H new ATOM 0 HG22 VAL B 416 10.563 -9.028 2.692 1.00 0.00 H new ATOM 0 HG23 VAL B 416 10.889 -8.491 1.027 1.00 0.00 H new ATOM 1839 N GLY B 417 8.527 -7.967 3.102 1.00 0.00 N ATOM 1840 CA GLY B 417 7.585 -8.621 3.981 1.00 0.00 C ATOM 1841 C GLY B 417 7.211 -9.996 3.475 1.00 0.00 C ATOM 1842 O GLY B 417 7.357 -10.269 2.290 1.00 0.00 O ATOM 0 H GLY B 417 8.586 -8.359 2.162 1.00 0.00 H new ATOM 0 HA2 GLY B 417 8.016 -8.705 4.979 1.00 0.00 H new ATOM 0 HA3 GLY B 417 6.687 -8.010 4.072 1.00 0.00 H new ATOM 1846 N ARG B 418 6.743 -10.859 4.371 1.00 0.00 N ATOM 1847 CA ARG B 418 6.363 -12.223 3.998 1.00 0.00 C ATOM 1848 C ARG B 418 5.049 -12.248 3.221 1.00 0.00 C ATOM 1849 O ARG B 418 4.902 -12.991 2.251 1.00 0.00 O ATOM 1850 CB ARG B 418 6.248 -13.101 5.247 1.00 0.00 C ATOM 1851 CG ARG B 418 4.860 -13.102 5.868 1.00 0.00 C ATOM 1852 CD ARG B 418 4.897 -13.563 7.316 1.00 0.00 C ATOM 1853 NE ARG B 418 4.224 -14.845 7.497 1.00 0.00 N ATOM 1854 CZ ARG B 418 3.925 -15.358 8.685 1.00 0.00 C ATOM 1855 NH1 ARG B 418 4.237 -14.700 9.793 1.00 0.00 N ATOM 1856 NH2 ARG B 418 3.314 -16.532 8.766 1.00 0.00 N ATOM 0 H ARG B 418 6.617 -10.642 5.360 1.00 0.00 H new ATOM 0 HA ARG B 418 7.145 -12.618 3.349 1.00 0.00 H new ATOM 0 HB2 ARG B 418 6.521 -14.124 4.988 1.00 0.00 H new ATOM 0 HB3 ARG B 418 6.968 -12.757 5.989 1.00 0.00 H new ATOM 0 HG2 ARG B 418 4.436 -12.099 5.815 1.00 0.00 H new ATOM 0 HG3 ARG B 418 4.204 -13.756 5.294 1.00 0.00 H new ATOM 0 HD2 ARG B 418 5.933 -13.648 7.644 1.00 0.00 H new ATOM 0 HD3 ARG B 418 4.423 -12.812 7.948 1.00 0.00 H new ATOM 0 HE ARG B 418 3.969 -15.377 6.665 1.00 0.00 H new ATOM 0 HH11 ARG B 418 4.708 -13.797 9.734 1.00 0.00 H new ATOM 0 HH12 ARG B 418 4.006 -15.097 10.704 1.00 0.00 H new ATOM 0 HH21 ARG B 418 3.073 -17.041 7.916 1.00 0.00 H new ATOM 0 HH22 ARG B 418 3.085 -16.926 9.679 1.00 0.00 H new ATOM 1870 N ASN B 419 4.100 -11.425 3.650 1.00 0.00 N ATOM 1871 CA ASN B 419 2.802 -11.341 2.998 1.00 0.00 C ATOM 1872 C ASN B 419 2.759 -10.110 2.096 1.00 0.00 C ATOM 1873 O ASN B 419 1.699 -9.554 1.834 1.00 0.00 O ATOM 1874 CB ASN B 419 1.696 -11.286 4.062 1.00 0.00 C ATOM 1875 CG ASN B 419 0.360 -10.830 3.513 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -0.039 -11.213 2.416 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -0.339 -9.997 4.275 1.00 0.00 N ATOM 0 H ASN B 419 4.208 -10.803 4.452 1.00 0.00 H new ATOM 0 HA ASN B 419 2.640 -12.224 2.379 1.00 0.00 H new ATOM 0 HB2 ASN B 419 1.580 -12.274 4.507 1.00 0.00 H new ATOM 0 HB3 ASN B 419 2.003 -10.611 4.861 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -1.244 -9.651 3.955 1.00 0.00 H new ATOM 0 HD22 ASN B 419 0.029 -9.703 5.180 1.00 0.00 H new ATOM 1884 N ILE B 420 3.943 -9.713 1.627 1.00 0.00 N ATOM 1885 CA ILE B 420 4.136 -8.555 0.739 1.00 0.00 C ATOM 1886 C ILE B 420 3.560 -7.245 1.288 1.00 0.00 C ATOM 1887 O ILE B 420 4.237 -6.224 1.253 1.00 0.00 O ATOM 1888 CB ILE B 420 3.616 -8.795 -0.692 1.00 0.00 C ATOM 1889 CG1 ILE B 420 2.144 -8.397 -0.849 1.00 0.00 C ATOM 1890 CG2 ILE B 420 3.822 -10.246 -1.100 1.00 0.00 C ATOM 1891 CD1 ILE B 420 1.939 -6.921 -1.104 1.00 0.00 C ATOM 0 H ILE B 420 4.814 -10.193 1.855 1.00 0.00 H new ATOM 0 HA ILE B 420 5.219 -8.442 0.697 1.00 0.00 H new ATOM 0 HB ILE B 420 4.196 -8.154 -1.356 1.00 0.00 H new ATOM 0 HG12 ILE B 420 1.709 -8.963 -1.673 1.00 0.00 H new ATOM 0 HG13 ILE B 420 1.602 -8.680 0.053 1.00 0.00 H new ATOM 0 HG21 ILE B 420 3.449 -10.396 -2.113 1.00 0.00 H new ATOM 0 HG22 ILE B 420 4.885 -10.486 -1.066 1.00 0.00 H new ATOM 0 HG23 ILE B 420 3.280 -10.897 -0.414 1.00 0.00 H new ATOM 0 HD11 ILE B 420 0.874 -6.714 -1.204 1.00 0.00 H new ATOM 0 HD12 ILE B 420 2.343 -6.348 -0.269 1.00 0.00 H new ATOM 0 HD13 ILE B 420 2.452 -6.636 -2.022 1.00 0.00 H new ATOM 1903 N LYS B 421 2.325 -7.255 1.771 1.00 0.00 N ATOM 1904 CA LYS B 421 1.736 -6.031 2.297 1.00 0.00 C ATOM 1905 C LYS B 421 2.757 -5.310 3.156 1.00 0.00 C ATOM 1906 O LYS B 421 3.142 -4.178 2.870 1.00 0.00 O ATOM 1907 CB LYS B 421 0.473 -6.310 3.094 1.00 0.00 C ATOM 1908 CG LYS B 421 -0.712 -5.564 2.533 1.00 0.00 C ATOM 1909 CD LYS B 421 -1.022 -6.039 1.126 1.00 0.00 C ATOM 1910 CE LYS B 421 -2.360 -6.753 1.068 1.00 0.00 C ATOM 1911 NZ LYS B 421 -2.207 -8.232 1.161 1.00 0.00 N ATOM 0 H LYS B 421 1.723 -8.077 1.810 1.00 0.00 H new ATOM 0 HA LYS B 421 1.452 -5.399 1.456 1.00 0.00 H new ATOM 0 HB2 LYS B 421 0.267 -7.380 3.087 1.00 0.00 H new ATOM 0 HB3 LYS B 421 0.627 -6.021 4.134 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -1.581 -5.715 3.174 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -0.505 -4.494 2.524 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -1.032 -5.187 0.446 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -0.234 -6.710 0.784 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -2.994 -6.402 1.882 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -2.867 -6.499 0.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -3.144 -8.681 1.118 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -1.623 -8.571 0.370 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -1.747 -8.477 2.061 1.00 0.00 H new ATOM 1925 N ILE B 422 3.225 -5.995 4.195 1.00 0.00 N ATOM 1926 CA ILE B 422 4.247 -5.431 5.075 1.00 0.00 C ATOM 1927 C ILE B 422 5.333 -4.770 4.246 1.00 0.00 C ATOM 1928 O ILE B 422 6.028 -3.882 4.719 1.00 0.00 O ATOM 1929 CB ILE B 422 4.929 -6.479 5.983 1.00 0.00 C ATOM 1930 CG1 ILE B 422 4.238 -7.837 5.882 1.00 0.00 C ATOM 1931 CG2 ILE B 422 4.959 -5.987 7.419 1.00 0.00 C ATOM 1932 CD1 ILE B 422 4.477 -8.528 4.557 1.00 0.00 C ATOM 0 H ILE B 422 2.917 -6.934 4.448 1.00 0.00 H new ATOM 0 HA ILE B 422 3.726 -4.716 5.712 1.00 0.00 H new ATOM 0 HB ILE B 422 5.955 -6.612 5.640 1.00 0.00 H new ATOM 0 HG12 ILE B 422 4.592 -8.479 6.689 1.00 0.00 H new ATOM 0 HG13 ILE B 422 3.166 -7.704 6.027 1.00 0.00 H new ATOM 0 HG21 ILE B 422 5.442 -6.734 8.049 1.00 0.00 H new ATOM 0 HG22 ILE B 422 5.517 -5.052 7.472 1.00 0.00 H new ATOM 0 HG23 ILE B 422 3.940 -5.821 7.768 1.00 0.00 H new ATOM 0 HD11 ILE B 422 3.960 -9.487 4.548 1.00 0.00 H new ATOM 0 HD12 ILE B 422 4.098 -7.904 3.748 1.00 0.00 H new ATOM 0 HD13 ILE B 422 5.546 -8.691 4.419 1.00 0.00 H new ATOM 1944 N ALA B 423 5.440 -5.186 2.989 1.00 0.00 N ATOM 1945 CA ALA B 423 6.404 -4.609 2.078 1.00 0.00 C ATOM 1946 C ALA B 423 5.850 -3.302 1.524 1.00 0.00 C ATOM 1947 O ALA B 423 6.521 -2.270 1.569 1.00 0.00 O ATOM 1948 CB ALA B 423 6.755 -5.575 0.963 1.00 0.00 C ATOM 0 H ALA B 423 4.865 -5.924 2.583 1.00 0.00 H new ATOM 0 HA ALA B 423 7.327 -4.403 2.620 1.00 0.00 H new ATOM 0 HB1 ALA B 423 7.481 -5.112 0.295 1.00 0.00 H new ATOM 0 HB2 ALA B 423 7.181 -6.483 1.389 1.00 0.00 H new ATOM 0 HB3 ALA B 423 5.855 -5.826 0.402 1.00 0.00 H new ATOM 1954 N GLY B 424 4.608 -3.333 1.029 1.00 0.00 N ATOM 1955 CA GLY B 424 4.010 -2.115 0.520 1.00 0.00 C ATOM 1956 C GLY B 424 4.015 -1.043 1.586 1.00 0.00 C ATOM 1957 O GLY B 424 4.457 0.087 1.359 1.00 0.00 O ATOM 0 H GLY B 424 4.020 -4.165 0.974 1.00 0.00 H new ATOM 0 HA2 GLY B 424 4.560 -1.770 -0.355 1.00 0.00 H new ATOM 0 HA3 GLY B 424 2.988 -2.311 0.197 1.00 0.00 H new ATOM 1961 N ILE B 425 3.558 -1.424 2.772 1.00 0.00 N ATOM 1962 CA ILE B 425 3.542 -0.520 3.904 1.00 0.00 C ATOM 1963 C ILE B 425 4.973 -0.176 4.287 1.00 0.00 C ATOM 1964 O ILE B 425 5.394 0.972 4.177 1.00 0.00 O ATOM 1965 CB ILE B 425 2.816 -1.137 5.113 1.00 0.00 C ATOM 1966 CG1 ILE B 425 1.320 -1.272 4.823 1.00 0.00 C ATOM 1967 CG2 ILE B 425 3.043 -0.291 6.357 1.00 0.00 C ATOM 1968 CD1 ILE B 425 1.009 -1.970 3.516 1.00 0.00 C ATOM 0 H ILE B 425 3.194 -2.356 2.970 1.00 0.00 H new ATOM 0 HA ILE B 425 3.000 0.381 3.615 1.00 0.00 H new ATOM 0 HB ILE B 425 3.225 -2.131 5.293 1.00 0.00 H new ATOM 0 HG12 ILE B 425 0.850 -1.822 5.638 1.00 0.00 H new ATOM 0 HG13 ILE B 425 0.872 -0.279 4.809 1.00 0.00 H new ATOM 0 HG21 ILE B 425 2.523 -0.741 7.203 1.00 0.00 H new ATOM 0 HG22 ILE B 425 4.110 -0.240 6.573 1.00 0.00 H new ATOM 0 HG23 ILE B 425 2.658 0.715 6.188 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -0.071 -2.027 3.382 1.00 0.00 H new ATOM 0 HD12 ILE B 425 1.448 -1.409 2.691 1.00 0.00 H new ATOM 0 HD13 ILE B 425 1.426 -2.977 3.533 1.00 0.00 H new ATOM 1980 N ARG B 426 5.722 -1.184 4.733 1.00 0.00 N ATOM 1981 CA ARG B 426 7.111 -0.975 5.115 1.00 0.00 C ATOM 1982 C ARG B 426 7.771 -0.004 4.145 1.00 0.00 C ATOM 1983 O ARG B 426 8.642 0.766 4.532 1.00 0.00 O ATOM 1984 CB ARG B 426 7.882 -2.295 5.149 1.00 0.00 C ATOM 1985 CG ARG B 426 9.366 -2.121 5.414 1.00 0.00 C ATOM 1986 CD ARG B 426 9.615 -1.457 6.758 1.00 0.00 C ATOM 1987 NE ARG B 426 11.023 -1.502 7.141 1.00 0.00 N ATOM 1988 CZ ARG B 426 11.618 -2.583 7.633 1.00 0.00 C ATOM 1989 NH1 ARG B 426 10.929 -3.701 7.804 1.00 0.00 N ATOM 1990 NH2 ARG B 426 12.903 -2.545 7.960 1.00 0.00 N ATOM 0 H ARG B 426 5.391 -2.143 4.837 1.00 0.00 H new ATOM 0 HA ARG B 426 7.130 -0.552 6.119 1.00 0.00 H new ATOM 0 HB2 ARG B 426 7.456 -2.936 5.921 1.00 0.00 H new ATOM 0 HB3 ARG B 426 7.749 -2.810 4.197 1.00 0.00 H new ATOM 0 HG2 ARG B 426 9.858 -3.093 5.390 1.00 0.00 H new ATOM 0 HG3 ARG B 426 9.811 -1.519 4.621 1.00 0.00 H new ATOM 0 HD2 ARG B 426 9.284 -0.419 6.716 1.00 0.00 H new ATOM 0 HD3 ARG B 426 9.016 -1.952 7.523 1.00 0.00 H new ATOM 0 HE ARG B 426 11.581 -0.656 7.024 1.00 0.00 H new ATOM 0 HH11 ARG B 426 9.940 -3.733 7.558 1.00 0.00 H new ATOM 0 HH12 ARG B 426 11.388 -4.530 8.182 1.00 0.00 H new ATOM 0 HH21 ARG B 426 13.436 -1.685 7.834 1.00 0.00 H new ATOM 0 HH22 ARG B 426 13.358 -3.376 8.338 1.00 0.00 H new ATOM 2004 N ALA B 427 7.324 -0.020 2.885 1.00 0.00 N ATOM 2005 CA ALA B 427 7.857 0.897 1.887 1.00 0.00 C ATOM 2006 C ALA B 427 7.481 2.317 2.289 1.00 0.00 C ATOM 2007 O ALA B 427 8.331 3.199 2.413 1.00 0.00 O ATOM 2008 CB ALA B 427 7.331 0.568 0.498 1.00 0.00 C ATOM 0 H ALA B 427 6.602 -0.653 2.540 1.00 0.00 H new ATOM 0 HA ALA B 427 8.942 0.799 1.846 1.00 0.00 H new ATOM 0 HB1 ALA B 427 7.747 1.270 -0.224 1.00 0.00 H new ATOM 0 HB2 ALA B 427 7.625 -0.447 0.229 1.00 0.00 H new ATOM 0 HB3 ALA B 427 6.244 0.644 0.493 1.00 0.00 H new ATOM 2014 N ALA B 428 6.198 2.523 2.537 1.00 0.00 N ATOM 2015 CA ALA B 428 5.731 3.822 2.980 1.00 0.00 C ATOM 2016 C ALA B 428 6.500 4.215 4.239 1.00 0.00 C ATOM 2017 O ALA B 428 7.081 5.297 4.322 1.00 0.00 O ATOM 2018 CB ALA B 428 4.233 3.811 3.247 1.00 0.00 C ATOM 0 H ALA B 428 5.470 1.815 2.440 1.00 0.00 H new ATOM 0 HA ALA B 428 5.911 4.554 2.193 1.00 0.00 H new ATOM 0 HB1 ALA B 428 3.915 4.800 3.577 1.00 0.00 H new ATOM 0 HB2 ALA B 428 3.702 3.546 2.333 1.00 0.00 H new ATOM 0 HB3 ALA B 428 4.007 3.079 4.023 1.00 0.00 H new ATOM 2024 N GLU B 429 6.511 3.308 5.214 1.00 0.00 N ATOM 2025 CA GLU B 429 7.218 3.536 6.469 1.00 0.00 C ATOM 2026 C GLU B 429 8.700 3.807 6.217 1.00 0.00 C ATOM 2027 O GLU B 429 9.335 4.570 6.940 1.00 0.00 O ATOM 2028 CB GLU B 429 7.061 2.326 7.391 1.00 0.00 C ATOM 2029 CG GLU B 429 6.542 2.679 8.774 1.00 0.00 C ATOM 2030 CD GLU B 429 7.609 2.562 9.844 1.00 0.00 C ATOM 2031 OE1 GLU B 429 8.795 2.408 9.484 1.00 0.00 O ATOM 2032 OE2 GLU B 429 7.259 2.623 11.042 1.00 0.00 O ATOM 0 H GLU B 429 6.037 2.407 5.157 1.00 0.00 H new ATOM 0 HA GLU B 429 6.783 4.412 6.950 1.00 0.00 H new ATOM 0 HB2 GLU B 429 6.380 1.613 6.928 1.00 0.00 H new ATOM 0 HB3 GLU B 429 8.025 1.828 7.490 1.00 0.00 H new ATOM 0 HG2 GLU B 429 6.154 3.697 8.763 1.00 0.00 H new ATOM 0 HG3 GLU B 429 5.709 2.022 9.024 1.00 0.00 H new ATOM 2039 N ASN B 430 9.237 3.199 5.168 1.00 0.00 N ATOM 2040 CA ASN B 430 10.632 3.405 4.810 1.00 0.00 C ATOM 2041 C ASN B 430 10.862 4.897 4.586 1.00 0.00 C ATOM 2042 O ASN B 430 11.881 5.456 4.992 1.00 0.00 O ATOM 2043 CB ASN B 430 10.984 2.592 3.564 1.00 0.00 C ATOM 2044 CG ASN B 430 11.125 1.114 3.866 1.00 0.00 C ATOM 2045 OD1 ASN B 430 10.491 0.278 3.224 1.00 0.00 O ATOM 2046 ND2 ASN B 430 11.953 0.786 4.850 1.00 0.00 N ATOM 0 H ASN B 430 8.730 2.562 4.553 1.00 0.00 H new ATOM 0 HA ASN B 430 11.282 3.063 5.615 1.00 0.00 H new ATOM 0 HB2 ASN B 430 10.211 2.735 2.809 1.00 0.00 H new ATOM 0 HB3 ASN B 430 11.916 2.965 3.140 1.00 0.00 H new ATOM 0 HD21 ASN B 430 12.084 -0.194 5.101 1.00 0.00 H new ATOM 0 HD22 ASN B 430 12.458 1.514 5.355 1.00 0.00 H new ATOM 2053 N ALA B 431 9.892 5.531 3.925 1.00 0.00 N ATOM 2054 CA ALA B 431 9.957 6.958 3.627 1.00 0.00 C ATOM 2055 C ALA B 431 9.826 7.805 4.891 1.00 0.00 C ATOM 2056 O ALA B 431 10.571 8.765 5.083 1.00 0.00 O ATOM 2057 CB ALA B 431 8.881 7.347 2.625 1.00 0.00 C ATOM 0 H ALA B 431 9.047 5.072 3.585 1.00 0.00 H new ATOM 0 HA ALA B 431 10.937 7.154 3.191 1.00 0.00 H new ATOM 0 HB1 ALA B 431 8.947 8.415 2.417 1.00 0.00 H new ATOM 0 HB2 ALA B 431 9.025 6.787 1.701 1.00 0.00 H new ATOM 0 HB3 ALA B 431 7.899 7.118 3.039 1.00 0.00 H new ATOM 2063 N LEU B 432 8.870 7.453 5.742 1.00 0.00 N ATOM 2064 CA LEU B 432 8.633 8.190 6.981 1.00 0.00 C ATOM 2065 C LEU B 432 9.663 7.834 8.047 1.00 0.00 C ATOM 2066 O LEU B 432 9.732 8.474 9.097 1.00 0.00 O ATOM 2067 CB LEU B 432 7.215 7.906 7.492 1.00 0.00 C ATOM 2068 CG LEU B 432 7.115 7.289 8.894 1.00 0.00 C ATOM 2069 CD1 LEU B 432 5.663 7.128 9.286 1.00 0.00 C ATOM 2070 CD2 LEU B 432 7.819 5.944 8.948 1.00 0.00 C ATOM 0 H LEU B 432 8.244 6.660 5.598 1.00 0.00 H new ATOM 0 HA LEU B 432 8.733 9.254 6.768 1.00 0.00 H new ATOM 0 HB2 LEU B 432 6.655 8.841 7.488 1.00 0.00 H new ATOM 0 HB3 LEU B 432 6.723 7.236 6.786 1.00 0.00 H new ATOM 0 HG LEU B 432 7.606 7.961 9.598 1.00 0.00 H new ATOM 0 HD11 LEU B 432 5.601 6.690 10.282 1.00 0.00 H new ATOM 0 HD12 LEU B 432 5.176 8.103 9.288 1.00 0.00 H new ATOM 0 HD13 LEU B 432 5.163 6.475 8.571 1.00 0.00 H new ATOM 0 HD21 LEU B 432 7.733 5.529 9.952 1.00 0.00 H new ATOM 0 HD22 LEU B 432 7.358 5.263 8.233 1.00 0.00 H new ATOM 0 HD23 LEU B 432 8.872 6.074 8.698 1.00 0.00 H new ATOM 2082 N ARG B 433 10.452 6.806 7.776 1.00 0.00 N ATOM 2083 CA ARG B 433 11.470 6.362 8.722 1.00 0.00 C ATOM 2084 C ARG B 433 12.722 7.233 8.653 1.00 0.00 C ATOM 2085 O ARG B 433 13.777 6.843 9.152 1.00 0.00 O ATOM 2086 CB ARG B 433 11.841 4.896 8.477 1.00 0.00 C ATOM 2087 CG ARG B 433 12.864 4.694 7.372 1.00 0.00 C ATOM 2088 CD ARG B 433 14.059 3.894 7.861 1.00 0.00 C ATOM 2089 NE ARG B 433 13.654 2.689 8.581 1.00 0.00 N ATOM 2090 CZ ARG B 433 14.512 1.865 9.174 1.00 0.00 C ATOM 2091 NH1 ARG B 433 15.812 2.121 9.133 1.00 0.00 N ATOM 2092 NH2 ARG B 433 14.069 0.787 9.808 1.00 0.00 N ATOM 0 H ARG B 433 10.409 6.264 6.913 1.00 0.00 H new ATOM 0 HA ARG B 433 11.044 6.458 9.721 1.00 0.00 H new ATOM 0 HB2 ARG B 433 12.232 4.471 9.402 1.00 0.00 H new ATOM 0 HB3 ARG B 433 10.937 4.340 8.228 1.00 0.00 H new ATOM 0 HG2 ARG B 433 12.398 4.178 6.533 1.00 0.00 H new ATOM 0 HG3 ARG B 433 13.200 5.663 7.003 1.00 0.00 H new ATOM 0 HD2 ARG B 433 14.682 3.616 7.011 1.00 0.00 H new ATOM 0 HD3 ARG B 433 14.670 4.518 8.513 1.00 0.00 H new ATOM 0 HE ARG B 433 12.659 2.468 8.631 1.00 0.00 H new ATOM 0 HH11 ARG B 433 16.153 2.950 8.647 1.00 0.00 H new ATOM 0 HH12 ARG B 433 16.471 1.489 9.588 1.00 0.00 H new ATOM 0 HH21 ARG B 433 13.069 0.590 9.841 1.00 0.00 H new ATOM 0 HH22 ARG B 433 14.729 0.156 10.263 1.00 0.00 H new ATOM 2106 N ASP B 434 12.608 8.416 8.053 1.00 0.00 N ATOM 2107 CA ASP B 434 13.743 9.328 7.954 1.00 0.00 C ATOM 2108 C ASP B 434 13.288 10.768 8.180 1.00 0.00 C ATOM 2109 O ASP B 434 13.096 11.523 7.226 1.00 0.00 O ATOM 2110 CB ASP B 434 14.412 9.203 6.587 1.00 0.00 C ATOM 2111 CG ASP B 434 15.145 7.887 6.420 1.00 0.00 C ATOM 2112 OD1 ASP B 434 15.534 7.291 7.446 1.00 0.00 O ATOM 2113 OD2 ASP B 434 15.331 7.455 5.264 1.00 0.00 O ATOM 0 H ASP B 434 11.747 8.763 7.631 1.00 0.00 H new ATOM 0 HA ASP B 434 14.466 9.060 8.724 1.00 0.00 H new ATOM 0 HB2 ASP B 434 13.657 9.297 5.806 1.00 0.00 H new ATOM 0 HB3 ASP B 434 15.114 10.026 6.452 1.00 0.00 H new ATOM 2118 N LYS B 435 13.111 11.138 9.443 1.00 0.00 N ATOM 2119 CA LYS B 435 12.668 12.486 9.792 1.00 0.00 C ATOM 2120 C LYS B 435 13.463 13.535 9.019 1.00 0.00 C ATOM 2121 O LYS B 435 12.892 14.346 8.292 1.00 0.00 O ATOM 2122 CB LYS B 435 12.785 12.715 11.309 1.00 0.00 C ATOM 2123 CG LYS B 435 14.081 13.382 11.745 1.00 0.00 C ATOM 2124 CD LYS B 435 14.062 13.747 13.218 1.00 0.00 C ATOM 2125 CE LYS B 435 13.170 14.946 13.483 1.00 0.00 C ATOM 2126 NZ LYS B 435 11.743 14.550 13.627 1.00 0.00 N ATOM 0 H LYS B 435 13.267 10.525 10.243 1.00 0.00 H new ATOM 0 HA LYS B 435 11.620 12.587 9.512 1.00 0.00 H new ATOM 0 HB2 LYS B 435 11.946 13.329 11.637 1.00 0.00 H new ATOM 0 HB3 LYS B 435 12.696 11.755 11.817 1.00 0.00 H new ATOM 0 HG2 LYS B 435 14.918 12.712 11.548 1.00 0.00 H new ATOM 0 HG3 LYS B 435 14.245 14.281 11.150 1.00 0.00 H new ATOM 0 HD2 LYS B 435 13.711 12.895 13.800 1.00 0.00 H new ATOM 0 HD3 LYS B 435 15.076 13.966 13.553 1.00 0.00 H new ATOM 0 HE2 LYS B 435 13.500 15.452 14.390 1.00 0.00 H new ATOM 0 HE3 LYS B 435 13.269 15.660 12.666 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 11.198 14.917 12.821 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 11.671 13.513 13.650 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 11.361 14.943 14.511 1.00 0.00 H new ATOM 2140 N LYS B 436 14.779 13.521 9.189 1.00 0.00 N ATOM 2141 CA LYS B 436 15.643 14.478 8.516 1.00 0.00 C ATOM 2142 C LYS B 436 15.322 14.530 7.027 1.00 0.00 C ATOM 2143 O LYS B 436 15.347 15.596 6.412 1.00 0.00 O ATOM 2144 CB LYS B 436 17.110 14.110 8.739 1.00 0.00 C ATOM 2145 CG LYS B 436 17.480 13.970 10.209 1.00 0.00 C ATOM 2146 CD LYS B 436 17.874 15.309 10.814 1.00 0.00 C ATOM 2147 CE LYS B 436 16.746 15.901 11.644 1.00 0.00 C ATOM 2148 NZ LYS B 436 17.141 16.083 13.069 1.00 0.00 N ATOM 0 H LYS B 436 15.270 12.857 9.788 1.00 0.00 H new ATOM 0 HA LYS B 436 15.466 15.467 8.938 1.00 0.00 H new ATOM 0 HB2 LYS B 436 17.324 13.172 8.227 1.00 0.00 H new ATOM 0 HB3 LYS B 436 17.742 14.873 8.284 1.00 0.00 H new ATOM 0 HG2 LYS B 436 16.636 13.555 10.760 1.00 0.00 H new ATOM 0 HG3 LYS B 436 18.306 13.266 10.312 1.00 0.00 H new ATOM 0 HD2 LYS B 436 18.758 15.181 11.439 1.00 0.00 H new ATOM 0 HD3 LYS B 436 18.144 16.003 10.018 1.00 0.00 H new ATOM 0 HE2 LYS B 436 16.452 16.862 11.223 1.00 0.00 H new ATOM 0 HE3 LYS B 436 15.874 15.249 11.589 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 16.345 16.489 13.601 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 17.398 15.162 13.478 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 17.957 16.726 13.124 1.00 0.00 H new ATOM 2162 N MET B 437 15.004 13.371 6.462 1.00 0.00 N ATOM 2163 CA MET B 437 14.660 13.279 5.050 1.00 0.00 C ATOM 2164 C MET B 437 13.266 13.850 4.801 1.00 0.00 C ATOM 2165 O MET B 437 13.078 14.706 3.938 1.00 0.00 O ATOM 2166 CB MET B 437 14.728 11.822 4.588 1.00 0.00 C ATOM 2167 CG MET B 437 14.158 11.598 3.198 1.00 0.00 C ATOM 2168 SD MET B 437 13.092 10.149 3.113 1.00 0.00 S ATOM 2169 CE MET B 437 11.475 10.915 3.191 1.00 0.00 C ATOM 0 H MET B 437 14.978 12.482 6.961 1.00 0.00 H new ATOM 0 HA MET B 437 15.379 13.864 4.477 1.00 0.00 H new ATOM 0 HB2 MET B 437 15.767 11.493 4.603 1.00 0.00 H new ATOM 0 HB3 MET B 437 14.186 11.198 5.299 1.00 0.00 H new ATOM 0 HG2 MET B 437 13.592 12.479 2.895 1.00 0.00 H new ATOM 0 HG3 MET B 437 14.977 11.485 2.487 1.00 0.00 H new ATOM 0 HE1 MET B 437 10.705 10.146 3.131 1.00 0.00 H new ATOM 0 HE2 MET B 437 11.374 11.457 4.131 1.00 0.00 H new ATOM 0 HE3 MET B 437 11.361 11.609 2.358 1.00 0.00 H new ATOM 2179 N LEU B 438 12.292 13.380 5.575 1.00 0.00 N ATOM 2180 CA LEU B 438 10.918 13.853 5.450 1.00 0.00 C ATOM 2181 C LEU B 438 10.864 15.371 5.519 1.00 0.00 C ATOM 2182 O LEU B 438 10.462 16.041 4.566 1.00 0.00 O ATOM 2183 CB LEU B 438 10.060 13.278 6.567 1.00 0.00 C ATOM 2184 CG LEU B 438 9.789 11.781 6.483 1.00 0.00 C ATOM 2185 CD1 LEU B 438 9.102 11.322 7.752 1.00 0.00 C ATOM 2186 CD2 LEU B 438 8.943 11.459 5.259 1.00 0.00 C ATOM 0 H LEU B 438 12.429 12.671 6.296 1.00 0.00 H new ATOM 0 HA LEU B 438 10.536 13.523 4.484 1.00 0.00 H new ATOM 0 HB2 LEU B 438 10.546 13.488 7.520 1.00 0.00 H new ATOM 0 HB3 LEU B 438 9.105 13.802 6.574 1.00 0.00 H new ATOM 0 HG LEU B 438 10.735 11.249 6.382 1.00 0.00 H new ATOM 0 HD11 LEU B 438 8.907 10.251 7.693 1.00 0.00 H new ATOM 0 HD12 LEU B 438 9.744 11.528 8.608 1.00 0.00 H new ATOM 0 HD13 LEU B 438 8.159 11.856 7.869 1.00 0.00 H new ATOM 0 HD21 LEU B 438 8.760 10.385 5.216 1.00 0.00 H new ATOM 0 HD22 LEU B 438 7.992 11.987 5.325 1.00 0.00 H new ATOM 0 HD23 LEU B 438 9.471 11.774 4.359 1.00 0.00 H new ATOM 2198 N ASP B 439 11.295 15.906 6.654 1.00 0.00 N ATOM 2199 CA ASP B 439 11.320 17.345 6.842 1.00 0.00 C ATOM 2200 C ASP B 439 11.982 17.980 5.633 1.00 0.00 C ATOM 2201 O ASP B 439 11.447 18.905 5.018 1.00 0.00 O ATOM 2202 CB ASP B 439 12.090 17.707 8.114 1.00 0.00 C ATOM 2203 CG ASP B 439 12.317 19.201 8.244 1.00 0.00 C ATOM 2204 OD1 ASP B 439 13.141 19.744 7.478 1.00 0.00 O ATOM 2205 OD2 ASP B 439 11.672 19.827 9.111 1.00 0.00 O ATOM 0 H ASP B 439 11.630 15.366 7.452 1.00 0.00 H new ATOM 0 HA ASP B 439 10.301 17.717 6.947 1.00 0.00 H new ATOM 0 HB2 ASP B 439 11.539 17.348 8.984 1.00 0.00 H new ATOM 0 HB3 ASP B 439 13.052 17.194 8.112 1.00 0.00 H new ATOM 2210 N PHE B 440 13.159 17.460 5.302 1.00 0.00 N ATOM 2211 CA PHE B 440 13.910 17.963 4.164 1.00 0.00 C ATOM 2212 C PHE B 440 12.944 18.257 3.020 1.00 0.00 C ATOM 2213 O PHE B 440 13.044 19.286 2.349 1.00 0.00 O ATOM 2214 CB PHE B 440 14.989 16.954 3.738 1.00 0.00 C ATOM 2215 CG PHE B 440 15.204 16.869 2.251 1.00 0.00 C ATOM 2216 CD1 PHE B 440 15.476 18.008 1.509 1.00 0.00 C ATOM 2217 CD2 PHE B 440 15.133 15.651 1.598 1.00 0.00 C ATOM 2218 CE1 PHE B 440 15.672 17.931 0.143 1.00 0.00 C ATOM 2219 CE2 PHE B 440 15.326 15.567 0.232 1.00 0.00 C ATOM 2220 CZ PHE B 440 15.597 16.708 -0.497 1.00 0.00 C ATOM 0 H PHE B 440 13.609 16.695 5.804 1.00 0.00 H new ATOM 0 HA PHE B 440 14.420 18.885 4.442 1.00 0.00 H new ATOM 0 HB2 PHE B 440 15.931 17.224 4.215 1.00 0.00 H new ATOM 0 HB3 PHE B 440 14.715 15.967 4.111 1.00 0.00 H new ATOM 0 HD1 PHE B 440 15.535 18.966 2.004 1.00 0.00 H new ATOM 0 HD2 PHE B 440 14.924 14.755 2.163 1.00 0.00 H new ATOM 0 HE1 PHE B 440 15.884 18.826 -0.424 1.00 0.00 H new ATOM 0 HE2 PHE B 440 15.265 14.610 -0.265 1.00 0.00 H new ATOM 0 HZ PHE B 440 15.750 16.645 -1.564 1.00 0.00 H new ATOM 2230 N TYR B 441 11.997 17.347 2.814 1.00 0.00 N ATOM 2231 CA TYR B 441 11.006 17.514 1.763 1.00 0.00 C ATOM 2232 C TYR B 441 10.079 18.671 2.077 1.00 0.00 C ATOM 2233 O TYR B 441 9.779 19.477 1.195 1.00 0.00 O ATOM 2234 CB TYR B 441 10.230 16.222 1.540 1.00 0.00 C ATOM 2235 CG TYR B 441 11.030 15.234 0.735 1.00 0.00 C ATOM 2236 CD1 TYR B 441 11.071 15.313 -0.649 1.00 0.00 C ATOM 2237 CD2 TYR B 441 11.785 14.256 1.360 1.00 0.00 C ATOM 2238 CE1 TYR B 441 11.835 14.439 -1.389 1.00 0.00 C ATOM 2239 CE2 TYR B 441 12.558 13.379 0.631 1.00 0.00 C ATOM 2240 CZ TYR B 441 12.581 13.473 -0.746 1.00 0.00 C ATOM 2241 OH TYR B 441 13.352 12.600 -1.480 1.00 0.00 O ATOM 0 H TYR B 441 11.897 16.491 3.360 1.00 0.00 H new ATOM 0 HA TYR B 441 11.527 17.750 0.835 1.00 0.00 H new ATOM 0 HB2 TYR B 441 9.968 15.782 2.502 1.00 0.00 H new ATOM 0 HB3 TYR B 441 9.295 16.442 1.025 1.00 0.00 H new ATOM 0 HD1 TYR B 441 10.494 16.073 -1.155 1.00 0.00 H new ATOM 0 HD2 TYR B 441 11.768 14.179 2.437 1.00 0.00 H new ATOM 0 HE1 TYR B 441 11.850 14.509 -2.467 1.00 0.00 H new ATOM 0 HE2 TYR B 441 13.142 12.623 1.134 1.00 0.00 H new ATOM 0 HH TYR B 441 13.649 13.039 -2.304 1.00 0.00 H new ATOM 2251 N ALA B 442 9.650 18.795 3.336 1.00 0.00 N ATOM 2252 CA ALA B 442 8.797 19.915 3.707 1.00 0.00 C ATOM 2253 C ALA B 442 9.363 21.160 3.048 1.00 0.00 C ATOM 2254 O ALA B 442 8.703 21.811 2.238 1.00 0.00 O ATOM 2255 CB ALA B 442 8.723 20.088 5.217 1.00 0.00 C ATOM 0 H ALA B 442 9.874 18.150 4.094 1.00 0.00 H new ATOM 0 HA ALA B 442 7.778 19.731 3.367 1.00 0.00 H new ATOM 0 HB1 ALA B 442 8.078 20.933 5.455 1.00 0.00 H new ATOM 0 HB2 ALA B 442 8.316 19.183 5.667 1.00 0.00 H new ATOM 0 HB3 ALA B 442 9.722 20.272 5.612 1.00 0.00 H new ATOM 2261 N LYS B 443 10.613 21.463 3.385 1.00 0.00 N ATOM 2262 CA LYS B 443 11.297 22.601 2.799 1.00 0.00 C ATOM 2263 C LYS B 443 11.128 22.538 1.287 1.00 0.00 C ATOM 2264 O LYS B 443 10.850 23.547 0.637 1.00 0.00 O ATOM 2265 CB LYS B 443 12.781 22.589 3.183 1.00 0.00 C ATOM 2266 CG LYS B 443 13.696 23.197 2.132 1.00 0.00 C ATOM 2267 CD LYS B 443 14.902 23.868 2.768 1.00 0.00 C ATOM 2268 CE LYS B 443 15.110 25.270 2.223 1.00 0.00 C ATOM 2269 NZ LYS B 443 16.408 25.848 2.667 1.00 0.00 N ATOM 0 H LYS B 443 11.168 20.936 4.059 1.00 0.00 H new ATOM 0 HA LYS B 443 10.867 23.529 3.176 1.00 0.00 H new ATOM 0 HB2 LYS B 443 12.908 23.133 4.119 1.00 0.00 H new ATOM 0 HB3 LYS B 443 13.090 21.560 3.368 1.00 0.00 H new ATOM 0 HG2 LYS B 443 14.030 22.420 1.445 1.00 0.00 H new ATOM 0 HG3 LYS B 443 13.141 23.926 1.542 1.00 0.00 H new ATOM 0 HD2 LYS B 443 14.767 23.913 3.849 1.00 0.00 H new ATOM 0 HD3 LYS B 443 15.793 23.268 2.583 1.00 0.00 H new ATOM 0 HE2 LYS B 443 15.077 25.245 1.134 1.00 0.00 H new ATOM 0 HE3 LYS B 443 14.294 25.913 2.553 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 16.514 26.805 2.275 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 16.430 25.895 3.706 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 17.188 25.248 2.331 1.00 0.00 H new ATOM 2283 N GLN B 444 11.280 21.330 0.736 1.00 0.00 N ATOM 2284 CA GLN B 444 11.128 21.104 -0.698 1.00 0.00 C ATOM 2285 C GLN B 444 9.649 21.166 -1.109 1.00 0.00 C ATOM 2286 O GLN B 444 9.306 20.949 -2.270 1.00 0.00 O ATOM 2287 CB GLN B 444 11.743 19.739 -1.068 1.00 0.00 C ATOM 2288 CG GLN B 444 10.733 18.633 -1.327 1.00 0.00 C ATOM 2289 CD GLN B 444 10.473 18.430 -2.803 1.00 0.00 C ATOM 2290 OE1 GLN B 444 10.075 17.349 -3.235 1.00 0.00 O ATOM 2291 NE2 GLN B 444 10.697 19.477 -3.587 1.00 0.00 N ATOM 0 H GLN B 444 11.510 20.491 1.268 1.00 0.00 H new ATOM 0 HA GLN B 444 11.653 21.891 -1.240 1.00 0.00 H new ATOM 0 HB2 GLN B 444 12.360 19.864 -1.958 1.00 0.00 H new ATOM 0 HB3 GLN B 444 12.406 19.425 -0.262 1.00 0.00 H new ATOM 0 HG2 GLN B 444 11.097 17.702 -0.893 1.00 0.00 H new ATOM 0 HG3 GLN B 444 9.796 18.874 -0.825 1.00 0.00 H new ATOM 0 HE21 GLN B 444 11.027 20.354 -3.184 1.00 0.00 H new ATOM 0 HE22 GLN B 444 10.539 19.405 -4.592 1.00 0.00 H new ATOM 2300 N ARG B 445 8.784 21.479 -0.147 1.00 0.00 N ATOM 2301 CA ARG B 445 7.354 21.590 -0.396 1.00 0.00 C ATOM 2302 C ARG B 445 6.957 23.053 -0.569 1.00 0.00 C ATOM 2303 O ARG B 445 6.210 23.403 -1.482 1.00 0.00 O ATOM 2304 CB ARG B 445 6.564 20.968 0.759 1.00 0.00 C ATOM 2305 CG ARG B 445 5.355 20.163 0.309 1.00 0.00 C ATOM 2306 CD ARG B 445 4.513 20.938 -0.691 1.00 0.00 C ATOM 2307 NE ARG B 445 3.122 21.055 -0.263 1.00 0.00 N ATOM 2308 CZ ARG B 445 2.204 21.753 -0.926 1.00 0.00 C ATOM 2309 NH1 ARG B 445 2.530 22.387 -2.045 1.00 0.00 N ATOM 2310 NH2 ARG B 445 0.961 21.815 -0.472 1.00 0.00 N ATOM 0 H ARG B 445 9.055 21.661 0.819 1.00 0.00 H new ATOM 0 HA ARG B 445 7.121 21.051 -1.314 1.00 0.00 H new ATOM 0 HB2 ARG B 445 7.227 20.321 1.334 1.00 0.00 H new ATOM 0 HB3 ARG B 445 6.232 21.761 1.429 1.00 0.00 H new ATOM 0 HG2 ARG B 445 5.686 19.227 -0.140 1.00 0.00 H new ATOM 0 HG3 ARG B 445 4.746 19.903 1.175 1.00 0.00 H new ATOM 0 HD2 ARG B 445 4.936 21.934 -0.825 1.00 0.00 H new ATOM 0 HD3 ARG B 445 4.553 20.441 -1.660 1.00 0.00 H new ATOM 0 HE ARG B 445 2.839 20.575 0.591 1.00 0.00 H new ATOM 0 HH11 ARG B 445 3.486 22.340 -2.398 1.00 0.00 H new ATOM 0 HH12 ARG B 445 1.825 22.922 -2.552 1.00 0.00 H new ATOM 0 HH21 ARG B 445 0.707 21.327 0.387 1.00 0.00 H new ATOM 0 HH22 ARG B 445 0.258 22.351 -0.981 1.00 0.00 H new ATOM 2324 N ALA B 446 7.466 23.907 0.312 1.00 0.00 N ATOM 2325 CA ALA B 446 7.169 25.332 0.248 1.00 0.00 C ATOM 2326 C ALA B 446 8.021 26.014 -0.819 1.00 0.00 C ATOM 2327 O ALA B 446 7.576 26.951 -1.481 1.00 0.00 O ATOM 2328 CB ALA B 446 7.383 25.998 1.601 1.00 0.00 C ATOM 0 H ALA B 446 8.085 23.638 1.077 1.00 0.00 H new ATOM 0 HA ALA B 446 6.119 25.441 -0.023 1.00 0.00 H new ATOM 0 HB1 ALA B 446 7.154 27.061 1.524 1.00 0.00 H new ATOM 0 HB2 ALA B 446 6.727 25.538 2.341 1.00 0.00 H new ATOM 0 HB3 ALA B 446 8.421 25.872 1.908 1.00 0.00 H new ATOM 2334 N ALA B 447 9.251 25.534 -0.973 1.00 0.00 N ATOM 2335 CA ALA B 447 10.175 26.092 -1.953 1.00 0.00 C ATOM 2336 C ALA B 447 9.686 25.826 -3.369 1.00 0.00 C ATOM 2337 O ALA B 447 9.326 26.757 -4.088 1.00 0.00 O ATOM 2338 CB ALA B 447 11.574 25.526 -1.762 1.00 0.00 C ATOM 0 H ALA B 447 9.631 24.758 -0.430 1.00 0.00 H new ATOM 0 HA ALA B 447 10.216 27.170 -1.799 1.00 0.00 H new ATOM 0 HB1 ALA B 447 12.245 25.957 -2.505 1.00 0.00 H new ATOM 0 HB2 ALA B 447 11.933 25.772 -0.762 1.00 0.00 H new ATOM 0 HB3 ALA B 447 11.548 24.443 -1.882 1.00 0.00 H new