USER MOD reduce.3.24.130724 H: found=0, std=0, add=642, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 643 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 419 ASN : amide:sc= -4.77! C(o=-4.8!,f=-21!) USER MOD Set 1.2: B 421 LYS NZ :NH3+ -172:sc= 0 (180deg=0) USER MOD Set 2.1: B 368 MET CE :methyl 178:sc= -13.3! (180deg=-7.5!) USER MOD Set 2.2: B 369 ASN : amide:sc= -5.85! C(o=-19!,f=-19!) USER MOD Single : B 371 LYS NZ :NH3+ 171:sc= 0.0918 (180deg=0.0747) USER MOD Single : B 373 GLN : amide:sc= -9.42 K(o=-9.4,f=-4.2!) 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 380 TYR OH : rot 30:sc= -0.344 USER MOD Single : B 382 SER OG : rot -49:sc= 0.232 USER MOD Single : B 386 HIS : no HE2:sc= -3.17! C(o=-3.2!,f=-8.2!) USER MOD Single : B 387 TYR OH : rot -70:sc= -2.72! 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 153:sc= -4.19! USER MOD Single : B 399 ASN : amide:sc= -1.84 K(o=-1.8,f=-9.4!) USER MOD Single : B 400 SER OG : rot 5:sc= 0.965 USER MOD Single : B 404 CYS SG : rot 94:sc= 1.05 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 180:sc= -0.732 USER MOD Single : B 430 ASN : amide:sc= -1.03! C(o=-1!,f=-9.8!) USER MOD Single : B 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 436 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0541) USER MOD Single : B 437 MET CE :methyl -118:sc= -11.4! (180deg=-14.8!) USER MOD Single : B 441 TYR OH : rot 180:sc= -1.01 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN : amide:sc= -1.14 X(o=-1.1,f=-1!) USER MOD ----------------------------------------------------------------- ATOM 1069 N ASP B 367 -5.275 5.356 -17.615 1.00 0.00 N ATOM 1070 CA ASP B 367 -4.254 5.002 -16.633 1.00 0.00 C ATOM 1071 C ASP B 367 -2.856 5.121 -17.232 1.00 0.00 C ATOM 1072 O ASP B 367 -1.915 5.565 -16.565 1.00 0.00 O ATOM 1073 CB ASP B 367 -4.485 3.584 -16.104 1.00 0.00 C ATOM 1074 CG ASP B 367 -4.379 2.535 -17.194 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -3.242 2.177 -17.566 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -5.434 2.070 -17.674 1.00 0.00 O ATOM 0 HA ASP B 367 -4.331 5.702 -15.801 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -3.756 3.367 -15.323 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -5.471 3.527 -15.644 1.00 0.00 H new ATOM 1081 N MET B 368 -2.730 4.743 -18.502 1.00 0.00 N ATOM 1082 CA MET B 368 -1.455 4.831 -19.198 1.00 0.00 C ATOM 1083 C MET B 368 -0.921 6.254 -19.097 1.00 0.00 C ATOM 1084 O MET B 368 0.188 6.480 -18.614 1.00 0.00 O ATOM 1085 CB MET B 368 -1.615 4.421 -20.663 1.00 0.00 C ATOM 1086 CG MET B 368 -0.417 4.768 -21.531 1.00 0.00 C ATOM 1087 SD MET B 368 -0.884 5.683 -23.010 1.00 0.00 S ATOM 1088 CE MET B 368 -1.784 7.049 -22.279 1.00 0.00 C ATOM 0 H MET B 368 -3.495 4.374 -19.066 1.00 0.00 H new ATOM 0 HA MET B 368 -0.745 4.148 -18.732 1.00 0.00 H new ATOM 0 HB2 MET B 368 -1.789 3.346 -20.713 1.00 0.00 H new ATOM 0 HB3 MET B 368 -2.501 4.907 -21.072 1.00 0.00 H new ATOM 0 HG2 MET B 368 0.291 5.359 -20.950 1.00 0.00 H new ATOM 0 HG3 MET B 368 0.096 3.851 -21.821 1.00 0.00 H new ATOM 0 HE1 MET B 368 -2.111 7.731 -23.064 1.00 0.00 H new ATOM 0 HE2 MET B 368 -2.654 6.667 -21.744 1.00 0.00 H new ATOM 0 HE3 MET B 368 -1.135 7.581 -21.584 1.00 0.00 H new ATOM 1098 N ASN B 369 -1.736 7.218 -19.526 1.00 0.00 N ATOM 1099 CA ASN B 369 -1.359 8.622 -19.450 1.00 0.00 C ATOM 1100 C ASN B 369 -0.992 8.970 -18.017 1.00 0.00 C ATOM 1101 O ASN B 369 -0.065 9.739 -17.767 1.00 0.00 O ATOM 1102 CB ASN B 369 -2.511 9.519 -19.915 1.00 0.00 C ATOM 1103 CG ASN B 369 -2.655 9.554 -21.422 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -3.697 9.189 -21.966 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -1.606 9.991 -22.107 1.00 0.00 N ATOM 0 H ASN B 369 -2.658 7.049 -19.928 1.00 0.00 H new ATOM 0 HA ASN B 369 -0.503 8.789 -20.104 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -3.442 9.165 -19.474 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -2.349 10.532 -19.546 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -1.644 10.034 -23.125 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -0.762 10.284 -21.615 1.00 0.00 H new ATOM 1112 N ALA B 370 -1.731 8.389 -17.075 1.00 0.00 N ATOM 1113 CA ALA B 370 -1.491 8.627 -15.658 1.00 0.00 C ATOM 1114 C ALA B 370 -0.017 8.438 -15.321 1.00 0.00 C ATOM 1115 O ALA B 370 0.728 9.410 -15.188 1.00 0.00 O ATOM 1116 CB ALA B 370 -2.346 7.709 -14.798 1.00 0.00 C ATOM 0 H ALA B 370 -2.501 7.750 -17.270 1.00 0.00 H new ATOM 0 HA ALA B 370 -1.769 9.659 -15.443 1.00 0.00 H new ATOM 0 HB1 ALA B 370 -2.147 7.908 -13.745 1.00 0.00 H new ATOM 0 HB2 ALA B 370 -3.400 7.890 -15.009 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -2.104 6.670 -15.023 1.00 0.00 H new ATOM 1122 N LYS B 371 0.404 7.183 -15.191 1.00 0.00 N ATOM 1123 CA LYS B 371 1.796 6.879 -14.878 1.00 0.00 C ATOM 1124 C LYS B 371 2.720 7.789 -15.680 1.00 0.00 C ATOM 1125 O LYS B 371 3.712 8.316 -15.162 1.00 0.00 O ATOM 1126 CB LYS B 371 2.103 5.410 -15.184 1.00 0.00 C ATOM 1127 CG LYS B 371 1.265 4.831 -16.314 1.00 0.00 C ATOM 1128 CD LYS B 371 0.351 3.720 -15.820 1.00 0.00 C ATOM 1129 CE LYS B 371 0.773 2.364 -16.364 1.00 0.00 C ATOM 1130 NZ LYS B 371 -0.343 1.380 -16.330 1.00 0.00 N ATOM 0 H LYS B 371 -0.195 6.365 -15.297 1.00 0.00 H new ATOM 0 HA LYS B 371 1.963 7.053 -13.815 1.00 0.00 H new ATOM 0 HB2 LYS B 371 3.158 5.315 -15.441 1.00 0.00 H new ATOM 0 HB3 LYS B 371 1.940 4.819 -14.283 1.00 0.00 H new ATOM 0 HG2 LYS B 371 0.666 5.622 -16.766 1.00 0.00 H new ATOM 0 HG3 LYS B 371 1.921 4.444 -17.093 1.00 0.00 H new ATOM 0 HD2 LYS B 371 0.364 3.695 -14.730 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -0.675 3.931 -16.122 1.00 0.00 H new ATOM 0 HE2 LYS B 371 1.125 2.478 -17.389 1.00 0.00 H new ATOM 0 HE3 LYS B 371 1.611 1.983 -15.780 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -0.064 0.521 -16.845 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -0.561 1.136 -15.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -1.185 1.794 -16.778 1.00 0.00 H new ATOM 1144 N ARG B 372 2.371 7.976 -16.950 1.00 0.00 N ATOM 1145 CA ARG B 372 3.143 8.828 -17.843 1.00 0.00 C ATOM 1146 C ARG B 372 3.285 10.227 -17.255 1.00 0.00 C ATOM 1147 O ARG B 372 4.371 10.792 -17.227 1.00 0.00 O ATOM 1148 CB ARG B 372 2.468 8.901 -19.214 1.00 0.00 C ATOM 1149 CG ARG B 372 3.408 9.302 -20.339 1.00 0.00 C ATOM 1150 CD ARG B 372 2.673 10.070 -21.426 1.00 0.00 C ATOM 1151 NE ARG B 372 2.011 11.260 -20.903 1.00 0.00 N ATOM 1152 CZ ARG B 372 1.321 12.109 -21.656 1.00 0.00 C ATOM 1153 NH1 ARG B 372 1.206 11.900 -22.960 1.00 0.00 N ATOM 1154 NH2 ARG B 372 0.745 13.168 -21.104 1.00 0.00 N ATOM 0 H ARG B 372 1.554 7.546 -17.383 1.00 0.00 H new ATOM 0 HA ARG B 372 4.137 8.397 -17.960 1.00 0.00 H new ATOM 0 HB2 ARG B 372 2.032 7.929 -19.446 1.00 0.00 H new ATOM 0 HB3 ARG B 372 1.647 9.616 -19.167 1.00 0.00 H new ATOM 0 HG2 ARG B 372 4.215 9.916 -19.940 1.00 0.00 H new ATOM 0 HG3 ARG B 372 3.867 8.411 -20.767 1.00 0.00 H new ATOM 0 HD2 ARG B 372 3.378 10.360 -22.205 1.00 0.00 H new ATOM 0 HD3 ARG B 372 1.933 9.419 -21.892 1.00 0.00 H new ATOM 0 HE ARG B 372 2.082 11.451 -19.903 1.00 0.00 H new ATOM 0 HH11 ARG B 372 1.648 11.086 -23.387 1.00 0.00 H new ATOM 0 HH12 ARG B 372 0.676 12.553 -23.536 1.00 0.00 H new ATOM 0 HH21 ARG B 372 0.832 13.331 -20.101 1.00 0.00 H new ATOM 0 HH22 ARG B 372 0.215 13.820 -21.683 1.00 0.00 H new ATOM 1168 N GLN B 373 2.180 10.781 -16.778 1.00 0.00 N ATOM 1169 CA GLN B 373 2.199 12.111 -16.185 1.00 0.00 C ATOM 1170 C GLN B 373 3.186 12.164 -15.026 1.00 0.00 C ATOM 1171 O GLN B 373 3.991 13.086 -14.911 1.00 0.00 O ATOM 1172 CB GLN B 373 0.801 12.493 -15.689 1.00 0.00 C ATOM 1173 CG GLN B 373 0.316 13.833 -16.216 1.00 0.00 C ATOM 1174 CD GLN B 373 1.293 14.957 -15.934 1.00 0.00 C ATOM 1175 OE1 GLN B 373 1.406 15.907 -16.708 1.00 0.00 O ATOM 1176 NE2 GLN B 373 2.006 14.855 -14.817 1.00 0.00 N ATOM 0 H GLN B 373 1.263 10.334 -16.789 1.00 0.00 H new ATOM 0 HA GLN B 373 2.513 12.821 -16.950 1.00 0.00 H new ATOM 0 HB2 GLN B 373 0.095 11.718 -15.986 1.00 0.00 H new ATOM 0 HB3 GLN B 373 0.806 12.520 -14.599 1.00 0.00 H new ATOM 0 HG2 GLN B 373 0.153 13.759 -17.291 1.00 0.00 H new ATOM 0 HG3 GLN B 373 -0.647 14.071 -15.763 1.00 0.00 H new ATOM 0 HE21 GLN B 373 1.880 14.050 -14.204 1.00 0.00 H new ATOM 0 HE22 GLN B 373 2.679 15.582 -14.573 1.00 0.00 H new ATOM 1185 N LEU B 374 3.109 11.168 -14.162 1.00 0.00 N ATOM 1186 CA LEU B 374 3.975 11.102 -12.998 1.00 0.00 C ATOM 1187 C LEU B 374 5.452 11.259 -13.356 1.00 0.00 C ATOM 1188 O LEU B 374 6.076 12.265 -13.016 1.00 0.00 O ATOM 1189 CB LEU B 374 3.760 9.782 -12.251 1.00 0.00 C ATOM 1190 CG LEU B 374 2.299 9.346 -12.101 1.00 0.00 C ATOM 1191 CD1 LEU B 374 2.108 8.553 -10.818 1.00 0.00 C ATOM 1192 CD2 LEU B 374 1.375 10.553 -12.122 1.00 0.00 C ATOM 0 H LEU B 374 2.453 10.391 -14.245 1.00 0.00 H new ATOM 0 HA LEU B 374 3.705 11.939 -12.355 1.00 0.00 H new ATOM 0 HB2 LEU B 374 4.305 8.995 -12.773 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.200 9.870 -11.258 1.00 0.00 H new ATOM 0 HG LEU B 374 2.045 8.704 -12.945 1.00 0.00 H new ATOM 0 HD11 LEU B 374 1.064 8.252 -10.728 1.00 0.00 H new ATOM 0 HD12 LEU B 374 2.741 7.666 -10.841 1.00 0.00 H new ATOM 0 HD13 LEU B 374 2.382 9.172 -9.964 1.00 0.00 H new ATOM 0 HD21 LEU B 374 0.342 10.222 -12.014 1.00 0.00 H new ATOM 0 HD22 LEU B 374 1.630 11.221 -11.299 1.00 0.00 H new ATOM 0 HD23 LEU B 374 1.490 11.083 -13.068 1.00 0.00 H new ATOM 1204 N TYR B 375 6.020 10.245 -14.006 1.00 0.00 N ATOM 1205 CA TYR B 375 7.443 10.266 -14.354 1.00 0.00 C ATOM 1206 C TYR B 375 7.740 10.994 -15.664 1.00 0.00 C ATOM 1207 O TYR B 375 8.719 11.734 -15.757 1.00 0.00 O ATOM 1208 CB TYR B 375 7.979 8.837 -14.431 1.00 0.00 C ATOM 1209 CG TYR B 375 8.532 8.332 -13.118 1.00 0.00 C ATOM 1210 CD1 TYR B 375 7.771 8.391 -11.957 1.00 0.00 C ATOM 1211 CD2 TYR B 375 9.811 7.800 -13.040 1.00 0.00 C ATOM 1212 CE1 TYR B 375 8.272 7.934 -10.754 1.00 0.00 C ATOM 1213 CE2 TYR B 375 10.318 7.340 -11.840 1.00 0.00 C ATOM 1214 CZ TYR B 375 9.546 7.409 -10.701 1.00 0.00 C ATOM 1215 OH TYR B 375 10.049 6.950 -9.504 1.00 0.00 O ATOM 0 H TYR B 375 5.523 9.404 -14.301 1.00 0.00 H new ATOM 0 HA TYR B 375 7.945 10.824 -13.564 1.00 0.00 H new ATOM 0 HB2 TYR B 375 7.179 8.174 -14.759 1.00 0.00 H new ATOM 0 HB3 TYR B 375 8.762 8.791 -15.188 1.00 0.00 H new ATOM 0 HD1 TYR B 375 6.772 8.801 -11.996 1.00 0.00 H new ATOM 0 HD2 TYR B 375 10.419 7.745 -13.931 1.00 0.00 H new ATOM 0 HE1 TYR B 375 7.669 7.987 -9.859 1.00 0.00 H new ATOM 0 HE2 TYR B 375 11.315 6.928 -11.795 1.00 0.00 H new ATOM 0 HH TYR B 375 10.958 6.611 -9.640 1.00 0.00 H new ATOM 1225 N SER B 376 6.917 10.771 -16.677 1.00 0.00 N ATOM 1226 CA SER B 376 7.130 11.400 -17.979 1.00 0.00 C ATOM 1227 C SER B 376 6.973 12.918 -17.918 1.00 0.00 C ATOM 1228 O SER B 376 7.593 13.639 -18.700 1.00 0.00 O ATOM 1229 CB SER B 376 6.169 10.819 -19.019 1.00 0.00 C ATOM 1230 OG SER B 376 6.748 10.835 -20.313 1.00 0.00 O ATOM 0 H SER B 376 6.099 10.164 -16.627 1.00 0.00 H new ATOM 0 HA SER B 376 8.157 11.184 -18.273 1.00 0.00 H new ATOM 0 HB2 SER B 376 5.908 9.796 -18.746 1.00 0.00 H new ATOM 0 HB3 SER B 376 5.243 11.394 -19.024 1.00 0.00 H new ATOM 0 HG SER B 376 6.115 10.457 -20.959 1.00 0.00 H new ATOM 1236 N LEU B 377 6.140 13.409 -17.002 1.00 0.00 N ATOM 1237 CA LEU B 377 5.921 14.848 -16.883 1.00 0.00 C ATOM 1238 C LEU B 377 6.510 15.408 -15.592 1.00 0.00 C ATOM 1239 O LEU B 377 7.144 16.463 -15.598 1.00 0.00 O ATOM 1240 CB LEU B 377 4.427 15.169 -16.956 1.00 0.00 C ATOM 1241 CG LEU B 377 3.863 15.288 -18.372 1.00 0.00 C ATOM 1242 CD1 LEU B 377 4.423 16.519 -19.068 1.00 0.00 C ATOM 1243 CD2 LEU B 377 4.178 14.035 -19.173 1.00 0.00 C ATOM 0 H LEU B 377 5.612 12.840 -16.340 1.00 0.00 H new ATOM 0 HA LEU B 377 6.434 15.324 -17.719 1.00 0.00 H new ATOM 0 HB2 LEU B 377 3.877 14.392 -16.426 1.00 0.00 H new ATOM 0 HB3 LEU B 377 4.245 16.105 -16.428 1.00 0.00 H new ATOM 0 HG LEU B 377 2.780 15.394 -18.305 1.00 0.00 H new ATOM 0 HD11 LEU B 377 4.010 16.587 -20.075 1.00 0.00 H new ATOM 0 HD12 LEU B 377 4.152 17.411 -18.503 1.00 0.00 H new ATOM 0 HD13 LEU B 377 5.509 16.442 -19.125 1.00 0.00 H new ATOM 0 HD21 LEU B 377 3.770 14.134 -20.179 1.00 0.00 H new ATOM 0 HD22 LEU B 377 5.258 13.902 -19.231 1.00 0.00 H new ATOM 0 HD23 LEU B 377 3.732 13.169 -18.684 1.00 0.00 H new ATOM 1255 N ILE B 378 6.287 14.713 -14.483 1.00 0.00 N ATOM 1256 CA ILE B 378 6.789 15.167 -13.193 1.00 0.00 C ATOM 1257 C ILE B 378 7.762 14.163 -12.590 1.00 0.00 C ATOM 1258 O ILE B 378 7.620 13.757 -11.436 1.00 0.00 O ATOM 1259 CB ILE B 378 5.634 15.419 -12.208 1.00 0.00 C ATOM 1260 CG1 ILE B 378 4.352 15.718 -12.980 1.00 0.00 C ATOM 1261 CG2 ILE B 378 5.967 16.569 -11.267 1.00 0.00 C ATOM 1262 CD1 ILE B 378 4.391 17.039 -13.722 1.00 0.00 C ATOM 0 H ILE B 378 5.765 13.838 -14.451 1.00 0.00 H new ATOM 0 HA ILE B 378 7.318 16.104 -13.368 1.00 0.00 H new ATOM 0 HB ILE B 378 5.487 14.522 -11.606 1.00 0.00 H new ATOM 0 HG12 ILE B 378 4.170 14.914 -13.693 1.00 0.00 H new ATOM 0 HG13 ILE B 378 3.512 15.724 -12.286 1.00 0.00 H new ATOM 0 HG21 ILE B 378 5.136 16.729 -10.580 1.00 0.00 H new ATOM 0 HG22 ILE B 378 6.866 16.326 -10.700 1.00 0.00 H new ATOM 0 HG23 ILE B 378 6.138 17.476 -11.847 1.00 0.00 H new ATOM 0 HD11 ILE B 378 3.449 17.188 -14.249 1.00 0.00 H new ATOM 0 HD12 ILE B 378 4.542 17.851 -13.011 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.211 17.029 -14.440 1.00 0.00 H new ATOM 1274 N GLY B 379 8.754 13.773 -13.380 1.00 0.00 N ATOM 1275 CA GLY B 379 9.747 12.825 -12.914 1.00 0.00 C ATOM 1276 C GLY B 379 11.143 13.180 -13.384 1.00 0.00 C ATOM 1277 O GLY B 379 11.890 12.314 -13.840 1.00 0.00 O ATOM 0 H GLY B 379 8.889 14.097 -14.338 1.00 0.00 H new ATOM 0 HA2 GLY B 379 9.730 12.790 -11.825 1.00 0.00 H new ATOM 0 HA3 GLY B 379 9.489 11.827 -13.269 1.00 0.00 H new ATOM 1281 N TYR B 380 11.494 14.457 -13.280 1.00 0.00 N ATOM 1282 CA TYR B 380 12.808 14.923 -13.704 1.00 0.00 C ATOM 1283 C TYR B 380 13.807 14.877 -12.552 1.00 0.00 C ATOM 1284 O TYR B 380 14.931 14.407 -12.715 1.00 0.00 O ATOM 1285 CB TYR B 380 12.716 16.343 -14.262 1.00 0.00 C ATOM 1286 CG TYR B 380 12.321 17.378 -13.234 1.00 0.00 C ATOM 1287 CD1 TYR B 380 13.246 17.864 -12.317 1.00 0.00 C ATOM 1288 CD2 TYR B 380 11.025 17.876 -13.184 1.00 0.00 C ATOM 1289 CE1 TYR B 380 12.889 18.815 -11.379 1.00 0.00 C ATOM 1290 CE2 TYR B 380 10.661 18.826 -12.249 1.00 0.00 C ATOM 1291 CZ TYR B 380 11.596 19.293 -11.350 1.00 0.00 C ATOM 1292 OH TYR B 380 11.238 20.239 -10.418 1.00 0.00 O ATOM 0 H TYR B 380 10.887 15.187 -12.906 1.00 0.00 H new ATOM 0 HA TYR B 380 13.162 14.255 -14.489 1.00 0.00 H new ATOM 0 HB2 TYR B 380 13.680 16.619 -14.689 1.00 0.00 H new ATOM 0 HB3 TYR B 380 11.991 16.357 -15.076 1.00 0.00 H new ATOM 0 HD1 TYR B 380 14.260 17.493 -12.338 1.00 0.00 H new ATOM 0 HD2 TYR B 380 10.290 17.515 -13.888 1.00 0.00 H new ATOM 0 HE1 TYR B 380 13.619 19.182 -10.673 1.00 0.00 H new ATOM 0 HE2 TYR B 380 9.649 19.201 -12.223 1.00 0.00 H new ATOM 0 HH TYR B 380 12.016 20.794 -10.200 1.00 0.00 H new ATOM 1302 N ALA B 381 13.391 15.365 -11.386 1.00 0.00 N ATOM 1303 CA ALA B 381 14.262 15.371 -10.218 1.00 0.00 C ATOM 1304 C ALA B 381 13.783 16.365 -9.164 1.00 0.00 C ATOM 1305 O ALA B 381 12.675 16.894 -9.242 1.00 0.00 O ATOM 1306 CB ALA B 381 15.697 15.685 -10.618 1.00 0.00 C ATOM 0 H ALA B 381 12.463 15.758 -11.227 1.00 0.00 H new ATOM 0 HA ALA B 381 14.226 14.373 -9.781 1.00 0.00 H new ATOM 0 HB1 ALA B 381 16.330 15.684 -9.731 1.00 0.00 H new ATOM 0 HB2 ALA B 381 16.053 14.930 -11.319 1.00 0.00 H new ATOM 0 HB3 ALA B 381 15.736 16.666 -11.091 1.00 0.00 H new ATOM 1312 N SER B 382 14.643 16.619 -8.182 1.00 0.00 N ATOM 1313 CA SER B 382 14.342 17.554 -7.102 1.00 0.00 C ATOM 1314 C SER B 382 12.923 17.372 -6.563 1.00 0.00 C ATOM 1315 O SER B 382 12.358 18.296 -5.977 1.00 0.00 O ATOM 1316 CB SER B 382 14.527 18.992 -7.589 1.00 0.00 C ATOM 1317 OG SER B 382 14.660 19.887 -6.499 1.00 0.00 O ATOM 0 H SER B 382 15.564 16.185 -8.112 1.00 0.00 H new ATOM 0 HA SER B 382 15.036 17.345 -6.288 1.00 0.00 H new ATOM 0 HB2 SER B 382 15.411 19.053 -8.224 1.00 0.00 H new ATOM 0 HB3 SER B 382 13.674 19.284 -8.201 1.00 0.00 H new ATOM 0 HG SER B 382 13.945 19.720 -5.850 1.00 0.00 H new ATOM 1323 N LEU B 383 12.344 16.194 -6.767 1.00 0.00 N ATOM 1324 CA LEU B 383 10.987 15.929 -6.298 1.00 0.00 C ATOM 1325 C LEU B 383 10.919 14.656 -5.457 1.00 0.00 C ATOM 1326 O LEU B 383 9.858 14.298 -4.953 1.00 0.00 O ATOM 1327 CB LEU B 383 10.031 15.826 -7.488 1.00 0.00 C ATOM 1328 CG LEU B 383 9.966 14.450 -8.155 1.00 0.00 C ATOM 1329 CD1 LEU B 383 8.783 14.371 -9.106 1.00 0.00 C ATOM 1330 CD2 LEU B 383 11.263 14.157 -8.893 1.00 0.00 C ATOM 0 H LEU B 383 12.788 15.413 -7.250 1.00 0.00 H new ATOM 0 HA LEU B 383 10.686 16.762 -5.663 1.00 0.00 H new ATOM 0 HB2 LEU B 383 9.030 16.098 -7.154 1.00 0.00 H new ATOM 0 HB3 LEU B 383 10.327 16.561 -8.236 1.00 0.00 H new ATOM 0 HG LEU B 383 9.831 13.697 -7.378 1.00 0.00 H new ATOM 0 HD11 LEU B 383 8.754 13.385 -9.570 1.00 0.00 H new ATOM 0 HD12 LEU B 383 7.859 14.538 -8.552 1.00 0.00 H new ATOM 0 HD13 LEU B 383 8.886 15.133 -9.879 1.00 0.00 H new ATOM 0 HD21 LEU B 383 11.201 13.175 -9.362 1.00 0.00 H new ATOM 0 HD22 LEU B 383 11.425 14.915 -9.659 1.00 0.00 H new ATOM 0 HD23 LEU B 383 12.094 14.170 -8.188 1.00 0.00 H new ATOM 1342 N ARG B 384 12.064 13.995 -5.291 1.00 0.00 N ATOM 1343 CA ARG B 384 12.140 12.770 -4.493 1.00 0.00 C ATOM 1344 C ARG B 384 10.823 11.998 -4.533 1.00 0.00 C ATOM 1345 O ARG B 384 10.290 11.610 -3.494 1.00 0.00 O ATOM 1346 CB ARG B 384 12.491 13.107 -3.043 1.00 0.00 C ATOM 1347 CG ARG B 384 13.933 12.801 -2.677 1.00 0.00 C ATOM 1348 CD ARG B 384 14.153 11.310 -2.493 1.00 0.00 C ATOM 1349 NE ARG B 384 15.566 10.955 -2.569 1.00 0.00 N ATOM 1350 CZ ARG B 384 16.007 9.766 -2.968 1.00 0.00 C ATOM 1351 NH1 ARG B 384 15.147 8.818 -3.313 1.00 0.00 N ATOM 1352 NH2 ARG B 384 17.310 9.525 -3.019 1.00 0.00 N ATOM 0 H ARG B 384 12.953 14.287 -5.698 1.00 0.00 H new ATOM 0 HA ARG B 384 12.920 12.142 -4.922 1.00 0.00 H new ATOM 0 HB2 ARG B 384 12.298 14.165 -2.868 1.00 0.00 H new ATOM 0 HB3 ARG B 384 11.831 12.549 -2.379 1.00 0.00 H new ATOM 0 HG2 ARG B 384 14.595 13.174 -3.458 1.00 0.00 H new ATOM 0 HG3 ARG B 384 14.196 13.325 -1.758 1.00 0.00 H new ATOM 0 HD2 ARG B 384 13.752 11.000 -1.528 1.00 0.00 H new ATOM 0 HD3 ARG B 384 13.600 10.764 -3.258 1.00 0.00 H new ATOM 0 HE ARG B 384 16.254 11.659 -2.301 1.00 0.00 H new ATOM 0 HH11 ARG B 384 14.144 9.000 -3.273 1.00 0.00 H new ATOM 0 HH12 ARG B 384 15.488 7.907 -3.619 1.00 0.00 H new ATOM 0 HH21 ARG B 384 17.974 10.252 -2.752 1.00 0.00 H new ATOM 0 HH22 ARG B 384 17.648 8.613 -3.325 1.00 0.00 H new ATOM 1366 N LEU B 385 10.297 11.785 -5.736 1.00 0.00 N ATOM 1367 CA LEU B 385 9.037 11.069 -5.900 1.00 0.00 C ATOM 1368 C LEU B 385 9.123 9.662 -5.341 1.00 0.00 C ATOM 1369 O LEU B 385 10.047 8.910 -5.652 1.00 0.00 O ATOM 1370 CB LEU B 385 8.623 11.018 -7.372 1.00 0.00 C ATOM 1371 CG LEU B 385 7.120 11.162 -7.624 1.00 0.00 C ATOM 1372 CD1 LEU B 385 6.873 11.921 -8.915 1.00 0.00 C ATOM 1373 CD2 LEU B 385 6.446 9.797 -7.666 1.00 0.00 C ATOM 0 H LEU B 385 10.723 12.097 -6.609 1.00 0.00 H new ATOM 0 HA LEU B 385 8.280 11.617 -5.339 1.00 0.00 H new ATOM 0 HB2 LEU B 385 9.144 11.811 -7.909 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.959 10.072 -7.796 1.00 0.00 H new ATOM 0 HG LEU B 385 6.685 11.728 -6.800 1.00 0.00 H new ATOM 0 HD11 LEU B 385 5.800 12.016 -9.082 1.00 0.00 H new ATOM 0 HD12 LEU B 385 7.319 12.913 -8.845 1.00 0.00 H new ATOM 0 HD13 LEU B 385 7.323 11.380 -9.747 1.00 0.00 H new ATOM 0 HD21 LEU B 385 5.378 9.924 -7.846 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.881 9.201 -8.468 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.595 9.288 -6.714 1.00 0.00 H new ATOM 1385 N HIS B 386 8.148 9.315 -4.515 1.00 0.00 N ATOM 1386 CA HIS B 386 8.104 7.993 -3.908 1.00 0.00 C ATOM 1387 C HIS B 386 6.755 7.735 -3.250 1.00 0.00 C ATOM 1388 O HIS B 386 6.429 8.323 -2.216 1.00 0.00 O ATOM 1389 CB HIS B 386 9.229 7.841 -2.881 1.00 0.00 C ATOM 1390 CG HIS B 386 9.114 8.778 -1.718 1.00 0.00 C ATOM 1391 ND1 HIS B 386 9.816 9.964 -1.634 1.00 0.00 N ATOM 1392 CD2 HIS B 386 8.376 8.700 -0.585 1.00 0.00 C ATOM 1393 CE1 HIS B 386 9.513 10.574 -0.501 1.00 0.00 C ATOM 1394 NE2 HIS B 386 8.641 9.828 0.152 1.00 0.00 N ATOM 0 H HIS B 386 7.378 9.929 -4.250 1.00 0.00 H new ATOM 0 HA HIS B 386 8.243 7.256 -4.699 1.00 0.00 H new ATOM 0 HB2 HIS B 386 9.235 6.816 -2.511 1.00 0.00 H new ATOM 0 HB3 HIS B 386 10.186 8.007 -3.376 1.00 0.00 H new ATOM 0 HD1 HIS B 386 10.467 10.315 -2.337 1.00 0.00 H new ATOM 0 HD2 HIS B 386 7.704 7.900 -0.312 1.00 0.00 H new ATOM 0 HE1 HIS B 386 9.911 11.521 -0.167 1.00 0.00 H new ATOM 1403 N TYR B 387 5.969 6.854 -3.858 1.00 0.00 N ATOM 1404 CA TYR B 387 4.657 6.515 -3.333 1.00 0.00 C ATOM 1405 C TYR B 387 4.750 6.031 -1.895 1.00 0.00 C ATOM 1406 O TYR B 387 5.840 5.882 -1.342 1.00 0.00 O ATOM 1407 CB TYR B 387 3.995 5.443 -4.196 1.00 0.00 C ATOM 1408 CG TYR B 387 3.175 6.020 -5.321 1.00 0.00 C ATOM 1409 CD1 TYR B 387 3.608 7.150 -5.996 1.00 0.00 C ATOM 1410 CD2 TYR B 387 1.971 5.444 -5.701 1.00 0.00 C ATOM 1411 CE1 TYR B 387 2.866 7.693 -7.021 1.00 0.00 C ATOM 1412 CE2 TYR B 387 1.220 5.981 -6.729 1.00 0.00 C ATOM 1413 CZ TYR B 387 1.672 7.106 -7.386 1.00 0.00 C ATOM 1414 OH TYR B 387 0.928 7.647 -8.410 1.00 0.00 O ATOM 0 H TYR B 387 6.220 6.362 -4.716 1.00 0.00 H new ATOM 0 HA TYR B 387 4.048 7.419 -3.356 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.764 4.791 -4.611 1.00 0.00 H new ATOM 0 HB3 TYR B 387 3.356 4.822 -3.568 1.00 0.00 H new ATOM 0 HD1 TYR B 387 4.542 7.612 -5.714 1.00 0.00 H new ATOM 0 HD2 TYR B 387 1.616 4.564 -5.186 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.217 8.574 -7.537 1.00 0.00 H new ATOM 0 HE2 TYR B 387 0.285 5.523 -7.016 1.00 0.00 H new ATOM 0 HH TYR B 387 0.547 8.502 -8.121 1.00 0.00 H new ATOM 1424 N VAL B 388 3.593 5.785 -1.299 1.00 0.00 N ATOM 1425 CA VAL B 388 3.522 5.315 0.072 1.00 0.00 C ATOM 1426 C VAL B 388 2.215 4.602 0.354 1.00 0.00 C ATOM 1427 O VAL B 388 1.168 5.227 0.541 1.00 0.00 O ATOM 1428 CB VAL B 388 3.692 6.449 1.085 1.00 0.00 C ATOM 1429 CG1 VAL B 388 5.013 6.277 1.803 1.00 0.00 C ATOM 1430 CG2 VAL B 388 3.593 7.803 0.400 1.00 0.00 C ATOM 0 H VAL B 388 2.686 5.905 -1.749 1.00 0.00 H new ATOM 0 HA VAL B 388 4.349 4.615 0.186 1.00 0.00 H new ATOM 0 HB VAL B 388 2.889 6.408 1.821 1.00 0.00 H new ATOM 0 HG11 VAL B 388 5.141 7.082 2.527 1.00 0.00 H new ATOM 0 HG12 VAL B 388 5.023 5.318 2.321 1.00 0.00 H new ATOM 0 HG13 VAL B 388 5.827 6.307 1.079 1.00 0.00 H new ATOM 0 HG21 VAL B 388 3.717 8.595 1.139 1.00 0.00 H new ATOM 0 HG22 VAL B 388 4.374 7.887 -0.355 1.00 0.00 H new ATOM 0 HG23 VAL B 388 2.617 7.900 -0.075 1.00 0.00 H new ATOM 1440 N THR B 389 2.293 3.288 0.366 1.00 0.00 N ATOM 1441 CA THR B 389 1.127 2.455 0.616 1.00 0.00 C ATOM 1442 C THR B 389 0.790 2.435 2.098 1.00 0.00 C ATOM 1443 O THR B 389 1.481 1.796 2.891 1.00 0.00 O ATOM 1444 CB THR B 389 1.341 1.009 0.130 1.00 0.00 C ATOM 1445 OG1 THR B 389 1.425 0.948 -1.300 1.00 0.00 O ATOM 1446 CG2 THR B 389 0.198 0.113 0.586 1.00 0.00 C ATOM 0 H THR B 389 3.155 2.768 0.205 1.00 0.00 H new ATOM 0 HA THR B 389 0.300 2.891 0.055 1.00 0.00 H new ATOM 0 HB THR B 389 2.280 0.662 0.562 1.00 0.00 H new ATOM 0 HG1 THR B 389 1.563 0.019 -1.580 1.00 0.00 H new ATOM 0 HG21 THR B 389 0.369 -0.904 0.232 1.00 0.00 H new ATOM 0 HG22 THR B 389 0.147 0.114 1.675 1.00 0.00 H new ATOM 0 HG23 THR B 389 -0.742 0.486 0.178 1.00 0.00 H new ATOM 1454 N VAL B 390 -0.278 3.132 2.468 1.00 0.00 N ATOM 1455 CA VAL B 390 -0.696 3.178 3.858 1.00 0.00 C ATOM 1456 C VAL B 390 -2.025 2.458 4.044 1.00 0.00 C ATOM 1457 O VAL B 390 -2.848 2.394 3.128 1.00 0.00 O ATOM 1458 CB VAL B 390 -0.811 4.626 4.374 1.00 0.00 C ATOM 1459 CG1 VAL B 390 0.521 5.346 4.237 1.00 0.00 C ATOM 1460 CG2 VAL B 390 -1.904 5.379 3.639 1.00 0.00 C ATOM 0 H VAL B 390 -0.864 3.668 1.828 1.00 0.00 H new ATOM 0 HA VAL B 390 0.073 2.671 4.441 1.00 0.00 H new ATOM 0 HB VAL B 390 -1.078 4.591 5.430 1.00 0.00 H new ATOM 0 HG11 VAL B 390 0.422 6.367 4.606 1.00 0.00 H new ATOM 0 HG12 VAL B 390 1.279 4.822 4.818 1.00 0.00 H new ATOM 0 HG13 VAL B 390 0.818 5.366 3.188 1.00 0.00 H new ATOM 0 HG21 VAL B 390 -1.965 6.398 4.022 1.00 0.00 H new ATOM 0 HG22 VAL B 390 -1.675 5.405 2.574 1.00 0.00 H new ATOM 0 HG23 VAL B 390 -2.859 4.876 3.793 1.00 0.00 H new ATOM 1470 N LYS B 391 -2.219 1.902 5.231 1.00 0.00 N ATOM 1471 CA LYS B 391 -3.438 1.172 5.541 1.00 0.00 C ATOM 1472 C LYS B 391 -3.455 -0.165 4.813 1.00 0.00 C ATOM 1473 O LYS B 391 -4.439 -0.517 4.161 1.00 0.00 O ATOM 1474 CB LYS B 391 -4.664 1.996 5.151 1.00 0.00 C ATOM 1475 CG LYS B 391 -5.968 1.458 5.716 1.00 0.00 C ATOM 1476 CD LYS B 391 -5.859 1.182 7.206 1.00 0.00 C ATOM 1477 CE LYS B 391 -5.347 2.399 7.960 1.00 0.00 C ATOM 1478 NZ LYS B 391 -5.797 2.405 9.379 1.00 0.00 N ATOM 0 H LYS B 391 -1.546 1.943 5.996 1.00 0.00 H new ATOM 0 HA LYS B 391 -3.466 0.987 6.615 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -4.526 3.021 5.494 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -4.736 2.031 4.064 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -6.767 2.177 5.536 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -6.241 0.541 5.194 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -6.835 0.894 7.597 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -5.188 0.340 7.373 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -4.258 2.416 7.925 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -5.696 3.305 7.465 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -5.426 3.251 9.857 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -6.836 2.415 9.414 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -5.443 1.553 9.859 1.00 0.00 H new ATOM 1492 N LYS B 392 -2.351 -0.900 4.920 1.00 0.00 N ATOM 1493 CA LYS B 392 -2.224 -2.197 4.266 1.00 0.00 C ATOM 1494 C LYS B 392 -3.562 -2.924 4.220 1.00 0.00 C ATOM 1495 O LYS B 392 -4.364 -2.835 5.150 1.00 0.00 O ATOM 1496 CB LYS B 392 -1.183 -3.055 4.986 1.00 0.00 C ATOM 1497 CG LYS B 392 0.126 -3.184 4.223 1.00 0.00 C ATOM 1498 CD LYS B 392 1.261 -3.631 5.129 1.00 0.00 C ATOM 1499 CE LYS B 392 1.694 -2.519 6.070 1.00 0.00 C ATOM 1500 NZ LYS B 392 1.594 -2.929 7.498 1.00 0.00 N ATOM 0 H LYS B 392 -1.530 -0.617 5.455 1.00 0.00 H new ATOM 0 HA LYS B 392 -1.896 -2.025 3.241 1.00 0.00 H new ATOM 0 HB2 LYS B 392 -0.982 -2.623 5.966 1.00 0.00 H new ATOM 0 HB3 LYS B 392 -1.596 -4.049 5.154 1.00 0.00 H new ATOM 0 HG2 LYS B 392 0.005 -3.900 3.410 1.00 0.00 H new ATOM 0 HG3 LYS B 392 0.379 -2.226 3.768 1.00 0.00 H new ATOM 0 HD2 LYS B 392 0.945 -4.498 5.710 1.00 0.00 H new ATOM 0 HD3 LYS B 392 2.110 -3.946 4.522 1.00 0.00 H new ATOM 0 HE2 LYS B 392 2.722 -2.233 5.846 1.00 0.00 H new ATOM 0 HE3 LYS B 392 1.074 -1.639 5.901 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 1.898 -2.143 8.107 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 0.609 -3.177 7.720 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 2.205 -3.754 7.666 1.00 0.00 H new ATOM 1514 N PRO B 393 -3.818 -3.652 3.124 1.00 0.00 N ATOM 1515 CA PRO B 393 -5.066 -4.399 2.936 1.00 0.00 C ATOM 1516 C PRO B 393 -5.308 -5.420 4.044 1.00 0.00 C ATOM 1517 O PRO B 393 -4.505 -5.552 4.968 1.00 0.00 O ATOM 1518 CB PRO B 393 -4.864 -5.112 1.596 1.00 0.00 C ATOM 1519 CG PRO B 393 -3.803 -4.332 0.897 1.00 0.00 C ATOM 1520 CD PRO B 393 -2.908 -3.795 1.976 1.00 0.00 C ATOM 0 HA PRO B 393 -5.934 -3.740 2.958 1.00 0.00 H new ATOM 0 HB2 PRO B 393 -4.559 -6.148 1.743 1.00 0.00 H new ATOM 0 HB3 PRO B 393 -5.787 -5.130 1.016 1.00 0.00 H new ATOM 0 HG2 PRO B 393 -3.245 -4.964 0.206 1.00 0.00 H new ATOM 0 HG3 PRO B 393 -4.236 -3.522 0.310 1.00 0.00 H new ATOM 0 HD2 PRO B 393 -2.087 -4.477 2.195 1.00 0.00 H new ATOM 0 HD3 PRO B 393 -2.463 -2.841 1.693 1.00 0.00 H new ATOM 1528 N THR B 394 -6.423 -6.138 3.943 1.00 0.00 N ATOM 1529 CA THR B 394 -6.776 -7.149 4.935 1.00 0.00 C ATOM 1530 C THR B 394 -7.803 -8.131 4.377 1.00 0.00 C ATOM 1531 O THR B 394 -8.551 -7.806 3.456 1.00 0.00 O ATOM 1532 CB THR B 394 -7.343 -6.513 6.220 1.00 0.00 C ATOM 1533 OG1 THR B 394 -8.751 -6.742 6.333 1.00 0.00 O ATOM 1534 CG2 THR B 394 -7.096 -5.012 6.245 1.00 0.00 C ATOM 0 H THR B 394 -7.098 -6.039 3.184 1.00 0.00 H new ATOM 0 HA THR B 394 -5.856 -7.681 5.179 1.00 0.00 H new ATOM 0 HB THR B 394 -6.828 -6.983 7.058 1.00 0.00 H new ATOM 0 HG1 THR B 394 -9.008 -6.736 7.279 1.00 0.00 H new ATOM 0 HG21 THR B 394 -7.507 -4.591 7.163 1.00 0.00 H new ATOM 0 HG22 THR B 394 -6.024 -4.819 6.205 1.00 0.00 H new ATOM 0 HG23 THR B 394 -7.580 -4.549 5.385 1.00 0.00 H new ATOM 1542 N ALA B 395 -7.831 -9.335 4.940 1.00 0.00 N ATOM 1543 CA ALA B 395 -8.765 -10.366 4.496 1.00 0.00 C ATOM 1544 C ALA B 395 -10.209 -9.899 4.641 1.00 0.00 C ATOM 1545 O ALA B 395 -11.103 -10.402 3.959 1.00 0.00 O ATOM 1546 CB ALA B 395 -8.554 -11.661 5.265 1.00 0.00 C ATOM 0 H ALA B 395 -7.219 -9.621 5.704 1.00 0.00 H new ATOM 0 HA ALA B 395 -8.568 -10.554 3.440 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -9.262 -12.412 4.915 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -7.537 -12.018 5.104 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -8.711 -11.482 6.329 1.00 0.00 H new ATOM 1552 N VAL B 396 -10.434 -8.937 5.529 1.00 0.00 N ATOM 1553 CA VAL B 396 -11.766 -8.406 5.758 1.00 0.00 C ATOM 1554 C VAL B 396 -11.775 -6.901 5.552 1.00 0.00 C ATOM 1555 O VAL B 396 -12.728 -6.212 5.918 1.00 0.00 O ATOM 1556 CB VAL B 396 -12.270 -8.735 7.177 1.00 0.00 C ATOM 1557 CG1 VAL B 396 -11.951 -10.179 7.532 1.00 0.00 C ATOM 1558 CG2 VAL B 396 -11.663 -7.784 8.198 1.00 0.00 C ATOM 0 H VAL B 396 -9.706 -8.510 6.102 1.00 0.00 H new ATOM 0 HA VAL B 396 -12.436 -8.878 5.039 1.00 0.00 H new ATOM 0 HB VAL B 396 -13.352 -8.607 7.196 1.00 0.00 H new ATOM 0 HG11 VAL B 396 -12.313 -10.395 8.537 1.00 0.00 H new ATOM 0 HG12 VAL B 396 -12.438 -10.845 6.820 1.00 0.00 H new ATOM 0 HG13 VAL B 396 -10.873 -10.333 7.494 1.00 0.00 H new ATOM 0 HG21 VAL B 396 -12.032 -8.034 9.193 1.00 0.00 H new ATOM 0 HG22 VAL B 396 -10.577 -7.876 8.180 1.00 0.00 H new ATOM 0 HG23 VAL B 396 -11.944 -6.760 7.953 1.00 0.00 H new ATOM 1568 N ASP B 397 -10.703 -6.404 4.952 1.00 0.00 N ATOM 1569 CA ASP B 397 -10.565 -4.987 4.677 1.00 0.00 C ATOM 1570 C ASP B 397 -9.572 -4.758 3.540 1.00 0.00 C ATOM 1571 O ASP B 397 -8.631 -3.976 3.674 1.00 0.00 O ATOM 1572 CB ASP B 397 -10.114 -4.232 5.929 1.00 0.00 C ATOM 1573 CG ASP B 397 -11.240 -3.441 6.565 1.00 0.00 C ATOM 1574 OD1 ASP B 397 -12.405 -3.876 6.458 1.00 0.00 O ATOM 1575 OD2 ASP B 397 -10.955 -2.384 7.168 1.00 0.00 O ATOM 0 H ASP B 397 -9.911 -6.969 4.645 1.00 0.00 H new ATOM 0 HA ASP B 397 -11.540 -4.604 4.375 1.00 0.00 H new ATOM 0 HB2 ASP B 397 -9.718 -4.942 6.655 1.00 0.00 H new ATOM 0 HB3 ASP B 397 -9.300 -3.555 5.668 1.00 0.00 H new ATOM 1580 N PRO B 398 -9.773 -5.446 2.405 1.00 0.00 N ATOM 1581 CA PRO B 398 -8.896 -5.324 1.237 1.00 0.00 C ATOM 1582 C PRO B 398 -8.587 -3.872 0.892 1.00 0.00 C ATOM 1583 O PRO B 398 -7.532 -3.565 0.336 1.00 0.00 O ATOM 1584 CB PRO B 398 -9.717 -5.973 0.121 1.00 0.00 C ATOM 1585 CG PRO B 398 -10.563 -6.980 0.816 1.00 0.00 C ATOM 1586 CD PRO B 398 -10.875 -6.401 2.172 1.00 0.00 C ATOM 0 HA PRO B 398 -7.924 -5.788 1.403 1.00 0.00 H new ATOM 0 HB2 PRO B 398 -10.326 -5.236 -0.403 1.00 0.00 H new ATOM 0 HB3 PRO B 398 -9.074 -6.442 -0.624 1.00 0.00 H new ATOM 0 HG2 PRO B 398 -11.477 -7.174 0.255 1.00 0.00 H new ATOM 0 HG3 PRO B 398 -10.039 -7.931 0.910 1.00 0.00 H new ATOM 0 HD2 PRO B 398 -11.845 -5.904 2.182 1.00 0.00 H new ATOM 0 HD3 PRO B 398 -10.905 -7.174 2.940 1.00 0.00 H new ATOM 1594 N ASN B 399 -9.519 -2.985 1.215 1.00 0.00 N ATOM 1595 CA ASN B 399 -9.361 -1.569 0.933 1.00 0.00 C ATOM 1596 C ASN B 399 -8.049 -1.037 1.495 1.00 0.00 C ATOM 1597 O ASN B 399 -7.710 -1.275 2.655 1.00 0.00 O ATOM 1598 CB ASN B 399 -10.530 -0.783 1.516 1.00 0.00 C ATOM 1599 CG ASN B 399 -10.660 -0.978 3.010 1.00 0.00 C ATOM 1600 OD1 ASN B 399 -10.372 -2.053 3.536 1.00 0.00 O ATOM 1601 ND2 ASN B 399 -11.094 0.064 3.699 1.00 0.00 N ATOM 0 H ASN B 399 -10.397 -3.226 1.675 1.00 0.00 H new ATOM 0 HA ASN B 399 -9.345 -1.443 -0.150 1.00 0.00 H new ATOM 0 HB2 ASN B 399 -10.397 0.277 1.300 1.00 0.00 H new ATOM 0 HB3 ASN B 399 -11.454 -1.094 1.029 1.00 0.00 H new ATOM 0 HD21 ASN B 399 -11.202 -0.003 4.711 1.00 0.00 H new ATOM 0 HD22 ASN B 399 -11.320 0.935 3.218 1.00 0.00 H new ATOM 1608 N SER B 400 -7.325 -0.308 0.661 1.00 0.00 N ATOM 1609 CA SER B 400 -6.051 0.279 1.054 1.00 0.00 C ATOM 1610 C SER B 400 -5.970 1.722 0.577 1.00 0.00 C ATOM 1611 O SER B 400 -6.483 2.059 -0.493 1.00 0.00 O ATOM 1612 CB SER B 400 -4.886 -0.531 0.482 1.00 0.00 C ATOM 1613 OG SER B 400 -3.970 -0.896 1.500 1.00 0.00 O ATOM 0 H SER B 400 -7.600 -0.107 -0.300 1.00 0.00 H new ATOM 0 HA SER B 400 -5.983 0.261 2.142 1.00 0.00 H new ATOM 0 HB2 SER B 400 -5.268 -1.427 -0.007 1.00 0.00 H new ATOM 0 HB3 SER B 400 -4.372 0.054 -0.281 1.00 0.00 H new ATOM 0 HG SER B 400 -4.317 -0.609 2.370 1.00 0.00 H new ATOM 1619 N ILE B 401 -5.340 2.575 1.376 1.00 0.00 N ATOM 1620 CA ILE B 401 -5.209 3.976 1.035 1.00 0.00 C ATOM 1621 C ILE B 401 -3.780 4.313 0.626 1.00 0.00 C ATOM 1622 O ILE B 401 -2.900 4.491 1.469 1.00 0.00 O ATOM 1623 CB ILE B 401 -5.659 4.860 2.218 1.00 0.00 C ATOM 1624 CG1 ILE B 401 -5.055 6.266 2.134 1.00 0.00 C ATOM 1625 CG2 ILE B 401 -5.301 4.209 3.543 1.00 0.00 C ATOM 1626 CD1 ILE B 401 -5.579 7.087 0.979 1.00 0.00 C ATOM 0 H ILE B 401 -4.913 2.315 2.265 1.00 0.00 H new ATOM 0 HA ILE B 401 -5.856 4.178 0.181 1.00 0.00 H new ATOM 0 HB ILE B 401 -6.743 4.958 2.158 1.00 0.00 H new ATOM 0 HG12 ILE B 401 -5.258 6.795 3.065 1.00 0.00 H new ATOM 0 HG13 ILE B 401 -3.972 6.181 2.045 1.00 0.00 H new ATOM 0 HG21 ILE B 401 -5.627 4.849 4.363 1.00 0.00 H new ATOM 0 HG22 ILE B 401 -5.797 3.241 3.619 1.00 0.00 H new ATOM 0 HG23 ILE B 401 -4.222 4.069 3.600 1.00 0.00 H new ATOM 0 HD11 ILE B 401 -5.105 8.069 0.986 1.00 0.00 H new ATOM 0 HD12 ILE B 401 -5.352 6.581 0.041 1.00 0.00 H new ATOM 0 HD13 ILE B 401 -6.658 7.204 1.076 1.00 0.00 H new ATOM 1638 N VAL B 402 -3.555 4.394 -0.680 1.00 0.00 N ATOM 1639 CA VAL B 402 -2.239 4.714 -1.206 1.00 0.00 C ATOM 1640 C VAL B 402 -1.923 6.183 -0.963 1.00 0.00 C ATOM 1641 O VAL B 402 -2.824 6.992 -0.717 1.00 0.00 O ATOM 1642 CB VAL B 402 -2.132 4.405 -2.715 1.00 0.00 C ATOM 1643 CG1 VAL B 402 -0.729 3.934 -3.068 1.00 0.00 C ATOM 1644 CG2 VAL B 402 -3.163 3.363 -3.122 1.00 0.00 C ATOM 0 H VAL B 402 -4.269 4.242 -1.392 1.00 0.00 H new ATOM 0 HA VAL B 402 -1.516 4.088 -0.682 1.00 0.00 H new ATOM 0 HB VAL B 402 -2.334 5.323 -3.267 1.00 0.00 H new ATOM 0 HG11 VAL B 402 -0.674 3.721 -4.136 1.00 0.00 H new ATOM 0 HG12 VAL B 402 -0.009 4.713 -2.816 1.00 0.00 H new ATOM 0 HG13 VAL B 402 -0.497 3.030 -2.506 1.00 0.00 H new ATOM 0 HG21 VAL B 402 -3.072 3.158 -4.189 1.00 0.00 H new ATOM 0 HG22 VAL B 402 -2.993 2.444 -2.561 1.00 0.00 H new ATOM 0 HG23 VAL B 402 -4.164 3.739 -2.909 1.00 0.00 H new ATOM 1654 N GLU B 403 -0.650 6.530 -1.072 1.00 0.00 N ATOM 1655 CA GLU B 403 -0.199 7.896 -0.892 1.00 0.00 C ATOM 1656 C GLU B 403 1.008 8.137 -1.765 1.00 0.00 C ATOM 1657 O GLU B 403 1.699 7.204 -2.155 1.00 0.00 O ATOM 1658 CB GLU B 403 0.161 8.150 0.573 1.00 0.00 C ATOM 1659 CG GLU B 403 0.739 9.534 0.820 1.00 0.00 C ATOM 1660 CD GLU B 403 1.270 9.703 2.229 1.00 0.00 C ATOM 1661 OE1 GLU B 403 1.900 8.755 2.743 1.00 0.00 O ATOM 1662 OE2 GLU B 403 1.055 10.783 2.818 1.00 0.00 O ATOM 0 H GLU B 403 0.098 5.871 -1.288 1.00 0.00 H new ATOM 0 HA GLU B 403 -1.001 8.579 -1.174 1.00 0.00 H new ATOM 0 HB2 GLU B 403 -0.731 8.022 1.186 1.00 0.00 H new ATOM 0 HB3 GLU B 403 0.882 7.400 0.898 1.00 0.00 H new ATOM 0 HG2 GLU B 403 1.543 9.720 0.108 1.00 0.00 H new ATOM 0 HG3 GLU B 403 -0.031 10.283 0.634 1.00 0.00 H new ATOM 1669 N CYS B 404 1.266 9.385 -2.055 1.00 0.00 N ATOM 1670 CA CYS B 404 2.410 9.751 -2.856 1.00 0.00 C ATOM 1671 C CYS B 404 3.108 10.881 -2.153 1.00 0.00 C ATOM 1672 O CYS B 404 2.459 11.826 -1.720 1.00 0.00 O ATOM 1673 CB CYS B 404 2.002 10.164 -4.271 1.00 0.00 C ATOM 1674 SG CYS B 404 3.392 10.340 -5.415 1.00 0.00 S ATOM 0 H CYS B 404 0.696 10.173 -1.747 1.00 0.00 H new ATOM 0 HA CYS B 404 3.074 8.893 -2.965 1.00 0.00 H new ATOM 0 HB2 CYS B 404 1.309 9.423 -4.669 1.00 0.00 H new ATOM 0 HB3 CYS B 404 1.463 11.110 -4.221 1.00 0.00 H new ATOM 0 HG CYS B 404 3.570 9.224 -6.057 1.00 0.00 H new ATOM 1680 N ARG B 405 4.413 10.753 -1.992 1.00 0.00 N ATOM 1681 CA ARG B 405 5.194 11.762 -1.298 1.00 0.00 C ATOM 1682 C ARG B 405 6.409 12.168 -2.124 1.00 0.00 C ATOM 1683 O ARG B 405 7.186 11.322 -2.565 1.00 0.00 O ATOM 1684 CB ARG B 405 5.621 11.234 0.069 1.00 0.00 C ATOM 1685 CG ARG B 405 6.340 12.266 0.923 1.00 0.00 C ATOM 1686 CD ARG B 405 5.457 12.763 2.055 1.00 0.00 C ATOM 1687 NE ARG B 405 5.489 11.867 3.207 1.00 0.00 N ATOM 1688 CZ ARG B 405 4.749 12.040 4.296 1.00 0.00 C ATOM 1689 NH1 ARG B 405 3.919 13.072 4.380 1.00 0.00 N ATOM 1690 NH2 ARG B 405 4.838 11.181 5.302 1.00 0.00 N ATOM 0 H ARG B 405 4.955 9.959 -2.333 1.00 0.00 H new ATOM 0 HA ARG B 405 4.576 12.649 -1.156 1.00 0.00 H new ATOM 0 HB2 ARG B 405 4.739 10.882 0.605 1.00 0.00 H new ATOM 0 HB3 ARG B 405 6.274 10.372 -0.071 1.00 0.00 H new ATOM 0 HG2 ARG B 405 7.250 11.829 1.335 1.00 0.00 H new ATOM 0 HG3 ARG B 405 6.644 13.108 0.300 1.00 0.00 H new ATOM 0 HD2 ARG B 405 5.784 13.757 2.360 1.00 0.00 H new ATOM 0 HD3 ARG B 405 4.431 12.860 1.699 1.00 0.00 H new ATOM 0 HE ARG B 405 6.115 11.063 3.174 1.00 0.00 H new ATOM 0 HH11 ARG B 405 3.849 13.734 3.607 1.00 0.00 H new ATOM 0 HH12 ARG B 405 3.351 13.203 5.217 1.00 0.00 H new ATOM 0 HH21 ARG B 405 5.475 10.387 5.240 1.00 0.00 H new ATOM 0 HH22 ARG B 405 4.269 11.314 6.138 1.00 0.00 H new ATOM 1704 N VAL B 406 6.553 13.471 -2.342 1.00 0.00 N ATOM 1705 CA VAL B 406 7.658 14.001 -3.127 1.00 0.00 C ATOM 1706 C VAL B 406 8.446 15.039 -2.349 1.00 0.00 C ATOM 1707 O VAL B 406 7.872 15.922 -1.706 1.00 0.00 O ATOM 1708 CB VAL B 406 7.154 14.631 -4.429 1.00 0.00 C ATOM 1709 CG1 VAL B 406 7.203 13.612 -5.541 1.00 0.00 C ATOM 1710 CG2 VAL B 406 5.745 15.159 -4.250 1.00 0.00 C ATOM 0 H VAL B 406 5.914 14.181 -1.984 1.00 0.00 H new ATOM 0 HA VAL B 406 8.312 13.161 -3.359 1.00 0.00 H new ATOM 0 HB VAL B 406 7.799 15.469 -4.692 1.00 0.00 H new ATOM 0 HG11 VAL B 406 6.844 14.064 -6.465 1.00 0.00 H new ATOM 0 HG12 VAL B 406 8.230 13.273 -5.678 1.00 0.00 H new ATOM 0 HG13 VAL B 406 6.571 12.762 -5.284 1.00 0.00 H new ATOM 0 HG21 VAL B 406 5.402 15.603 -5.184 1.00 0.00 H new ATOM 0 HG22 VAL B 406 5.082 14.340 -3.973 1.00 0.00 H new ATOM 0 HG23 VAL B 406 5.737 15.914 -3.464 1.00 0.00 H new ATOM 1720 N GLY B 407 9.768 14.918 -2.402 1.00 0.00 N ATOM 1721 CA GLY B 407 10.624 15.839 -1.688 1.00 0.00 C ATOM 1722 C GLY B 407 10.436 15.737 -0.189 1.00 0.00 C ATOM 1723 O GLY B 407 10.996 16.529 0.569 1.00 0.00 O ATOM 0 H GLY B 407 10.260 14.196 -2.929 1.00 0.00 H new ATOM 0 HA2 GLY B 407 11.665 15.635 -1.938 1.00 0.00 H new ATOM 0 HA3 GLY B 407 10.412 16.858 -2.012 1.00 0.00 H new ATOM 1727 N ASP B 408 9.632 14.766 0.239 1.00 0.00 N ATOM 1728 CA ASP B 408 9.364 14.576 1.658 1.00 0.00 C ATOM 1729 C ASP B 408 8.582 15.765 2.196 1.00 0.00 C ATOM 1730 O ASP B 408 9.097 16.558 2.986 1.00 0.00 O ATOM 1731 CB ASP B 408 10.672 14.410 2.432 1.00 0.00 C ATOM 1732 CG ASP B 408 10.618 13.262 3.420 1.00 0.00 C ATOM 1733 OD1 ASP B 408 10.628 12.094 2.976 1.00 0.00 O ATOM 1734 OD2 ASP B 408 10.568 13.529 4.639 1.00 0.00 O ATOM 0 H ASP B 408 9.158 14.103 -0.375 1.00 0.00 H new ATOM 0 HA ASP B 408 8.771 13.670 1.787 1.00 0.00 H new ATOM 0 HB2 ASP B 408 11.488 14.242 1.729 1.00 0.00 H new ATOM 0 HB3 ASP B 408 10.895 15.334 2.965 1.00 0.00 H new ATOM 1739 N GLY B 409 7.338 15.882 1.755 1.00 0.00 N ATOM 1740 CA GLY B 409 6.498 16.978 2.187 1.00 0.00 C ATOM 1741 C GLY B 409 5.287 17.154 1.295 1.00 0.00 C ATOM 1742 O GLY B 409 4.164 17.299 1.780 1.00 0.00 O ATOM 0 H GLY B 409 6.895 15.234 1.103 1.00 0.00 H new ATOM 0 HA2 GLY B 409 6.170 16.801 3.211 1.00 0.00 H new ATOM 0 HA3 GLY B 409 7.080 17.900 2.193 1.00 0.00 H new ATOM 1746 N THR B 410 5.516 17.132 -0.013 1.00 0.00 N ATOM 1747 CA THR B 410 4.438 17.277 -0.984 1.00 0.00 C ATOM 1748 C THR B 410 3.816 15.914 -1.279 1.00 0.00 C ATOM 1749 O THR B 410 4.478 15.025 -1.805 1.00 0.00 O ATOM 1750 CB THR B 410 4.953 17.913 -2.289 1.00 0.00 C ATOM 1751 OG1 THR B 410 5.225 19.312 -2.115 1.00 0.00 O ATOM 1752 CG2 THR B 410 3.940 17.755 -3.406 1.00 0.00 C ATOM 0 H THR B 410 6.441 17.015 -0.426 1.00 0.00 H new ATOM 0 HA THR B 410 3.681 17.935 -0.558 1.00 0.00 H new ATOM 0 HB THR B 410 5.875 17.394 -2.552 1.00 0.00 H new ATOM 0 HG1 THR B 410 5.552 19.689 -2.958 1.00 0.00 H new ATOM 0 HG21 THR B 410 4.328 18.212 -4.316 1.00 0.00 H new ATOM 0 HG22 THR B 410 3.755 16.695 -3.583 1.00 0.00 H new ATOM 0 HG23 THR B 410 3.008 18.244 -3.123 1.00 0.00 H new ATOM 1760 N VAL B 411 2.559 15.734 -0.884 1.00 0.00 N ATOM 1761 CA VAL B 411 1.883 14.451 -1.055 1.00 0.00 C ATOM 1762 C VAL B 411 1.412 14.151 -2.470 1.00 0.00 C ATOM 1763 O VAL B 411 1.847 13.175 -3.065 1.00 0.00 O ATOM 1764 CB VAL B 411 0.672 14.314 -0.121 1.00 0.00 C ATOM 1765 CG1 VAL B 411 0.246 12.855 -0.039 1.00 0.00 C ATOM 1766 CG2 VAL B 411 0.996 14.861 1.259 1.00 0.00 C ATOM 0 H VAL B 411 1.989 16.457 -0.445 1.00 0.00 H new ATOM 0 HA VAL B 411 2.659 13.728 -0.805 1.00 0.00 H new ATOM 0 HB VAL B 411 -0.155 14.897 -0.526 1.00 0.00 H new ATOM 0 HG11 VAL B 411 -0.614 12.764 0.625 1.00 0.00 H new ATOM 0 HG12 VAL B 411 -0.024 12.498 -1.033 1.00 0.00 H new ATOM 0 HG13 VAL B 411 1.070 12.257 0.350 1.00 0.00 H new ATOM 0 HG21 VAL B 411 0.125 14.755 1.906 1.00 0.00 H new ATOM 0 HG22 VAL B 411 1.833 14.306 1.683 1.00 0.00 H new ATOM 0 HG23 VAL B 411 1.262 15.915 1.179 1.00 0.00 H new ATOM 1776 N LEU B 412 0.537 14.943 -3.051 1.00 0.00 N ATOM 1777 CA LEU B 412 0.069 14.627 -4.394 1.00 0.00 C ATOM 1778 C LEU B 412 -0.706 13.297 -4.425 1.00 0.00 C ATOM 1779 O LEU B 412 -1.705 13.191 -5.132 1.00 0.00 O ATOM 1780 CB LEU B 412 1.231 14.571 -5.389 1.00 0.00 C ATOM 1781 CG LEU B 412 1.825 15.924 -5.785 1.00 0.00 C ATOM 1782 CD1 LEU B 412 1.482 16.990 -4.756 1.00 0.00 C ATOM 1783 CD2 LEU B 412 3.330 15.805 -5.944 1.00 0.00 C ATOM 0 H LEU B 412 0.142 15.786 -2.635 1.00 0.00 H new ATOM 0 HA LEU B 412 -0.608 15.429 -4.689 1.00 0.00 H new ATOM 0 HB2 LEU B 412 2.024 13.957 -4.961 1.00 0.00 H new ATOM 0 HB3 LEU B 412 0.889 14.066 -6.292 1.00 0.00 H new ATOM 0 HG LEU B 412 1.391 16.225 -6.739 1.00 0.00 H new ATOM 0 HD11 LEU B 412 1.916 17.943 -5.060 1.00 0.00 H new ATOM 0 HD12 LEU B 412 0.399 17.091 -4.684 1.00 0.00 H new ATOM 0 HD13 LEU B 412 1.885 16.702 -3.785 1.00 0.00 H new ATOM 0 HD21 LEU B 412 3.744 16.773 -6.226 1.00 0.00 H new ATOM 0 HD22 LEU B 412 3.771 15.483 -5.001 1.00 0.00 H new ATOM 0 HD23 LEU B 412 3.557 15.074 -6.720 1.00 0.00 H new ATOM 1795 N GLY B 413 -0.260 12.270 -3.671 1.00 0.00 N ATOM 1796 CA GLY B 413 -0.970 11.006 -3.694 1.00 0.00 C ATOM 1797 C GLY B 413 -1.644 10.662 -2.386 1.00 0.00 C ATOM 1798 O GLY B 413 -1.009 10.663 -1.331 1.00 0.00 O ATOM 0 H GLY B 413 0.560 12.301 -3.065 1.00 0.00 H new ATOM 0 HA2 GLY B 413 -1.722 11.036 -4.483 1.00 0.00 H new ATOM 0 HA3 GLY B 413 -0.270 10.211 -3.952 1.00 0.00 H new ATOM 1802 N THR B 414 -2.936 10.356 -2.462 1.00 0.00 N ATOM 1803 CA THR B 414 -3.708 9.992 -1.277 1.00 0.00 C ATOM 1804 C THR B 414 -5.042 9.359 -1.658 1.00 0.00 C ATOM 1805 O THR B 414 -6.104 9.915 -1.379 1.00 0.00 O ATOM 1806 CB THR B 414 -3.976 11.216 -0.381 1.00 0.00 C ATOM 1807 OG1 THR B 414 -3.073 12.290 -0.676 1.00 0.00 O ATOM 1808 CG2 THR B 414 -3.833 10.855 1.089 1.00 0.00 C ATOM 0 H THR B 414 -3.470 10.353 -3.331 1.00 0.00 H new ATOM 0 HA THR B 414 -3.109 9.268 -0.725 1.00 0.00 H new ATOM 0 HB THR B 414 -4.997 11.538 -0.585 1.00 0.00 H new ATOM 0 HG1 THR B 414 -3.269 13.052 -0.092 1.00 0.00 H new ATOM 0 HG21 THR B 414 -4.027 11.736 1.701 1.00 0.00 H new ATOM 0 HG22 THR B 414 -4.548 10.072 1.343 1.00 0.00 H new ATOM 0 HG23 THR B 414 -2.821 10.497 1.279 1.00 0.00 H new ATOM 1816 N GLY B 415 -4.983 8.210 -2.325 1.00 0.00 N ATOM 1817 CA GLY B 415 -6.204 7.548 -2.762 1.00 0.00 C ATOM 1818 C GLY B 415 -6.506 6.267 -2.007 1.00 0.00 C ATOM 1819 O GLY B 415 -5.695 5.798 -1.216 1.00 0.00 O ATOM 0 H GLY B 415 -4.119 7.727 -2.570 1.00 0.00 H new ATOM 0 HA2 GLY B 415 -7.042 8.235 -2.644 1.00 0.00 H new ATOM 0 HA3 GLY B 415 -6.124 7.323 -3.825 1.00 0.00 H new ATOM 1823 N VAL B 416 -7.683 5.701 -2.262 1.00 0.00 N ATOM 1824 CA VAL B 416 -8.104 4.463 -1.614 1.00 0.00 C ATOM 1825 C VAL B 416 -8.642 3.475 -2.642 1.00 0.00 C ATOM 1826 O VAL B 416 -8.908 3.844 -3.786 1.00 0.00 O ATOM 1827 CB VAL B 416 -9.192 4.726 -0.556 1.00 0.00 C ATOM 1828 CG1 VAL B 416 -10.532 5.000 -1.223 1.00 0.00 C ATOM 1829 CG2 VAL B 416 -9.302 3.553 0.410 1.00 0.00 C ATOM 0 H VAL B 416 -8.365 6.083 -2.917 1.00 0.00 H new ATOM 0 HA VAL B 416 -7.227 4.041 -1.123 1.00 0.00 H new ATOM 0 HB VAL B 416 -8.906 5.610 0.015 1.00 0.00 H new ATOM 0 HG11 VAL B 416 -11.288 5.183 -0.459 1.00 0.00 H new ATOM 0 HG12 VAL B 416 -10.446 5.876 -1.866 1.00 0.00 H new ATOM 0 HG13 VAL B 416 -10.823 4.137 -1.822 1.00 0.00 H new ATOM 0 HG21 VAL B 416 -10.076 3.761 1.148 1.00 0.00 H new ATOM 0 HG22 VAL B 416 -9.561 2.650 -0.142 1.00 0.00 H new ATOM 0 HG23 VAL B 416 -8.348 3.408 0.916 1.00 0.00 H new ATOM 1839 N GLY B 417 -8.805 2.220 -2.234 1.00 0.00 N ATOM 1840 CA GLY B 417 -9.316 1.218 -3.150 1.00 0.00 C ATOM 1841 C GLY B 417 -9.603 -0.113 -2.480 1.00 0.00 C ATOM 1842 O GLY B 417 -8.689 -0.776 -1.989 1.00 0.00 O ATOM 0 H GLY B 417 -8.595 1.882 -1.295 1.00 0.00 H new ATOM 0 HA2 GLY B 417 -10.231 1.590 -3.612 1.00 0.00 H new ATOM 0 HA3 GLY B 417 -8.593 1.066 -3.952 1.00 0.00 H new ATOM 1846 N ARG B 418 -10.874 -0.509 -2.474 1.00 0.00 N ATOM 1847 CA ARG B 418 -11.276 -1.778 -1.873 1.00 0.00 C ATOM 1848 C ARG B 418 -10.304 -2.881 -2.264 1.00 0.00 C ATOM 1849 O ARG B 418 -9.554 -3.383 -1.428 1.00 0.00 O ATOM 1850 CB ARG B 418 -12.695 -2.152 -2.310 1.00 0.00 C ATOM 1851 CG ARG B 418 -13.090 -1.571 -3.657 1.00 0.00 C ATOM 1852 CD ARG B 418 -14.107 -0.452 -3.507 1.00 0.00 C ATOM 1853 NE ARG B 418 -15.447 -0.872 -3.908 1.00 0.00 N ATOM 1854 CZ ARG B 418 -16.549 -0.189 -3.617 1.00 0.00 C ATOM 1855 NH1 ARG B 418 -16.468 0.939 -2.923 1.00 0.00 N ATOM 1856 NH2 ARG B 418 -17.733 -0.633 -4.016 1.00 0.00 N ATOM 0 H ARG B 418 -11.641 0.029 -2.877 1.00 0.00 H new ATOM 0 HA ARG B 418 -11.262 -1.664 -0.789 1.00 0.00 H new ATOM 0 HB2 ARG B 418 -12.778 -3.238 -2.354 1.00 0.00 H new ATOM 0 HB3 ARG B 418 -13.401 -1.808 -1.554 1.00 0.00 H new ATOM 0 HG2 ARG B 418 -12.203 -1.192 -4.164 1.00 0.00 H new ATOM 0 HG3 ARG B 418 -13.505 -2.359 -4.286 1.00 0.00 H new ATOM 0 HD2 ARG B 418 -14.127 -0.117 -2.470 1.00 0.00 H new ATOM 0 HD3 ARG B 418 -13.799 0.401 -4.111 1.00 0.00 H new ATOM 0 HE ARG B 418 -15.542 -1.737 -4.440 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -15.559 1.283 -2.612 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -17.315 1.463 -2.700 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -17.799 -1.501 -4.548 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -18.577 -0.107 -3.791 1.00 0.00 H new ATOM 1870 N ASN B 419 -10.304 -3.248 -3.541 1.00 0.00 N ATOM 1871 CA ASN B 419 -9.399 -4.279 -4.025 1.00 0.00 C ATOM 1872 C ASN B 419 -7.960 -3.776 -3.932 1.00 0.00 C ATOM 1873 O ASN B 419 -7.017 -4.564 -3.930 1.00 0.00 O ATOM 1874 CB ASN B 419 -9.775 -4.690 -5.459 1.00 0.00 C ATOM 1875 CG ASN B 419 -8.799 -4.202 -6.513 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -8.492 -3.012 -6.588 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -8.313 -5.124 -7.334 1.00 0.00 N ATOM 0 H ASN B 419 -10.916 -2.849 -4.253 1.00 0.00 H new ATOM 0 HA ASN B 419 -9.486 -5.170 -3.403 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -9.837 -5.777 -5.511 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -10.767 -4.303 -5.689 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -7.655 -4.859 -8.067 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -8.597 -6.098 -7.232 1.00 0.00 H new ATOM 1884 N ILE B 420 -7.830 -2.445 -3.867 1.00 0.00 N ATOM 1885 CA ILE B 420 -6.547 -1.742 -3.774 1.00 0.00 C ATOM 1886 C ILE B 420 -6.141 -1.152 -5.113 1.00 0.00 C ATOM 1887 O ILE B 420 -5.619 -0.039 -5.170 1.00 0.00 O ATOM 1888 CB ILE B 420 -5.381 -2.596 -3.233 1.00 0.00 C ATOM 1889 CG1 ILE B 420 -4.761 -3.445 -4.347 1.00 0.00 C ATOM 1890 CG2 ILE B 420 -5.826 -3.453 -2.056 1.00 0.00 C ATOM 1891 CD1 ILE B 420 -3.621 -2.749 -5.070 1.00 0.00 C ATOM 0 H ILE B 420 -8.632 -1.815 -3.878 1.00 0.00 H new ATOM 0 HA ILE B 420 -6.728 -0.952 -3.045 1.00 0.00 H new ATOM 0 HB ILE B 420 -4.609 -1.919 -2.867 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -4.395 -4.379 -3.921 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -5.535 -3.705 -5.069 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -4.983 -4.043 -1.697 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -6.187 -2.810 -1.254 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -6.627 -4.120 -2.374 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -3.228 -3.406 -5.846 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -3.987 -1.828 -5.525 1.00 0.00 H new ATOM 0 HD13 ILE B 420 -2.829 -2.513 -4.359 1.00 0.00 H new ATOM 1903 N LYS B 421 -6.375 -1.889 -6.194 1.00 0.00 N ATOM 1904 CA LYS B 421 -6.018 -1.387 -7.511 1.00 0.00 C ATOM 1905 C LYS B 421 -6.564 0.017 -7.668 1.00 0.00 C ATOM 1906 O LYS B 421 -5.827 0.953 -7.977 1.00 0.00 O ATOM 1907 CB LYS B 421 -6.540 -2.300 -8.614 1.00 0.00 C ATOM 1908 CG LYS B 421 -5.426 -2.920 -9.433 1.00 0.00 C ATOM 1909 CD LYS B 421 -4.470 -3.712 -8.555 1.00 0.00 C ATOM 1910 CE LYS B 421 -4.240 -5.112 -9.099 1.00 0.00 C ATOM 1911 NZ LYS B 421 -5.236 -6.085 -8.568 1.00 0.00 N ATOM 0 H LYS B 421 -6.801 -2.816 -6.184 1.00 0.00 H new ATOM 0 HA LYS B 421 -4.932 -1.367 -7.601 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -7.143 -3.092 -8.170 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -7.196 -1.730 -9.272 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -5.852 -3.575 -10.193 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -4.878 -2.137 -9.957 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -3.517 -3.186 -8.487 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -4.872 -3.775 -7.544 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -4.296 -5.092 -10.187 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -3.235 -5.442 -8.838 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -4.966 -7.048 -8.853 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -5.261 -6.025 -7.530 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -6.177 -5.862 -8.950 1.00 0.00 H new ATOM 1925 N ILE B 422 -7.856 0.170 -7.401 1.00 0.00 N ATOM 1926 CA ILE B 422 -8.473 1.487 -7.465 1.00 0.00 C ATOM 1927 C ILE B 422 -7.581 2.448 -6.713 1.00 0.00 C ATOM 1928 O ILE B 422 -7.461 3.616 -7.065 1.00 0.00 O ATOM 1929 CB ILE B 422 -9.875 1.537 -6.818 1.00 0.00 C ATOM 1930 CG1 ILE B 422 -10.473 0.138 -6.687 1.00 0.00 C ATOM 1931 CG2 ILE B 422 -10.797 2.446 -7.614 1.00 0.00 C ATOM 1932 CD1 ILE B 422 -9.985 -0.601 -5.461 1.00 0.00 C ATOM 0 H ILE B 422 -8.487 -0.589 -7.142 1.00 0.00 H new ATOM 0 HA ILE B 422 -8.590 1.746 -8.517 1.00 0.00 H new ATOM 0 HB ILE B 422 -9.769 1.948 -5.814 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -11.560 0.215 -6.649 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -10.226 -0.442 -7.576 1.00 0.00 H new ATOM 0 HG21 ILE B 422 -11.780 2.469 -7.144 1.00 0.00 H new ATOM 0 HG22 ILE B 422 -10.382 3.454 -7.638 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -10.891 2.068 -8.632 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -10.446 -1.588 -5.424 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -8.901 -0.708 -5.508 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -10.256 -0.040 -4.566 1.00 0.00 H new ATOM 1944 N ALA B 423 -6.946 1.919 -5.671 1.00 0.00 N ATOM 1945 CA ALA B 423 -6.042 2.688 -4.841 1.00 0.00 C ATOM 1946 C ALA B 423 -4.729 2.934 -5.570 1.00 0.00 C ATOM 1947 O ALA B 423 -4.122 3.995 -5.428 1.00 0.00 O ATOM 1948 CB ALA B 423 -5.805 1.975 -3.521 1.00 0.00 C ATOM 0 H ALA B 423 -7.048 0.946 -5.384 1.00 0.00 H new ATOM 0 HA ALA B 423 -6.497 3.656 -4.630 1.00 0.00 H new ATOM 0 HB1 ALA B 423 -5.124 2.564 -2.907 1.00 0.00 H new ATOM 0 HB2 ALA B 423 -6.753 1.854 -2.997 1.00 0.00 H new ATOM 0 HB3 ALA B 423 -5.368 0.995 -3.710 1.00 0.00 H new ATOM 1954 N GLY B 424 -4.302 1.961 -6.377 1.00 0.00 N ATOM 1955 CA GLY B 424 -3.076 2.127 -7.132 1.00 0.00 C ATOM 1956 C GLY B 424 -3.249 3.150 -8.239 1.00 0.00 C ATOM 1957 O GLY B 424 -2.519 4.145 -8.304 1.00 0.00 O ATOM 0 H GLY B 424 -4.780 1.071 -6.518 1.00 0.00 H new ATOM 0 HA2 GLY B 424 -2.274 2.442 -6.464 1.00 0.00 H new ATOM 0 HA3 GLY B 424 -2.777 1.170 -7.560 1.00 0.00 H new ATOM 1961 N ILE B 425 -4.232 2.914 -9.102 1.00 0.00 N ATOM 1962 CA ILE B 425 -4.518 3.824 -10.200 1.00 0.00 C ATOM 1963 C ILE B 425 -4.964 5.181 -9.665 1.00 0.00 C ATOM 1964 O ILE B 425 -4.528 6.225 -10.154 1.00 0.00 O ATOM 1965 CB ILE B 425 -5.603 3.255 -11.139 1.00 0.00 C ATOM 1966 CG1 ILE B 425 -5.046 2.073 -11.937 1.00 0.00 C ATOM 1967 CG2 ILE B 425 -6.119 4.337 -12.076 1.00 0.00 C ATOM 1968 CD1 ILE B 425 -5.053 0.766 -11.173 1.00 0.00 C ATOM 0 H ILE B 425 -4.843 2.099 -9.060 1.00 0.00 H new ATOM 0 HA ILE B 425 -3.598 3.944 -10.773 1.00 0.00 H new ATOM 0 HB ILE B 425 -6.437 2.902 -10.533 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -5.631 1.954 -12.849 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -4.024 2.300 -12.241 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -6.883 3.917 -12.730 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -6.549 5.150 -11.491 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -5.295 4.720 -12.679 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -4.644 -0.025 -11.802 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -4.444 0.866 -10.275 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -6.076 0.514 -10.892 1.00 0.00 H new ATOM 1980 N ARG B 426 -5.822 5.164 -8.646 1.00 0.00 N ATOM 1981 CA ARG B 426 -6.302 6.401 -8.039 1.00 0.00 C ATOM 1982 C ARG B 426 -5.118 7.264 -7.632 1.00 0.00 C ATOM 1983 O ARG B 426 -5.025 8.430 -8.018 1.00 0.00 O ATOM 1984 CB ARG B 426 -7.182 6.111 -6.821 1.00 0.00 C ATOM 1985 CG ARG B 426 -7.453 7.333 -5.957 1.00 0.00 C ATOM 1986 CD ARG B 426 -8.586 8.175 -6.524 1.00 0.00 C ATOM 1987 NE ARG B 426 -9.002 9.230 -5.602 1.00 0.00 N ATOM 1988 CZ ARG B 426 -9.918 10.147 -5.901 1.00 0.00 C ATOM 1989 NH1 ARG B 426 -10.510 10.130 -7.087 1.00 0.00 N ATOM 1990 NH2 ARG B 426 -10.243 11.080 -5.016 1.00 0.00 N ATOM 0 H ARG B 426 -6.196 4.313 -8.227 1.00 0.00 H new ATOM 0 HA ARG B 426 -6.906 6.934 -8.773 1.00 0.00 H new ATOM 0 HB2 ARG B 426 -8.132 5.699 -7.160 1.00 0.00 H new ATOM 0 HB3 ARG B 426 -6.702 5.345 -6.211 1.00 0.00 H new ATOM 0 HG2 ARG B 426 -7.705 7.016 -4.945 1.00 0.00 H new ATOM 0 HG3 ARG B 426 -6.549 7.938 -5.886 1.00 0.00 H new ATOM 0 HD2 ARG B 426 -8.268 8.622 -7.466 1.00 0.00 H new ATOM 0 HD3 ARG B 426 -9.438 7.533 -6.747 1.00 0.00 H new ATOM 0 HE ARG B 426 -8.567 9.265 -4.680 1.00 0.00 H new ATOM 0 HH11 ARG B 426 -10.263 9.414 -7.770 1.00 0.00 H new ATOM 0 HH12 ARG B 426 -11.212 10.833 -7.316 1.00 0.00 H new ATOM 0 HH21 ARG B 426 -9.790 11.096 -4.102 1.00 0.00 H new ATOM 0 HH22 ARG B 426 -10.946 11.781 -5.249 1.00 0.00 H new ATOM 2004 N ALA B 427 -4.201 6.679 -6.866 1.00 0.00 N ATOM 2005 CA ALA B 427 -3.014 7.397 -6.432 1.00 0.00 C ATOM 2006 C ALA B 427 -2.332 8.025 -7.640 1.00 0.00 C ATOM 2007 O ALA B 427 -1.873 9.166 -7.587 1.00 0.00 O ATOM 2008 CB ALA B 427 -2.053 6.485 -5.684 1.00 0.00 C ATOM 0 H ALA B 427 -4.259 5.715 -6.536 1.00 0.00 H new ATOM 0 HA ALA B 427 -3.317 8.182 -5.740 1.00 0.00 H new ATOM 0 HB1 ALA B 427 -1.177 7.055 -5.374 1.00 0.00 H new ATOM 0 HB2 ALA B 427 -2.550 6.076 -4.804 1.00 0.00 H new ATOM 0 HB3 ALA B 427 -1.743 5.669 -6.337 1.00 0.00 H new ATOM 2014 N ALA B 428 -2.295 7.280 -8.743 1.00 0.00 N ATOM 2015 CA ALA B 428 -1.698 7.786 -9.970 1.00 0.00 C ATOM 2016 C ALA B 428 -2.314 9.138 -10.313 1.00 0.00 C ATOM 2017 O ALA B 428 -1.689 10.188 -10.124 1.00 0.00 O ATOM 2018 CB ALA B 428 -1.882 6.805 -11.120 1.00 0.00 C ATOM 0 H ALA B 428 -2.668 6.333 -8.809 1.00 0.00 H new ATOM 0 HA ALA B 428 -0.626 7.907 -9.813 1.00 0.00 H new ATOM 0 HB1 ALA B 428 -1.425 7.212 -12.022 1.00 0.00 H new ATOM 0 HB2 ALA B 428 -1.407 5.857 -10.869 1.00 0.00 H new ATOM 0 HB3 ALA B 428 -2.946 6.643 -11.293 1.00 0.00 H new ATOM 2024 N GLU B 429 -3.556 9.121 -10.796 1.00 0.00 N ATOM 2025 CA GLU B 429 -4.238 10.363 -11.123 1.00 0.00 C ATOM 2026 C GLU B 429 -3.977 11.373 -10.015 1.00 0.00 C ATOM 2027 O GLU B 429 -3.809 12.568 -10.258 1.00 0.00 O ATOM 2028 CB GLU B 429 -5.741 10.129 -11.284 1.00 0.00 C ATOM 2029 CG GLU B 429 -6.083 9.065 -12.312 1.00 0.00 C ATOM 2030 CD GLU B 429 -7.208 8.157 -11.855 1.00 0.00 C ATOM 2031 OE1 GLU B 429 -6.978 7.346 -10.933 1.00 0.00 O ATOM 2032 OE2 GLU B 429 -8.318 8.258 -12.417 1.00 0.00 O ATOM 0 H GLU B 429 -4.099 8.274 -10.966 1.00 0.00 H new ATOM 0 HA GLU B 429 -3.856 10.746 -12.069 1.00 0.00 H new ATOM 0 HB2 GLU B 429 -6.161 9.840 -10.320 1.00 0.00 H new ATOM 0 HB3 GLU B 429 -6.218 11.066 -11.571 1.00 0.00 H new ATOM 0 HG2 GLU B 429 -6.366 9.546 -13.248 1.00 0.00 H new ATOM 0 HG3 GLU B 429 -5.197 8.465 -12.518 1.00 0.00 H new ATOM 2039 N ASN B 430 -3.925 10.854 -8.794 1.00 0.00 N ATOM 2040 CA ASN B 430 -3.664 11.654 -7.612 1.00 0.00 C ATOM 2041 C ASN B 430 -2.387 12.477 -7.771 1.00 0.00 C ATOM 2042 O ASN B 430 -2.317 13.618 -7.317 1.00 0.00 O ATOM 2043 CB ASN B 430 -3.542 10.731 -6.409 1.00 0.00 C ATOM 2044 CG ASN B 430 -4.566 11.046 -5.342 1.00 0.00 C ATOM 2045 OD1 ASN B 430 -4.222 11.409 -4.218 1.00 0.00 O ATOM 2046 ND2 ASN B 430 -5.838 10.910 -5.695 1.00 0.00 N ATOM 0 H ASN B 430 -4.064 9.862 -8.599 1.00 0.00 H new ATOM 0 HA ASN B 430 -4.491 12.350 -7.468 1.00 0.00 H new ATOM 0 HB2 ASN B 430 -3.663 9.697 -6.733 1.00 0.00 H new ATOM 0 HB3 ASN B 430 -2.541 10.818 -5.987 1.00 0.00 H new ATOM 0 HD21 ASN B 430 -6.578 11.109 -5.022 1.00 0.00 H new ATOM 0 HD22 ASN B 430 -6.076 10.606 -6.639 1.00 0.00 H new ATOM 2053 N ALA B 431 -1.381 11.898 -8.426 1.00 0.00 N ATOM 2054 CA ALA B 431 -0.117 12.594 -8.639 1.00 0.00 C ATOM 2055 C ALA B 431 -0.199 13.500 -9.855 1.00 0.00 C ATOM 2056 O ALA B 431 0.594 14.425 -10.007 1.00 0.00 O ATOM 2057 CB ALA B 431 1.039 11.620 -8.792 1.00 0.00 C ATOM 0 H ALA B 431 -1.418 10.956 -8.815 1.00 0.00 H new ATOM 0 HA ALA B 431 0.070 13.204 -7.755 1.00 0.00 H new ATOM 0 HB1 ALA B 431 1.964 12.175 -8.949 1.00 0.00 H new ATOM 0 HB2 ALA B 431 1.127 11.015 -7.889 1.00 0.00 H new ATOM 0 HB3 ALA B 431 0.856 10.970 -9.648 1.00 0.00 H new ATOM 2063 N LEU B 432 -1.174 13.239 -10.713 1.00 0.00 N ATOM 2064 CA LEU B 432 -1.366 14.055 -11.905 1.00 0.00 C ATOM 2065 C LEU B 432 -2.709 14.770 -11.835 1.00 0.00 C ATOM 2066 O LEU B 432 -3.263 15.186 -12.852 1.00 0.00 O ATOM 2067 CB LEU B 432 -1.289 13.196 -13.167 1.00 0.00 C ATOM 2068 CG LEU B 432 -2.431 12.199 -13.332 1.00 0.00 C ATOM 2069 CD1 LEU B 432 -3.204 12.478 -14.611 1.00 0.00 C ATOM 2070 CD2 LEU B 432 -1.895 10.775 -13.325 1.00 0.00 C ATOM 0 H LEU B 432 -1.841 12.474 -10.609 1.00 0.00 H new ATOM 0 HA LEU B 432 -0.570 14.798 -11.949 1.00 0.00 H new ATOM 0 HB2 LEU B 432 -1.271 13.853 -14.036 1.00 0.00 H new ATOM 0 HB3 LEU B 432 -0.346 12.649 -13.161 1.00 0.00 H new ATOM 0 HG LEU B 432 -3.115 12.313 -12.491 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -4.015 11.756 -14.711 1.00 0.00 H new ATOM 0 HD12 LEU B 432 -3.618 13.486 -14.574 1.00 0.00 H new ATOM 0 HD13 LEU B 432 -2.534 12.392 -15.467 1.00 0.00 H new ATOM 0 HD21 LEU B 432 -2.722 10.074 -13.444 1.00 0.00 H new ATOM 0 HD22 LEU B 432 -1.190 10.647 -14.147 1.00 0.00 H new ATOM 0 HD23 LEU B 432 -1.388 10.582 -12.379 1.00 0.00 H new ATOM 2082 N ARG B 433 -3.221 14.905 -10.615 1.00 0.00 N ATOM 2083 CA ARG B 433 -4.501 15.567 -10.379 1.00 0.00 C ATOM 2084 C ARG B 433 -4.303 16.910 -9.686 1.00 0.00 C ATOM 2085 O ARG B 433 -5.269 17.591 -9.343 1.00 0.00 O ATOM 2086 CB ARG B 433 -5.397 14.679 -9.519 1.00 0.00 C ATOM 2087 CG ARG B 433 -6.342 13.811 -10.323 1.00 0.00 C ATOM 2088 CD ARG B 433 -7.349 13.110 -9.423 1.00 0.00 C ATOM 2089 NE ARG B 433 -8.423 12.477 -10.182 1.00 0.00 N ATOM 2090 CZ ARG B 433 -9.547 13.097 -10.525 1.00 0.00 C ATOM 2091 NH1 ARG B 433 -9.731 14.370 -10.201 1.00 0.00 N ATOM 2092 NH2 ARG B 433 -10.487 12.445 -11.195 1.00 0.00 N ATOM 0 H ARG B 433 -2.766 14.562 -9.769 1.00 0.00 H new ATOM 0 HA ARG B 433 -4.974 15.741 -11.345 1.00 0.00 H new ATOM 0 HB2 ARG B 433 -4.771 14.040 -8.897 1.00 0.00 H new ATOM 0 HB3 ARG B 433 -5.979 15.308 -8.846 1.00 0.00 H new ATOM 0 HG2 ARG B 433 -6.869 14.424 -11.054 1.00 0.00 H new ATOM 0 HG3 ARG B 433 -5.772 13.069 -10.881 1.00 0.00 H new ATOM 0 HD2 ARG B 433 -6.836 12.356 -8.826 1.00 0.00 H new ATOM 0 HD3 ARG B 433 -7.776 13.832 -8.727 1.00 0.00 H new ATOM 0 HE ARG B 433 -8.304 11.504 -10.465 1.00 0.00 H new ATOM 0 HH11 ARG B 433 -9.009 14.875 -9.687 1.00 0.00 H new ATOM 0 HH12 ARG B 433 -10.595 14.844 -10.465 1.00 0.00 H new ATOM 0 HH21 ARG B 433 -10.348 11.467 -11.448 1.00 0.00 H new ATOM 0 HH22 ARG B 433 -11.350 12.922 -11.458 1.00 0.00 H new ATOM 2106 N ASP B 434 -3.046 17.281 -9.476 1.00 0.00 N ATOM 2107 CA ASP B 434 -2.724 18.538 -8.813 1.00 0.00 C ATOM 2108 C ASP B 434 -2.197 19.567 -9.804 1.00 0.00 C ATOM 2109 O ASP B 434 -0.994 19.823 -9.871 1.00 0.00 O ATOM 2110 CB ASP B 434 -1.692 18.308 -7.711 1.00 0.00 C ATOM 2111 CG ASP B 434 -2.306 17.728 -6.452 1.00 0.00 C ATOM 2112 OD1 ASP B 434 -3.441 18.120 -6.110 1.00 0.00 O ATOM 2113 OD2 ASP B 434 -1.653 16.880 -5.809 1.00 0.00 O ATOM 0 H ASP B 434 -2.234 16.730 -9.755 1.00 0.00 H new ATOM 0 HA ASP B 434 -3.643 18.925 -8.372 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -0.918 17.634 -8.078 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -1.204 19.253 -7.471 1.00 0.00 H new ATOM 2118 N LYS B 435 -3.104 20.159 -10.566 1.00 0.00 N ATOM 2119 CA LYS B 435 -2.732 21.169 -11.547 1.00 0.00 C ATOM 2120 C LYS B 435 -1.631 22.070 -10.997 1.00 0.00 C ATOM 2121 O LYS B 435 -0.631 22.331 -11.665 1.00 0.00 O ATOM 2122 CB LYS B 435 -3.951 22.012 -11.920 1.00 0.00 C ATOM 2123 CG LYS B 435 -4.208 23.161 -10.956 1.00 0.00 C ATOM 2124 CD LYS B 435 -5.331 24.060 -11.439 1.00 0.00 C ATOM 2125 CE LYS B 435 -6.682 23.575 -10.943 1.00 0.00 C ATOM 2126 NZ LYS B 435 -7.043 24.188 -9.634 1.00 0.00 N ATOM 0 H LYS B 435 -4.103 19.958 -10.525 1.00 0.00 H new ATOM 0 HA LYS B 435 -2.359 20.663 -12.437 1.00 0.00 H new ATOM 0 HB2 LYS B 435 -3.813 22.414 -12.924 1.00 0.00 H new ATOM 0 HB3 LYS B 435 -4.831 21.370 -11.952 1.00 0.00 H new ATOM 0 HG2 LYS B 435 -4.459 22.762 -9.973 1.00 0.00 H new ATOM 0 HG3 LYS B 435 -3.297 23.748 -10.839 1.00 0.00 H new ATOM 0 HD2 LYS B 435 -5.159 25.079 -11.092 1.00 0.00 H new ATOM 0 HD3 LYS B 435 -5.331 24.091 -12.529 1.00 0.00 H new ATOM 0 HE2 LYS B 435 -7.448 23.815 -11.681 1.00 0.00 H new ATOM 0 HE3 LYS B 435 -6.665 22.490 -10.844 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 -7.971 23.832 -9.328 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 -6.326 23.938 -8.924 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 -7.084 25.222 -9.735 1.00 0.00 H new ATOM 2140 N LYS B 436 -1.833 22.546 -9.772 1.00 0.00 N ATOM 2141 CA LYS B 436 -0.869 23.425 -9.120 1.00 0.00 C ATOM 2142 C LYS B 436 0.501 22.762 -9.027 1.00 0.00 C ATOM 2143 O LYS B 436 1.508 23.344 -9.430 1.00 0.00 O ATOM 2144 CB LYS B 436 -1.368 23.811 -7.728 1.00 0.00 C ATOM 2145 CG LYS B 436 -2.594 24.711 -7.752 1.00 0.00 C ATOM 2146 CD LYS B 436 -2.229 26.157 -7.462 1.00 0.00 C ATOM 2147 CE LYS B 436 -1.598 26.827 -8.673 1.00 0.00 C ATOM 2148 NZ LYS B 436 -2.607 27.147 -9.721 1.00 0.00 N ATOM 0 H LYS B 436 -2.658 22.337 -9.210 1.00 0.00 H new ATOM 0 HA LYS B 436 -0.767 24.327 -9.723 1.00 0.00 H new ATOM 0 HB2 LYS B 436 -1.603 22.904 -7.171 1.00 0.00 H new ATOM 0 HB3 LYS B 436 -0.566 24.317 -7.190 1.00 0.00 H new ATOM 0 HG2 LYS B 436 -3.076 24.645 -8.727 1.00 0.00 H new ATOM 0 HG3 LYS B 436 -3.317 24.362 -7.015 1.00 0.00 H new ATOM 0 HD2 LYS B 436 -3.123 26.706 -7.166 1.00 0.00 H new ATOM 0 HD3 LYS B 436 -1.537 26.197 -6.621 1.00 0.00 H new ATOM 0 HE2 LYS B 436 -1.096 27.743 -8.361 1.00 0.00 H new ATOM 0 HE3 LYS B 436 -0.834 26.173 -9.093 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 -2.168 27.735 -10.458 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 -2.958 26.265 -10.146 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 -3.401 27.665 -9.292 1.00 0.00 H new ATOM 2162 N MET B 437 0.537 21.541 -8.500 1.00 0.00 N ATOM 2163 CA MET B 437 1.792 20.810 -8.370 1.00 0.00 C ATOM 2164 C MET B 437 2.404 20.578 -9.744 1.00 0.00 C ATOM 2165 O MET B 437 3.535 20.978 -10.012 1.00 0.00 O ATOM 2166 CB MET B 437 1.570 19.470 -7.667 1.00 0.00 C ATOM 2167 CG MET B 437 2.813 18.595 -7.626 1.00 0.00 C ATOM 2168 SD MET B 437 3.031 17.624 -9.131 1.00 0.00 S ATOM 2169 CE MET B 437 1.595 16.557 -9.053 1.00 0.00 C ATOM 0 H MET B 437 -0.283 21.040 -8.158 1.00 0.00 H new ATOM 0 HA MET B 437 2.476 21.407 -7.767 1.00 0.00 H new ATOM 0 HB2 MET B 437 1.231 19.655 -6.648 1.00 0.00 H new ATOM 0 HB3 MET B 437 0.771 18.930 -8.175 1.00 0.00 H new ATOM 0 HG2 MET B 437 3.690 19.224 -7.474 1.00 0.00 H new ATOM 0 HG3 MET B 437 2.751 17.923 -6.770 1.00 0.00 H new ATOM 0 HE1 MET B 437 1.917 15.518 -8.986 1.00 0.00 H new ATOM 0 HE2 MET B 437 1.001 16.810 -8.175 1.00 0.00 H new ATOM 0 HE3 MET B 437 0.992 16.692 -9.951 1.00 0.00 H new ATOM 2179 N LEU B 438 1.636 19.942 -10.619 1.00 0.00 N ATOM 2180 CA LEU B 438 2.093 19.677 -11.972 1.00 0.00 C ATOM 2181 C LEU B 438 2.686 20.942 -12.575 1.00 0.00 C ATOM 2182 O LEU B 438 3.881 21.011 -12.861 1.00 0.00 O ATOM 2183 CB LEU B 438 0.930 19.188 -12.834 1.00 0.00 C ATOM 2184 CG LEU B 438 0.350 17.829 -12.435 1.00 0.00 C ATOM 2185 CD1 LEU B 438 -0.726 17.400 -13.419 1.00 0.00 C ATOM 2186 CD2 LEU B 438 1.453 16.787 -12.358 1.00 0.00 C ATOM 0 H LEU B 438 0.696 19.602 -10.414 1.00 0.00 H new ATOM 0 HA LEU B 438 2.859 18.902 -11.940 1.00 0.00 H new ATOM 0 HB2 LEU B 438 0.133 19.931 -12.796 1.00 0.00 H new ATOM 0 HB3 LEU B 438 1.265 19.132 -13.870 1.00 0.00 H new ATOM 0 HG LEU B 438 -0.106 17.921 -11.449 1.00 0.00 H new ATOM 0 HD11 LEU B 438 -1.127 16.432 -13.120 1.00 0.00 H new ATOM 0 HD12 LEU B 438 -1.528 18.139 -13.426 1.00 0.00 H new ATOM 0 HD13 LEU B 438 -0.296 17.322 -14.417 1.00 0.00 H new ATOM 0 HD21 LEU B 438 1.026 15.825 -12.073 1.00 0.00 H new ATOM 0 HD22 LEU B 438 1.936 16.696 -13.331 1.00 0.00 H new ATOM 0 HD23 LEU B 438 2.190 17.091 -11.615 1.00 0.00 H new ATOM 2198 N ASP B 439 1.835 21.946 -12.753 1.00 0.00 N ATOM 2199 CA ASP B 439 2.263 23.222 -13.308 1.00 0.00 C ATOM 2200 C ASP B 439 3.422 23.794 -12.498 1.00 0.00 C ATOM 2201 O ASP B 439 4.229 24.569 -13.014 1.00 0.00 O ATOM 2202 CB ASP B 439 1.097 24.212 -13.331 1.00 0.00 C ATOM 2203 CG ASP B 439 1.398 25.441 -14.166 1.00 0.00 C ATOM 2204 OD1 ASP B 439 2.169 25.323 -15.141 1.00 0.00 O ATOM 2205 OD2 ASP B 439 0.861 26.523 -13.846 1.00 0.00 O ATOM 0 H ASP B 439 0.843 21.900 -12.520 1.00 0.00 H new ATOM 0 HA ASP B 439 2.601 23.056 -14.331 1.00 0.00 H new ATOM 0 HB2 ASP B 439 0.211 23.716 -13.726 1.00 0.00 H new ATOM 0 HB3 ASP B 439 0.863 24.517 -12.311 1.00 0.00 H new ATOM 2210 N PHE B 440 3.507 23.398 -11.230 1.00 0.00 N ATOM 2211 CA PHE B 440 4.579 23.866 -10.362 1.00 0.00 C ATOM 2212 C PHE B 440 5.902 23.254 -10.807 1.00 0.00 C ATOM 2213 O PHE B 440 6.938 23.919 -10.810 1.00 0.00 O ATOM 2214 CB PHE B 440 4.272 23.518 -8.895 1.00 0.00 C ATOM 2215 CG PHE B 440 5.473 23.097 -8.092 1.00 0.00 C ATOM 2216 CD1 PHE B 440 6.534 23.967 -7.901 1.00 0.00 C ATOM 2217 CD2 PHE B 440 5.540 21.831 -7.533 1.00 0.00 C ATOM 2218 CE1 PHE B 440 7.639 23.583 -7.166 1.00 0.00 C ATOM 2219 CE2 PHE B 440 6.642 21.440 -6.798 1.00 0.00 C ATOM 2220 CZ PHE B 440 7.694 22.317 -6.614 1.00 0.00 C ATOM 0 H PHE B 440 2.849 22.758 -10.785 1.00 0.00 H new ATOM 0 HA PHE B 440 4.656 24.951 -10.437 1.00 0.00 H new ATOM 0 HB2 PHE B 440 3.816 24.385 -8.416 1.00 0.00 H new ATOM 0 HB3 PHE B 440 3.535 22.716 -8.871 1.00 0.00 H new ATOM 0 HD1 PHE B 440 6.497 24.957 -8.332 1.00 0.00 H new ATOM 0 HD2 PHE B 440 4.721 21.142 -7.674 1.00 0.00 H new ATOM 0 HE1 PHE B 440 8.459 24.271 -7.023 1.00 0.00 H new ATOM 0 HE2 PHE B 440 6.682 20.450 -6.368 1.00 0.00 H new ATOM 0 HZ PHE B 440 8.557 22.014 -6.040 1.00 0.00 H new ATOM 2230 N TYR B 441 5.853 21.985 -11.201 1.00 0.00 N ATOM 2231 CA TYR B 441 7.042 21.288 -11.668 1.00 0.00 C ATOM 2232 C TYR B 441 7.391 21.734 -13.079 1.00 0.00 C ATOM 2233 O TYR B 441 8.519 22.141 -13.344 1.00 0.00 O ATOM 2234 CB TYR B 441 6.834 19.776 -11.613 1.00 0.00 C ATOM 2235 CG TYR B 441 7.072 19.216 -10.233 1.00 0.00 C ATOM 2236 CD1 TYR B 441 8.360 18.969 -9.779 1.00 0.00 C ATOM 2237 CD2 TYR B 441 6.011 18.955 -9.377 1.00 0.00 C ATOM 2238 CE1 TYR B 441 8.586 18.474 -8.512 1.00 0.00 C ATOM 2239 CE2 TYR B 441 6.226 18.463 -8.106 1.00 0.00 C ATOM 2240 CZ TYR B 441 7.515 18.223 -7.676 1.00 0.00 C ATOM 2241 OH TYR B 441 7.735 17.730 -6.410 1.00 0.00 O ATOM 0 H TYR B 441 5.003 21.421 -11.205 1.00 0.00 H new ATOM 0 HA TYR B 441 7.875 21.539 -11.011 1.00 0.00 H new ATOM 0 HB2 TYR B 441 5.818 19.539 -11.929 1.00 0.00 H new ATOM 0 HB3 TYR B 441 7.508 19.293 -12.320 1.00 0.00 H new ATOM 0 HD1 TYR B 441 9.199 19.168 -10.429 1.00 0.00 H new ATOM 0 HD2 TYR B 441 5.001 19.140 -9.711 1.00 0.00 H new ATOM 0 HE1 TYR B 441 9.594 18.284 -8.175 1.00 0.00 H new ATOM 0 HE2 TYR B 441 5.390 18.267 -7.451 1.00 0.00 H new ATOM 0 HH TYR B 441 6.877 17.610 -5.952 1.00 0.00 H new ATOM 2251 N ALA B 442 6.415 21.679 -13.982 1.00 0.00 N ATOM 2252 CA ALA B 442 6.643 22.106 -15.355 1.00 0.00 C ATOM 2253 C ALA B 442 7.415 23.418 -15.355 1.00 0.00 C ATOM 2254 O ALA B 442 8.402 23.575 -16.075 1.00 0.00 O ATOM 2255 CB ALA B 442 5.332 22.258 -16.110 1.00 0.00 C ATOM 0 H ALA B 442 5.470 21.347 -13.789 1.00 0.00 H new ATOM 0 HA ALA B 442 7.228 21.341 -15.866 1.00 0.00 H new ATOM 0 HB1 ALA B 442 5.536 22.578 -17.132 1.00 0.00 H new ATOM 0 HB2 ALA B 442 4.809 21.302 -16.126 1.00 0.00 H new ATOM 0 HB3 ALA B 442 4.711 23.003 -15.614 1.00 0.00 H new ATOM 2261 N LYS B 443 6.972 24.351 -14.514 1.00 0.00 N ATOM 2262 CA LYS B 443 7.633 25.641 -14.386 1.00 0.00 C ATOM 2263 C LYS B 443 9.027 25.430 -13.801 1.00 0.00 C ATOM 2264 O LYS B 443 9.999 26.052 -14.225 1.00 0.00 O ATOM 2265 CB LYS B 443 6.789 26.581 -13.504 1.00 0.00 C ATOM 2266 CG LYS B 443 7.558 27.281 -12.387 1.00 0.00 C ATOM 2267 CD LYS B 443 8.299 28.505 -12.898 1.00 0.00 C ATOM 2268 CE LYS B 443 7.477 29.769 -12.709 1.00 0.00 C ATOM 2269 NZ LYS B 443 8.290 30.885 -12.154 1.00 0.00 N ATOM 0 H LYS B 443 6.157 24.234 -13.912 1.00 0.00 H new ATOM 0 HA LYS B 443 7.733 26.109 -15.365 1.00 0.00 H new ATOM 0 HB2 LYS B 443 6.332 27.339 -14.140 1.00 0.00 H new ATOM 0 HB3 LYS B 443 5.976 26.006 -13.060 1.00 0.00 H new ATOM 0 HG2 LYS B 443 6.866 27.577 -11.599 1.00 0.00 H new ATOM 0 HG3 LYS B 443 8.269 26.584 -11.942 1.00 0.00 H new ATOM 0 HD2 LYS B 443 9.248 28.604 -12.371 1.00 0.00 H new ATOM 0 HD3 LYS B 443 8.533 28.376 -13.955 1.00 0.00 H new ATOM 0 HE2 LYS B 443 7.052 30.071 -13.666 1.00 0.00 H new ATOM 0 HE3 LYS B 443 6.642 29.562 -12.040 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 7.691 31.728 -12.041 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 8.675 30.607 -11.229 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 9.073 31.101 -12.804 1.00 0.00 H new ATOM 2283 N GLN B 444 9.104 24.521 -12.833 1.00 0.00 N ATOM 2284 CA GLN B 444 10.359 24.182 -12.185 1.00 0.00 C ATOM 2285 C GLN B 444 11.283 23.451 -13.158 1.00 0.00 C ATOM 2286 O GLN B 444 12.448 23.193 -12.851 1.00 0.00 O ATOM 2287 CB GLN B 444 10.073 23.310 -10.962 1.00 0.00 C ATOM 2288 CG GLN B 444 9.991 24.093 -9.665 1.00 0.00 C ATOM 2289 CD GLN B 444 11.104 23.727 -8.708 1.00 0.00 C ATOM 2290 OE1 GLN B 444 10.935 23.771 -7.489 1.00 0.00 O ATOM 2291 NE2 GLN B 444 12.251 23.364 -9.263 1.00 0.00 N ATOM 0 H GLN B 444 8.300 24.003 -12.480 1.00 0.00 H new ATOM 0 HA GLN B 444 10.860 25.097 -11.867 1.00 0.00 H new ATOM 0 HB2 GLN B 444 9.134 22.779 -11.116 1.00 0.00 H new ATOM 0 HB3 GLN B 444 10.855 22.556 -10.873 1.00 0.00 H new ATOM 0 HG2 GLN B 444 10.037 25.160 -9.883 1.00 0.00 H new ATOM 0 HG3 GLN B 444 9.028 23.906 -9.189 1.00 0.00 H new ATOM 0 HE21 GLN B 444 12.342 23.343 -10.279 1.00 0.00 H new ATOM 0 HE22 GLN B 444 13.043 23.105 -8.675 1.00 0.00 H new ATOM 2300 N ARG B 445 10.751 23.125 -14.333 1.00 0.00 N ATOM 2301 CA ARG B 445 11.510 22.427 -15.360 1.00 0.00 C ATOM 2302 C ARG B 445 12.095 23.422 -16.358 1.00 0.00 C ATOM 2303 O ARG B 445 13.234 23.276 -16.800 1.00 0.00 O ATOM 2304 CB ARG B 445 10.611 21.426 -16.088 1.00 0.00 C ATOM 2305 CG ARG B 445 10.613 20.039 -15.465 1.00 0.00 C ATOM 2306 CD ARG B 445 11.925 19.319 -15.735 1.00 0.00 C ATOM 2307 NE ARG B 445 11.724 18.078 -16.475 1.00 0.00 N ATOM 2308 CZ ARG B 445 12.603 17.582 -17.342 1.00 0.00 C ATOM 2309 NH1 ARG B 445 13.749 18.210 -17.570 1.00 0.00 N ATOM 2310 NH2 ARG B 445 12.337 16.452 -17.981 1.00 0.00 N ATOM 0 H ARG B 445 9.789 23.336 -14.596 1.00 0.00 H new ATOM 0 HA ARG B 445 12.328 21.889 -14.882 1.00 0.00 H new ATOM 0 HB2 ARG B 445 9.590 21.808 -16.099 1.00 0.00 H new ATOM 0 HB3 ARG B 445 10.934 21.349 -17.126 1.00 0.00 H new ATOM 0 HG2 ARG B 445 10.454 20.120 -14.390 1.00 0.00 H new ATOM 0 HG3 ARG B 445 9.785 19.455 -15.867 1.00 0.00 H new ATOM 0 HD2 ARG B 445 12.589 19.974 -16.299 1.00 0.00 H new ATOM 0 HD3 ARG B 445 12.421 19.101 -14.789 1.00 0.00 H new ATOM 0 HE ARG B 445 10.859 17.560 -16.319 1.00 0.00 H new ATOM 0 HH11 ARG B 445 13.961 19.079 -17.079 1.00 0.00 H new ATOM 0 HH12 ARG B 445 14.418 17.824 -18.236 1.00 0.00 H new ATOM 0 HH21 ARG B 445 11.459 15.963 -17.808 1.00 0.00 H new ATOM 0 HH22 ARG B 445 13.010 16.071 -18.646 1.00 0.00 H new