USER MOD reduce.3.24.130724 H: found=0, std=0, add=679, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 680 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 435 LYS NZ :NH3+ 148:sc=-0.00496 (180deg=0) USER MOD Set 1.2: B 436 LYS NZ :NH3+ -136:sc=-0.00472 (180deg=-0.728) USER MOD Set 2.1: B 389 THR OG1 : rot 18:sc= 0.214 USER MOD Set 2.2: B 400 SER OG : rot -168:sc= 0.19 USER MOD Set 3.1: B 368 MET CE :methyl 156:sc= -0.612 (180deg=-2.44) USER MOD Set 3.2: B 369 ASN : amide:sc= -0.339 K(o=-0.95,f=-3.5) USER MOD Single : B 365 SER OG : rot 9:sc= 0.726 USER MOD Single : B 371 LYS NZ :NH3+ 151:sc= -0.394 (180deg=-0.769) USER MOD Single : B 373 GLN : amide:sc= -11.9! C(o=-12!,f=-13!) USER MOD Single : B 375 TYR OH : rot -45:sc= 0.162 USER MOD Single : B 376 SER OG : rot -150:sc= 0 USER MOD Single : B 380 TYR OH : rot 180:sc= 0 USER MOD Single : B 382 SER OG : rot -100:sc= 0.199 USER MOD Single : B 386 HIS : no HE2:sc= -5.19! C(o=-5.2!,f=-6.6!) USER MOD Single : B 387 TYR OH : rot 60:sc= -5.58! USER MOD Single : B 391 LYS NZ :NH3+ -166:sc= -0.109 (180deg=-0.568) USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot 7:sc= -0.979! USER MOD Single : B 399 ASN : amide:sc= -3.24! C(o=-3.2!,f=-3.9!) USER MOD Single : B 404 CYS SG : rot 98:sc= 0.555 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 180:sc= -0.0425 USER MOD Single : B 419 ASN : amide:sc= -1.21 K(o=-1.2,f=-3!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -4.13! C(o=-4.1!,f=-5.9!) USER MOD Single : B 437 MET CE :methyl -120:sc= -6.75! (180deg=-9.26!) USER MOD Single : B 441 TYR OH : rot 180:sc= 0 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN :FLIP amide:sc= -2.96! C(o=-4.2!,f=-3!) USER MOD ----------------------------------------------------------------- ATOM 1036 N SER B 365 -1.764 2.190 12.692 1.00 0.00 N ATOM 1037 CA SER B 365 -1.163 1.515 11.548 1.00 0.00 C ATOM 1038 C SER B 365 -2.204 1.257 10.463 1.00 0.00 C ATOM 1039 O SER B 365 -2.912 0.250 10.495 1.00 0.00 O ATOM 1040 CB SER B 365 -0.524 0.196 11.986 1.00 0.00 C ATOM 1041 OG SER B 365 -0.315 0.172 13.388 1.00 0.00 O ATOM 0 HA SER B 365 -0.390 2.164 11.137 1.00 0.00 H new ATOM 0 HB2 SER B 365 -1.165 -0.636 11.696 1.00 0.00 H new ATOM 0 HB3 SER B 365 0.427 0.060 11.471 1.00 0.00 H new ATOM 0 HG SER B 365 -0.756 0.945 13.798 1.00 0.00 H new ATOM 1047 N LEU B 366 -2.292 2.175 9.507 1.00 0.00 N ATOM 1048 CA LEU B 366 -3.249 2.050 8.412 1.00 0.00 C ATOM 1049 C LEU B 366 -2.687 2.648 7.127 1.00 0.00 C ATOM 1050 O LEU B 366 -1.966 3.645 7.160 1.00 0.00 O ATOM 1051 CB LEU B 366 -4.563 2.743 8.779 1.00 0.00 C ATOM 1052 CG LEU B 366 -5.801 2.213 8.056 1.00 0.00 C ATOM 1053 CD1 LEU B 366 -7.049 2.449 8.893 1.00 0.00 C ATOM 1054 CD2 LEU B 366 -5.941 2.871 6.691 1.00 0.00 C ATOM 0 H LEU B 366 -1.713 3.014 9.467 1.00 0.00 H new ATOM 0 HA LEU B 366 -3.438 0.990 8.244 1.00 0.00 H new ATOM 0 HB2 LEU B 366 -4.719 2.645 9.853 1.00 0.00 H new ATOM 0 HB3 LEU B 366 -4.466 3.808 8.567 1.00 0.00 H new ATOM 0 HG LEU B 366 -5.683 1.139 7.911 1.00 0.00 H new ATOM 0 HD11 LEU B 366 -7.921 2.065 8.363 1.00 0.00 H new ATOM 0 HD12 LEU B 366 -6.949 1.933 9.848 1.00 0.00 H new ATOM 0 HD13 LEU B 366 -7.173 3.518 9.069 1.00 0.00 H new ATOM 0 HD21 LEU B 366 -6.827 2.483 6.189 1.00 0.00 H new ATOM 0 HD22 LEU B 366 -6.038 3.950 6.815 1.00 0.00 H new ATOM 0 HD23 LEU B 366 -5.059 2.653 6.090 1.00 0.00 H new ATOM 1066 N ASP B 367 -3.029 2.042 5.995 1.00 0.00 N ATOM 1067 CA ASP B 367 -2.561 2.530 4.704 1.00 0.00 C ATOM 1068 C ASP B 367 -3.011 3.968 4.494 1.00 0.00 C ATOM 1069 O ASP B 367 -2.191 4.886 4.447 1.00 0.00 O ATOM 1070 CB ASP B 367 -3.086 1.645 3.571 1.00 0.00 C ATOM 1071 CG ASP B 367 -2.080 1.496 2.446 1.00 0.00 C ATOM 1072 OD1 ASP B 367 -0.969 2.052 2.566 1.00 0.00 O ATOM 1073 OD2 ASP B 367 -2.404 0.824 1.444 1.00 0.00 O ATOM 0 H ASP B 367 -3.626 1.216 5.946 1.00 0.00 H new ATOM 0 HA ASP B 367 -1.472 2.494 4.695 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -3.334 0.660 3.967 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -4.008 2.072 3.177 1.00 0.00 H new ATOM 1078 N MET B 368 -4.322 4.154 4.374 1.00 0.00 N ATOM 1079 CA MET B 368 -4.897 5.478 4.176 1.00 0.00 C ATOM 1080 C MET B 368 -4.081 6.535 4.914 1.00 0.00 C ATOM 1081 O MET B 368 -3.725 7.570 4.349 1.00 0.00 O ATOM 1082 CB MET B 368 -6.348 5.501 4.665 1.00 0.00 C ATOM 1083 CG MET B 368 -7.071 6.806 4.376 1.00 0.00 C ATOM 1084 SD MET B 368 -7.768 7.558 5.860 1.00 0.00 S ATOM 1085 CE MET B 368 -6.362 8.491 6.463 1.00 0.00 C ATOM 0 H MET B 368 -5.008 3.400 4.411 1.00 0.00 H new ATOM 0 HA MET B 368 -4.877 5.706 3.110 1.00 0.00 H new ATOM 0 HB2 MET B 368 -6.893 4.682 4.195 1.00 0.00 H new ATOM 0 HB3 MET B 368 -6.363 5.318 5.739 1.00 0.00 H new ATOM 0 HG2 MET B 368 -6.377 7.506 3.910 1.00 0.00 H new ATOM 0 HG3 MET B 368 -7.869 6.623 3.657 1.00 0.00 H new ATOM 0 HE1 MET B 368 -6.712 9.314 7.086 1.00 0.00 H new ATOM 0 HE2 MET B 368 -5.718 7.838 7.052 1.00 0.00 H new ATOM 0 HE3 MET B 368 -5.800 8.889 5.618 1.00 0.00 H new ATOM 1095 N ASN B 369 -3.789 6.264 6.181 1.00 0.00 N ATOM 1096 CA ASN B 369 -3.018 7.188 7.003 1.00 0.00 C ATOM 1097 C ASN B 369 -1.632 7.435 6.415 1.00 0.00 C ATOM 1098 O ASN B 369 -1.204 8.582 6.286 1.00 0.00 O ATOM 1099 CB ASN B 369 -2.886 6.649 8.427 1.00 0.00 C ATOM 1100 CG ASN B 369 -4.071 7.014 9.298 1.00 0.00 C ATOM 1101 OD1 ASN B 369 -4.630 8.104 9.180 1.00 0.00 O ATOM 1102 ND2 ASN B 369 -4.461 6.100 10.180 1.00 0.00 N ATOM 0 H ASN B 369 -4.075 5.411 6.661 1.00 0.00 H new ATOM 0 HA ASN B 369 -3.554 8.137 7.023 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -2.784 5.564 8.393 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -1.974 7.041 8.877 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -5.253 6.289 10.794 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -3.968 5.209 10.243 1.00 0.00 H new ATOM 1109 N ALA B 370 -0.922 6.362 6.071 1.00 0.00 N ATOM 1110 CA ALA B 370 0.418 6.500 5.515 1.00 0.00 C ATOM 1111 C ALA B 370 0.384 7.220 4.173 1.00 0.00 C ATOM 1112 O ALA B 370 0.962 8.296 4.028 1.00 0.00 O ATOM 1113 CB ALA B 370 1.085 5.141 5.366 1.00 0.00 C ATOM 0 H ALA B 370 -1.249 5.400 6.167 1.00 0.00 H new ATOM 0 HA ALA B 370 1.004 7.100 6.211 1.00 0.00 H new ATOM 0 HB1 ALA B 370 2.084 5.270 4.949 1.00 0.00 H new ATOM 0 HB2 ALA B 370 1.158 4.663 6.343 1.00 0.00 H new ATOM 0 HB3 ALA B 370 0.491 4.516 4.699 1.00 0.00 H new ATOM 1119 N LYS B 371 -0.269 6.618 3.180 1.00 0.00 N ATOM 1120 CA LYS B 371 -0.327 7.214 1.852 1.00 0.00 C ATOM 1121 C LYS B 371 -0.651 8.701 1.947 1.00 0.00 C ATOM 1122 O LYS B 371 -0.158 9.501 1.151 1.00 0.00 O ATOM 1123 CB LYS B 371 -1.354 6.463 0.982 1.00 0.00 C ATOM 1124 CG LYS B 371 -2.514 7.309 0.464 1.00 0.00 C ATOM 1125 CD LYS B 371 -3.651 7.373 1.470 1.00 0.00 C ATOM 1126 CE LYS B 371 -4.873 6.615 0.974 1.00 0.00 C ATOM 1127 NZ LYS B 371 -4.580 5.170 0.770 1.00 0.00 N ATOM 0 H LYS B 371 -0.759 5.728 3.270 1.00 0.00 H new ATOM 0 HA LYS B 371 0.649 7.122 1.376 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -0.834 6.028 0.129 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -1.761 5.635 1.563 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -2.162 8.317 0.247 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -2.880 6.891 -0.474 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -3.322 6.954 2.421 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -3.917 8.414 1.656 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -5.685 6.724 1.693 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -5.217 7.052 0.037 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -5.448 4.616 0.918 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -4.233 5.019 -0.199 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -3.854 4.864 1.449 1.00 0.00 H new ATOM 1141 N ARG B 372 -1.451 9.073 2.937 1.00 0.00 N ATOM 1142 CA ARG B 372 -1.792 10.474 3.134 1.00 0.00 C ATOM 1143 C ARG B 372 -0.569 11.232 3.646 1.00 0.00 C ATOM 1144 O ARG B 372 -0.308 12.360 3.251 1.00 0.00 O ATOM 1145 CB ARG B 372 -2.951 10.612 4.125 1.00 0.00 C ATOM 1146 CG ARG B 372 -4.084 11.492 3.620 1.00 0.00 C ATOM 1147 CD ARG B 372 -3.872 12.948 4.005 1.00 0.00 C ATOM 1148 NE ARG B 372 -4.076 13.173 5.435 1.00 0.00 N ATOM 1149 CZ ARG B 372 -3.589 14.220 6.092 1.00 0.00 C ATOM 1150 NH1 ARG B 372 -2.871 15.132 5.451 1.00 0.00 N ATOM 1151 NH2 ARG B 372 -3.818 14.358 7.391 1.00 0.00 N ATOM 0 H ARG B 372 -1.872 8.432 3.609 1.00 0.00 H new ATOM 0 HA ARG B 372 -2.105 10.898 2.180 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -3.345 9.621 4.350 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -2.571 11.024 5.060 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -4.156 11.408 2.536 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -5.030 11.140 4.030 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -2.862 13.252 3.731 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -4.559 13.576 3.438 1.00 0.00 H new ATOM 0 HE ARG B 372 -4.623 12.488 5.957 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -2.692 15.030 4.452 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -2.498 15.935 5.957 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -4.370 13.659 7.889 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -3.443 15.163 7.892 1.00 0.00 H new ATOM 1165 N GLN B 373 0.178 10.596 4.531 1.00 0.00 N ATOM 1166 CA GLN B 373 1.370 11.205 5.104 1.00 0.00 C ATOM 1167 C GLN B 373 2.447 11.475 4.050 1.00 0.00 C ATOM 1168 O GLN B 373 2.940 12.590 3.918 1.00 0.00 O ATOM 1169 CB GLN B 373 1.944 10.291 6.185 1.00 0.00 C ATOM 1170 CG GLN B 373 2.110 10.962 7.537 1.00 0.00 C ATOM 1171 CD GLN B 373 2.688 12.360 7.437 1.00 0.00 C ATOM 1172 OE1 GLN B 373 2.197 13.294 8.071 1.00 0.00 O ATOM 1173 NE2 GLN B 373 3.736 12.511 6.636 1.00 0.00 N ATOM 0 H GLN B 373 -0.019 9.655 4.871 1.00 0.00 H new ATOM 0 HA GLN B 373 1.073 12.163 5.531 1.00 0.00 H new ATOM 0 HB2 GLN B 373 1.292 9.425 6.298 1.00 0.00 H new ATOM 0 HB3 GLN B 373 2.914 9.919 5.854 1.00 0.00 H new ATOM 0 HG2 GLN B 373 1.141 11.010 8.034 1.00 0.00 H new ATOM 0 HG3 GLN B 373 2.759 10.350 8.163 1.00 0.00 H new ATOM 0 HE21 GLN B 373 4.110 11.709 6.129 1.00 0.00 H new ATOM 0 HE22 GLN B 373 4.167 13.429 6.527 1.00 0.00 H new ATOM 1182 N LEU B 374 2.823 10.439 3.320 1.00 0.00 N ATOM 1183 CA LEU B 374 3.872 10.577 2.314 1.00 0.00 C ATOM 1184 C LEU B 374 3.436 11.449 1.132 1.00 0.00 C ATOM 1185 O LEU B 374 4.096 12.439 0.817 1.00 0.00 O ATOM 1186 CB LEU B 374 4.304 9.193 1.837 1.00 0.00 C ATOM 1187 CG LEU B 374 4.323 8.131 2.939 1.00 0.00 C ATOM 1188 CD1 LEU B 374 5.072 6.893 2.484 1.00 0.00 C ATOM 1189 CD2 LEU B 374 4.949 8.688 4.210 1.00 0.00 C ATOM 0 H LEU B 374 2.426 9.503 3.400 1.00 0.00 H new ATOM 0 HA LEU B 374 4.718 11.085 2.778 1.00 0.00 H new ATOM 0 HB2 LEU B 374 3.631 8.867 1.044 1.00 0.00 H new ATOM 0 HB3 LEU B 374 5.300 9.265 1.400 1.00 0.00 H new ATOM 0 HG LEU B 374 3.292 7.850 3.153 1.00 0.00 H new ATOM 0 HD11 LEU B 374 5.072 6.153 3.284 1.00 0.00 H new ATOM 0 HD12 LEU B 374 4.584 6.475 1.603 1.00 0.00 H new ATOM 0 HD13 LEU B 374 6.100 7.160 2.237 1.00 0.00 H new ATOM 0 HD21 LEU B 374 4.953 7.918 4.981 1.00 0.00 H new ATOM 0 HD22 LEU B 374 5.973 9.001 4.004 1.00 0.00 H new ATOM 0 HD23 LEU B 374 4.370 9.544 4.556 1.00 0.00 H new ATOM 1201 N TYR B 375 2.352 11.076 0.465 1.00 0.00 N ATOM 1202 CA TYR B 375 1.883 11.834 -0.695 1.00 0.00 C ATOM 1203 C TYR B 375 1.239 13.164 -0.298 1.00 0.00 C ATOM 1204 O TYR B 375 1.547 14.207 -0.875 1.00 0.00 O ATOM 1205 CB TYR B 375 0.896 10.998 -1.511 1.00 0.00 C ATOM 1206 CG TYR B 375 1.561 9.909 -2.324 1.00 0.00 C ATOM 1207 CD1 TYR B 375 2.590 9.145 -1.788 1.00 0.00 C ATOM 1208 CD2 TYR B 375 1.161 9.645 -3.630 1.00 0.00 C ATOM 1209 CE1 TYR B 375 3.203 8.151 -2.527 1.00 0.00 C ATOM 1210 CE2 TYR B 375 1.769 8.652 -4.375 1.00 0.00 C ATOM 1211 CZ TYR B 375 2.788 7.909 -3.819 1.00 0.00 C ATOM 1212 OH TYR B 375 3.394 6.920 -4.559 1.00 0.00 O ATOM 0 H TYR B 375 1.784 10.263 0.701 1.00 0.00 H new ATOM 0 HA TYR B 375 2.758 12.063 -1.304 1.00 0.00 H new ATOM 0 HB2 TYR B 375 0.170 10.545 -0.836 1.00 0.00 H new ATOM 0 HB3 TYR B 375 0.342 11.655 -2.181 1.00 0.00 H new ATOM 0 HD1 TYR B 375 2.917 9.331 -0.776 1.00 0.00 H new ATOM 0 HD2 TYR B 375 0.363 10.225 -4.069 1.00 0.00 H new ATOM 0 HE1 TYR B 375 4.002 7.567 -2.095 1.00 0.00 H new ATOM 0 HE2 TYR B 375 1.447 8.459 -5.388 1.00 0.00 H new ATOM 0 HH TYR B 375 4.366 6.983 -4.455 1.00 0.00 H new ATOM 1222 N SER B 376 0.348 13.123 0.684 1.00 0.00 N ATOM 1223 CA SER B 376 -0.316 14.343 1.126 1.00 0.00 C ATOM 1224 C SER B 376 0.652 15.212 1.920 1.00 0.00 C ATOM 1225 O SER B 376 0.834 16.389 1.609 1.00 0.00 O ATOM 1226 CB SER B 376 -1.571 14.036 1.948 1.00 0.00 C ATOM 1227 OG SER B 376 -2.674 14.806 1.502 1.00 0.00 O ATOM 0 H SER B 376 0.072 12.276 1.182 1.00 0.00 H new ATOM 0 HA SER B 376 -0.634 14.892 0.240 1.00 0.00 H new ATOM 0 HB2 SER B 376 -1.809 12.975 1.871 1.00 0.00 H new ATOM 0 HB3 SER B 376 -1.380 14.244 3.001 1.00 0.00 H new ATOM 0 HG SER B 376 -3.279 14.977 2.254 1.00 0.00 H new ATOM 1233 N LEU B 377 1.259 14.642 2.959 1.00 0.00 N ATOM 1234 CA LEU B 377 2.184 15.396 3.793 1.00 0.00 C ATOM 1235 C LEU B 377 3.526 15.631 3.100 1.00 0.00 C ATOM 1236 O LEU B 377 4.048 16.746 3.138 1.00 0.00 O ATOM 1237 CB LEU B 377 2.389 14.696 5.135 1.00 0.00 C ATOM 1238 CG LEU B 377 2.040 15.539 6.358 1.00 0.00 C ATOM 1239 CD1 LEU B 377 2.398 16.990 6.105 1.00 0.00 C ATOM 1240 CD2 LEU B 377 0.562 15.403 6.696 1.00 0.00 C ATOM 0 H LEU B 377 1.127 13.670 3.239 1.00 0.00 H new ATOM 0 HA LEU B 377 1.736 16.374 3.969 1.00 0.00 H new ATOM 0 HB2 LEU B 377 1.784 13.789 5.152 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.431 14.385 5.211 1.00 0.00 H new ATOM 0 HG LEU B 377 2.617 15.179 7.210 1.00 0.00 H new ATOM 0 HD11 LEU B 377 2.146 17.585 6.983 1.00 0.00 H new ATOM 0 HD12 LEU B 377 3.467 17.072 5.906 1.00 0.00 H new ATOM 0 HD13 LEU B 377 1.839 17.358 5.244 1.00 0.00 H new ATOM 0 HD21 LEU B 377 0.331 16.011 7.571 1.00 0.00 H new ATOM 0 HD22 LEU B 377 -0.037 15.741 5.851 1.00 0.00 H new ATOM 0 HD23 LEU B 377 0.332 14.359 6.909 1.00 0.00 H new ATOM 1252 N ILE B 378 4.098 14.601 2.473 1.00 0.00 N ATOM 1253 CA ILE B 378 5.384 14.751 1.795 1.00 0.00 C ATOM 1254 C ILE B 378 5.218 14.794 0.279 1.00 0.00 C ATOM 1255 O ILE B 378 6.036 14.243 -0.457 1.00 0.00 O ATOM 1256 CB ILE B 378 6.342 13.599 2.154 1.00 0.00 C ATOM 1257 CG1 ILE B 378 6.345 13.363 3.664 1.00 0.00 C ATOM 1258 CG2 ILE B 378 7.749 13.903 1.658 1.00 0.00 C ATOM 1259 CD1 ILE B 378 6.386 14.643 4.467 1.00 0.00 C ATOM 0 H ILE B 378 3.696 13.665 2.421 1.00 0.00 H new ATOM 0 HA ILE B 378 5.806 15.696 2.136 1.00 0.00 H new ATOM 0 HB ILE B 378 5.993 12.691 1.662 1.00 0.00 H new ATOM 0 HG12 ILE B 378 5.454 12.798 3.939 1.00 0.00 H new ATOM 0 HG13 ILE B 378 7.206 12.749 3.927 1.00 0.00 H new ATOM 0 HG21 ILE B 378 8.413 13.079 1.920 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.734 14.027 0.575 1.00 0.00 H new ATOM 0 HG23 ILE B 378 8.109 14.821 2.123 1.00 0.00 H new ATOM 0 HD11 ILE B 378 6.386 14.405 5.531 1.00 0.00 H new ATOM 0 HD12 ILE B 378 7.290 15.199 4.219 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.511 15.249 4.231 1.00 0.00 H new ATOM 1271 N GLY B 379 4.160 15.449 -0.184 1.00 0.00 N ATOM 1272 CA GLY B 379 3.921 15.542 -1.613 1.00 0.00 C ATOM 1273 C GLY B 379 3.238 16.834 -2.012 1.00 0.00 C ATOM 1274 O GLY B 379 2.335 17.307 -1.322 1.00 0.00 O ATOM 0 H GLY B 379 3.466 15.915 0.400 1.00 0.00 H new ATOM 0 HA2 GLY B 379 4.871 15.460 -2.141 1.00 0.00 H new ATOM 0 HA3 GLY B 379 3.307 14.699 -1.929 1.00 0.00 H new ATOM 1278 N TYR B 380 3.666 17.401 -3.135 1.00 0.00 N ATOM 1279 CA TYR B 380 3.089 18.641 -3.637 1.00 0.00 C ATOM 1280 C TYR B 380 2.456 18.412 -5.005 1.00 0.00 C ATOM 1281 O TYR B 380 1.247 18.203 -5.114 1.00 0.00 O ATOM 1282 CB TYR B 380 4.157 19.738 -3.725 1.00 0.00 C ATOM 1283 CG TYR B 380 5.544 19.227 -4.055 1.00 0.00 C ATOM 1284 CD1 TYR B 380 6.199 18.335 -3.213 1.00 0.00 C ATOM 1285 CD2 TYR B 380 6.201 19.638 -5.209 1.00 0.00 C ATOM 1286 CE1 TYR B 380 7.466 17.869 -3.512 1.00 0.00 C ATOM 1287 CE2 TYR B 380 7.467 19.176 -5.515 1.00 0.00 C ATOM 1288 CZ TYR B 380 8.095 18.293 -4.663 1.00 0.00 C ATOM 1289 OH TYR B 380 9.355 17.830 -4.964 1.00 0.00 O ATOM 0 H TYR B 380 4.413 17.019 -3.716 1.00 0.00 H new ATOM 0 HA TYR B 380 2.316 18.967 -2.941 1.00 0.00 H new ATOM 0 HB2 TYR B 380 3.858 20.461 -4.484 1.00 0.00 H new ATOM 0 HB3 TYR B 380 4.194 20.271 -2.775 1.00 0.00 H new ATOM 0 HD1 TYR B 380 5.710 18.001 -2.310 1.00 0.00 H new ATOM 0 HD2 TYR B 380 5.713 20.331 -5.879 1.00 0.00 H new ATOM 0 HE1 TYR B 380 7.960 17.176 -2.847 1.00 0.00 H new ATOM 0 HE2 TYR B 380 7.962 19.505 -6.417 1.00 0.00 H new ATOM 0 HH TYR B 380 9.655 18.225 -5.809 1.00 0.00 H new ATOM 1299 N ALA B 381 3.281 18.438 -6.046 1.00 0.00 N ATOM 1300 CA ALA B 381 2.804 18.217 -7.403 1.00 0.00 C ATOM 1301 C ALA B 381 2.640 16.726 -7.672 1.00 0.00 C ATOM 1302 O ALA B 381 1.760 16.316 -8.427 1.00 0.00 O ATOM 1303 CB ALA B 381 3.747 18.839 -8.423 1.00 0.00 C ATOM 0 H ALA B 381 4.284 18.610 -5.974 1.00 0.00 H new ATOM 0 HA ALA B 381 1.832 18.701 -7.502 1.00 0.00 H new ATOM 0 HB1 ALA B 381 3.366 18.659 -9.428 1.00 0.00 H new ATOM 0 HB2 ALA B 381 3.815 19.913 -8.248 1.00 0.00 H new ATOM 0 HB3 ALA B 381 4.736 18.392 -8.324 1.00 0.00 H new ATOM 1309 N SER B 382 3.498 15.926 -7.033 1.00 0.00 N ATOM 1310 CA SER B 382 3.472 14.471 -7.175 1.00 0.00 C ATOM 1311 C SER B 382 4.875 13.888 -7.026 1.00 0.00 C ATOM 1312 O SER B 382 5.471 13.430 -8.001 1.00 0.00 O ATOM 1313 CB SER B 382 2.891 14.062 -8.531 1.00 0.00 C ATOM 1314 OG SER B 382 3.395 14.882 -9.571 1.00 0.00 O ATOM 0 H SER B 382 4.226 16.268 -6.406 1.00 0.00 H new ATOM 0 HA SER B 382 2.834 14.075 -6.384 1.00 0.00 H new ATOM 0 HB2 SER B 382 3.135 13.020 -8.735 1.00 0.00 H new ATOM 0 HB3 SER B 382 1.804 14.135 -8.501 1.00 0.00 H new ATOM 0 HG SER B 382 2.730 15.564 -9.801 1.00 0.00 H new ATOM 1320 N LEU B 383 5.400 13.905 -5.803 1.00 0.00 N ATOM 1321 CA LEU B 383 6.733 13.371 -5.546 1.00 0.00 C ATOM 1322 C LEU B 383 6.926 12.048 -6.275 1.00 0.00 C ATOM 1323 O LEU B 383 5.959 11.344 -6.564 1.00 0.00 O ATOM 1324 CB LEU B 383 6.961 13.180 -4.045 1.00 0.00 C ATOM 1325 CG LEU B 383 8.430 13.129 -3.623 1.00 0.00 C ATOM 1326 CD1 LEU B 383 9.199 14.290 -4.235 1.00 0.00 C ATOM 1327 CD2 LEU B 383 8.551 13.146 -2.107 1.00 0.00 C ATOM 0 H LEU B 383 4.926 14.280 -4.981 1.00 0.00 H new ATOM 0 HA LEU B 383 7.463 14.089 -5.919 1.00 0.00 H new ATOM 0 HB2 LEU B 383 6.472 13.994 -3.511 1.00 0.00 H new ATOM 0 HB3 LEU B 383 6.475 12.256 -3.732 1.00 0.00 H new ATOM 0 HG LEU B 383 8.863 12.198 -3.990 1.00 0.00 H new ATOM 0 HD11 LEU B 383 10.243 14.239 -3.925 1.00 0.00 H new ATOM 0 HD12 LEU B 383 9.140 14.233 -5.322 1.00 0.00 H new ATOM 0 HD13 LEU B 383 8.766 15.232 -3.897 1.00 0.00 H new ATOM 0 HD21 LEU B 383 9.603 13.109 -1.826 1.00 0.00 H new ATOM 0 HD22 LEU B 383 8.103 14.060 -1.716 1.00 0.00 H new ATOM 0 HD23 LEU B 383 8.034 12.281 -1.691 1.00 0.00 H new ATOM 1339 N ARG B 384 8.175 11.720 -6.583 1.00 0.00 N ATOM 1340 CA ARG B 384 8.477 10.486 -7.295 1.00 0.00 C ATOM 1341 C ARG B 384 9.079 9.431 -6.370 1.00 0.00 C ATOM 1342 O ARG B 384 10.190 8.963 -6.600 1.00 0.00 O ATOM 1343 CB ARG B 384 9.438 10.771 -8.450 1.00 0.00 C ATOM 1344 CG ARG B 384 9.615 9.599 -9.401 1.00 0.00 C ATOM 1345 CD ARG B 384 10.613 9.923 -10.501 1.00 0.00 C ATOM 1346 NE ARG B 384 11.503 8.799 -10.779 1.00 0.00 N ATOM 1347 CZ ARG B 384 12.615 8.902 -11.499 1.00 0.00 C ATOM 1348 NH1 ARG B 384 12.976 10.072 -12.008 1.00 0.00 N ATOM 1349 NH2 ARG B 384 13.371 7.832 -11.710 1.00 0.00 N ATOM 0 H ARG B 384 8.990 12.288 -6.352 1.00 0.00 H new ATOM 0 HA ARG B 384 7.539 10.092 -7.686 1.00 0.00 H new ATOM 0 HB2 ARG B 384 9.072 11.631 -9.011 1.00 0.00 H new ATOM 0 HB3 ARG B 384 10.411 11.047 -8.042 1.00 0.00 H new ATOM 0 HG2 ARG B 384 9.955 8.725 -8.845 1.00 0.00 H new ATOM 0 HG3 ARG B 384 8.654 9.340 -9.845 1.00 0.00 H new ATOM 0 HD2 ARG B 384 10.076 10.194 -11.410 1.00 0.00 H new ATOM 0 HD3 ARG B 384 11.205 10.791 -10.210 1.00 0.00 H new ATOM 0 HE ARG B 384 11.257 7.885 -10.400 1.00 0.00 H new ATOM 0 HH11 ARG B 384 12.399 10.898 -11.847 1.00 0.00 H new ATOM 0 HH12 ARG B 384 13.830 10.146 -12.560 1.00 0.00 H new ATOM 0 HH21 ARG B 384 13.099 6.930 -11.319 1.00 0.00 H new ATOM 0 HH22 ARG B 384 14.225 7.912 -12.263 1.00 0.00 H new ATOM 1363 N LEU B 385 8.318 9.015 -5.361 1.00 0.00 N ATOM 1364 CA LEU B 385 8.749 7.967 -4.440 1.00 0.00 C ATOM 1365 C LEU B 385 7.612 6.963 -4.324 1.00 0.00 C ATOM 1366 O LEU B 385 6.478 7.353 -4.042 1.00 0.00 O ATOM 1367 CB LEU B 385 9.093 8.545 -3.064 1.00 0.00 C ATOM 1368 CG LEU B 385 7.896 8.793 -2.147 1.00 0.00 C ATOM 1369 CD1 LEU B 385 8.358 9.126 -0.737 1.00 0.00 C ATOM 1370 CD2 LEU B 385 7.031 9.908 -2.705 1.00 0.00 C ATOM 0 H LEU B 385 7.392 9.392 -5.160 1.00 0.00 H new ATOM 0 HA LEU B 385 9.651 7.487 -4.819 1.00 0.00 H new ATOM 0 HB2 LEU B 385 9.780 7.864 -2.562 1.00 0.00 H new ATOM 0 HB3 LEU B 385 9.624 9.486 -3.205 1.00 0.00 H new ATOM 0 HG LEU B 385 7.300 7.881 -2.100 1.00 0.00 H new ATOM 0 HD11 LEU B 385 7.490 9.299 -0.101 1.00 0.00 H new ATOM 0 HD12 LEU B 385 8.940 8.295 -0.339 1.00 0.00 H new ATOM 0 HD13 LEU B 385 8.976 10.024 -0.759 1.00 0.00 H new ATOM 0 HD21 LEU B 385 6.181 10.075 -2.043 1.00 0.00 H new ATOM 0 HD22 LEU B 385 7.619 10.823 -2.779 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.670 9.628 -3.695 1.00 0.00 H new ATOM 1382 N HIS B 386 7.881 5.682 -4.530 1.00 0.00 N ATOM 1383 CA HIS B 386 6.833 4.669 -4.429 1.00 0.00 C ATOM 1384 C HIS B 386 7.255 3.535 -3.499 1.00 0.00 C ATOM 1385 O HIS B 386 8.285 3.616 -2.830 1.00 0.00 O ATOM 1386 CB HIS B 386 6.510 4.106 -5.813 1.00 0.00 C ATOM 1387 CG HIS B 386 7.607 3.257 -6.373 1.00 0.00 C ATOM 1388 ND1 HIS B 386 7.421 2.370 -7.414 1.00 0.00 N ATOM 1389 CD2 HIS B 386 8.912 3.159 -6.027 1.00 0.00 C ATOM 1390 CE1 HIS B 386 8.564 1.766 -7.682 1.00 0.00 C ATOM 1391 NE2 HIS B 386 9.484 2.227 -6.856 1.00 0.00 N ATOM 0 H HIS B 386 8.805 5.319 -4.766 1.00 0.00 H new ATOM 0 HA HIS B 386 5.944 5.144 -4.014 1.00 0.00 H new ATOM 0 HB2 HIS B 386 5.596 3.515 -5.754 1.00 0.00 H new ATOM 0 HB3 HIS B 386 6.312 4.931 -6.497 1.00 0.00 H new ATOM 0 HD1 HIS B 386 6.539 2.207 -7.900 1.00 0.00 H new ATOM 0 HD2 HIS B 386 9.410 3.712 -5.244 1.00 0.00 H new ATOM 0 HE1 HIS B 386 8.720 1.021 -8.448 1.00 0.00 H new ATOM 1400 N TYR B 387 6.465 2.461 -3.492 1.00 0.00 N ATOM 1401 CA TYR B 387 6.769 1.288 -2.681 1.00 0.00 C ATOM 1402 C TYR B 387 7.177 0.120 -3.574 1.00 0.00 C ATOM 1403 O TYR B 387 6.384 -0.354 -4.386 1.00 0.00 O ATOM 1404 CB TYR B 387 5.557 0.877 -1.847 1.00 0.00 C ATOM 1405 CG TYR B 387 5.056 1.958 -0.926 1.00 0.00 C ATOM 1406 CD1 TYR B 387 4.188 2.938 -1.383 1.00 0.00 C ATOM 1407 CD2 TYR B 387 5.449 1.997 0.403 1.00 0.00 C ATOM 1408 CE1 TYR B 387 3.727 3.928 -0.541 1.00 0.00 C ATOM 1409 CE2 TYR B 387 4.989 2.984 1.251 1.00 0.00 C ATOM 1410 CZ TYR B 387 4.129 3.946 0.774 1.00 0.00 C ATOM 1411 OH TYR B 387 3.667 4.929 1.618 1.00 0.00 O ATOM 0 H TYR B 387 5.609 2.382 -4.041 1.00 0.00 H new ATOM 0 HA TYR B 387 7.592 1.546 -2.014 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.750 0.582 -2.518 1.00 0.00 H new ATOM 0 HB3 TYR B 387 5.816 -0.000 -1.254 1.00 0.00 H new ATOM 0 HD1 TYR B 387 3.868 2.926 -2.414 1.00 0.00 H new ATOM 0 HD2 TYR B 387 6.125 1.244 0.780 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.053 4.686 -0.913 1.00 0.00 H new ATOM 0 HE2 TYR B 387 5.303 3.001 2.284 1.00 0.00 H new ATOM 0 HH TYR B 387 2.689 4.884 1.668 1.00 0.00 H new ATOM 1421 N VAL B 388 8.410 -0.346 -3.418 1.00 0.00 N ATOM 1422 CA VAL B 388 8.906 -1.464 -4.210 1.00 0.00 C ATOM 1423 C VAL B 388 8.822 -2.763 -3.415 1.00 0.00 C ATOM 1424 O VAL B 388 9.417 -2.885 -2.346 1.00 0.00 O ATOM 1425 CB VAL B 388 10.361 -1.236 -4.657 1.00 0.00 C ATOM 1426 CG1 VAL B 388 10.423 -0.178 -5.748 1.00 0.00 C ATOM 1427 CG2 VAL B 388 11.227 -0.841 -3.470 1.00 0.00 C ATOM 0 H VAL B 388 9.083 0.032 -2.752 1.00 0.00 H new ATOM 0 HA VAL B 388 8.276 -1.537 -5.097 1.00 0.00 H new ATOM 0 HB VAL B 388 10.749 -2.169 -5.066 1.00 0.00 H new ATOM 0 HG11 VAL B 388 11.459 -0.029 -6.052 1.00 0.00 H new ATOM 0 HG12 VAL B 388 9.836 -0.506 -6.606 1.00 0.00 H new ATOM 0 HG13 VAL B 388 10.018 0.760 -5.368 1.00 0.00 H new ATOM 0 HG21 VAL B 388 12.253 -0.684 -3.804 1.00 0.00 H new ATOM 0 HG22 VAL B 388 10.843 0.080 -3.030 1.00 0.00 H new ATOM 0 HG23 VAL B 388 11.206 -1.636 -2.724 1.00 0.00 H new ATOM 1437 N THR B 389 8.075 -3.728 -3.938 1.00 0.00 N ATOM 1438 CA THR B 389 7.910 -5.010 -3.266 1.00 0.00 C ATOM 1439 C THR B 389 9.012 -5.992 -3.650 1.00 0.00 C ATOM 1440 O THR B 389 9.184 -6.324 -4.822 1.00 0.00 O ATOM 1441 CB THR B 389 6.543 -5.641 -3.590 1.00 0.00 C ATOM 1442 OG1 THR B 389 6.292 -6.791 -2.770 1.00 0.00 O ATOM 1443 CG2 THR B 389 6.474 -6.063 -5.049 1.00 0.00 C ATOM 0 H THR B 389 7.575 -3.647 -4.823 1.00 0.00 H new ATOM 0 HA THR B 389 7.970 -4.809 -2.196 1.00 0.00 H new ATOM 0 HB THR B 389 5.787 -4.882 -3.389 1.00 0.00 H new ATOM 0 HG1 THR B 389 6.892 -6.778 -1.996 1.00 0.00 H new ATOM 0 HG21 THR B 389 5.499 -6.506 -5.254 1.00 0.00 H new ATOM 0 HG22 THR B 389 6.618 -5.191 -5.687 1.00 0.00 H new ATOM 0 HG23 THR B 389 7.255 -6.795 -5.253 1.00 0.00 H new ATOM 1451 N VAL B 390 9.753 -6.456 -2.648 1.00 0.00 N ATOM 1452 CA VAL B 390 10.837 -7.403 -2.871 1.00 0.00 C ATOM 1453 C VAL B 390 10.761 -8.575 -1.892 1.00 0.00 C ATOM 1454 O VAL B 390 10.799 -8.396 -0.671 1.00 0.00 O ATOM 1455 CB VAL B 390 12.213 -6.725 -2.741 1.00 0.00 C ATOM 1456 CG1 VAL B 390 12.518 -5.894 -3.977 1.00 0.00 C ATOM 1457 CG2 VAL B 390 12.272 -5.867 -1.487 1.00 0.00 C ATOM 0 H VAL B 390 9.621 -6.190 -1.672 1.00 0.00 H new ATOM 0 HA VAL B 390 10.721 -7.778 -3.888 1.00 0.00 H new ATOM 0 HB VAL B 390 12.972 -7.503 -2.657 1.00 0.00 H new ATOM 0 HG11 VAL B 390 13.495 -5.423 -3.867 1.00 0.00 H new ATOM 0 HG12 VAL B 390 12.523 -6.538 -4.856 1.00 0.00 H new ATOM 0 HG13 VAL B 390 11.755 -5.125 -4.096 1.00 0.00 H new ATOM 0 HG21 VAL B 390 13.253 -5.397 -1.414 1.00 0.00 H new ATOM 0 HG22 VAL B 390 11.503 -5.096 -1.537 1.00 0.00 H new ATOM 0 HG23 VAL B 390 12.103 -6.492 -0.610 1.00 0.00 H new ATOM 1467 N LYS B 391 10.623 -9.775 -2.436 1.00 0.00 N ATOM 1468 CA LYS B 391 10.535 -10.975 -1.620 1.00 0.00 C ATOM 1469 C LYS B 391 10.355 -12.203 -2.499 1.00 0.00 C ATOM 1470 O LYS B 391 10.013 -12.083 -3.674 1.00 0.00 O ATOM 1471 CB LYS B 391 9.416 -10.864 -0.592 1.00 0.00 C ATOM 1472 CG LYS B 391 9.937 -10.722 0.832 1.00 0.00 C ATOM 1473 CD LYS B 391 10.717 -11.954 1.261 1.00 0.00 C ATOM 1474 CE LYS B 391 11.107 -11.882 2.729 1.00 0.00 C ATOM 1475 NZ LYS B 391 11.356 -10.482 3.171 1.00 0.00 N ATOM 0 H LYS B 391 10.570 -9.943 -3.441 1.00 0.00 H new ATOM 0 HA LYS B 391 11.471 -11.082 -1.071 1.00 0.00 H new ATOM 0 HB2 LYS B 391 8.791 -10.004 -0.833 1.00 0.00 H new ATOM 0 HB3 LYS B 391 8.781 -11.748 -0.656 1.00 0.00 H new ATOM 0 HG2 LYS B 391 10.576 -9.842 0.901 1.00 0.00 H new ATOM 0 HG3 LYS B 391 9.101 -10.563 1.513 1.00 0.00 H new ATOM 0 HD2 LYS B 391 10.115 -12.846 1.086 1.00 0.00 H new ATOM 0 HD3 LYS B 391 11.614 -12.050 0.649 1.00 0.00 H new ATOM 0 HE2 LYS B 391 10.314 -12.319 3.337 1.00 0.00 H new ATOM 0 HE3 LYS B 391 12.003 -12.480 2.896 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 11.842 -10.489 4.091 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 11.951 -9.997 2.469 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 10.450 -9.980 3.262 1.00 0.00 H new ATOM 1489 N LYS B 392 10.565 -13.384 -1.929 1.00 0.00 N ATOM 1490 CA LYS B 392 10.391 -14.620 -2.677 1.00 0.00 C ATOM 1491 C LYS B 392 9.032 -15.232 -2.347 1.00 0.00 C ATOM 1492 O LYS B 392 8.930 -16.137 -1.519 1.00 0.00 O ATOM 1493 CB LYS B 392 11.508 -15.610 -2.345 1.00 0.00 C ATOM 1494 CG LYS B 392 12.897 -15.110 -2.711 1.00 0.00 C ATOM 1495 CD LYS B 392 13.982 -16.023 -2.163 1.00 0.00 C ATOM 1496 CE LYS B 392 13.598 -17.488 -2.297 1.00 0.00 C ATOM 1497 NZ LYS B 392 14.792 -18.377 -2.296 1.00 0.00 N ATOM 0 H LYS B 392 10.854 -13.510 -0.959 1.00 0.00 H new ATOM 0 HA LYS B 392 10.436 -14.396 -3.743 1.00 0.00 H new ATOM 0 HB2 LYS B 392 11.480 -15.831 -1.278 1.00 0.00 H new ATOM 0 HB3 LYS B 392 11.319 -16.547 -2.869 1.00 0.00 H new ATOM 0 HG2 LYS B 392 12.988 -15.046 -3.795 1.00 0.00 H new ATOM 0 HG3 LYS B 392 13.037 -14.102 -2.320 1.00 0.00 H new ATOM 0 HD2 LYS B 392 14.916 -15.840 -2.695 1.00 0.00 H new ATOM 0 HD3 LYS B 392 14.162 -15.787 -1.114 1.00 0.00 H new ATOM 0 HE2 LYS B 392 12.937 -17.767 -1.476 1.00 0.00 H new ATOM 0 HE3 LYS B 392 13.038 -17.633 -3.221 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 14.488 -19.367 -2.389 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 15.411 -18.128 -3.094 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 15.313 -18.257 -1.404 1.00 0.00 H new ATOM 1511 N PRO B 393 7.962 -14.727 -2.987 1.00 0.00 N ATOM 1512 CA PRO B 393 6.593 -15.205 -2.758 1.00 0.00 C ATOM 1513 C PRO B 393 6.401 -16.663 -3.145 1.00 0.00 C ATOM 1514 O PRO B 393 6.636 -17.052 -4.289 1.00 0.00 O ATOM 1515 CB PRO B 393 5.740 -14.305 -3.658 1.00 0.00 C ATOM 1516 CG PRO B 393 6.688 -13.791 -4.684 1.00 0.00 C ATOM 1517 CD PRO B 393 7.999 -13.637 -3.973 1.00 0.00 C ATOM 0 HA PRO B 393 6.329 -15.157 -1.702 1.00 0.00 H new ATOM 0 HB2 PRO B 393 4.924 -14.863 -4.117 1.00 0.00 H new ATOM 0 HB3 PRO B 393 5.290 -13.490 -3.091 1.00 0.00 H new ATOM 0 HG2 PRO B 393 6.774 -14.484 -5.521 1.00 0.00 H new ATOM 0 HG3 PRO B 393 6.348 -12.839 -5.091 1.00 0.00 H new ATOM 0 HD2 PRO B 393 8.844 -13.736 -4.655 1.00 0.00 H new ATOM 0 HD3 PRO B 393 8.088 -12.661 -3.495 1.00 0.00 H new ATOM 1525 N THR B 394 5.957 -17.460 -2.184 1.00 0.00 N ATOM 1526 CA THR B 394 5.713 -18.873 -2.419 1.00 0.00 C ATOM 1527 C THR B 394 4.379 -19.297 -1.821 1.00 0.00 C ATOM 1528 O THR B 394 3.868 -18.659 -0.900 1.00 0.00 O ATOM 1529 CB THR B 394 6.836 -19.748 -1.835 1.00 0.00 C ATOM 1530 OG1 THR B 394 7.386 -19.170 -0.644 1.00 0.00 O ATOM 1531 CG2 THR B 394 7.957 -19.929 -2.845 1.00 0.00 C ATOM 0 H THR B 394 5.758 -17.150 -1.233 1.00 0.00 H new ATOM 0 HA THR B 394 5.688 -19.018 -3.499 1.00 0.00 H new ATOM 0 HB THR B 394 6.393 -20.714 -1.593 1.00 0.00 H new ATOM 0 HG1 THR B 394 6.856 -18.388 -0.385 1.00 0.00 H new ATOM 0 HG21 THR B 394 8.740 -20.551 -2.412 1.00 0.00 H new ATOM 0 HG22 THR B 394 7.565 -20.411 -3.741 1.00 0.00 H new ATOM 0 HG23 THR B 394 8.370 -18.955 -3.108 1.00 0.00 H new ATOM 1539 N ALA B 395 3.802 -20.352 -2.376 1.00 0.00 N ATOM 1540 CA ALA B 395 2.503 -20.821 -1.915 1.00 0.00 C ATOM 1541 C ALA B 395 2.497 -20.957 -0.395 1.00 0.00 C ATOM 1542 O ALA B 395 1.605 -20.432 0.272 1.00 0.00 O ATOM 1543 CB ALA B 395 2.138 -22.146 -2.565 1.00 0.00 C ATOM 0 H ALA B 395 4.207 -20.895 -3.138 1.00 0.00 H new ATOM 0 HA ALA B 395 1.755 -20.084 -2.206 1.00 0.00 H new ATOM 0 HB1 ALA B 395 1.163 -22.473 -2.203 1.00 0.00 H new ATOM 0 HB2 ALA B 395 2.100 -22.022 -3.647 1.00 0.00 H new ATOM 0 HB3 ALA B 395 2.889 -22.895 -2.312 1.00 0.00 H new ATOM 1549 N VAL B 396 3.489 -21.649 0.155 1.00 0.00 N ATOM 1550 CA VAL B 396 3.571 -21.821 1.607 1.00 0.00 C ATOM 1551 C VAL B 396 4.057 -20.535 2.272 1.00 0.00 C ATOM 1552 O VAL B 396 3.516 -20.102 3.291 1.00 0.00 O ATOM 1553 CB VAL B 396 4.496 -23.012 2.012 1.00 0.00 C ATOM 1554 CG1 VAL B 396 4.902 -23.829 0.799 1.00 0.00 C ATOM 1555 CG2 VAL B 396 5.741 -22.551 2.767 1.00 0.00 C ATOM 0 H VAL B 396 4.240 -22.096 -0.371 1.00 0.00 H new ATOM 0 HA VAL B 396 2.565 -22.053 1.956 1.00 0.00 H new ATOM 0 HB VAL B 396 3.911 -23.640 2.685 1.00 0.00 H new ATOM 0 HG11 VAL B 396 5.546 -24.651 1.113 1.00 0.00 H new ATOM 0 HG12 VAL B 396 4.011 -24.230 0.316 1.00 0.00 H new ATOM 0 HG13 VAL B 396 5.441 -23.194 0.096 1.00 0.00 H new ATOM 0 HG21 VAL B 396 6.351 -23.417 3.026 1.00 0.00 H new ATOM 0 HG22 VAL B 396 6.319 -21.875 2.137 1.00 0.00 H new ATOM 0 HG23 VAL B 396 5.443 -22.032 3.678 1.00 0.00 H new ATOM 1565 N ASP B 397 5.092 -19.945 1.691 1.00 0.00 N ATOM 1566 CA ASP B 397 5.679 -18.722 2.219 1.00 0.00 C ATOM 1567 C ASP B 397 5.412 -17.540 1.291 1.00 0.00 C ATOM 1568 O ASP B 397 6.198 -17.255 0.387 1.00 0.00 O ATOM 1569 CB ASP B 397 7.181 -18.926 2.403 1.00 0.00 C ATOM 1570 CG ASP B 397 7.903 -17.645 2.771 1.00 0.00 C ATOM 1571 OD1 ASP B 397 7.670 -17.131 3.884 1.00 0.00 O ATOM 1572 OD2 ASP B 397 8.701 -17.157 1.944 1.00 0.00 O ATOM 0 H ASP B 397 5.545 -20.297 0.848 1.00 0.00 H new ATOM 0 HA ASP B 397 5.220 -18.496 3.182 1.00 0.00 H new ATOM 0 HB2 ASP B 397 7.350 -19.670 3.181 1.00 0.00 H new ATOM 0 HB3 ASP B 397 7.605 -19.326 1.482 1.00 0.00 H new ATOM 1577 N PRO B 398 4.282 -16.848 1.497 1.00 0.00 N ATOM 1578 CA PRO B 398 3.883 -15.703 0.678 1.00 0.00 C ATOM 1579 C PRO B 398 4.479 -14.377 1.151 1.00 0.00 C ATOM 1580 O PRO B 398 4.613 -13.438 0.365 1.00 0.00 O ATOM 1581 CB PRO B 398 2.368 -15.693 0.853 1.00 0.00 C ATOM 1582 CG PRO B 398 2.148 -16.200 2.241 1.00 0.00 C ATOM 1583 CD PRO B 398 3.287 -17.145 2.542 1.00 0.00 C ATOM 0 HA PRO B 398 4.229 -15.799 -0.351 1.00 0.00 H new ATOM 0 HB2 PRO B 398 1.961 -14.690 0.728 1.00 0.00 H new ATOM 0 HB3 PRO B 398 1.879 -16.330 0.116 1.00 0.00 H new ATOM 0 HG2 PRO B 398 2.129 -15.377 2.955 1.00 0.00 H new ATOM 0 HG3 PRO B 398 1.189 -16.712 2.319 1.00 0.00 H new ATOM 0 HD2 PRO B 398 3.693 -16.976 3.539 1.00 0.00 H new ATOM 0 HD3 PRO B 398 2.964 -18.185 2.501 1.00 0.00 H new ATOM 1591 N ASN B 399 4.792 -14.286 2.440 1.00 0.00 N ATOM 1592 CA ASN B 399 5.323 -13.052 3.017 1.00 0.00 C ATOM 1593 C ASN B 399 6.199 -12.288 2.027 1.00 0.00 C ATOM 1594 O ASN B 399 7.104 -12.848 1.408 1.00 0.00 O ATOM 1595 CB ASN B 399 6.127 -13.367 4.280 1.00 0.00 C ATOM 1596 CG ASN B 399 5.358 -13.054 5.549 1.00 0.00 C ATOM 1597 OD1 ASN B 399 5.265 -11.898 5.963 1.00 0.00 O ATOM 1598 ND2 ASN B 399 4.803 -14.085 6.175 1.00 0.00 N ATOM 0 H ASN B 399 4.688 -15.051 3.106 1.00 0.00 H new ATOM 0 HA ASN B 399 4.473 -12.417 3.268 1.00 0.00 H new ATOM 0 HB2 ASN B 399 6.404 -14.421 4.277 1.00 0.00 H new ATOM 0 HB3 ASN B 399 7.054 -12.794 4.270 1.00 0.00 H new ATOM 0 HD21 ASN B 399 4.274 -13.935 7.034 1.00 0.00 H new ATOM 0 HD22 ASN B 399 4.905 -15.027 5.796 1.00 0.00 H new ATOM 1605 N SER B 400 5.901 -10.994 1.884 1.00 0.00 N ATOM 1606 CA SER B 400 6.634 -10.125 0.967 1.00 0.00 C ATOM 1607 C SER B 400 7.023 -8.803 1.635 1.00 0.00 C ATOM 1608 O SER B 400 6.298 -8.297 2.492 1.00 0.00 O ATOM 1609 CB SER B 400 5.787 -9.842 -0.276 1.00 0.00 C ATOM 1610 OG SER B 400 6.311 -8.751 -1.012 1.00 0.00 O ATOM 0 H SER B 400 5.153 -10.526 2.395 1.00 0.00 H new ATOM 0 HA SER B 400 7.549 -10.643 0.679 1.00 0.00 H new ATOM 0 HB2 SER B 400 5.755 -10.729 -0.908 1.00 0.00 H new ATOM 0 HB3 SER B 400 4.761 -9.625 0.021 1.00 0.00 H new ATOM 0 HG SER B 400 5.656 -8.463 -1.682 1.00 0.00 H new ATOM 1616 N ILE B 401 8.163 -8.233 1.225 1.00 0.00 N ATOM 1617 CA ILE B 401 8.622 -6.962 1.776 1.00 0.00 C ATOM 1618 C ILE B 401 8.354 -5.838 0.782 1.00 0.00 C ATOM 1619 O ILE B 401 8.387 -6.052 -0.427 1.00 0.00 O ATOM 1620 CB ILE B 401 10.129 -7.007 2.145 1.00 0.00 C ATOM 1621 CG1 ILE B 401 10.378 -6.205 3.422 1.00 0.00 C ATOM 1622 CG2 ILE B 401 11.009 -6.484 1.014 1.00 0.00 C ATOM 1623 CD1 ILE B 401 11.452 -6.799 4.307 1.00 0.00 C ATOM 0 H ILE B 401 8.778 -8.633 0.517 1.00 0.00 H new ATOM 0 HA ILE B 401 8.065 -6.774 2.694 1.00 0.00 H new ATOM 0 HB ILE B 401 10.398 -8.050 2.312 1.00 0.00 H new ATOM 0 HG12 ILE B 401 10.661 -5.187 3.153 1.00 0.00 H new ATOM 0 HG13 ILE B 401 9.448 -6.138 3.987 1.00 0.00 H new ATOM 0 HG21 ILE B 401 12.056 -6.533 1.315 1.00 0.00 H new ATOM 0 HG22 ILE B 401 10.858 -7.094 0.124 1.00 0.00 H new ATOM 0 HG23 ILE B 401 10.743 -5.450 0.794 1.00 0.00 H new ATOM 0 HD11 ILE B 401 11.576 -6.179 5.195 1.00 0.00 H new ATOM 0 HD12 ILE B 401 11.161 -7.806 4.606 1.00 0.00 H new ATOM 0 HD13 ILE B 401 12.393 -6.840 3.759 1.00 0.00 H new ATOM 1635 N VAL B 402 8.116 -4.639 1.287 1.00 0.00 N ATOM 1636 CA VAL B 402 7.882 -3.488 0.423 1.00 0.00 C ATOM 1637 C VAL B 402 8.700 -2.316 0.920 1.00 0.00 C ATOM 1638 O VAL B 402 8.513 -1.858 2.044 1.00 0.00 O ATOM 1639 CB VAL B 402 6.400 -3.071 0.366 1.00 0.00 C ATOM 1640 CG1 VAL B 402 5.927 -2.990 -1.075 1.00 0.00 C ATOM 1641 CG2 VAL B 402 5.535 -4.027 1.166 1.00 0.00 C ATOM 0 H VAL B 402 8.079 -4.435 2.286 1.00 0.00 H new ATOM 0 HA VAL B 402 8.179 -3.780 -0.584 1.00 0.00 H new ATOM 0 HB VAL B 402 6.306 -2.082 0.815 1.00 0.00 H new ATOM 0 HG11 VAL B 402 4.878 -2.694 -1.098 1.00 0.00 H new ATOM 0 HG12 VAL B 402 6.523 -2.253 -1.613 1.00 0.00 H new ATOM 0 HG13 VAL B 402 6.039 -3.964 -1.550 1.00 0.00 H new ATOM 0 HG21 VAL B 402 4.494 -3.710 1.109 1.00 0.00 H new ATOM 0 HG22 VAL B 402 5.631 -5.033 0.757 1.00 0.00 H new ATOM 0 HG23 VAL B 402 5.858 -4.026 2.207 1.00 0.00 H new ATOM 1651 N GLU B 403 9.611 -1.838 0.088 1.00 0.00 N ATOM 1652 CA GLU B 403 10.466 -0.725 0.465 1.00 0.00 C ATOM 1653 C GLU B 403 9.929 0.592 -0.067 1.00 0.00 C ATOM 1654 O GLU B 403 9.403 0.665 -1.175 1.00 0.00 O ATOM 1655 CB GLU B 403 11.886 -0.954 -0.053 1.00 0.00 C ATOM 1656 CG GLU B 403 12.486 -2.282 0.379 1.00 0.00 C ATOM 1657 CD GLU B 403 13.883 -2.497 -0.171 1.00 0.00 C ATOM 1658 OE1 GLU B 403 14.717 -1.576 -0.044 1.00 0.00 O ATOM 1659 OE2 GLU B 403 14.142 -3.583 -0.727 1.00 0.00 O ATOM 0 H GLU B 403 9.777 -2.202 -0.850 1.00 0.00 H new ATOM 0 HA GLU B 403 10.481 -0.669 1.553 1.00 0.00 H new ATOM 0 HB2 GLU B 403 11.878 -0.906 -1.142 1.00 0.00 H new ATOM 0 HB3 GLU B 403 12.526 -0.145 0.298 1.00 0.00 H new ATOM 0 HG2 GLU B 403 12.517 -2.325 1.468 1.00 0.00 H new ATOM 0 HG3 GLU B 403 11.839 -3.094 0.046 1.00 0.00 H new ATOM 1666 N CYS B 404 10.095 1.637 0.727 1.00 0.00 N ATOM 1667 CA CYS B 404 9.661 2.965 0.342 1.00 0.00 C ATOM 1668 C CYS B 404 10.864 3.764 -0.124 1.00 0.00 C ATOM 1669 O CYS B 404 11.654 4.230 0.694 1.00 0.00 O ATOM 1670 CB CYS B 404 8.980 3.670 1.518 1.00 0.00 C ATOM 1671 SG CYS B 404 7.903 5.041 1.035 1.00 0.00 S ATOM 0 H CYS B 404 10.531 1.588 1.648 1.00 0.00 H new ATOM 0 HA CYS B 404 8.938 2.886 -0.470 1.00 0.00 H new ATOM 0 HB2 CYS B 404 8.393 2.940 2.075 1.00 0.00 H new ATOM 0 HB3 CYS B 404 9.747 4.046 2.196 1.00 0.00 H new ATOM 0 HG CYS B 404 6.669 4.633 1.002 1.00 0.00 H new ATOM 1677 N ARG B 405 11.009 3.892 -1.441 1.00 0.00 N ATOM 1678 CA ARG B 405 12.132 4.615 -2.029 1.00 0.00 C ATOM 1679 C ARG B 405 11.652 5.853 -2.776 1.00 0.00 C ATOM 1680 O ARG B 405 10.491 5.926 -3.198 1.00 0.00 O ATOM 1681 CB ARG B 405 12.908 3.701 -2.978 1.00 0.00 C ATOM 1682 CG ARG B 405 14.308 4.199 -3.294 1.00 0.00 C ATOM 1683 CD ARG B 405 14.997 3.311 -4.318 1.00 0.00 C ATOM 1684 NE ARG B 405 14.580 3.621 -5.682 1.00 0.00 N ATOM 1685 CZ ARG B 405 15.350 3.436 -6.751 1.00 0.00 C ATOM 1686 NH1 ARG B 405 16.573 2.941 -6.615 1.00 0.00 N ATOM 1687 NH2 ARG B 405 14.896 3.745 -7.958 1.00 0.00 N ATOM 0 H ARG B 405 10.359 3.502 -2.123 1.00 0.00 H new ATOM 0 HA ARG B 405 12.790 4.935 -1.221 1.00 0.00 H new ATOM 0 HB2 ARG B 405 12.976 2.707 -2.536 1.00 0.00 H new ATOM 0 HB3 ARG B 405 12.349 3.599 -3.908 1.00 0.00 H new ATOM 0 HG2 ARG B 405 14.255 5.220 -3.673 1.00 0.00 H new ATOM 0 HG3 ARG B 405 14.900 4.228 -2.379 1.00 0.00 H new ATOM 0 HD2 ARG B 405 16.077 3.431 -4.233 1.00 0.00 H new ATOM 0 HD3 ARG B 405 14.774 2.267 -4.100 1.00 0.00 H new ATOM 0 HE ARG B 405 13.644 4.001 -5.824 1.00 0.00 H new ATOM 0 HH11 ARG B 405 16.926 2.701 -5.689 1.00 0.00 H new ATOM 0 HH12 ARG B 405 17.161 2.800 -7.437 1.00 0.00 H new ATOM 0 HH21 ARG B 405 13.956 4.125 -8.067 1.00 0.00 H new ATOM 0 HH22 ARG B 405 15.487 3.603 -8.777 1.00 0.00 H new ATOM 1701 N VAL B 406 12.550 6.826 -2.950 1.00 0.00 N ATOM 1702 CA VAL B 406 12.213 8.057 -3.648 1.00 0.00 C ATOM 1703 C VAL B 406 13.069 8.241 -4.901 1.00 0.00 C ATOM 1704 O VAL B 406 14.217 7.794 -4.955 1.00 0.00 O ATOM 1705 CB VAL B 406 12.381 9.287 -2.732 1.00 0.00 C ATOM 1706 CG1 VAL B 406 11.840 8.995 -1.341 1.00 0.00 C ATOM 1707 CG2 VAL B 406 13.840 9.715 -2.661 1.00 0.00 C ATOM 0 H VAL B 406 13.513 6.780 -2.616 1.00 0.00 H new ATOM 0 HA VAL B 406 11.167 7.974 -3.943 1.00 0.00 H new ATOM 0 HB VAL B 406 11.807 10.110 -3.159 1.00 0.00 H new ATOM 0 HG11 VAL B 406 11.967 9.874 -0.709 1.00 0.00 H new ATOM 0 HG12 VAL B 406 10.781 8.746 -1.407 1.00 0.00 H new ATOM 0 HG13 VAL B 406 12.384 8.155 -0.908 1.00 0.00 H new ATOM 0 HG21 VAL B 406 13.933 10.584 -2.009 1.00 0.00 H new ATOM 0 HG22 VAL B 406 14.440 8.897 -2.263 1.00 0.00 H new ATOM 0 HG23 VAL B 406 14.193 9.971 -3.660 1.00 0.00 H new ATOM 1717 N GLY B 407 12.477 8.897 -5.897 1.00 0.00 N ATOM 1718 CA GLY B 407 13.137 9.155 -7.170 1.00 0.00 C ATOM 1719 C GLY B 407 14.651 9.180 -7.101 1.00 0.00 C ATOM 1720 O GLY B 407 15.321 8.632 -7.977 1.00 0.00 O ATOM 0 H GLY B 407 11.527 9.263 -5.842 1.00 0.00 H new ATOM 0 HA2 GLY B 407 12.831 8.391 -7.884 1.00 0.00 H new ATOM 0 HA3 GLY B 407 12.788 10.112 -7.558 1.00 0.00 H new ATOM 1724 N ASP B 408 15.202 9.827 -6.080 1.00 0.00 N ATOM 1725 CA ASP B 408 16.653 9.929 -5.935 1.00 0.00 C ATOM 1726 C ASP B 408 17.291 8.605 -5.506 1.00 0.00 C ATOM 1727 O ASP B 408 18.462 8.574 -5.127 1.00 0.00 O ATOM 1728 CB ASP B 408 17.006 11.021 -4.923 1.00 0.00 C ATOM 1729 CG ASP B 408 17.429 12.315 -5.592 1.00 0.00 C ATOM 1730 OD1 ASP B 408 18.101 12.249 -6.642 1.00 0.00 O ATOM 1731 OD2 ASP B 408 17.089 13.394 -5.063 1.00 0.00 O ATOM 0 H ASP B 408 14.670 10.288 -5.342 1.00 0.00 H new ATOM 0 HA ASP B 408 17.055 10.186 -6.915 1.00 0.00 H new ATOM 0 HB2 ASP B 408 16.145 11.211 -4.283 1.00 0.00 H new ATOM 0 HB3 ASP B 408 17.811 10.668 -4.278 1.00 0.00 H new ATOM 1736 N GLY B 409 16.527 7.517 -5.555 1.00 0.00 N ATOM 1737 CA GLY B 409 17.058 6.230 -5.158 1.00 0.00 C ATOM 1738 C GLY B 409 17.370 6.190 -3.681 1.00 0.00 C ATOM 1739 O GLY B 409 18.446 5.751 -3.275 1.00 0.00 O ATOM 0 H GLY B 409 15.554 7.506 -5.862 1.00 0.00 H new ATOM 0 HA2 GLY B 409 16.338 5.448 -5.400 1.00 0.00 H new ATOM 0 HA3 GLY B 409 17.963 6.017 -5.728 1.00 0.00 H new ATOM 1743 N THR B 410 16.427 6.662 -2.872 1.00 0.00 N ATOM 1744 CA THR B 410 16.613 6.685 -1.425 1.00 0.00 C ATOM 1745 C THR B 410 15.551 5.857 -0.714 1.00 0.00 C ATOM 1746 O THR B 410 14.370 6.202 -0.733 1.00 0.00 O ATOM 1747 CB THR B 410 16.567 8.131 -0.885 1.00 0.00 C ATOM 1748 OG1 THR B 410 17.769 8.843 -1.205 1.00 0.00 O ATOM 1749 CG2 THR B 410 16.385 8.155 0.627 1.00 0.00 C ATOM 0 H THR B 410 15.531 7.032 -3.191 1.00 0.00 H new ATOM 0 HA THR B 410 17.593 6.253 -1.224 1.00 0.00 H new ATOM 0 HB THR B 410 15.714 8.614 -1.363 1.00 0.00 H new ATOM 0 HG1 THR B 410 17.712 9.756 -0.853 1.00 0.00 H new ATOM 0 HG21 THR B 410 16.357 9.188 0.974 1.00 0.00 H new ATOM 0 HG22 THR B 410 15.451 7.659 0.889 1.00 0.00 H new ATOM 0 HG23 THR B 410 17.217 7.635 1.102 1.00 0.00 H new ATOM 1757 N VAL B 411 15.977 4.777 -0.064 1.00 0.00 N ATOM 1758 CA VAL B 411 15.056 3.925 0.671 1.00 0.00 C ATOM 1759 C VAL B 411 14.678 4.594 1.982 1.00 0.00 C ATOM 1760 O VAL B 411 15.536 4.870 2.820 1.00 0.00 O ATOM 1761 CB VAL B 411 15.665 2.542 0.962 1.00 0.00 C ATOM 1762 CG1 VAL B 411 14.576 1.482 1.019 1.00 0.00 C ATOM 1763 CG2 VAL B 411 16.709 2.188 -0.084 1.00 0.00 C ATOM 0 H VAL B 411 16.951 4.475 -0.033 1.00 0.00 H new ATOM 0 HA VAL B 411 14.171 3.780 0.051 1.00 0.00 H new ATOM 0 HB VAL B 411 16.157 2.578 1.934 1.00 0.00 H new ATOM 0 HG11 VAL B 411 15.025 0.510 1.226 1.00 0.00 H new ATOM 0 HG12 VAL B 411 13.868 1.730 1.809 1.00 0.00 H new ATOM 0 HG13 VAL B 411 14.054 1.445 0.063 1.00 0.00 H new ATOM 0 HG21 VAL B 411 17.129 1.207 0.138 1.00 0.00 H new ATOM 0 HG22 VAL B 411 16.244 2.169 -1.070 1.00 0.00 H new ATOM 0 HG23 VAL B 411 17.504 2.934 -0.072 1.00 0.00 H new ATOM 1773 N LEU B 412 13.397 4.876 2.141 1.00 0.00 N ATOM 1774 CA LEU B 412 12.913 5.539 3.336 1.00 0.00 C ATOM 1775 C LEU B 412 11.781 4.770 4.002 1.00 0.00 C ATOM 1776 O LEU B 412 11.163 5.273 4.940 1.00 0.00 O ATOM 1777 CB LEU B 412 12.441 6.950 2.988 1.00 0.00 C ATOM 1778 CG LEU B 412 13.531 8.018 3.024 1.00 0.00 C ATOM 1779 CD1 LEU B 412 13.091 9.259 2.264 1.00 0.00 C ATOM 1780 CD2 LEU B 412 13.877 8.363 4.463 1.00 0.00 C ATOM 0 H LEU B 412 12.674 4.656 1.456 1.00 0.00 H new ATOM 0 HA LEU B 412 13.741 5.584 4.044 1.00 0.00 H new ATOM 0 HB2 LEU B 412 12.000 6.935 1.991 1.00 0.00 H new ATOM 0 HB3 LEU B 412 11.650 7.235 3.682 1.00 0.00 H new ATOM 0 HG LEU B 412 14.423 7.623 2.537 1.00 0.00 H new ATOM 0 HD11 LEU B 412 13.882 10.008 2.302 1.00 0.00 H new ATOM 0 HD12 LEU B 412 12.888 8.997 1.226 1.00 0.00 H new ATOM 0 HD13 LEU B 412 12.187 9.663 2.719 1.00 0.00 H new ATOM 0 HD21 LEU B 412 14.656 9.126 4.477 1.00 0.00 H new ATOM 0 HD22 LEU B 412 12.989 8.741 4.970 1.00 0.00 H new ATOM 0 HD23 LEU B 412 14.235 7.470 4.975 1.00 0.00 H new ATOM 1792 N GLY B 413 11.501 3.549 3.544 1.00 0.00 N ATOM 1793 CA GLY B 413 10.436 2.781 4.164 1.00 0.00 C ATOM 1794 C GLY B 413 10.534 1.285 3.901 1.00 0.00 C ATOM 1795 O GLY B 413 11.247 0.846 2.998 1.00 0.00 O ATOM 0 H GLY B 413 11.982 3.088 2.772 1.00 0.00 H new ATOM 0 HA2 GLY B 413 10.453 2.955 5.240 1.00 0.00 H new ATOM 0 HA3 GLY B 413 9.476 3.144 3.797 1.00 0.00 H new ATOM 1799 N THR B 414 9.793 0.512 4.688 1.00 0.00 N ATOM 1800 CA THR B 414 9.758 -0.944 4.545 1.00 0.00 C ATOM 1801 C THR B 414 8.495 -1.514 5.165 1.00 0.00 C ATOM 1802 O THR B 414 8.000 -0.999 6.164 1.00 0.00 O ATOM 1803 CB THR B 414 10.966 -1.643 5.192 1.00 0.00 C ATOM 1804 OG1 THR B 414 11.921 -0.700 5.694 1.00 0.00 O ATOM 1805 CG2 THR B 414 11.660 -2.556 4.191 1.00 0.00 C ATOM 0 H THR B 414 9.203 0.871 5.438 1.00 0.00 H new ATOM 0 HA THR B 414 9.784 -1.135 3.472 1.00 0.00 H new ATOM 0 HB THR B 414 10.580 -2.230 6.025 1.00 0.00 H new ATOM 0 HG1 THR B 414 12.673 -1.180 6.099 1.00 0.00 H new ATOM 0 HG21 THR B 414 12.511 -3.040 4.670 1.00 0.00 H new ATOM 0 HG22 THR B 414 10.959 -3.315 3.844 1.00 0.00 H new ATOM 0 HG23 THR B 414 12.007 -1.968 3.342 1.00 0.00 H new ATOM 1813 N GLY B 415 7.985 -2.589 4.580 1.00 0.00 N ATOM 1814 CA GLY B 415 6.788 -3.210 5.105 1.00 0.00 C ATOM 1815 C GLY B 415 6.670 -4.663 4.701 1.00 0.00 C ATOM 1816 O GLY B 415 6.612 -4.987 3.516 1.00 0.00 O ATOM 0 H GLY B 415 8.378 -3.040 3.754 1.00 0.00 H new ATOM 0 HA2 GLY B 415 6.791 -3.137 6.193 1.00 0.00 H new ATOM 0 HA3 GLY B 415 5.913 -2.665 4.751 1.00 0.00 H new ATOM 1820 N VAL B 416 6.632 -5.540 5.689 1.00 0.00 N ATOM 1821 CA VAL B 416 6.512 -6.965 5.436 1.00 0.00 C ATOM 1822 C VAL B 416 5.107 -7.441 5.786 1.00 0.00 C ATOM 1823 O VAL B 416 4.487 -6.927 6.718 1.00 0.00 O ATOM 1824 CB VAL B 416 7.550 -7.763 6.244 1.00 0.00 C ATOM 1825 CG1 VAL B 416 7.574 -9.215 5.801 1.00 0.00 C ATOM 1826 CG2 VAL B 416 8.930 -7.138 6.107 1.00 0.00 C ATOM 0 H VAL B 416 6.683 -5.289 6.676 1.00 0.00 H new ATOM 0 HA VAL B 416 6.700 -7.136 4.376 1.00 0.00 H new ATOM 0 HB VAL B 416 7.262 -7.732 7.295 1.00 0.00 H new ATOM 0 HG11 VAL B 416 8.315 -9.761 6.385 1.00 0.00 H new ATOM 0 HG12 VAL B 416 6.591 -9.659 5.956 1.00 0.00 H new ATOM 0 HG13 VAL B 416 7.834 -9.269 4.744 1.00 0.00 H new ATOM 0 HG21 VAL B 416 9.650 -7.716 6.685 1.00 0.00 H new ATOM 0 HG22 VAL B 416 9.226 -7.135 5.058 1.00 0.00 H new ATOM 0 HG23 VAL B 416 8.904 -6.114 6.479 1.00 0.00 H new ATOM 1836 N GLY B 417 4.598 -8.410 5.034 1.00 0.00 N ATOM 1837 CA GLY B 417 3.261 -8.909 5.293 1.00 0.00 C ATOM 1838 C GLY B 417 3.039 -10.309 4.759 1.00 0.00 C ATOM 1839 O GLY B 417 3.495 -10.644 3.667 1.00 0.00 O ATOM 0 H GLY B 417 5.083 -8.856 4.255 1.00 0.00 H new ATOM 0 HA2 GLY B 417 3.078 -8.903 6.368 1.00 0.00 H new ATOM 0 HA3 GLY B 417 2.533 -8.234 4.842 1.00 0.00 H new ATOM 1843 N ARG B 418 2.333 -11.124 5.535 1.00 0.00 N ATOM 1844 CA ARG B 418 2.045 -12.499 5.146 1.00 0.00 C ATOM 1845 C ARG B 418 1.387 -12.560 3.769 1.00 0.00 C ATOM 1846 O ARG B 418 1.830 -13.305 2.895 1.00 0.00 O ATOM 1847 CB ARG B 418 1.139 -13.163 6.185 1.00 0.00 C ATOM 1848 CG ARG B 418 1.706 -13.127 7.595 1.00 0.00 C ATOM 1849 CD ARG B 418 1.051 -12.037 8.430 1.00 0.00 C ATOM 1850 NE ARG B 418 0.670 -12.516 9.756 1.00 0.00 N ATOM 1851 CZ ARG B 418 -0.307 -13.393 9.968 1.00 0.00 C ATOM 1852 NH1 ARG B 418 -0.993 -13.884 8.946 1.00 0.00 N ATOM 1853 NH2 ARG B 418 -0.597 -13.778 11.203 1.00 0.00 N ATOM 0 H ARG B 418 1.948 -10.855 6.440 1.00 0.00 H new ATOM 0 HA ARG B 418 2.991 -13.037 5.095 1.00 0.00 H new ATOM 0 HB2 ARG B 418 0.169 -12.667 6.179 1.00 0.00 H new ATOM 0 HB3 ARG B 418 0.968 -14.200 5.897 1.00 0.00 H new ATOM 0 HG2 ARG B 418 1.555 -14.094 8.074 1.00 0.00 H new ATOM 0 HG3 ARG B 418 2.782 -12.957 7.552 1.00 0.00 H new ATOM 0 HD2 ARG B 418 1.738 -11.197 8.532 1.00 0.00 H new ATOM 0 HD3 ARG B 418 0.167 -11.665 7.911 1.00 0.00 H new ATOM 0 HE ARG B 418 1.181 -12.159 10.563 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -0.772 -13.589 7.995 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -1.742 -14.557 9.111 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -0.071 -13.402 11.991 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -1.347 -14.451 11.365 1.00 0.00 H new ATOM 1867 N ASN B 419 0.329 -11.777 3.580 1.00 0.00 N ATOM 1868 CA ASN B 419 -0.380 -11.757 2.303 1.00 0.00 C ATOM 1869 C ASN B 419 -0.004 -10.523 1.494 1.00 0.00 C ATOM 1870 O ASN B 419 -0.747 -10.102 0.608 1.00 0.00 O ATOM 1871 CB ASN B 419 -1.896 -11.791 2.523 1.00 0.00 C ATOM 1872 CG ASN B 419 -2.276 -12.014 3.974 1.00 0.00 C ATOM 1873 OD1 ASN B 419 -1.706 -12.868 4.653 1.00 0.00 O ATOM 1874 ND2 ASN B 419 -3.246 -11.246 4.456 1.00 0.00 N ATOM 0 H ASN B 419 -0.055 -11.152 4.289 1.00 0.00 H new ATOM 0 HA ASN B 419 -0.085 -12.646 1.745 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -2.329 -10.852 2.179 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -2.329 -12.584 1.913 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -3.546 -11.352 5.425 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -3.691 -10.550 3.857 1.00 0.00 H new ATOM 1881 N ILE B 420 1.158 -9.956 1.800 1.00 0.00 N ATOM 1882 CA ILE B 420 1.657 -8.771 1.105 1.00 0.00 C ATOM 1883 C ILE B 420 0.952 -7.489 1.568 1.00 0.00 C ATOM 1884 O ILE B 420 1.597 -6.454 1.735 1.00 0.00 O ATOM 1885 CB ILE B 420 1.560 -8.930 -0.434 1.00 0.00 C ATOM 1886 CG1 ILE B 420 0.291 -8.283 -1.003 1.00 0.00 C ATOM 1887 CG2 ILE B 420 1.610 -10.403 -0.810 1.00 0.00 C ATOM 1888 CD1 ILE B 420 0.513 -6.879 -1.518 1.00 0.00 C ATOM 0 H ILE B 420 1.779 -10.301 2.532 1.00 0.00 H new ATOM 0 HA ILE B 420 2.711 -8.676 1.368 1.00 0.00 H new ATOM 0 HB ILE B 420 2.414 -8.412 -0.871 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -0.092 -8.903 -1.813 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -0.476 -8.261 -0.228 1.00 0.00 H new ATOM 0 HG21 ILE B 420 1.541 -10.505 -1.893 1.00 0.00 H new ATOM 0 HG22 ILE B 420 2.549 -10.835 -0.464 1.00 0.00 H new ATOM 0 HG23 ILE B 420 0.776 -10.926 -0.343 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -0.425 -6.481 -1.906 1.00 0.00 H new ATOM 0 HD12 ILE B 420 0.867 -6.245 -0.705 1.00 0.00 H new ATOM 0 HD13 ILE B 420 1.257 -6.897 -2.315 1.00 0.00 H new ATOM 1900 N LYS B 421 -0.363 -7.554 1.776 1.00 0.00 N ATOM 1901 CA LYS B 421 -1.100 -6.377 2.217 1.00 0.00 C ATOM 1902 C LYS B 421 -0.370 -5.750 3.392 1.00 0.00 C ATOM 1903 O LYS B 421 0.054 -4.597 3.325 1.00 0.00 O ATOM 1904 CB LYS B 421 -2.528 -6.750 2.620 1.00 0.00 C ATOM 1905 CG LYS B 421 -3.466 -6.938 1.440 1.00 0.00 C ATOM 1906 CD LYS B 421 -3.848 -8.398 1.262 1.00 0.00 C ATOM 1907 CE LYS B 421 -5.107 -8.744 2.040 1.00 0.00 C ATOM 1908 NZ LYS B 421 -5.691 -10.043 1.607 1.00 0.00 N ATOM 0 H LYS B 421 -0.928 -8.393 1.648 1.00 0.00 H new ATOM 0 HA LYS B 421 -1.159 -5.663 1.396 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -2.503 -7.671 3.203 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -2.928 -5.972 3.270 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -4.365 -6.341 1.590 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -2.988 -6.572 0.531 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -4.004 -8.608 0.204 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -3.027 -9.033 1.595 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -4.875 -8.788 3.104 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -5.845 -7.953 1.907 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -6.548 -10.241 2.163 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -5.937 -9.994 0.598 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -4.997 -10.803 1.758 1.00 0.00 H new ATOM 1922 N ILE B 422 -0.211 -6.515 4.467 1.00 0.00 N ATOM 1923 CA ILE B 422 0.487 -6.013 5.637 1.00 0.00 C ATOM 1924 C ILE B 422 1.815 -5.427 5.199 1.00 0.00 C ATOM 1925 O ILE B 422 2.343 -4.509 5.815 1.00 0.00 O ATOM 1926 CB ILE B 422 0.735 -7.120 6.682 1.00 0.00 C ATOM 1927 CG1 ILE B 422 -0.567 -7.854 7.006 1.00 0.00 C ATOM 1928 CG2 ILE B 422 1.343 -6.528 7.944 1.00 0.00 C ATOM 1929 CD1 ILE B 422 -0.376 -9.331 7.272 1.00 0.00 C ATOM 0 H ILE B 422 -0.552 -7.473 4.549 1.00 0.00 H new ATOM 0 HA ILE B 422 -0.138 -5.252 6.106 1.00 0.00 H new ATOM 0 HB ILE B 422 1.438 -7.840 6.264 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -1.028 -7.392 7.879 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -1.262 -7.729 6.175 1.00 0.00 H new ATOM 0 HG21 ILE B 422 1.513 -7.321 8.673 1.00 0.00 H new ATOM 0 HG22 ILE B 422 2.292 -6.050 7.701 1.00 0.00 H new ATOM 0 HG23 ILE B 422 0.661 -5.789 8.364 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -1.340 -9.788 7.495 1.00 0.00 H new ATOM 0 HD12 ILE B 422 0.056 -9.806 6.391 1.00 0.00 H new ATOM 0 HD13 ILE B 422 0.294 -9.464 8.122 1.00 0.00 H new ATOM 1941 N ALA B 423 2.325 -5.937 4.088 1.00 0.00 N ATOM 1942 CA ALA B 423 3.563 -5.430 3.531 1.00 0.00 C ATOM 1943 C ALA B 423 3.315 -4.041 2.961 1.00 0.00 C ATOM 1944 O ALA B 423 3.990 -3.075 3.315 1.00 0.00 O ATOM 1945 CB ALA B 423 4.105 -6.363 2.457 1.00 0.00 C ATOM 0 H ALA B 423 1.900 -6.698 3.559 1.00 0.00 H new ATOM 0 HA ALA B 423 4.313 -5.373 4.320 1.00 0.00 H new ATOM 0 HB1 ALA B 423 5.034 -5.957 2.057 1.00 0.00 H new ATOM 0 HB2 ALA B 423 4.295 -7.345 2.890 1.00 0.00 H new ATOM 0 HB3 ALA B 423 3.374 -6.456 1.653 1.00 0.00 H new ATOM 1951 N GLY B 424 2.321 -3.955 2.082 1.00 0.00 N ATOM 1952 CA GLY B 424 1.971 -2.689 1.470 1.00 0.00 C ATOM 1953 C GLY B 424 1.569 -1.629 2.482 1.00 0.00 C ATOM 1954 O GLY B 424 2.103 -0.516 2.475 1.00 0.00 O ATOM 0 H GLY B 424 1.750 -4.745 1.782 1.00 0.00 H new ATOM 0 HA2 GLY B 424 2.819 -2.326 0.890 1.00 0.00 H new ATOM 0 HA3 GLY B 424 1.150 -2.845 0.770 1.00 0.00 H new ATOM 1958 N ILE B 425 0.620 -1.967 3.354 1.00 0.00 N ATOM 1959 CA ILE B 425 0.157 -1.015 4.356 1.00 0.00 C ATOM 1960 C ILE B 425 1.229 -0.762 5.410 1.00 0.00 C ATOM 1961 O ILE B 425 1.642 0.378 5.621 1.00 0.00 O ATOM 1962 CB ILE B 425 -1.122 -1.518 5.052 1.00 0.00 C ATOM 1963 CG1 ILE B 425 -2.292 -1.539 4.066 1.00 0.00 C ATOM 1964 CG2 ILE B 425 -1.449 -0.648 6.255 1.00 0.00 C ATOM 1965 CD1 ILE B 425 -2.555 -2.904 3.467 1.00 0.00 C ATOM 0 H ILE B 425 0.164 -2.879 3.386 1.00 0.00 H new ATOM 0 HA ILE B 425 -0.061 -0.083 3.834 1.00 0.00 H new ATOM 0 HB ILE B 425 -0.950 -2.536 5.402 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -3.192 -1.196 4.576 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -2.091 -0.831 3.262 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -2.355 -1.017 6.735 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -0.622 -0.683 6.965 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -1.604 0.380 5.929 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -3.398 -2.843 2.778 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -1.670 -3.242 2.928 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -2.788 -3.612 4.263 1.00 0.00 H new ATOM 1977 N ARG B 426 1.656 -1.818 6.095 1.00 0.00 N ATOM 1978 CA ARG B 426 2.652 -1.661 7.147 1.00 0.00 C ATOM 1979 C ARG B 426 3.890 -0.943 6.612 1.00 0.00 C ATOM 1980 O ARG B 426 4.571 -0.240 7.360 1.00 0.00 O ATOM 1981 CB ARG B 426 3.008 -3.007 7.794 1.00 0.00 C ATOM 1982 CG ARG B 426 4.279 -3.656 7.267 1.00 0.00 C ATOM 1983 CD ARG B 426 5.377 -3.639 8.319 1.00 0.00 C ATOM 1984 NE ARG B 426 5.842 -4.983 8.654 1.00 0.00 N ATOM 1985 CZ ARG B 426 5.067 -5.922 9.192 1.00 0.00 C ATOM 1986 NH1 ARG B 426 3.798 -5.659 9.472 1.00 0.00 N ATOM 1987 NH2 ARG B 426 5.564 -7.122 9.455 1.00 0.00 N ATOM 0 H ARG B 426 1.335 -2.774 5.945 1.00 0.00 H new ATOM 0 HA ARG B 426 2.219 -1.040 7.932 1.00 0.00 H new ATOM 0 HB2 ARG B 426 3.111 -2.860 8.869 1.00 0.00 H new ATOM 0 HB3 ARG B 426 2.177 -3.696 7.645 1.00 0.00 H new ATOM 0 HG2 ARG B 426 4.071 -4.684 6.971 1.00 0.00 H new ATOM 0 HG3 ARG B 426 4.617 -3.129 6.375 1.00 0.00 H new ATOM 0 HD2 ARG B 426 6.216 -3.046 7.956 1.00 0.00 H new ATOM 0 HD3 ARG B 426 5.007 -3.149 9.220 1.00 0.00 H new ATOM 0 HE ARG B 426 6.817 -5.215 8.465 1.00 0.00 H new ATOM 0 HH11 ARG B 426 3.413 -4.735 9.275 1.00 0.00 H new ATOM 0 HH12 ARG B 426 3.207 -6.381 9.884 1.00 0.00 H new ATOM 0 HH21 ARG B 426 6.541 -7.327 9.245 1.00 0.00 H new ATOM 0 HH22 ARG B 426 4.970 -7.841 9.867 1.00 0.00 H new ATOM 2001 N ALA B 427 4.162 -1.076 5.312 1.00 0.00 N ATOM 2002 CA ALA B 427 5.298 -0.379 4.716 1.00 0.00 C ATOM 2003 C ALA B 427 5.035 1.117 4.784 1.00 0.00 C ATOM 2004 O ALA B 427 5.837 1.891 5.313 1.00 0.00 O ATOM 2005 CB ALA B 427 5.525 -0.810 3.275 1.00 0.00 C ATOM 0 H ALA B 427 3.621 -1.649 4.664 1.00 0.00 H new ATOM 0 HA ALA B 427 6.201 -0.630 5.273 1.00 0.00 H new ATOM 0 HB1 ALA B 427 6.378 -0.271 2.864 1.00 0.00 H new ATOM 0 HB2 ALA B 427 5.723 -1.881 3.243 1.00 0.00 H new ATOM 0 HB3 ALA B 427 4.636 -0.587 2.684 1.00 0.00 H new ATOM 2011 N ALA B 428 3.880 1.510 4.263 1.00 0.00 N ATOM 2012 CA ALA B 428 3.487 2.908 4.285 1.00 0.00 C ATOM 2013 C ALA B 428 3.586 3.416 5.717 1.00 0.00 C ATOM 2014 O ALA B 428 4.136 4.490 5.983 1.00 0.00 O ATOM 2015 CB ALA B 428 2.076 3.088 3.744 1.00 0.00 C ATOM 0 H ALA B 428 3.205 0.884 3.824 1.00 0.00 H new ATOM 0 HA ALA B 428 4.154 3.484 3.643 1.00 0.00 H new ATOM 0 HB1 ALA B 428 1.808 4.144 3.772 1.00 0.00 H new ATOM 0 HB2 ALA B 428 2.032 2.730 2.716 1.00 0.00 H new ATOM 0 HB3 ALA B 428 1.376 2.519 4.356 1.00 0.00 H new ATOM 2021 N GLU B 429 3.071 2.612 6.640 1.00 0.00 N ATOM 2022 CA GLU B 429 3.110 2.940 8.056 1.00 0.00 C ATOM 2023 C GLU B 429 4.552 3.082 8.531 1.00 0.00 C ATOM 2024 O GLU B 429 4.837 3.830 9.466 1.00 0.00 O ATOM 2025 CB GLU B 429 2.403 1.849 8.864 1.00 0.00 C ATOM 2026 CG GLU B 429 0.931 1.666 8.518 1.00 0.00 C ATOM 2027 CD GLU B 429 0.392 2.745 7.597 1.00 0.00 C ATOM 2028 OE1 GLU B 429 0.278 3.906 8.045 1.00 0.00 O ATOM 2029 OE2 GLU B 429 0.083 2.429 6.429 1.00 0.00 O ATOM 0 H GLU B 429 2.619 1.722 6.429 1.00 0.00 H new ATOM 0 HA GLU B 429 2.597 3.890 8.207 1.00 0.00 H new ATOM 0 HB2 GLU B 429 2.921 0.903 8.706 1.00 0.00 H new ATOM 0 HB3 GLU B 429 2.488 2.086 9.924 1.00 0.00 H new ATOM 0 HG2 GLU B 429 0.794 0.693 8.046 1.00 0.00 H new ATOM 0 HG3 GLU B 429 0.347 1.658 9.438 1.00 0.00 H new ATOM 2036 N ASN B 430 5.459 2.362 7.874 1.00 0.00 N ATOM 2037 CA ASN B 430 6.872 2.419 8.230 1.00 0.00 C ATOM 2038 C ASN B 430 7.428 3.813 7.978 1.00 0.00 C ATOM 2039 O ASN B 430 8.066 4.398 8.852 1.00 0.00 O ATOM 2040 CB ASN B 430 7.674 1.378 7.452 1.00 0.00 C ATOM 2041 CG ASN B 430 8.211 0.288 8.355 1.00 0.00 C ATOM 2042 OD1 ASN B 430 9.421 0.077 8.447 1.00 0.00 O ATOM 2043 ND2 ASN B 430 7.308 -0.413 9.030 1.00 0.00 N ATOM 0 H ASN B 430 5.241 1.737 7.098 1.00 0.00 H new ATOM 0 HA ASN B 430 6.963 2.193 9.293 1.00 0.00 H new ATOM 0 HB2 ASN B 430 7.042 0.934 6.683 1.00 0.00 H new ATOM 0 HB3 ASN B 430 8.503 1.867 6.940 1.00 0.00 H new ATOM 0 HD21 ASN B 430 7.607 -1.161 9.656 1.00 0.00 H new ATOM 0 HD22 ASN B 430 6.316 -0.203 8.923 1.00 0.00 H new ATOM 2050 N ALA B 431 7.164 4.362 6.792 1.00 0.00 N ATOM 2051 CA ALA B 431 7.634 5.707 6.486 1.00 0.00 C ATOM 2052 C ALA B 431 7.078 6.663 7.527 1.00 0.00 C ATOM 2053 O ALA B 431 7.767 7.570 7.992 1.00 0.00 O ATOM 2054 CB ALA B 431 7.243 6.146 5.082 1.00 0.00 C ATOM 0 H ALA B 431 6.639 3.907 6.045 1.00 0.00 H new ATOM 0 HA ALA B 431 8.724 5.713 6.517 1.00 0.00 H new ATOM 0 HB1 ALA B 431 7.615 7.154 4.899 1.00 0.00 H new ATOM 0 HB2 ALA B 431 7.677 5.462 4.353 1.00 0.00 H new ATOM 0 HB3 ALA B 431 6.157 6.137 4.987 1.00 0.00 H new ATOM 2060 N LEU B 432 5.825 6.420 7.919 1.00 0.00 N ATOM 2061 CA LEU B 432 5.156 7.217 8.944 1.00 0.00 C ATOM 2062 C LEU B 432 5.906 7.132 10.274 1.00 0.00 C ATOM 2063 O LEU B 432 5.633 7.894 11.201 1.00 0.00 O ATOM 2064 CB LEU B 432 3.713 6.742 9.127 1.00 0.00 C ATOM 2065 CG LEU B 432 2.673 7.857 9.224 1.00 0.00 C ATOM 2066 CD1 LEU B 432 1.265 7.285 9.161 1.00 0.00 C ATOM 2067 CD2 LEU B 432 2.868 8.656 10.504 1.00 0.00 C ATOM 0 H LEU B 432 5.250 5.669 7.536 1.00 0.00 H new ATOM 0 HA LEU B 432 5.150 8.257 8.616 1.00 0.00 H new ATOM 0 HB2 LEU B 432 3.451 6.093 8.291 1.00 0.00 H new ATOM 0 HB3 LEU B 432 3.658 6.135 10.031 1.00 0.00 H new ATOM 0 HG LEU B 432 2.808 8.527 8.375 1.00 0.00 H new ATOM 0 HD11 LEU B 432 0.540 8.095 9.232 1.00 0.00 H new ATOM 0 HD12 LEU B 432 1.129 6.757 8.217 1.00 0.00 H new ATOM 0 HD13 LEU B 432 1.116 6.592 9.989 1.00 0.00 H new ATOM 0 HD21 LEU B 432 2.119 9.446 10.557 1.00 0.00 H new ATOM 0 HD22 LEU B 432 2.761 7.996 11.365 1.00 0.00 H new ATOM 0 HD23 LEU B 432 3.864 9.099 10.508 1.00 0.00 H new ATOM 2079 N ARG B 433 6.873 6.219 10.345 1.00 0.00 N ATOM 2080 CA ARG B 433 7.685 6.059 11.541 1.00 0.00 C ATOM 2081 C ARG B 433 8.798 7.099 11.541 1.00 0.00 C ATOM 2082 O ARG B 433 9.353 7.434 12.588 1.00 0.00 O ATOM 2083 CB ARG B 433 8.273 4.650 11.607 1.00 0.00 C ATOM 2084 CG ARG B 433 7.224 3.554 11.517 1.00 0.00 C ATOM 2085 CD ARG B 433 7.858 2.174 11.510 1.00 0.00 C ATOM 2086 NE ARG B 433 9.072 2.136 10.700 1.00 0.00 N ATOM 2087 CZ ARG B 433 10.084 1.304 10.925 1.00 0.00 C ATOM 2088 NH1 ARG B 433 10.022 0.437 11.926 1.00 0.00 N ATOM 2089 NH2 ARG B 433 11.158 1.336 10.148 1.00 0.00 N ATOM 0 H ARG B 433 7.110 5.580 9.586 1.00 0.00 H new ATOM 0 HA ARG B 433 7.057 6.205 12.420 1.00 0.00 H new ATOM 0 HB2 ARG B 433 8.989 4.525 10.795 1.00 0.00 H new ATOM 0 HB3 ARG B 433 8.826 4.538 12.540 1.00 0.00 H new ATOM 0 HG2 ARG B 433 6.538 3.636 12.360 1.00 0.00 H new ATOM 0 HG3 ARG B 433 6.633 3.688 10.611 1.00 0.00 H new ATOM 0 HD2 ARG B 433 8.094 1.878 12.532 1.00 0.00 H new ATOM 0 HD3 ARG B 433 7.142 1.448 11.125 1.00 0.00 H new ATOM 0 HE ARG B 433 9.148 2.785 9.917 1.00 0.00 H new ATOM 0 HH11 ARG B 433 9.197 0.408 12.525 1.00 0.00 H new ATOM 0 HH12 ARG B 433 10.799 -0.201 12.097 1.00 0.00 H new ATOM 0 HH21 ARG B 433 11.209 2.000 9.376 1.00 0.00 H new ATOM 0 HH22 ARG B 433 11.933 0.697 10.323 1.00 0.00 H new ATOM 2103 N ASP B 434 9.092 7.629 10.356 1.00 0.00 N ATOM 2104 CA ASP B 434 10.109 8.660 10.208 1.00 0.00 C ATOM 2105 C ASP B 434 9.444 10.030 10.257 1.00 0.00 C ATOM 2106 O ASP B 434 9.745 10.917 9.458 1.00 0.00 O ATOM 2107 CB ASP B 434 10.864 8.485 8.888 1.00 0.00 C ATOM 2108 CG ASP B 434 12.351 8.747 9.034 1.00 0.00 C ATOM 2109 OD1 ASP B 434 12.784 9.106 10.149 1.00 0.00 O ATOM 2110 OD2 ASP B 434 13.081 8.592 8.033 1.00 0.00 O ATOM 0 H ASP B 434 8.637 7.359 9.484 1.00 0.00 H new ATOM 0 HA ASP B 434 10.827 8.574 11.023 1.00 0.00 H new ATOM 0 HB2 ASP B 434 10.711 7.472 8.517 1.00 0.00 H new ATOM 0 HB3 ASP B 434 10.450 9.164 8.143 1.00 0.00 H new ATOM 2115 N LYS B 435 8.528 10.178 11.207 1.00 0.00 N ATOM 2116 CA LYS B 435 7.803 11.426 11.372 1.00 0.00 C ATOM 2117 C LYS B 435 8.768 12.597 11.235 1.00 0.00 C ATOM 2118 O LYS B 435 8.568 13.484 10.405 1.00 0.00 O ATOM 2119 CB LYS B 435 7.064 11.448 12.715 1.00 0.00 C ATOM 2120 CG LYS B 435 7.733 12.278 13.797 1.00 0.00 C ATOM 2121 CD LYS B 435 6.950 12.211 15.094 1.00 0.00 C ATOM 2122 CE LYS B 435 7.145 10.871 15.786 1.00 0.00 C ATOM 2123 NZ LYS B 435 7.512 11.034 17.220 1.00 0.00 N ATOM 0 H LYS B 435 8.272 9.449 11.872 1.00 0.00 H new ATOM 0 HA LYS B 435 7.048 11.514 10.591 1.00 0.00 H new ATOM 0 HB2 LYS B 435 6.057 11.832 12.553 1.00 0.00 H new ATOM 0 HB3 LYS B 435 6.961 10.424 13.074 1.00 0.00 H new ATOM 0 HG2 LYS B 435 8.748 11.917 13.962 1.00 0.00 H new ATOM 0 HG3 LYS B 435 7.812 13.314 13.469 1.00 0.00 H new ATOM 0 HD2 LYS B 435 7.270 13.015 15.757 1.00 0.00 H new ATOM 0 HD3 LYS B 435 5.891 12.367 14.891 1.00 0.00 H new ATOM 0 HE2 LYS B 435 6.228 10.287 15.710 1.00 0.00 H new ATOM 0 HE3 LYS B 435 7.925 10.308 15.273 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 7.127 10.239 17.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 8.548 11.050 17.314 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 7.118 11.927 17.580 1.00 0.00 H new ATOM 2137 N LYS B 436 9.818 12.594 12.049 1.00 0.00 N ATOM 2138 CA LYS B 436 10.808 13.647 12.009 1.00 0.00 C ATOM 2139 C LYS B 436 11.258 13.879 10.573 1.00 0.00 C ATOM 2140 O LYS B 436 11.584 15.001 10.184 1.00 0.00 O ATOM 2141 CB LYS B 436 11.996 13.268 12.891 1.00 0.00 C ATOM 2142 CG LYS B 436 11.919 13.834 14.300 1.00 0.00 C ATOM 2143 CD LYS B 436 10.562 13.566 14.936 1.00 0.00 C ATOM 2144 CE LYS B 436 10.319 14.476 16.129 1.00 0.00 C ATOM 2145 NZ LYS B 436 9.607 13.772 17.231 1.00 0.00 N ATOM 0 H LYS B 436 10.000 11.869 12.744 1.00 0.00 H new ATOM 0 HA LYS B 436 10.372 14.571 12.388 1.00 0.00 H new ATOM 0 HB2 LYS B 436 12.062 12.182 12.949 1.00 0.00 H new ATOM 0 HB3 LYS B 436 12.914 13.618 12.418 1.00 0.00 H new ATOM 0 HG2 LYS B 436 12.703 13.392 14.914 1.00 0.00 H new ATOM 0 HG3 LYS B 436 12.103 14.908 14.272 1.00 0.00 H new ATOM 0 HD2 LYS B 436 9.776 13.716 14.196 1.00 0.00 H new ATOM 0 HD3 LYS B 436 10.507 12.525 15.254 1.00 0.00 H new ATOM 0 HE2 LYS B 436 11.273 14.854 16.497 1.00 0.00 H new ATOM 0 HE3 LYS B 436 9.734 15.340 15.813 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 8.858 14.386 17.608 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 9.184 12.894 16.866 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 10.281 13.543 17.989 1.00 0.00 H new ATOM 2159 N MET B 437 11.250 12.809 9.780 1.00 0.00 N ATOM 2160 CA MET B 437 11.635 12.893 8.378 1.00 0.00 C ATOM 2161 C MET B 437 10.522 13.546 7.568 1.00 0.00 C ATOM 2162 O MET B 437 10.759 14.494 6.820 1.00 0.00 O ATOM 2163 CB MET B 437 11.942 11.502 7.821 1.00 0.00 C ATOM 2164 CG MET B 437 12.548 11.529 6.427 1.00 0.00 C ATOM 2165 SD MET B 437 11.304 11.423 5.127 1.00 0.00 S ATOM 2166 CE MET B 437 10.972 9.664 5.128 1.00 0.00 C ATOM 0 H MET B 437 10.980 11.875 10.088 1.00 0.00 H new ATOM 0 HA MET B 437 12.535 13.503 8.302 1.00 0.00 H new ATOM 0 HB2 MET B 437 12.628 10.991 8.497 1.00 0.00 H new ATOM 0 HB3 MET B 437 11.023 10.917 7.798 1.00 0.00 H new ATOM 0 HG2 MET B 437 13.121 12.448 6.302 1.00 0.00 H new ATOM 0 HG3 MET B 437 13.248 10.700 6.323 1.00 0.00 H new ATOM 0 HE1 MET B 437 11.204 9.249 4.147 1.00 0.00 H new ATOM 0 HE2 MET B 437 11.590 9.177 5.883 1.00 0.00 H new ATOM 0 HE3 MET B 437 9.920 9.492 5.355 1.00 0.00 H new ATOM 2176 N LEU B 438 9.302 13.033 7.724 1.00 0.00 N ATOM 2177 CA LEU B 438 8.157 13.574 7.002 1.00 0.00 C ATOM 2178 C LEU B 438 8.124 15.088 7.142 1.00 0.00 C ATOM 2179 O LEU B 438 7.971 15.805 6.154 1.00 0.00 O ATOM 2180 CB LEU B 438 6.853 12.968 7.530 1.00 0.00 C ATOM 2181 CG LEU B 438 6.889 11.454 7.746 1.00 0.00 C ATOM 2182 CD1 LEU B 438 5.538 10.950 8.226 1.00 0.00 C ATOM 2183 CD2 LEU B 438 7.302 10.743 6.467 1.00 0.00 C ATOM 0 H LEU B 438 9.084 12.249 8.340 1.00 0.00 H new ATOM 0 HA LEU B 438 8.256 13.315 5.948 1.00 0.00 H new ATOM 0 HB2 LEU B 438 6.602 13.450 8.475 1.00 0.00 H new ATOM 0 HB3 LEU B 438 6.051 13.202 6.830 1.00 0.00 H new ATOM 0 HG LEU B 438 7.629 11.234 8.516 1.00 0.00 H new ATOM 0 HD11 LEU B 438 5.584 9.871 8.374 1.00 0.00 H new ATOM 0 HD12 LEU B 438 5.283 11.435 9.168 1.00 0.00 H new ATOM 0 HD13 LEU B 438 4.777 11.182 7.481 1.00 0.00 H new ATOM 0 HD21 LEU B 438 7.322 9.667 6.639 1.00 0.00 H new ATOM 0 HD22 LEU B 438 6.586 10.971 5.677 1.00 0.00 H new ATOM 0 HD23 LEU B 438 8.294 11.081 6.167 1.00 0.00 H new ATOM 2195 N ASP B 439 8.281 15.577 8.369 1.00 0.00 N ATOM 2196 CA ASP B 439 8.282 17.011 8.617 1.00 0.00 C ATOM 2197 C ASP B 439 9.439 17.666 7.867 1.00 0.00 C ATOM 2198 O ASP B 439 9.247 18.621 7.114 1.00 0.00 O ATOM 2199 CB ASP B 439 8.408 17.281 10.119 1.00 0.00 C ATOM 2200 CG ASP B 439 8.663 18.744 10.425 1.00 0.00 C ATOM 2201 OD1 ASP B 439 8.397 19.589 9.544 1.00 0.00 O ATOM 2202 OD2 ASP B 439 9.126 19.045 11.545 1.00 0.00 O ATOM 0 H ASP B 439 8.408 15.002 9.202 1.00 0.00 H new ATOM 0 HA ASP B 439 7.344 17.436 8.260 1.00 0.00 H new ATOM 0 HB2 ASP B 439 7.494 16.962 10.620 1.00 0.00 H new ATOM 0 HB3 ASP B 439 9.221 16.681 10.526 1.00 0.00 H new ATOM 2207 N PHE B 440 10.638 17.134 8.080 1.00 0.00 N ATOM 2208 CA PHE B 440 11.833 17.654 7.425 1.00 0.00 C ATOM 2209 C PHE B 440 11.576 17.820 5.929 1.00 0.00 C ATOM 2210 O PHE B 440 11.809 18.888 5.358 1.00 0.00 O ATOM 2211 CB PHE B 440 13.019 16.712 7.666 1.00 0.00 C ATOM 2212 CG PHE B 440 14.059 16.746 6.580 1.00 0.00 C ATOM 2213 CD1 PHE B 440 15.045 17.721 6.575 1.00 0.00 C ATOM 2214 CD2 PHE B 440 14.050 15.802 5.565 1.00 0.00 C ATOM 2215 CE1 PHE B 440 16.000 17.754 5.578 1.00 0.00 C ATOM 2216 CE2 PHE B 440 15.003 15.831 4.566 1.00 0.00 C ATOM 2217 CZ PHE B 440 15.980 16.807 4.572 1.00 0.00 C ATOM 0 H PHE B 440 10.808 16.343 8.701 1.00 0.00 H new ATOM 0 HA PHE B 440 12.075 18.629 7.848 1.00 0.00 H new ATOM 0 HB2 PHE B 440 13.490 16.973 8.614 1.00 0.00 H new ATOM 0 HB3 PHE B 440 12.646 15.693 7.765 1.00 0.00 H new ATOM 0 HD1 PHE B 440 15.066 18.463 7.360 1.00 0.00 H new ATOM 0 HD2 PHE B 440 13.289 15.035 5.555 1.00 0.00 H new ATOM 0 HE1 PHE B 440 16.762 18.519 5.585 1.00 0.00 H new ATOM 0 HE2 PHE B 440 14.984 15.090 3.780 1.00 0.00 H new ATOM 0 HZ PHE B 440 16.727 16.830 3.792 1.00 0.00 H new ATOM 2227 N TYR B 441 11.069 16.762 5.308 1.00 0.00 N ATOM 2228 CA TYR B 441 10.756 16.791 3.887 1.00 0.00 C ATOM 2229 C TYR B 441 9.624 17.771 3.625 1.00 0.00 C ATOM 2230 O TYR B 441 9.603 18.468 2.616 1.00 0.00 O ATOM 2231 CB TYR B 441 10.361 15.396 3.405 1.00 0.00 C ATOM 2232 CG TYR B 441 11.444 14.711 2.614 1.00 0.00 C ATOM 2233 CD1 TYR B 441 12.427 13.968 3.250 1.00 0.00 C ATOM 2234 CD2 TYR B 441 11.489 14.817 1.231 1.00 0.00 C ATOM 2235 CE1 TYR B 441 13.427 13.344 2.529 1.00 0.00 C ATOM 2236 CE2 TYR B 441 12.485 14.198 0.503 1.00 0.00 C ATOM 2237 CZ TYR B 441 13.452 13.463 1.155 1.00 0.00 C ATOM 2238 OH TYR B 441 14.447 12.846 0.433 1.00 0.00 O ATOM 0 H TYR B 441 10.866 15.874 5.767 1.00 0.00 H new ATOM 0 HA TYR B 441 11.641 17.115 3.339 1.00 0.00 H new ATOM 0 HB2 TYR B 441 10.105 14.780 4.267 1.00 0.00 H new ATOM 0 HB3 TYR B 441 9.464 15.472 2.790 1.00 0.00 H new ATOM 0 HD1 TYR B 441 12.411 13.876 4.326 1.00 0.00 H new ATOM 0 HD2 TYR B 441 10.733 15.392 0.717 1.00 0.00 H new ATOM 0 HE1 TYR B 441 14.184 12.767 3.038 1.00 0.00 H new ATOM 0 HE2 TYR B 441 12.507 14.289 -0.573 1.00 0.00 H new ATOM 0 HH TYR B 441 14.319 13.028 -0.521 1.00 0.00 H new ATOM 2248 N ALA B 442 8.679 17.799 4.550 1.00 0.00 N ATOM 2249 CA ALA B 442 7.528 18.682 4.427 1.00 0.00 C ATOM 2250 C ALA B 442 7.994 20.122 4.235 1.00 0.00 C ATOM 2251 O ALA B 442 7.643 20.772 3.249 1.00 0.00 O ATOM 2252 CB ALA B 442 6.621 18.575 5.644 1.00 0.00 C ATOM 0 H ALA B 442 8.684 17.223 5.392 1.00 0.00 H new ATOM 0 HA ALA B 442 6.952 18.375 3.554 1.00 0.00 H new ATOM 0 HB1 ALA B 442 5.770 19.246 5.524 1.00 0.00 H new ATOM 0 HB2 ALA B 442 6.264 17.550 5.743 1.00 0.00 H new ATOM 0 HB3 ALA B 442 7.178 18.853 6.539 1.00 0.00 H new ATOM 2258 N LYS B 443 8.789 20.617 5.178 1.00 0.00 N ATOM 2259 CA LYS B 443 9.302 21.980 5.106 1.00 0.00 C ATOM 2260 C LYS B 443 10.168 22.159 3.865 1.00 0.00 C ATOM 2261 O LYS B 443 10.266 23.253 3.314 1.00 0.00 O ATOM 2262 CB LYS B 443 10.102 22.318 6.369 1.00 0.00 C ATOM 2263 CG LYS B 443 11.590 22.018 6.258 1.00 0.00 C ATOM 2264 CD LYS B 443 12.120 21.350 7.517 1.00 0.00 C ATOM 2265 CE LYS B 443 13.545 20.856 7.325 1.00 0.00 C ATOM 2266 NZ LYS B 443 14.519 21.980 7.250 1.00 0.00 N ATOM 0 H LYS B 443 9.092 20.095 6.000 1.00 0.00 H new ATOM 0 HA LYS B 443 8.456 22.664 5.038 1.00 0.00 H new ATOM 0 HB2 LYS B 443 9.971 23.376 6.597 1.00 0.00 H new ATOM 0 HB3 LYS B 443 9.690 21.757 7.208 1.00 0.00 H new ATOM 0 HG2 LYS B 443 11.769 21.371 5.399 1.00 0.00 H new ATOM 0 HG3 LYS B 443 12.136 22.944 6.079 1.00 0.00 H new ATOM 0 HD2 LYS B 443 12.087 22.056 8.347 1.00 0.00 H new ATOM 0 HD3 LYS B 443 11.476 20.512 7.785 1.00 0.00 H new ATOM 0 HE2 LYS B 443 13.815 20.197 8.150 1.00 0.00 H new ATOM 0 HE3 LYS B 443 13.604 20.264 6.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 15.478 21.600 7.119 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 14.278 22.595 6.447 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 14.482 22.531 8.132 1.00 0.00 H new ATOM 2280 N GLN B 444 10.791 21.069 3.431 1.00 0.00 N ATOM 2281 CA GLN B 444 11.646 21.096 2.252 1.00 0.00 C ATOM 2282 C GLN B 444 10.810 21.264 0.984 1.00 0.00 C ATOM 2283 O GLN B 444 10.988 22.222 0.232 1.00 0.00 O ATOM 2284 CB GLN B 444 12.491 19.813 2.200 1.00 0.00 C ATOM 2285 CG GLN B 444 12.378 19.012 0.910 1.00 0.00 C ATOM 2286 CD GLN B 444 12.791 19.800 -0.323 1.00 0.00 C ATOM 2287 OE1 GLN B 444 13.545 20.878 -0.122 1.00 0.00 O flip ATOM 2288 NE2 GLN B 444 12.436 19.443 -1.446 1.00 0.00 N flip ATOM 0 H GLN B 444 10.719 20.155 3.879 1.00 0.00 H new ATOM 0 HA GLN B 444 12.319 21.951 2.314 1.00 0.00 H new ATOM 0 HB2 GLN B 444 13.537 20.080 2.352 1.00 0.00 H new ATOM 0 HB3 GLN B 444 12.201 19.172 3.033 1.00 0.00 H new ATOM 0 HG2 GLN B 444 13.000 18.120 0.988 1.00 0.00 H new ATOM 0 HG3 GLN B 444 11.349 18.674 0.789 1.00 0.00 H new ATOM 0 HE21 GLN B 444 11.858 18.610 -1.557 1.00 0.00 H new ATOM 0 HE22 GLN B 444 12.720 19.980 -2.265 1.00 0.00 H new ATOM 2297 N ARG B 445 9.906 20.318 0.749 1.00 0.00 N ATOM 2298 CA ARG B 445 9.051 20.350 -0.429 1.00 0.00 C ATOM 2299 C ARG B 445 8.280 21.660 -0.498 1.00 0.00 C ATOM 2300 O ARG B 445 7.875 22.095 -1.574 1.00 0.00 O ATOM 2301 CB ARG B 445 8.082 19.162 -0.418 1.00 0.00 C ATOM 2302 CG ARG B 445 6.755 19.454 0.267 1.00 0.00 C ATOM 2303 CD ARG B 445 5.839 20.280 -0.624 1.00 0.00 C ATOM 2304 NE ARG B 445 4.432 19.940 -0.425 1.00 0.00 N ATOM 2305 CZ ARG B 445 3.431 20.796 -0.614 1.00 0.00 C ATOM 2306 NH1 ARG B 445 3.680 22.035 -1.016 1.00 0.00 N ATOM 2307 NH2 ARG B 445 2.179 20.411 -0.403 1.00 0.00 N ATOM 0 H ARG B 445 9.748 19.518 1.362 1.00 0.00 H new ATOM 0 HA ARG B 445 9.684 20.277 -1.314 1.00 0.00 H new ATOM 0 HB2 ARG B 445 7.889 18.854 -1.446 1.00 0.00 H new ATOM 0 HB3 ARG B 445 8.560 18.320 0.083 1.00 0.00 H new ATOM 0 HG2 ARG B 445 6.264 18.516 0.526 1.00 0.00 H new ATOM 0 HG3 ARG B 445 6.935 19.988 1.200 1.00 0.00 H new ATOM 0 HD2 ARG B 445 5.989 21.339 -0.416 1.00 0.00 H new ATOM 0 HD3 ARG B 445 6.107 20.119 -1.668 1.00 0.00 H new ATOM 0 HE ARG B 445 4.204 18.992 -0.124 1.00 0.00 H new ATOM 0 HH11 ARG B 445 4.641 22.334 -1.181 1.00 0.00 H new ATOM 0 HH12 ARG B 445 2.910 22.689 -1.160 1.00 0.00 H new ATOM 0 HH21 ARG B 445 1.983 19.458 -0.096 1.00 0.00 H new ATOM 0 HH22 ARG B 445 1.412 21.068 -0.548 1.00 0.00 H new ATOM 2321 N ALA B 446 8.076 22.285 0.655 1.00 0.00 N ATOM 2322 CA ALA B 446 7.355 23.546 0.714 1.00 0.00 C ATOM 2323 C ALA B 446 8.312 24.717 0.521 1.00 0.00 C ATOM 2324 O ALA B 446 8.063 25.608 -0.292 1.00 0.00 O ATOM 2325 CB ALA B 446 6.609 23.687 2.033 1.00 0.00 C ATOM 0 H ALA B 446 8.399 21.939 1.558 1.00 0.00 H new ATOM 0 HA ALA B 446 6.623 23.554 -0.094 1.00 0.00 H new ATOM 0 HB1 ALA B 446 6.078 24.639 2.051 1.00 0.00 H new ATOM 0 HB2 ALA B 446 5.894 22.871 2.136 1.00 0.00 H new ATOM 0 HB3 ALA B 446 7.320 23.652 2.859 1.00 0.00 H new ATOM 2331 N ALA B 447 9.404 24.713 1.279 1.00 0.00 N ATOM 2332 CA ALA B 447 10.396 25.779 1.198 1.00 0.00 C ATOM 2333 C ALA B 447 10.897 25.962 -0.231 1.00 0.00 C ATOM 2334 O ALA B 447 11.294 27.059 -0.622 1.00 0.00 O ATOM 2335 CB ALA B 447 11.565 25.508 2.132 1.00 0.00 C ATOM 0 H ALA B 447 9.624 23.983 1.957 1.00 0.00 H new ATOM 0 HA ALA B 447 9.908 26.702 1.511 1.00 0.00 H new ATOM 0 HB1 ALA B 447 12.290 26.318 2.052 1.00 0.00 H new ATOM 0 HB2 ALA B 447 11.204 25.445 3.158 1.00 0.00 H new ATOM 0 HB3 ALA B 447 12.041 24.567 1.856 1.00 0.00 H new ATOM 2341 N ILE B 448 10.881 24.883 -1.006 1.00 0.00 N ATOM 2342 CA ILE B 448 11.338 24.920 -2.388 1.00 0.00 C ATOM 2343 C ILE B 448 10.820 26.158 -3.115 1.00 0.00 C ATOM 2344 O ILE B 448 9.727 26.647 -2.830 1.00 0.00 O ATOM 2345 CB ILE B 448 10.877 23.660 -3.138 1.00 0.00 C ATOM 2346 CG1 ILE B 448 9.360 23.660 -3.273 1.00 0.00 C ATOM 2347 CG2 ILE B 448 11.339 22.408 -2.407 1.00 0.00 C ATOM 2348 CD1 ILE B 448 8.816 22.415 -3.937 1.00 0.00 C ATOM 0 H ILE B 448 10.554 23.968 -0.697 1.00 0.00 H new ATOM 0 HA ILE B 448 12.427 24.959 -2.371 1.00 0.00 H new ATOM 0 HB ILE B 448 11.321 23.663 -4.133 1.00 0.00 H new ATOM 0 HG12 ILE B 448 8.915 23.759 -2.283 1.00 0.00 H new ATOM 0 HG13 ILE B 448 9.054 24.533 -3.849 1.00 0.00 H new ATOM 0 HG21 ILE B 448 11.004 21.525 -2.951 1.00 0.00 H new ATOM 0 HG22 ILE B 448 12.427 22.404 -2.343 1.00 0.00 H new ATOM 0 HG23 ILE B 448 10.917 22.397 -1.402 1.00 0.00 H new ATOM 0 HD11 ILE B 448 7.730 22.482 -4.001 1.00 0.00 H new ATOM 0 HD12 ILE B 448 9.234 22.325 -4.940 1.00 0.00 H new ATOM 0 HD13 ILE B 448 9.092 21.539 -3.350 1.00 0.00 H new