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 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 399 ASN :FLIP amide:sc= 0.0931 F(o=-0.94,f=0.093) USER MOD Set 2.1: B 389 THR OG1 : rot 180:sc= 0.072 USER MOD Set 2.2: B 400 SER OG : rot -153:sc= -0.885 USER MOD Set 3.1: B 368 MET CE :methyl -178:sc= -3.7 (180deg=-2.79) USER MOD Set 3.2: B 369 ASN : amide:sc= -1.09 X(o=-4.8,f=-4.7) USER MOD Single : B 365 SER OG : rot 58:sc= 1.14 USER MOD Single : B 371 LYS NZ :NH3+ 156:sc= -0.239 (180deg=-0.957) USER MOD Single : B 373 GLN : amide:sc= -23.8! C(o=-24!,f=-27!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 59:sc= -0.927 USER MOD Single : B 380 TYR OH : rot 101:sc= -0.43 USER MOD Single : B 382 SER OG : rot -99:sc= -0.361 USER MOD Single : B 386 HIS : no HE2:sc= -2.99 K(o=-3,f=-4.8!) USER MOD Single : B 387 TYR OH : rot -81:sc= -5.58! USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot 61:sc= 0.299 USER MOD Single : B 404 CYS SG : rot -170:sc= -0.229 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 70:sc= 0.235 USER MOD Single : B 419 ASN :FLIP amide:sc= -0.3 F(o=-1.2,f=-0.3) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -3.01! C(o=-3!,f=-3.1!) USER MOD Single : B 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 437 MET CE :methyl -157:sc= -0.272 (180deg=-1.53) USER MOD Single : B 441 TYR OH : rot 30:sc= -0.0134 USER MOD Single : B 443 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.032) USER MOD Single : B 444 GLN :FLIP amide:sc= -5.08! C(o=-8!,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 1036 N SER B 365 -1.339 2.932 12.806 1.00 0.00 N ATOM 1037 CA SER B 365 -0.776 1.821 12.046 1.00 0.00 C ATOM 1038 C SER B 365 -1.786 1.289 11.035 1.00 0.00 C ATOM 1039 O SER B 365 -2.361 0.216 11.221 1.00 0.00 O ATOM 1040 CB SER B 365 -0.341 0.698 12.988 1.00 0.00 C ATOM 1041 OG SER B 365 -1.462 0.017 13.524 1.00 0.00 O ATOM 0 HA SER B 365 0.096 2.189 11.505 1.00 0.00 H new ATOM 0 HB2 SER B 365 0.293 -0.007 12.450 1.00 0.00 H new ATOM 0 HB3 SER B 365 0.259 1.111 13.799 1.00 0.00 H new ATOM 0 HG SER B 365 -2.003 -0.348 12.793 1.00 0.00 H new ATOM 1047 N LEU B 366 -2.001 2.049 9.966 1.00 0.00 N ATOM 1048 CA LEU B 366 -2.944 1.657 8.926 1.00 0.00 C ATOM 1049 C LEU B 366 -2.557 2.266 7.583 1.00 0.00 C ATOM 1050 O LEU B 366 -1.921 3.319 7.529 1.00 0.00 O ATOM 1051 CB LEU B 366 -4.359 2.095 9.306 1.00 0.00 C ATOM 1052 CG LEU B 366 -5.484 1.357 8.580 1.00 0.00 C ATOM 1053 CD1 LEU B 366 -6.738 1.329 9.437 1.00 0.00 C ATOM 1054 CD2 LEU B 366 -5.769 2.008 7.235 1.00 0.00 C ATOM 0 H LEU B 366 -1.534 2.940 9.798 1.00 0.00 H new ATOM 0 HA LEU B 366 -2.916 0.571 8.834 1.00 0.00 H new ATOM 0 HB2 LEU B 366 -4.489 1.958 10.379 1.00 0.00 H new ATOM 0 HB3 LEU B 366 -4.458 3.162 9.107 1.00 0.00 H new ATOM 0 HG LEU B 366 -5.165 0.330 8.402 1.00 0.00 H new ATOM 0 HD11 LEU B 366 -7.530 0.800 8.906 1.00 0.00 H new ATOM 0 HD12 LEU B 366 -6.526 0.817 10.376 1.00 0.00 H new ATOM 0 HD13 LEU B 366 -7.060 2.350 9.645 1.00 0.00 H new ATOM 0 HD21 LEU B 366 -6.572 1.469 6.733 1.00 0.00 H new ATOM 0 HD22 LEU B 366 -6.068 3.045 7.389 1.00 0.00 H new ATOM 0 HD23 LEU B 366 -4.871 1.977 6.618 1.00 0.00 H new ATOM 1066 N ASP B 367 -2.949 1.602 6.501 1.00 0.00 N ATOM 1067 CA ASP B 367 -2.646 2.089 5.161 1.00 0.00 C ATOM 1068 C ASP B 367 -3.282 3.454 4.934 1.00 0.00 C ATOM 1069 O ASP B 367 -2.584 4.454 4.767 1.00 0.00 O ATOM 1070 CB ASP B 367 -3.143 1.098 4.105 1.00 0.00 C ATOM 1071 CG ASP B 367 -2.957 1.619 2.693 1.00 0.00 C ATOM 1072 OD1 ASP B 367 -1.795 1.788 2.271 1.00 0.00 O ATOM 1073 OD2 ASP B 367 -3.975 1.859 2.010 1.00 0.00 O ATOM 0 H ASP B 367 -3.475 0.729 6.526 1.00 0.00 H new ATOM 0 HA ASP B 367 -1.564 2.186 5.069 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -2.608 0.155 4.215 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -4.199 0.888 4.276 1.00 0.00 H new ATOM 1078 N MET B 368 -4.611 3.487 4.935 1.00 0.00 N ATOM 1079 CA MET B 368 -5.346 4.731 4.733 1.00 0.00 C ATOM 1080 C MET B 368 -4.605 5.902 5.369 1.00 0.00 C ATOM 1081 O MET B 368 -4.407 6.942 4.742 1.00 0.00 O ATOM 1082 CB MET B 368 -6.752 4.619 5.324 1.00 0.00 C ATOM 1083 CG MET B 368 -7.497 5.944 5.377 1.00 0.00 C ATOM 1084 SD MET B 368 -8.253 6.253 6.985 1.00 0.00 S ATOM 1085 CE MET B 368 -6.815 6.204 8.050 1.00 0.00 C ATOM 0 H MET B 368 -5.201 2.667 5.073 1.00 0.00 H new ATOM 0 HA MET B 368 -5.426 4.911 3.661 1.00 0.00 H new ATOM 0 HB2 MET B 368 -7.331 3.910 4.732 1.00 0.00 H new ATOM 0 HB3 MET B 368 -6.682 4.210 6.332 1.00 0.00 H new ATOM 0 HG2 MET B 368 -6.806 6.754 5.143 1.00 0.00 H new ATOM 0 HG3 MET B 368 -8.270 5.952 4.609 1.00 0.00 H new ATOM 0 HE1 MET B 368 -7.124 6.343 9.086 1.00 0.00 H new ATOM 0 HE2 MET B 368 -6.318 5.239 7.946 1.00 0.00 H new ATOM 0 HE3 MET B 368 -6.126 7.000 7.767 1.00 0.00 H new ATOM 1095 N ASN B 369 -4.204 5.728 6.621 1.00 0.00 N ATOM 1096 CA ASN B 369 -3.489 6.772 7.343 1.00 0.00 C ATOM 1097 C ASN B 369 -2.187 7.139 6.634 1.00 0.00 C ATOM 1098 O ASN B 369 -1.883 8.318 6.452 1.00 0.00 O ATOM 1099 CB ASN B 369 -3.186 6.318 8.772 1.00 0.00 C ATOM 1100 CG ASN B 369 -4.243 6.769 9.761 1.00 0.00 C ATOM 1101 OD1 ASN B 369 -4.511 7.963 9.900 1.00 0.00 O ATOM 1102 ND2 ASN B 369 -4.848 5.814 10.457 1.00 0.00 N ATOM 0 H ASN B 369 -4.361 4.875 7.157 1.00 0.00 H new ATOM 0 HA ASN B 369 -4.128 7.655 7.372 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -3.111 5.231 8.796 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -2.216 6.711 9.077 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -5.566 6.057 11.139 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -4.595 4.837 10.310 1.00 0.00 H new ATOM 1109 N ALA B 370 -1.414 6.126 6.252 1.00 0.00 N ATOM 1110 CA ALA B 370 -0.139 6.361 5.583 1.00 0.00 C ATOM 1111 C ALA B 370 -0.329 7.109 4.267 1.00 0.00 C ATOM 1112 O ALA B 370 0.180 8.218 4.103 1.00 0.00 O ATOM 1113 CB ALA B 370 0.595 5.052 5.343 1.00 0.00 C ATOM 0 H ALA B 370 -1.646 5.143 6.393 1.00 0.00 H new ATOM 0 HA ALA B 370 0.465 6.985 6.242 1.00 0.00 H new ATOM 0 HB1 ALA B 370 1.543 5.253 4.843 1.00 0.00 H new ATOM 0 HB2 ALA B 370 0.785 4.561 6.297 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -0.015 4.402 4.716 1.00 0.00 H new ATOM 1119 N LYS B 371 -1.035 6.498 3.317 1.00 0.00 N ATOM 1120 CA LYS B 371 -1.238 7.127 2.016 1.00 0.00 C ATOM 1121 C LYS B 371 -1.623 8.587 2.190 1.00 0.00 C ATOM 1122 O LYS B 371 -1.109 9.459 1.491 1.00 0.00 O ATOM 1123 CB LYS B 371 -2.317 6.389 1.217 1.00 0.00 C ATOM 1124 CG LYS B 371 -3.661 6.316 1.923 1.00 0.00 C ATOM 1125 CD LYS B 371 -4.589 7.437 1.480 1.00 0.00 C ATOM 1126 CE LYS B 371 -5.984 7.273 2.067 1.00 0.00 C ATOM 1127 NZ LYS B 371 -6.437 8.503 2.776 1.00 0.00 N ATOM 0 H LYS B 371 -1.470 5.581 3.422 1.00 0.00 H new ATOM 0 HA LYS B 371 -0.301 7.072 1.461 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -2.448 6.887 0.256 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -1.972 5.377 1.007 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -4.129 5.353 1.717 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -3.510 6.373 3.001 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -4.174 8.397 1.788 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -4.651 7.451 0.392 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -6.688 7.034 1.270 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -5.990 6.432 2.760 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -7.476 8.525 2.803 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -6.065 8.501 3.747 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -6.086 9.343 2.273 1.00 0.00 H new ATOM 1141 N ARG B 372 -2.499 8.858 3.148 1.00 0.00 N ATOM 1142 CA ARG B 372 -2.903 10.226 3.422 1.00 0.00 C ATOM 1143 C ARG B 372 -1.681 11.031 3.850 1.00 0.00 C ATOM 1144 O ARG B 372 -1.505 12.181 3.465 1.00 0.00 O ATOM 1145 CB ARG B 372 -3.966 10.259 4.526 1.00 0.00 C ATOM 1146 CG ARG B 372 -5.213 11.047 4.155 1.00 0.00 C ATOM 1147 CD ARG B 372 -5.220 12.418 4.813 1.00 0.00 C ATOM 1148 NE ARG B 372 -3.866 12.919 5.044 1.00 0.00 N ATOM 1149 CZ ARG B 372 -3.495 13.612 6.120 1.00 0.00 C ATOM 1150 NH1 ARG B 372 -4.374 13.913 7.066 1.00 0.00 N ATOM 1151 NH2 ARG B 372 -2.236 14.009 6.247 1.00 0.00 N ATOM 0 H ARG B 372 -2.939 8.155 3.742 1.00 0.00 H new ATOM 0 HA ARG B 372 -3.332 10.662 2.520 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -4.253 9.237 4.771 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -3.529 10.692 5.426 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -5.264 11.161 3.072 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -6.100 10.491 4.459 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -5.764 13.121 4.182 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -5.753 12.362 5.762 1.00 0.00 H new ATOM 0 HE ARG B 372 -3.159 12.725 4.335 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -5.345 13.614 6.974 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -4.079 14.444 7.886 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -1.555 13.784 5.522 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -1.949 14.540 7.070 1.00 0.00 H new ATOM 1165 N GLN B 373 -0.843 10.402 4.660 1.00 0.00 N ATOM 1166 CA GLN B 373 0.366 11.027 5.171 1.00 0.00 C ATOM 1167 C GLN B 373 1.362 11.370 4.063 1.00 0.00 C ATOM 1168 O GLN B 373 1.896 12.472 4.016 1.00 0.00 O ATOM 1169 CB GLN B 373 1.030 10.082 6.172 1.00 0.00 C ATOM 1170 CG GLN B 373 2.135 10.723 6.993 1.00 0.00 C ATOM 1171 CD GLN B 373 3.232 11.325 6.137 1.00 0.00 C ATOM 1172 OE1 GLN B 373 3.610 12.484 6.315 1.00 0.00 O ATOM 1173 NE2 GLN B 373 3.749 10.539 5.200 1.00 0.00 N ATOM 0 H GLN B 373 -0.983 9.444 4.981 1.00 0.00 H new ATOM 0 HA GLN B 373 0.077 11.963 5.650 1.00 0.00 H new ATOM 0 HB2 GLN B 373 0.269 9.694 6.848 1.00 0.00 H new ATOM 0 HB3 GLN B 373 1.442 9.229 5.632 1.00 0.00 H new ATOM 0 HG2 GLN B 373 1.707 11.501 7.625 1.00 0.00 H new ATOM 0 HG3 GLN B 373 2.568 9.975 7.657 1.00 0.00 H new ATOM 0 HE21 GLN B 373 3.405 9.585 5.088 1.00 0.00 H new ATOM 0 HE22 GLN B 373 4.490 10.889 4.592 1.00 0.00 H new ATOM 1182 N LEU B 374 1.636 10.415 3.191 1.00 0.00 N ATOM 1183 CA LEU B 374 2.608 10.640 2.125 1.00 0.00 C ATOM 1184 C LEU B 374 2.139 11.704 1.138 1.00 0.00 C ATOM 1185 O LEU B 374 2.832 12.696 0.908 1.00 0.00 O ATOM 1186 CB LEU B 374 2.877 9.332 1.381 1.00 0.00 C ATOM 1187 CG LEU B 374 2.830 8.073 2.248 1.00 0.00 C ATOM 1188 CD1 LEU B 374 3.044 6.835 1.400 1.00 0.00 C ATOM 1189 CD2 LEU B 374 3.870 8.152 3.356 1.00 0.00 C ATOM 0 H LEU B 374 1.209 9.489 3.195 1.00 0.00 H new ATOM 0 HA LEU B 374 3.526 10.999 2.590 1.00 0.00 H new ATOM 0 HB2 LEU B 374 2.145 9.230 0.580 1.00 0.00 H new ATOM 0 HB3 LEU B 374 3.858 9.394 0.911 1.00 0.00 H new ATOM 0 HG LEU B 374 1.844 8.006 2.707 1.00 0.00 H new ATOM 0 HD11 LEU B 374 3.007 5.949 2.034 1.00 0.00 H new ATOM 0 HD12 LEU B 374 2.262 6.773 0.643 1.00 0.00 H new ATOM 0 HD13 LEU B 374 4.017 6.892 0.912 1.00 0.00 H new ATOM 0 HD21 LEU B 374 3.823 7.248 3.964 1.00 0.00 H new ATOM 0 HD22 LEU B 374 4.863 8.243 2.917 1.00 0.00 H new ATOM 0 HD23 LEU B 374 3.669 9.021 3.982 1.00 0.00 H new ATOM 1201 N TYR B 375 0.984 11.480 0.530 1.00 0.00 N ATOM 1202 CA TYR B 375 0.456 12.407 -0.464 1.00 0.00 C ATOM 1203 C TYR B 375 -0.103 13.685 0.161 1.00 0.00 C ATOM 1204 O TYR B 375 0.165 14.785 -0.323 1.00 0.00 O ATOM 1205 CB TYR B 375 -0.600 11.710 -1.315 1.00 0.00 C ATOM 1206 CG TYR B 375 -0.004 10.923 -2.461 1.00 0.00 C ATOM 1207 CD1 TYR B 375 1.252 10.342 -2.341 1.00 0.00 C ATOM 1208 CD2 TYR B 375 -0.691 10.763 -3.658 1.00 0.00 C ATOM 1209 CE1 TYR B 375 1.808 9.622 -3.380 1.00 0.00 C ATOM 1210 CE2 TYR B 375 -0.141 10.043 -4.703 1.00 0.00 C ATOM 1211 CZ TYR B 375 1.109 9.475 -4.559 1.00 0.00 C ATOM 1212 OH TYR B 375 1.659 8.757 -5.597 1.00 0.00 O ATOM 0 H TYR B 375 0.394 10.667 0.706 1.00 0.00 H new ATOM 0 HA TYR B 375 1.287 12.713 -1.100 1.00 0.00 H new ATOM 0 HB2 TYR B 375 -1.183 11.039 -0.684 1.00 0.00 H new ATOM 0 HB3 TYR B 375 -1.290 12.455 -1.712 1.00 0.00 H new ATOM 0 HD1 TYR B 375 1.803 10.455 -1.419 1.00 0.00 H new ATOM 0 HD2 TYR B 375 -1.669 11.207 -3.774 1.00 0.00 H new ATOM 0 HE1 TYR B 375 2.786 9.176 -3.269 1.00 0.00 H new ATOM 0 HE2 TYR B 375 -0.687 9.926 -5.627 1.00 0.00 H new ATOM 0 HH TYR B 375 1.037 8.748 -6.354 1.00 0.00 H new ATOM 1222 N SER B 376 -0.873 13.554 1.232 1.00 0.00 N ATOM 1223 CA SER B 376 -1.429 14.739 1.874 1.00 0.00 C ATOM 1224 C SER B 376 -0.332 15.497 2.617 1.00 0.00 C ATOM 1225 O SER B 376 -0.134 16.691 2.396 1.00 0.00 O ATOM 1226 CB SER B 376 -2.569 14.376 2.827 1.00 0.00 C ATOM 1227 OG SER B 376 -3.272 13.231 2.373 1.00 0.00 O ATOM 0 H SER B 376 -1.123 12.665 1.666 1.00 0.00 H new ATOM 0 HA SER B 376 -1.841 15.382 1.096 1.00 0.00 H new ATOM 0 HB2 SER B 376 -2.168 14.189 3.823 1.00 0.00 H new ATOM 0 HB3 SER B 376 -3.256 15.218 2.913 1.00 0.00 H new ATOM 0 HG SER B 376 -2.654 12.473 2.305 1.00 0.00 H new ATOM 1233 N LEU B 377 0.375 14.801 3.507 1.00 0.00 N ATOM 1234 CA LEU B 377 1.441 15.427 4.282 1.00 0.00 C ATOM 1235 C LEU B 377 2.641 15.787 3.405 1.00 0.00 C ATOM 1236 O LEU B 377 3.096 16.931 3.424 1.00 0.00 O ATOM 1237 CB LEU B 377 1.879 14.525 5.437 1.00 0.00 C ATOM 1238 CG LEU B 377 1.989 15.216 6.797 1.00 0.00 C ATOM 1239 CD1 LEU B 377 1.599 14.261 7.916 1.00 0.00 C ATOM 1240 CD2 LEU B 377 3.398 15.746 7.011 1.00 0.00 C ATOM 0 H LEU B 377 0.229 13.811 3.707 1.00 0.00 H new ATOM 0 HA LEU B 377 1.039 16.352 4.695 1.00 0.00 H new ATOM 0 HB2 LEU B 377 1.171 13.701 5.522 1.00 0.00 H new ATOM 0 HB3 LEU B 377 2.847 14.089 5.190 1.00 0.00 H new ATOM 0 HG LEU B 377 1.298 16.059 6.812 1.00 0.00 H new ATOM 0 HD11 LEU B 377 1.684 14.771 8.876 1.00 0.00 H new ATOM 0 HD12 LEU B 377 0.571 13.930 7.770 1.00 0.00 H new ATOM 0 HD13 LEU B 377 2.263 13.397 7.905 1.00 0.00 H new ATOM 0 HD21 LEU B 377 3.459 16.235 7.983 1.00 0.00 H new ATOM 0 HD22 LEU B 377 4.107 14.919 6.975 1.00 0.00 H new ATOM 0 HD23 LEU B 377 3.639 16.465 6.228 1.00 0.00 H new ATOM 1252 N ILE B 378 3.176 14.821 2.653 1.00 0.00 N ATOM 1253 CA ILE B 378 4.340 15.073 1.804 1.00 0.00 C ATOM 1254 C ILE B 378 4.026 14.904 0.321 1.00 0.00 C ATOM 1255 O ILE B 378 4.859 14.414 -0.443 1.00 0.00 O ATOM 1256 CB ILE B 378 5.494 14.126 2.176 1.00 0.00 C ATOM 1257 CG1 ILE B 378 5.718 14.144 3.683 1.00 0.00 C ATOM 1258 CG2 ILE B 378 6.766 14.523 1.446 1.00 0.00 C ATOM 1259 CD1 ILE B 378 6.273 15.459 4.185 1.00 0.00 C ATOM 0 H ILE B 378 2.824 13.865 2.616 1.00 0.00 H new ATOM 0 HA ILE B 378 4.630 16.109 1.977 1.00 0.00 H new ATOM 0 HB ILE B 378 5.227 13.114 1.872 1.00 0.00 H new ATOM 0 HG12 ILE B 378 4.774 13.939 4.187 1.00 0.00 H new ATOM 0 HG13 ILE B 378 6.404 13.341 3.952 1.00 0.00 H new ATOM 0 HG21 ILE B 378 7.571 13.842 1.722 1.00 0.00 H new ATOM 0 HG22 ILE B 378 6.599 14.471 0.370 1.00 0.00 H new ATOM 0 HG23 ILE B 378 7.041 15.541 1.722 1.00 0.00 H new ATOM 0 HD11 ILE B 378 6.410 15.408 5.265 1.00 0.00 H new ATOM 0 HD12 ILE B 378 7.233 15.655 3.707 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.577 16.263 3.945 1.00 0.00 H new ATOM 1271 N GLY B 379 2.834 15.319 -0.090 1.00 0.00 N ATOM 1272 CA GLY B 379 2.458 15.205 -1.488 1.00 0.00 C ATOM 1273 C GLY B 379 1.867 16.490 -2.030 1.00 0.00 C ATOM 1274 O GLY B 379 0.647 16.644 -2.092 1.00 0.00 O ATOM 0 H GLY B 379 2.124 15.730 0.515 1.00 0.00 H new ATOM 0 HA2 GLY B 379 3.334 14.934 -2.077 1.00 0.00 H new ATOM 0 HA3 GLY B 379 1.734 14.398 -1.603 1.00 0.00 H new ATOM 1278 N TYR B 380 2.736 17.415 -2.419 1.00 0.00 N ATOM 1279 CA TYR B 380 2.304 18.699 -2.956 1.00 0.00 C ATOM 1280 C TYR B 380 1.886 18.559 -4.422 1.00 0.00 C ATOM 1281 O TYR B 380 1.343 17.529 -4.819 1.00 0.00 O ATOM 1282 CB TYR B 380 3.428 19.731 -2.800 1.00 0.00 C ATOM 1283 CG TYR B 380 4.704 19.365 -3.530 1.00 0.00 C ATOM 1284 CD1 TYR B 380 5.591 18.442 -2.991 1.00 0.00 C ATOM 1285 CD2 TYR B 380 5.023 19.943 -4.754 1.00 0.00 C ATOM 1286 CE1 TYR B 380 6.758 18.104 -3.648 1.00 0.00 C ATOM 1287 CE2 TYR B 380 6.187 19.609 -5.419 1.00 0.00 C ATOM 1288 CZ TYR B 380 7.052 18.691 -4.862 1.00 0.00 C ATOM 1289 OH TYR B 380 8.213 18.356 -5.520 1.00 0.00 O ATOM 0 H TYR B 380 3.748 17.299 -2.372 1.00 0.00 H new ATOM 0 HA TYR B 380 1.435 19.044 -2.396 1.00 0.00 H new ATOM 0 HB2 TYR B 380 3.076 20.695 -3.166 1.00 0.00 H new ATOM 0 HB3 TYR B 380 3.650 19.854 -1.740 1.00 0.00 H new ATOM 0 HD1 TYR B 380 5.364 17.980 -2.041 1.00 0.00 H new ATOM 0 HD2 TYR B 380 4.350 20.665 -5.192 1.00 0.00 H new ATOM 0 HE1 TYR B 380 7.437 17.384 -3.214 1.00 0.00 H new ATOM 0 HE2 TYR B 380 6.418 20.065 -6.370 1.00 0.00 H new ATOM 0 HH TYR B 380 8.010 17.721 -6.238 1.00 0.00 H new ATOM 1299 N ALA B 381 2.131 19.595 -5.220 1.00 0.00 N ATOM 1300 CA ALA B 381 1.767 19.573 -6.630 1.00 0.00 C ATOM 1301 C ALA B 381 2.153 18.248 -7.282 1.00 0.00 C ATOM 1302 O ALA B 381 1.554 17.845 -8.280 1.00 0.00 O ATOM 1303 CB ALA B 381 2.413 20.732 -7.375 1.00 0.00 C ATOM 0 H ALA B 381 2.579 20.458 -4.913 1.00 0.00 H new ATOM 0 HA ALA B 381 0.684 19.680 -6.690 1.00 0.00 H new ATOM 0 HB1 ALA B 381 2.126 20.694 -8.426 1.00 0.00 H new ATOM 0 HB2 ALA B 381 2.079 21.675 -6.942 1.00 0.00 H new ATOM 0 HB3 ALA B 381 3.497 20.659 -7.292 1.00 0.00 H new ATOM 1309 N SER B 382 3.147 17.570 -6.711 1.00 0.00 N ATOM 1310 CA SER B 382 3.598 16.287 -7.243 1.00 0.00 C ATOM 1311 C SER B 382 5.024 15.970 -6.798 1.00 0.00 C ATOM 1312 O SER B 382 5.880 16.853 -6.739 1.00 0.00 O ATOM 1313 CB SER B 382 3.523 16.287 -8.771 1.00 0.00 C ATOM 1314 OG SER B 382 3.959 17.526 -9.304 1.00 0.00 O ATOM 0 H SER B 382 3.653 17.886 -5.884 1.00 0.00 H new ATOM 0 HA SER B 382 2.936 15.516 -6.849 1.00 0.00 H new ATOM 0 HB2 SER B 382 4.139 15.480 -9.168 1.00 0.00 H new ATOM 0 HB3 SER B 382 2.498 16.092 -9.088 1.00 0.00 H new ATOM 0 HG SER B 382 3.181 18.081 -9.521 1.00 0.00 H new ATOM 1320 N LEU B 383 5.270 14.696 -6.496 1.00 0.00 N ATOM 1321 CA LEU B 383 6.591 14.246 -6.068 1.00 0.00 C ATOM 1322 C LEU B 383 6.970 12.955 -6.786 1.00 0.00 C ATOM 1323 O LEU B 383 6.640 12.774 -7.959 1.00 0.00 O ATOM 1324 CB LEU B 383 6.623 14.028 -4.556 1.00 0.00 C ATOM 1325 CG LEU B 383 7.967 14.325 -3.895 1.00 0.00 C ATOM 1326 CD1 LEU B 383 8.553 15.618 -4.443 1.00 0.00 C ATOM 1327 CD2 LEU B 383 7.815 14.405 -2.384 1.00 0.00 C ATOM 0 H LEU B 383 4.569 13.956 -6.540 1.00 0.00 H new ATOM 0 HA LEU B 383 7.314 15.020 -6.325 1.00 0.00 H new ATOM 0 HB2 LEU B 383 5.861 14.657 -4.096 1.00 0.00 H new ATOM 0 HB3 LEU B 383 6.352 12.993 -4.346 1.00 0.00 H new ATOM 0 HG LEU B 383 8.652 13.510 -4.126 1.00 0.00 H new ATOM 0 HD11 LEU B 383 9.511 15.816 -3.962 1.00 0.00 H new ATOM 0 HD12 LEU B 383 8.700 15.524 -5.519 1.00 0.00 H new ATOM 0 HD13 LEU B 383 7.869 16.442 -4.241 1.00 0.00 H new ATOM 0 HD21 LEU B 383 8.784 14.617 -1.932 1.00 0.00 H new ATOM 0 HD22 LEU B 383 7.114 15.200 -2.130 1.00 0.00 H new ATOM 0 HD23 LEU B 383 7.438 13.455 -2.005 1.00 0.00 H new ATOM 1339 N ARG B 384 7.653 12.051 -6.085 1.00 0.00 N ATOM 1340 CA ARG B 384 8.052 10.790 -6.682 1.00 0.00 C ATOM 1341 C ARG B 384 8.621 9.824 -5.646 1.00 0.00 C ATOM 1342 O ARG B 384 9.806 9.506 -5.674 1.00 0.00 O ATOM 1343 CB ARG B 384 9.079 11.025 -7.790 1.00 0.00 C ATOM 1344 CG ARG B 384 9.952 12.248 -7.563 1.00 0.00 C ATOM 1345 CD ARG B 384 10.566 12.246 -6.172 1.00 0.00 C ATOM 1346 NE ARG B 384 11.215 13.515 -5.857 1.00 0.00 N ATOM 1347 CZ ARG B 384 12.368 13.905 -6.390 1.00 0.00 C ATOM 1348 NH1 ARG B 384 12.991 13.129 -7.268 1.00 0.00 N ATOM 1349 NH2 ARG B 384 12.900 15.070 -6.047 1.00 0.00 N ATOM 0 H ARG B 384 7.937 12.172 -5.113 1.00 0.00 H new ATOM 0 HA ARG B 384 7.157 10.336 -7.107 1.00 0.00 H new ATOM 0 HB2 ARG B 384 9.717 10.145 -7.875 1.00 0.00 H new ATOM 0 HB3 ARG B 384 8.557 11.133 -8.741 1.00 0.00 H new ATOM 0 HG2 ARG B 384 10.744 12.274 -8.311 1.00 0.00 H new ATOM 0 HG3 ARG B 384 9.357 13.151 -7.697 1.00 0.00 H new ATOM 0 HD2 ARG B 384 9.790 12.043 -5.434 1.00 0.00 H new ATOM 0 HD3 ARG B 384 11.295 11.439 -6.099 1.00 0.00 H new ATOM 0 HE ARG B 384 10.758 14.137 -5.190 1.00 0.00 H new ATOM 0 HH11 ARG B 384 12.585 12.232 -7.534 1.00 0.00 H new ATOM 0 HH12 ARG B 384 13.876 13.430 -7.676 1.00 0.00 H new ATOM 0 HH21 ARG B 384 12.424 15.669 -5.373 1.00 0.00 H new ATOM 0 HH22 ARG B 384 13.785 15.367 -6.458 1.00 0.00 H new ATOM 1363 N LEU B 385 7.764 9.311 -4.770 1.00 0.00 N ATOM 1364 CA LEU B 385 8.169 8.326 -3.772 1.00 0.00 C ATOM 1365 C LEU B 385 7.145 7.199 -3.804 1.00 0.00 C ATOM 1366 O LEU B 385 5.958 7.450 -3.596 1.00 0.00 O ATOM 1367 CB LEU B 385 8.248 8.951 -2.375 1.00 0.00 C ATOM 1368 CG LEU B 385 6.908 9.108 -1.656 1.00 0.00 C ATOM 1369 CD1 LEU B 385 7.119 9.576 -0.226 1.00 0.00 C ATOM 1370 CD2 LEU B 385 6.017 10.081 -2.408 1.00 0.00 C ATOM 0 H LEU B 385 6.776 9.563 -4.731 1.00 0.00 H new ATOM 0 HA LEU B 385 9.165 7.946 -4.001 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.904 8.338 -1.757 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.714 9.933 -2.459 1.00 0.00 H new ATOM 0 HG LEU B 385 6.416 8.136 -1.628 1.00 0.00 H new ATOM 0 HD11 LEU B 385 6.153 9.682 0.268 1.00 0.00 H new ATOM 0 HD12 LEU B 385 7.723 8.845 0.311 1.00 0.00 H new ATOM 0 HD13 LEU B 385 7.632 10.538 -0.230 1.00 0.00 H new ATOM 0 HD21 LEU B 385 5.066 10.183 -1.885 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.506 11.053 -2.464 1.00 0.00 H new ATOM 0 HD23 LEU B 385 5.838 9.706 -3.416 1.00 0.00 H new ATOM 1382 N HIS B 386 7.568 5.964 -4.051 1.00 0.00 N ATOM 1383 CA HIS B 386 6.630 4.846 -4.082 1.00 0.00 C ATOM 1384 C HIS B 386 7.114 3.702 -3.195 1.00 0.00 C ATOM 1385 O HIS B 386 8.206 3.766 -2.623 1.00 0.00 O ATOM 1386 CB HIS B 386 6.458 4.347 -5.516 1.00 0.00 C ATOM 1387 CG HIS B 386 7.708 3.749 -6.078 1.00 0.00 C ATOM 1388 ND1 HIS B 386 7.770 3.150 -7.319 1.00 0.00 N ATOM 1389 CD2 HIS B 386 8.951 3.660 -5.555 1.00 0.00 C ATOM 1390 CE1 HIS B 386 9.001 2.716 -7.533 1.00 0.00 C ATOM 1391 NE2 HIS B 386 9.737 3.014 -6.478 1.00 0.00 N ATOM 0 H HIS B 386 8.540 5.713 -4.230 1.00 0.00 H new ATOM 0 HA HIS B 386 5.671 5.197 -3.701 1.00 0.00 H new ATOM 0 HB2 HIS B 386 5.661 3.604 -5.544 1.00 0.00 H new ATOM 0 HB3 HIS B 386 6.142 5.176 -6.149 1.00 0.00 H new ATOM 0 HD1 HIS B 386 6.990 3.056 -7.969 1.00 0.00 H new ATOM 0 HD2 HIS B 386 9.268 4.028 -4.590 1.00 0.00 H new ATOM 0 HE1 HIS B 386 9.346 2.205 -8.420 1.00 0.00 H new ATOM 1400 N TYR B 387 6.318 2.637 -3.123 1.00 0.00 N ATOM 1401 CA TYR B 387 6.683 1.454 -2.351 1.00 0.00 C ATOM 1402 C TYR B 387 6.946 0.283 -3.296 1.00 0.00 C ATOM 1403 O TYR B 387 6.053 -0.159 -4.017 1.00 0.00 O ATOM 1404 CB TYR B 387 5.579 1.092 -1.365 1.00 0.00 C ATOM 1405 CG TYR B 387 5.326 2.168 -0.344 1.00 0.00 C ATOM 1406 CD1 TYR B 387 4.604 3.303 -0.675 1.00 0.00 C ATOM 1407 CD2 TYR B 387 5.815 2.055 0.948 1.00 0.00 C ATOM 1408 CE1 TYR B 387 4.375 4.295 0.251 1.00 0.00 C ATOM 1409 CE2 TYR B 387 5.588 3.045 1.883 1.00 0.00 C ATOM 1410 CZ TYR B 387 4.869 4.162 1.531 1.00 0.00 C ATOM 1411 OH TYR B 387 4.643 5.150 2.462 1.00 0.00 O ATOM 0 H TYR B 387 5.414 2.570 -3.592 1.00 0.00 H new ATOM 0 HA TYR B 387 7.589 1.672 -1.786 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.658 0.897 -1.915 1.00 0.00 H new ATOM 0 HB3 TYR B 387 5.846 0.168 -0.852 1.00 0.00 H new ATOM 0 HD1 TYR B 387 4.214 3.411 -1.676 1.00 0.00 H new ATOM 0 HD2 TYR B 387 6.382 1.179 1.227 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.811 5.174 -0.024 1.00 0.00 H new ATOM 0 HE2 TYR B 387 5.974 2.942 2.887 1.00 0.00 H new ATOM 0 HH TYR B 387 5.288 5.877 2.331 1.00 0.00 H new ATOM 1421 N VAL B 388 8.183 -0.197 -3.297 1.00 0.00 N ATOM 1422 CA VAL B 388 8.575 -1.300 -4.169 1.00 0.00 C ATOM 1423 C VAL B 388 8.526 -2.644 -3.443 1.00 0.00 C ATOM 1424 O VAL B 388 9.135 -2.818 -2.391 1.00 0.00 O ATOM 1425 CB VAL B 388 9.988 -1.077 -4.736 1.00 0.00 C ATOM 1426 CG1 VAL B 388 10.035 0.198 -5.563 1.00 0.00 C ATOM 1427 CG2 VAL B 388 11.015 -1.033 -3.614 1.00 0.00 C ATOM 0 H VAL B 388 8.933 0.159 -2.704 1.00 0.00 H new ATOM 0 HA VAL B 388 7.856 -1.325 -4.988 1.00 0.00 H new ATOM 0 HB VAL B 388 10.234 -1.915 -5.388 1.00 0.00 H new ATOM 0 HG11 VAL B 388 11.042 0.340 -5.956 1.00 0.00 H new ATOM 0 HG12 VAL B 388 9.330 0.121 -6.391 1.00 0.00 H new ATOM 0 HG13 VAL B 388 9.767 1.048 -4.936 1.00 0.00 H new ATOM 0 HG21 VAL B 388 12.008 -0.875 -4.035 1.00 0.00 H new ATOM 0 HG22 VAL B 388 10.775 -0.216 -2.933 1.00 0.00 H new ATOM 0 HG23 VAL B 388 10.999 -1.977 -3.069 1.00 0.00 H new ATOM 1437 N THR B 389 7.794 -3.595 -4.020 1.00 0.00 N ATOM 1438 CA THR B 389 7.661 -4.928 -3.434 1.00 0.00 C ATOM 1439 C THR B 389 8.870 -5.799 -3.761 1.00 0.00 C ATOM 1440 O THR B 389 9.106 -6.139 -4.921 1.00 0.00 O ATOM 1441 CB THR B 389 6.386 -5.633 -3.934 1.00 0.00 C ATOM 1442 OG1 THR B 389 6.261 -6.947 -3.374 1.00 0.00 O ATOM 1443 CG2 THR B 389 6.396 -5.752 -5.450 1.00 0.00 C ATOM 0 H THR B 389 7.283 -3.467 -4.894 1.00 0.00 H new ATOM 0 HA THR B 389 7.597 -4.794 -2.354 1.00 0.00 H new ATOM 0 HB THR B 389 5.540 -5.025 -3.615 1.00 0.00 H new ATOM 0 HG1 THR B 389 5.442 -7.369 -3.708 1.00 0.00 H new ATOM 0 HG21 THR B 389 5.486 -6.253 -5.782 1.00 0.00 H new ATOM 0 HG22 THR B 389 6.444 -4.757 -5.893 1.00 0.00 H new ATOM 0 HG23 THR B 389 7.264 -6.331 -5.764 1.00 0.00 H new ATOM 1451 N VAL B 390 9.639 -6.149 -2.734 1.00 0.00 N ATOM 1452 CA VAL B 390 10.830 -6.970 -2.915 1.00 0.00 C ATOM 1453 C VAL B 390 10.777 -8.261 -2.097 1.00 0.00 C ATOM 1454 O VAL B 390 10.971 -8.257 -0.876 1.00 0.00 O ATOM 1455 CB VAL B 390 12.114 -6.200 -2.542 1.00 0.00 C ATOM 1456 CG1 VAL B 390 12.953 -5.929 -3.782 1.00 0.00 C ATOM 1457 CG2 VAL B 390 11.781 -4.899 -1.825 1.00 0.00 C ATOM 0 H VAL B 390 9.458 -5.876 -1.768 1.00 0.00 H new ATOM 0 HA VAL B 390 10.853 -7.226 -3.974 1.00 0.00 H new ATOM 0 HB VAL B 390 12.695 -6.821 -1.860 1.00 0.00 H new ATOM 0 HG11 VAL B 390 13.854 -5.385 -3.500 1.00 0.00 H new ATOM 0 HG12 VAL B 390 13.231 -6.875 -4.247 1.00 0.00 H new ATOM 0 HG13 VAL B 390 12.376 -5.333 -4.489 1.00 0.00 H new ATOM 0 HG21 VAL B 390 12.704 -4.376 -1.573 1.00 0.00 H new ATOM 0 HG22 VAL B 390 11.173 -4.270 -2.476 1.00 0.00 H new ATOM 0 HG23 VAL B 390 11.227 -5.118 -0.912 1.00 0.00 H new ATOM 1467 N LYS B 391 10.489 -9.364 -2.779 1.00 0.00 N ATOM 1468 CA LYS B 391 10.407 -10.670 -2.141 1.00 0.00 C ATOM 1469 C LYS B 391 10.096 -11.745 -3.171 1.00 0.00 C ATOM 1470 O LYS B 391 9.691 -11.440 -4.292 1.00 0.00 O ATOM 1471 CB LYS B 391 9.385 -10.698 -1.012 1.00 0.00 C ATOM 1472 CG LYS B 391 9.847 -11.544 0.167 1.00 0.00 C ATOM 1473 CD LYS B 391 10.688 -10.731 1.138 1.00 0.00 C ATOM 1474 CE LYS B 391 12.051 -11.368 1.362 1.00 0.00 C ATOM 1475 NZ LYS B 391 12.103 -12.135 2.637 1.00 0.00 N ATOM 0 H LYS B 391 10.307 -9.377 -3.783 1.00 0.00 H new ATOM 0 HA LYS B 391 11.381 -10.874 -1.696 1.00 0.00 H new ATOM 0 HB2 LYS B 391 9.194 -9.680 -0.673 1.00 0.00 H new ATOM 0 HB3 LYS B 391 8.441 -11.090 -1.390 1.00 0.00 H new ATOM 0 HG2 LYS B 391 8.980 -11.951 0.687 1.00 0.00 H new ATOM 0 HG3 LYS B 391 10.427 -12.392 -0.197 1.00 0.00 H new ATOM 0 HD2 LYS B 391 10.817 -9.720 0.752 1.00 0.00 H new ATOM 0 HD3 LYS B 391 10.165 -10.644 2.090 1.00 0.00 H new ATOM 0 HE2 LYS B 391 12.283 -12.032 0.529 1.00 0.00 H new ATOM 0 HE3 LYS B 391 12.817 -10.592 1.374 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 13.048 -12.553 2.752 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 11.907 -11.497 3.434 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 11.390 -12.892 2.616 1.00 0.00 H new ATOM 1489 N LYS B 392 10.280 -13.000 -2.786 1.00 0.00 N ATOM 1490 CA LYS B 392 9.997 -14.112 -3.680 1.00 0.00 C ATOM 1491 C LYS B 392 8.729 -14.836 -3.238 1.00 0.00 C ATOM 1492 O LYS B 392 8.795 -15.879 -2.587 1.00 0.00 O ATOM 1493 CB LYS B 392 11.170 -15.094 -3.697 1.00 0.00 C ATOM 1494 CG LYS B 392 12.426 -14.535 -4.342 1.00 0.00 C ATOM 1495 CD LYS B 392 12.341 -14.587 -5.859 1.00 0.00 C ATOM 1496 CE LYS B 392 12.628 -13.229 -6.478 1.00 0.00 C ATOM 1497 NZ LYS B 392 13.346 -13.352 -7.776 1.00 0.00 N ATOM 0 H LYS B 392 10.622 -13.272 -1.865 1.00 0.00 H new ATOM 0 HA LYS B 392 9.851 -13.716 -4.685 1.00 0.00 H new ATOM 0 HB2 LYS B 392 11.399 -15.390 -2.673 1.00 0.00 H new ATOM 0 HB3 LYS B 392 10.869 -15.996 -4.230 1.00 0.00 H new ATOM 0 HG2 LYS B 392 12.575 -13.504 -4.020 1.00 0.00 H new ATOM 0 HG3 LYS B 392 13.293 -15.103 -4.005 1.00 0.00 H new ATOM 0 HD2 LYS B 392 13.053 -15.320 -6.240 1.00 0.00 H new ATOM 0 HD3 LYS B 392 11.348 -14.922 -6.158 1.00 0.00 H new ATOM 0 HE2 LYS B 392 11.691 -12.694 -6.631 1.00 0.00 H new ATOM 0 HE3 LYS B 392 13.226 -12.634 -5.787 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 13.523 -12.404 -8.166 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 14.252 -13.840 -7.627 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 12.765 -13.898 -8.444 1.00 0.00 H new ATOM 1511 N PRO B 393 7.550 -14.293 -3.589 1.00 0.00 N ATOM 1512 CA PRO B 393 6.273 -14.900 -3.225 1.00 0.00 C ATOM 1513 C PRO B 393 6.252 -16.386 -3.535 1.00 0.00 C ATOM 1514 O PRO B 393 6.365 -16.788 -4.694 1.00 0.00 O ATOM 1515 CB PRO B 393 5.258 -14.160 -4.094 1.00 0.00 C ATOM 1516 CG PRO B 393 5.885 -12.839 -4.385 1.00 0.00 C ATOM 1517 CD PRO B 393 7.377 -13.051 -4.363 1.00 0.00 C ATOM 0 HA PRO B 393 6.068 -14.818 -2.158 1.00 0.00 H new ATOM 0 HB2 PRO B 393 5.051 -14.709 -5.013 1.00 0.00 H new ATOM 0 HB3 PRO B 393 4.308 -14.039 -3.574 1.00 0.00 H new ATOM 0 HG2 PRO B 393 5.562 -12.463 -5.356 1.00 0.00 H new ATOM 0 HG3 PRO B 393 5.589 -12.098 -3.642 1.00 0.00 H new ATOM 0 HD2 PRO B 393 7.781 -13.149 -5.371 1.00 0.00 H new ATOM 0 HD3 PRO B 393 7.892 -12.213 -3.893 1.00 0.00 H new ATOM 1525 N THR B 394 6.105 -17.203 -2.502 1.00 0.00 N ATOM 1526 CA THR B 394 6.069 -18.643 -2.678 1.00 0.00 C ATOM 1527 C THR B 394 4.841 -19.235 -2.001 1.00 0.00 C ATOM 1528 O THR B 394 4.260 -18.627 -1.102 1.00 0.00 O ATOM 1529 CB THR B 394 7.334 -19.313 -2.107 1.00 0.00 C ATOM 1530 OG1 THR B 394 8.255 -18.340 -1.599 1.00 0.00 O ATOM 1531 CG2 THR B 394 8.041 -20.134 -3.174 1.00 0.00 C ATOM 0 H THR B 394 6.009 -16.891 -1.535 1.00 0.00 H new ATOM 0 HA THR B 394 6.025 -18.836 -3.750 1.00 0.00 H new ATOM 0 HB THR B 394 7.009 -19.963 -1.294 1.00 0.00 H new ATOM 0 HG1 THR B 394 7.830 -17.834 -0.875 1.00 0.00 H new ATOM 0 HG21 THR B 394 8.931 -20.597 -2.747 1.00 0.00 H new ATOM 0 HG22 THR B 394 7.369 -20.910 -3.541 1.00 0.00 H new ATOM 0 HG23 THR B 394 8.331 -19.485 -4.000 1.00 0.00 H new ATOM 1539 N ALA B 395 4.431 -20.406 -2.462 1.00 0.00 N ATOM 1540 CA ALA B 395 3.247 -21.044 -1.913 1.00 0.00 C ATOM 1541 C ALA B 395 3.335 -21.090 -0.392 1.00 0.00 C ATOM 1542 O ALA B 395 2.421 -20.643 0.301 1.00 0.00 O ATOM 1543 CB ALA B 395 3.082 -22.446 -2.474 1.00 0.00 C ATOM 0 H ALA B 395 4.894 -20.928 -3.206 1.00 0.00 H new ATOM 0 HA ALA B 395 2.374 -20.457 -2.199 1.00 0.00 H new ATOM 0 HB1 ALA B 395 2.189 -22.905 -2.049 1.00 0.00 H new ATOM 0 HB2 ALA B 395 2.983 -22.395 -3.558 1.00 0.00 H new ATOM 0 HB3 ALA B 395 3.955 -23.046 -2.217 1.00 0.00 H new ATOM 1549 N VAL B 396 4.433 -21.625 0.126 1.00 0.00 N ATOM 1550 CA VAL B 396 4.624 -21.717 1.570 1.00 0.00 C ATOM 1551 C VAL B 396 5.251 -20.440 2.125 1.00 0.00 C ATOM 1552 O VAL B 396 5.033 -20.083 3.283 1.00 0.00 O ATOM 1553 CB VAL B 396 5.506 -22.925 1.939 1.00 0.00 C ATOM 1554 CG1 VAL B 396 6.629 -23.081 0.934 1.00 0.00 C ATOM 1555 CG2 VAL B 396 6.052 -22.796 3.354 1.00 0.00 C ATOM 0 H VAL B 396 5.203 -22.001 -0.428 1.00 0.00 H new ATOM 0 HA VAL B 396 3.639 -21.850 2.017 1.00 0.00 H new ATOM 0 HB VAL B 396 4.888 -23.822 1.908 1.00 0.00 H new ATOM 0 HG11 VAL B 396 7.245 -23.938 1.207 1.00 0.00 H new ATOM 0 HG12 VAL B 396 6.209 -23.237 -0.060 1.00 0.00 H new ATOM 0 HG13 VAL B 396 7.242 -22.180 0.931 1.00 0.00 H new ATOM 0 HG21 VAL B 396 6.670 -23.663 3.586 1.00 0.00 H new ATOM 0 HG22 VAL B 396 6.654 -21.890 3.431 1.00 0.00 H new ATOM 0 HG23 VAL B 396 5.223 -22.742 4.060 1.00 0.00 H new ATOM 1565 N ASP B 397 6.029 -19.760 1.292 1.00 0.00 N ATOM 1566 CA ASP B 397 6.691 -18.524 1.696 1.00 0.00 C ATOM 1567 C ASP B 397 6.208 -17.351 0.843 1.00 0.00 C ATOM 1568 O ASP B 397 6.869 -16.949 -0.115 1.00 0.00 O ATOM 1569 CB ASP B 397 8.210 -18.691 1.581 1.00 0.00 C ATOM 1570 CG ASP B 397 8.938 -17.379 1.355 1.00 0.00 C ATOM 1571 OD1 ASP B 397 9.077 -16.603 2.325 1.00 0.00 O ATOM 1572 OD2 ASP B 397 9.369 -17.127 0.211 1.00 0.00 O ATOM 0 H ASP B 397 6.218 -20.044 0.331 1.00 0.00 H new ATOM 0 HA ASP B 397 6.438 -18.309 2.734 1.00 0.00 H new ATOM 0 HB2 ASP B 397 8.588 -19.157 2.491 1.00 0.00 H new ATOM 0 HB3 ASP B 397 8.434 -19.370 0.758 1.00 0.00 H new ATOM 1577 N PRO B 398 5.030 -16.802 1.179 1.00 0.00 N ATOM 1578 CA PRO B 398 4.427 -15.687 0.448 1.00 0.00 C ATOM 1579 C PRO B 398 4.891 -14.312 0.930 1.00 0.00 C ATOM 1580 O PRO B 398 4.963 -13.369 0.144 1.00 0.00 O ATOM 1581 CB PRO B 398 2.943 -15.876 0.740 1.00 0.00 C ATOM 1582 CG PRO B 398 2.895 -16.474 2.109 1.00 0.00 C ATOM 1583 CD PRO B 398 4.179 -17.248 2.295 1.00 0.00 C ATOM 0 HA PRO B 398 4.698 -15.701 -0.608 1.00 0.00 H new ATOM 0 HB2 PRO B 398 2.409 -14.926 0.704 1.00 0.00 H new ATOM 0 HB3 PRO B 398 2.476 -16.532 0.005 1.00 0.00 H new ATOM 0 HG2 PRO B 398 2.800 -15.696 2.867 1.00 0.00 H new ATOM 0 HG3 PRO B 398 2.030 -17.129 2.214 1.00 0.00 H new ATOM 0 HD2 PRO B 398 4.639 -17.031 3.259 1.00 0.00 H new ATOM 0 HD3 PRO B 398 4.005 -18.323 2.259 1.00 0.00 H new ATOM 1591 N ASN B 399 5.162 -14.189 2.228 1.00 0.00 N ATOM 1592 CA ASN B 399 5.568 -12.909 2.809 1.00 0.00 C ATOM 1593 C ASN B 399 6.408 -12.085 1.838 1.00 0.00 C ATOM 1594 O ASN B 399 7.026 -12.620 0.918 1.00 0.00 O ATOM 1595 CB ASN B 399 6.355 -13.142 4.101 1.00 0.00 C ATOM 1596 CG ASN B 399 7.656 -13.883 3.859 1.00 0.00 C ATOM 1597 OD1 ASN B 399 8.672 -13.163 3.399 1.00 0.00 O flip ATOM 1598 ND2 ASN B 399 7.746 -15.091 4.085 1.00 0.00 N flip ATOM 0 H ASN B 399 5.108 -14.957 2.897 1.00 0.00 H new ATOM 0 HA ASN B 399 4.660 -12.347 3.028 1.00 0.00 H new ATOM 0 HB2 ASN B 399 6.569 -12.182 4.571 1.00 0.00 H new ATOM 0 HB3 ASN B 399 5.741 -13.710 4.800 1.00 0.00 H new ATOM 0 HD21 ASN B 399 6.939 -15.605 4.438 1.00 0.00 H new ATOM 0 HD22 ASN B 399 8.627 -15.577 3.919 1.00 0.00 H new ATOM 1605 N SER B 400 6.403 -10.769 2.050 1.00 0.00 N ATOM 1606 CA SER B 400 7.145 -9.855 1.186 1.00 0.00 C ATOM 1607 C SER B 400 7.568 -8.579 1.907 1.00 0.00 C ATOM 1608 O SER B 400 6.880 -8.101 2.812 1.00 0.00 O ATOM 1609 CB SER B 400 6.303 -9.499 -0.041 1.00 0.00 C ATOM 1610 OG SER B 400 7.095 -8.882 -1.041 1.00 0.00 O ATOM 0 H SER B 400 5.895 -10.315 2.809 1.00 0.00 H new ATOM 0 HA SER B 400 8.055 -10.371 0.880 1.00 0.00 H new ATOM 0 HB2 SER B 400 5.841 -10.401 -0.443 1.00 0.00 H new ATOM 0 HB3 SER B 400 5.494 -8.830 0.251 1.00 0.00 H new ATOM 0 HG SER B 400 6.531 -8.299 -1.591 1.00 0.00 H new ATOM 1616 N ILE B 401 8.697 -8.015 1.466 1.00 0.00 N ATOM 1617 CA ILE B 401 9.213 -6.773 2.024 1.00 0.00 C ATOM 1618 C ILE B 401 9.011 -5.666 1.006 1.00 0.00 C ATOM 1619 O ILE B 401 9.041 -5.923 -0.193 1.00 0.00 O ATOM 1620 CB ILE B 401 10.708 -6.886 2.398 1.00 0.00 C ATOM 1621 CG1 ILE B 401 11.092 -5.780 3.382 1.00 0.00 C ATOM 1622 CG2 ILE B 401 11.593 -6.829 1.159 1.00 0.00 C ATOM 1623 CD1 ILE B 401 12.098 -6.222 4.422 1.00 0.00 C ATOM 0 H ILE B 401 9.270 -8.407 0.719 1.00 0.00 H new ATOM 0 HA ILE B 401 8.670 -6.551 2.943 1.00 0.00 H new ATOM 0 HB ILE B 401 10.865 -7.853 2.876 1.00 0.00 H new ATOM 0 HG12 ILE B 401 11.502 -4.936 2.827 1.00 0.00 H new ATOM 0 HG13 ILE B 401 10.193 -5.424 3.885 1.00 0.00 H new ATOM 0 HG21 ILE B 401 12.639 -6.911 1.455 1.00 0.00 H new ATOM 0 HG22 ILE B 401 11.339 -7.653 0.492 1.00 0.00 H new ATOM 0 HG23 ILE B 401 11.435 -5.882 0.642 1.00 0.00 H new ATOM 0 HD11 ILE B 401 12.325 -5.388 5.086 1.00 0.00 H new ATOM 0 HD12 ILE B 401 11.683 -7.046 5.003 1.00 0.00 H new ATOM 0 HD13 ILE B 401 13.012 -6.551 3.927 1.00 0.00 H new ATOM 1635 N VAL B 402 8.802 -4.445 1.460 1.00 0.00 N ATOM 1636 CA VAL B 402 8.601 -3.338 0.539 1.00 0.00 C ATOM 1637 C VAL B 402 9.608 -2.236 0.807 1.00 0.00 C ATOM 1638 O VAL B 402 10.036 -2.040 1.943 1.00 0.00 O ATOM 1639 CB VAL B 402 7.176 -2.754 0.625 1.00 0.00 C ATOM 1640 CG1 VAL B 402 6.565 -2.640 -0.762 1.00 0.00 C ATOM 1641 CG2 VAL B 402 6.289 -3.596 1.531 1.00 0.00 C ATOM 0 H VAL B 402 8.767 -4.194 2.448 1.00 0.00 H new ATOM 0 HA VAL B 402 8.742 -3.737 -0.466 1.00 0.00 H new ATOM 0 HB VAL B 402 7.247 -1.757 1.059 1.00 0.00 H new ATOM 0 HG11 VAL B 402 5.560 -2.226 -0.684 1.00 0.00 H new ATOM 0 HG12 VAL B 402 7.180 -1.984 -1.378 1.00 0.00 H new ATOM 0 HG13 VAL B 402 6.516 -3.628 -1.220 1.00 0.00 H new ATOM 0 HG21 VAL B 402 5.291 -3.159 1.571 1.00 0.00 H new ATOM 0 HG22 VAL B 402 6.225 -4.610 1.137 1.00 0.00 H new ATOM 0 HG23 VAL B 402 6.714 -3.622 2.534 1.00 0.00 H new ATOM 1651 N GLU B 403 9.985 -1.526 -0.248 1.00 0.00 N ATOM 1652 CA GLU B 403 10.945 -0.442 -0.139 1.00 0.00 C ATOM 1653 C GLU B 403 10.289 0.888 -0.480 1.00 0.00 C ATOM 1654 O GLU B 403 9.775 1.081 -1.580 1.00 0.00 O ATOM 1655 CB GLU B 403 12.140 -0.695 -1.058 1.00 0.00 C ATOM 1656 CG GLU B 403 13.466 -0.764 -0.320 1.00 0.00 C ATOM 1657 CD GLU B 403 14.654 -0.519 -1.229 1.00 0.00 C ATOM 1658 OE1 GLU B 403 14.497 -0.654 -2.461 1.00 0.00 O ATOM 1659 OE2 GLU B 403 15.743 -0.195 -0.709 1.00 0.00 O ATOM 0 H GLU B 403 9.637 -1.685 -1.193 1.00 0.00 H new ATOM 0 HA GLU B 403 11.300 -0.399 0.891 1.00 0.00 H new ATOM 0 HB2 GLU B 403 11.983 -1.630 -1.596 1.00 0.00 H new ATOM 0 HB3 GLU B 403 12.189 0.098 -1.804 1.00 0.00 H new ATOM 0 HG2 GLU B 403 13.469 -0.026 0.483 1.00 0.00 H new ATOM 0 HG3 GLU B 403 13.567 -1.744 0.147 1.00 0.00 H new ATOM 1666 N CYS B 404 10.332 1.804 0.472 1.00 0.00 N ATOM 1667 CA CYS B 404 9.764 3.126 0.289 1.00 0.00 C ATOM 1668 C CYS B 404 10.884 4.119 0.026 1.00 0.00 C ATOM 1669 O CYS B 404 11.689 4.415 0.921 1.00 0.00 O ATOM 1670 CB CYS B 404 8.949 3.530 1.522 1.00 0.00 C ATOM 1671 SG CYS B 404 8.899 5.308 1.853 1.00 0.00 S ATOM 0 H CYS B 404 10.758 1.653 1.386 1.00 0.00 H new ATOM 0 HA CYS B 404 9.090 3.120 -0.567 1.00 0.00 H new ATOM 0 HB2 CYS B 404 7.928 3.169 1.399 1.00 0.00 H new ATOM 0 HB3 CYS B 404 9.363 3.024 2.395 1.00 0.00 H new ATOM 0 HG CYS B 404 8.367 5.517 3.021 1.00 0.00 H new ATOM 1677 N ARG B 405 10.944 4.604 -1.216 1.00 0.00 N ATOM 1678 CA ARG B 405 11.980 5.545 -1.624 1.00 0.00 C ATOM 1679 C ARG B 405 11.426 6.615 -2.564 1.00 0.00 C ATOM 1680 O ARG B 405 10.238 6.604 -2.900 1.00 0.00 O ATOM 1681 CB ARG B 405 13.121 4.796 -2.311 1.00 0.00 C ATOM 1682 CG ARG B 405 12.708 4.125 -3.611 1.00 0.00 C ATOM 1683 CD ARG B 405 13.595 4.556 -4.769 1.00 0.00 C ATOM 1684 NE ARG B 405 13.048 4.143 -6.059 1.00 0.00 N ATOM 1685 CZ ARG B 405 13.140 2.905 -6.536 1.00 0.00 C ATOM 1686 NH1 ARG B 405 13.758 1.966 -5.835 1.00 0.00 N ATOM 1687 NH2 ARG B 405 12.614 2.607 -7.716 1.00 0.00 N ATOM 0 H ARG B 405 10.285 4.358 -1.955 1.00 0.00 H new ATOM 0 HA ARG B 405 12.353 6.042 -0.728 1.00 0.00 H new ATOM 0 HB2 ARG B 405 13.934 5.494 -2.513 1.00 0.00 H new ATOM 0 HB3 ARG B 405 13.512 4.041 -1.629 1.00 0.00 H new ATOM 0 HG2 ARG B 405 12.760 3.042 -3.495 1.00 0.00 H new ATOM 0 HG3 ARG B 405 11.670 4.372 -3.835 1.00 0.00 H new ATOM 0 HD2 ARG B 405 13.710 5.640 -4.754 1.00 0.00 H new ATOM 0 HD3 ARG B 405 14.590 4.128 -4.643 1.00 0.00 H new ATOM 0 HE ARG B 405 12.569 4.843 -6.625 1.00 0.00 H new ATOM 0 HH11 ARG B 405 14.165 2.192 -4.927 1.00 0.00 H new ATOM 0 HH12 ARG B 405 13.827 1.017 -6.203 1.00 0.00 H new ATOM 0 HH21 ARG B 405 12.138 3.328 -8.259 1.00 0.00 H new ATOM 0 HH22 ARG B 405 12.685 1.657 -8.081 1.00 0.00 H new ATOM 1701 N VAL B 406 12.297 7.540 -2.984 1.00 0.00 N ATOM 1702 CA VAL B 406 11.901 8.624 -3.878 1.00 0.00 C ATOM 1703 C VAL B 406 12.756 8.659 -5.146 1.00 0.00 C ATOM 1704 O VAL B 406 13.951 8.353 -5.118 1.00 0.00 O ATOM 1705 CB VAL B 406 11.995 9.990 -3.169 1.00 0.00 C ATOM 1706 CG1 VAL B 406 11.465 9.890 -1.747 1.00 0.00 C ATOM 1707 CG2 VAL B 406 13.428 10.507 -3.172 1.00 0.00 C ATOM 0 H VAL B 406 13.281 7.556 -2.716 1.00 0.00 H new ATOM 0 HA VAL B 406 10.866 8.431 -4.161 1.00 0.00 H new ATOM 0 HB VAL B 406 11.378 10.701 -3.719 1.00 0.00 H new ATOM 0 HG11 VAL B 406 11.539 10.863 -1.262 1.00 0.00 H new ATOM 0 HG12 VAL B 406 10.422 9.574 -1.769 1.00 0.00 H new ATOM 0 HG13 VAL B 406 12.053 9.161 -1.190 1.00 0.00 H new ATOM 0 HG21 VAL B 406 13.468 11.472 -2.666 1.00 0.00 H new ATOM 0 HG22 VAL B 406 14.072 9.798 -2.652 1.00 0.00 H new ATOM 0 HG23 VAL B 406 13.771 10.622 -4.200 1.00 0.00 H new ATOM 1717 N GLY B 407 12.119 9.032 -6.255 1.00 0.00 N ATOM 1718 CA GLY B 407 12.794 9.105 -7.540 1.00 0.00 C ATOM 1719 C GLY B 407 14.271 9.440 -7.437 1.00 0.00 C ATOM 1720 O GLY B 407 15.079 8.933 -8.216 1.00 0.00 O ATOM 0 H GLY B 407 11.132 9.288 -6.284 1.00 0.00 H new ATOM 0 HA2 GLY B 407 12.682 8.150 -8.053 1.00 0.00 H new ATOM 0 HA3 GLY B 407 12.302 9.858 -8.156 1.00 0.00 H new ATOM 1724 N ASP B 408 14.629 10.308 -6.495 1.00 0.00 N ATOM 1725 CA ASP B 408 16.023 10.724 -6.319 1.00 0.00 C ATOM 1726 C ASP B 408 16.911 9.614 -5.743 1.00 0.00 C ATOM 1727 O ASP B 408 18.042 9.876 -5.337 1.00 0.00 O ATOM 1728 CB ASP B 408 16.088 11.955 -5.414 1.00 0.00 C ATOM 1729 CG ASP B 408 17.480 12.553 -5.351 1.00 0.00 C ATOM 1730 OD1 ASP B 408 17.934 13.108 -6.373 1.00 0.00 O ATOM 1731 OD2 ASP B 408 18.115 12.465 -4.280 1.00 0.00 O ATOM 0 H ASP B 408 13.976 10.739 -5.841 1.00 0.00 H new ATOM 0 HA ASP B 408 16.409 10.961 -7.310 1.00 0.00 H new ATOM 0 HB2 ASP B 408 15.388 12.707 -5.778 1.00 0.00 H new ATOM 0 HB3 ASP B 408 15.767 11.681 -4.409 1.00 0.00 H new ATOM 1736 N GLY B 409 16.413 8.381 -5.717 1.00 0.00 N ATOM 1737 CA GLY B 409 17.202 7.280 -5.198 1.00 0.00 C ATOM 1738 C GLY B 409 17.344 7.319 -3.690 1.00 0.00 C ATOM 1739 O GLY B 409 18.401 6.987 -3.153 1.00 0.00 O ATOM 0 H GLY B 409 15.481 8.126 -6.045 1.00 0.00 H new ATOM 0 HA2 GLY B 409 16.739 6.338 -5.490 1.00 0.00 H new ATOM 0 HA3 GLY B 409 18.193 7.303 -5.652 1.00 0.00 H new ATOM 1743 N THR B 410 16.280 7.720 -3.004 1.00 0.00 N ATOM 1744 CA THR B 410 16.298 7.790 -1.548 1.00 0.00 C ATOM 1745 C THR B 410 15.292 6.822 -0.948 1.00 0.00 C ATOM 1746 O THR B 410 14.090 7.002 -1.101 1.00 0.00 O ATOM 1747 CB THR B 410 15.978 9.219 -1.059 1.00 0.00 C ATOM 1748 OG1 THR B 410 17.091 10.101 -1.259 1.00 0.00 O ATOM 1749 CG2 THR B 410 15.618 9.231 0.420 1.00 0.00 C ATOM 0 H THR B 410 15.397 8.001 -3.431 1.00 0.00 H new ATOM 0 HA THR B 410 17.301 7.516 -1.221 1.00 0.00 H new ATOM 0 HB THR B 410 15.127 9.564 -1.646 1.00 0.00 H new ATOM 0 HG1 THR B 410 16.858 10.999 -0.942 1.00 0.00 H new ATOM 0 HG21 THR B 410 15.398 10.252 0.733 1.00 0.00 H new ATOM 0 HG22 THR B 410 14.742 8.604 0.586 1.00 0.00 H new ATOM 0 HG23 THR B 410 16.456 8.846 1.001 1.00 0.00 H new ATOM 1757 N VAL B 411 15.790 5.805 -0.247 1.00 0.00 N ATOM 1758 CA VAL B 411 14.924 4.819 0.388 1.00 0.00 C ATOM 1759 C VAL B 411 14.975 4.958 1.898 1.00 0.00 C ATOM 1760 O VAL B 411 16.012 4.719 2.519 1.00 0.00 O ATOM 1761 CB VAL B 411 15.324 3.376 0.022 1.00 0.00 C ATOM 1762 CG1 VAL B 411 14.202 2.408 0.374 1.00 0.00 C ATOM 1763 CG2 VAL B 411 15.691 3.275 -1.451 1.00 0.00 C ATOM 0 H VAL B 411 16.787 5.644 -0.106 1.00 0.00 H new ATOM 0 HA VAL B 411 13.915 5.010 0.022 1.00 0.00 H new ATOM 0 HB VAL B 411 16.204 3.103 0.604 1.00 0.00 H new ATOM 0 HG11 VAL B 411 14.500 1.394 0.109 1.00 0.00 H new ATOM 0 HG12 VAL B 411 13.999 2.459 1.444 1.00 0.00 H new ATOM 0 HG13 VAL B 411 13.302 2.677 -0.179 1.00 0.00 H new ATOM 0 HG21 VAL B 411 15.970 2.248 -1.687 1.00 0.00 H new ATOM 0 HG22 VAL B 411 14.836 3.568 -2.060 1.00 0.00 H new ATOM 0 HG23 VAL B 411 16.531 3.937 -1.663 1.00 0.00 H new ATOM 1773 N LEU B 412 13.854 5.333 2.488 1.00 0.00 N ATOM 1774 CA LEU B 412 13.782 5.484 3.931 1.00 0.00 C ATOM 1775 C LEU B 412 12.497 4.889 4.486 1.00 0.00 C ATOM 1776 O LEU B 412 11.982 5.350 5.505 1.00 0.00 O ATOM 1777 CB LEU B 412 13.927 6.957 4.355 1.00 0.00 C ATOM 1778 CG LEU B 412 12.920 7.960 3.770 1.00 0.00 C ATOM 1779 CD1 LEU B 412 13.514 8.682 2.576 1.00 0.00 C ATOM 1780 CD2 LEU B 412 11.610 7.290 3.387 1.00 0.00 C ATOM 0 H LEU B 412 12.985 5.538 1.994 1.00 0.00 H new ATOM 0 HA LEU B 412 14.621 4.932 4.354 1.00 0.00 H new ATOM 0 HB2 LEU B 412 13.858 7.004 5.442 1.00 0.00 H new ATOM 0 HB3 LEU B 412 14.930 7.289 4.085 1.00 0.00 H new ATOM 0 HG LEU B 412 12.701 8.690 4.549 1.00 0.00 H new ATOM 0 HD11 LEU B 412 12.785 9.387 2.177 1.00 0.00 H new ATOM 0 HD12 LEU B 412 14.409 9.222 2.886 1.00 0.00 H new ATOM 0 HD13 LEU B 412 13.776 7.957 1.806 1.00 0.00 H new ATOM 0 HD21 LEU B 412 10.927 8.034 2.978 1.00 0.00 H new ATOM 0 HD22 LEU B 412 11.800 6.521 2.638 1.00 0.00 H new ATOM 0 HD23 LEU B 412 11.163 6.834 4.270 1.00 0.00 H new ATOM 1792 N GLY B 413 11.992 3.838 3.837 1.00 0.00 N ATOM 1793 CA GLY B 413 10.788 3.190 4.318 1.00 0.00 C ATOM 1794 C GLY B 413 10.679 1.749 3.841 1.00 0.00 C ATOM 1795 O GLY B 413 11.323 1.357 2.872 1.00 0.00 O ATOM 0 H GLY B 413 12.395 3.429 2.994 1.00 0.00 H new ATOM 0 HA2 GLY B 413 10.777 3.212 5.408 1.00 0.00 H new ATOM 0 HA3 GLY B 413 9.916 3.750 3.979 1.00 0.00 H new ATOM 1799 N THR B 414 9.848 0.966 4.522 1.00 0.00 N ATOM 1800 CA THR B 414 9.634 -0.433 4.147 1.00 0.00 C ATOM 1801 C THR B 414 8.415 -1.033 4.818 1.00 0.00 C ATOM 1802 O THR B 414 7.937 -0.537 5.833 1.00 0.00 O ATOM 1803 CB THR B 414 10.844 -1.341 4.448 1.00 0.00 C ATOM 1804 OG1 THR B 414 10.457 -2.721 4.470 1.00 0.00 O ATOM 1805 CG2 THR B 414 11.469 -1.007 5.790 1.00 0.00 C ATOM 0 H THR B 414 9.312 1.272 5.334 1.00 0.00 H new ATOM 0 HA THR B 414 9.482 -0.398 3.068 1.00 0.00 H new ATOM 0 HB THR B 414 11.569 -1.167 3.653 1.00 0.00 H new ATOM 0 HG1 THR B 414 10.237 -3.014 3.561 1.00 0.00 H new ATOM 0 HG21 THR B 414 12.319 -1.666 5.970 1.00 0.00 H new ATOM 0 HG22 THR B 414 11.808 0.029 5.786 1.00 0.00 H new ATOM 0 HG23 THR B 414 10.730 -1.144 6.580 1.00 0.00 H new ATOM 1813 N GLY B 415 7.939 -2.133 4.251 1.00 0.00 N ATOM 1814 CA GLY B 415 6.798 -2.832 4.807 1.00 0.00 C ATOM 1815 C GLY B 415 6.952 -4.329 4.653 1.00 0.00 C ATOM 1816 O GLY B 415 7.247 -4.816 3.565 1.00 0.00 O ATOM 0 H GLY B 415 8.327 -2.557 3.408 1.00 0.00 H new ATOM 0 HA2 GLY B 415 6.692 -2.580 5.862 1.00 0.00 H new ATOM 0 HA3 GLY B 415 5.887 -2.503 4.307 1.00 0.00 H new ATOM 1820 N VAL B 416 6.763 -5.072 5.731 1.00 0.00 N ATOM 1821 CA VAL B 416 6.897 -6.516 5.681 1.00 0.00 C ATOM 1822 C VAL B 416 5.594 -7.186 6.098 1.00 0.00 C ATOM 1823 O VAL B 416 4.903 -6.708 6.998 1.00 0.00 O ATOM 1824 CB VAL B 416 8.040 -6.988 6.598 1.00 0.00 C ATOM 1825 CG1 VAL B 416 8.632 -8.292 6.093 1.00 0.00 C ATOM 1826 CG2 VAL B 416 9.112 -5.915 6.704 1.00 0.00 C ATOM 0 H VAL B 416 6.517 -4.699 6.648 1.00 0.00 H new ATOM 0 HA VAL B 416 7.130 -6.799 4.654 1.00 0.00 H new ATOM 0 HB VAL B 416 7.632 -7.166 7.593 1.00 0.00 H new ATOM 0 HG11 VAL B 416 9.438 -8.607 6.756 1.00 0.00 H new ATOM 0 HG12 VAL B 416 7.858 -9.059 6.073 1.00 0.00 H new ATOM 0 HG13 VAL B 416 9.026 -8.147 5.087 1.00 0.00 H new ATOM 0 HG21 VAL B 416 9.913 -6.264 7.356 1.00 0.00 H new ATOM 0 HG22 VAL B 416 9.516 -5.705 5.714 1.00 0.00 H new ATOM 0 HG23 VAL B 416 8.677 -5.006 7.119 1.00 0.00 H new ATOM 1836 N GLY B 417 5.256 -8.294 5.445 1.00 0.00 N ATOM 1837 CA GLY B 417 4.029 -8.995 5.778 1.00 0.00 C ATOM 1838 C GLY B 417 4.024 -10.426 5.279 1.00 0.00 C ATOM 1839 O GLY B 417 4.867 -10.813 4.470 1.00 0.00 O ATOM 0 H GLY B 417 5.805 -8.716 4.697 1.00 0.00 H new ATOM 0 HA2 GLY B 417 3.894 -8.990 6.860 1.00 0.00 H new ATOM 0 HA3 GLY B 417 3.181 -8.461 5.349 1.00 0.00 H new ATOM 1843 N ARG B 418 3.076 -11.218 5.770 1.00 0.00 N ATOM 1844 CA ARG B 418 2.966 -12.617 5.378 1.00 0.00 C ATOM 1845 C ARG B 418 2.297 -12.761 4.014 1.00 0.00 C ATOM 1846 O ARG B 418 2.781 -13.490 3.148 1.00 0.00 O ATOM 1847 CB ARG B 418 2.172 -13.397 6.427 1.00 0.00 C ATOM 1848 CG ARG B 418 2.136 -12.724 7.790 1.00 0.00 C ATOM 1849 CD ARG B 418 3.528 -12.316 8.249 1.00 0.00 C ATOM 1850 NE ARG B 418 3.827 -12.807 9.590 1.00 0.00 N ATOM 1851 CZ ARG B 418 4.027 -14.089 9.876 1.00 0.00 C ATOM 1852 NH1 ARG B 418 3.970 -15.000 8.914 1.00 0.00 N ATOM 1853 NH2 ARG B 418 4.286 -14.461 11.122 1.00 0.00 N ATOM 0 H ARG B 418 2.372 -10.913 6.442 1.00 0.00 H new ATOM 0 HA ARG B 418 3.975 -13.024 5.308 1.00 0.00 H new ATOM 0 HB2 ARG B 418 1.151 -13.532 6.071 1.00 0.00 H new ATOM 0 HB3 ARG B 418 2.606 -14.391 6.534 1.00 0.00 H new ATOM 0 HG2 ARG B 418 1.494 -11.844 7.745 1.00 0.00 H new ATOM 0 HG3 ARG B 418 1.696 -13.403 8.520 1.00 0.00 H new ATOM 0 HD2 ARG B 418 4.268 -12.702 7.548 1.00 0.00 H new ATOM 0 HD3 ARG B 418 3.611 -11.229 8.234 1.00 0.00 H new ATOM 0 HE ARG B 418 3.886 -12.129 10.350 1.00 0.00 H new ATOM 0 HH11 ARG B 418 3.773 -14.717 7.954 1.00 0.00 H new ATOM 0 HH12 ARG B 418 4.124 -15.984 9.134 1.00 0.00 H new ATOM 0 HH21 ARG B 418 4.332 -13.762 11.864 1.00 0.00 H new ATOM 0 HH22 ARG B 418 4.439 -15.446 11.339 1.00 0.00 H new ATOM 1867 N ASN B 419 1.179 -12.064 3.828 1.00 0.00 N ATOM 1868 CA ASN B 419 0.443 -12.123 2.568 1.00 0.00 C ATOM 1869 C ASN B 419 0.679 -10.870 1.734 1.00 0.00 C ATOM 1870 O ASN B 419 -0.142 -10.515 0.889 1.00 0.00 O ATOM 1871 CB ASN B 419 -1.057 -12.290 2.832 1.00 0.00 C ATOM 1872 CG ASN B 419 -1.434 -11.996 4.271 1.00 0.00 C ATOM 1873 OD1 ASN B 419 -1.953 -10.799 4.514 1.00 0.00 O flip ATOM 1874 ND2 ASN B 419 -1.263 -12.837 5.153 1.00 0.00 N flip ATOM 0 H ASN B 419 0.764 -11.453 4.532 1.00 0.00 H new ATOM 0 HA ASN B 419 0.809 -12.985 2.010 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -1.614 -11.625 2.172 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -1.354 -13.309 2.584 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -0.861 -13.745 4.921 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -1.524 -12.626 6.116 1.00 0.00 H new ATOM 1881 N ILE B 420 1.808 -10.210 1.971 1.00 0.00 N ATOM 1882 CA ILE B 420 2.170 -8.994 1.242 1.00 0.00 C ATOM 1883 C ILE B 420 1.391 -7.768 1.737 1.00 0.00 C ATOM 1884 O ILE B 420 1.946 -6.672 1.818 1.00 0.00 O ATOM 1885 CB ILE B 420 1.995 -9.171 -0.289 1.00 0.00 C ATOM 1886 CG1 ILE B 420 0.640 -8.649 -0.776 1.00 0.00 C ATOM 1887 CG2 ILE B 420 2.161 -10.632 -0.671 1.00 0.00 C ATOM 1888 CD1 ILE B 420 0.703 -7.259 -1.367 1.00 0.00 C ATOM 0 H ILE B 420 2.495 -10.498 2.668 1.00 0.00 H new ATOM 0 HA ILE B 420 3.226 -8.816 1.444 1.00 0.00 H new ATOM 0 HB ILE B 420 2.769 -8.579 -0.777 1.00 0.00 H new ATOM 0 HG12 ILE B 420 0.244 -9.335 -1.524 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -0.061 -8.648 0.059 1.00 0.00 H new ATOM 0 HG21 ILE B 420 2.036 -10.743 -1.748 1.00 0.00 H new ATOM 0 HG22 ILE B 420 3.156 -10.972 -0.384 1.00 0.00 H new ATOM 0 HG23 ILE B 420 1.410 -11.231 -0.155 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -0.293 -6.956 -1.690 1.00 0.00 H new ATOM 0 HD12 ILE B 420 1.069 -6.560 -0.615 1.00 0.00 H new ATOM 0 HD13 ILE B 420 1.378 -7.258 -2.223 1.00 0.00 H new ATOM 1900 N LYS B 421 0.111 -7.944 2.066 1.00 0.00 N ATOM 1901 CA LYS B 421 -0.688 -6.822 2.541 1.00 0.00 C ATOM 1902 C LYS B 421 0.071 -6.098 3.639 1.00 0.00 C ATOM 1903 O LYS B 421 0.395 -4.918 3.502 1.00 0.00 O ATOM 1904 CB LYS B 421 -2.043 -7.303 3.061 1.00 0.00 C ATOM 1905 CG LYS B 421 -3.161 -7.185 2.040 1.00 0.00 C ATOM 1906 CD LYS B 421 -2.846 -7.972 0.780 1.00 0.00 C ATOM 1907 CE LYS B 421 -4.046 -8.782 0.317 1.00 0.00 C ATOM 1908 NZ LYS B 421 -3.874 -9.287 -1.074 1.00 0.00 N ATOM 0 H LYS B 421 -0.384 -8.834 2.013 1.00 0.00 H new ATOM 0 HA LYS B 421 -0.870 -6.138 1.712 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -1.955 -8.344 3.373 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -2.309 -6.726 3.947 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -4.092 -7.548 2.474 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -3.315 -6.136 1.787 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -2.540 -7.288 -0.011 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -2.005 -8.640 0.967 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -4.198 -9.624 0.992 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -4.943 -8.165 0.371 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -4.714 -9.834 -1.351 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -3.755 -8.483 -1.723 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -3.033 -9.897 -1.120 1.00 0.00 H new ATOM 1922 N ILE B 422 0.372 -6.805 4.726 1.00 0.00 N ATOM 1923 CA ILE B 422 1.115 -6.185 5.816 1.00 0.00 C ATOM 1924 C ILE B 422 2.357 -5.546 5.237 1.00 0.00 C ATOM 1925 O ILE B 422 2.845 -4.537 5.725 1.00 0.00 O ATOM 1926 CB ILE B 422 1.541 -7.178 6.925 1.00 0.00 C ATOM 1927 CG1 ILE B 422 0.874 -8.541 6.749 1.00 0.00 C ATOM 1928 CG2 ILE B 422 1.214 -6.604 8.295 1.00 0.00 C ATOM 1929 CD1 ILE B 422 -0.633 -8.495 6.856 1.00 0.00 C ATOM 0 H ILE B 422 0.120 -7.782 4.873 1.00 0.00 H new ATOM 0 HA ILE B 422 0.452 -5.457 6.284 1.00 0.00 H new ATOM 0 HB ILE B 422 2.618 -7.325 6.844 1.00 0.00 H new ATOM 0 HG12 ILE B 422 1.149 -8.948 5.776 1.00 0.00 H new ATOM 0 HG13 ILE B 422 1.263 -9.226 7.502 1.00 0.00 H new ATOM 0 HG21 ILE B 422 1.518 -7.311 9.067 1.00 0.00 H new ATOM 0 HG22 ILE B 422 1.748 -5.664 8.433 1.00 0.00 H new ATOM 0 HG23 ILE B 422 0.141 -6.426 8.368 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -1.038 -9.498 6.721 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -0.917 -8.118 7.839 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -1.032 -7.835 6.086 1.00 0.00 H new ATOM 1941 N ALA B 423 2.828 -6.121 4.146 1.00 0.00 N ATOM 1942 CA ALA B 423 3.979 -5.581 3.457 1.00 0.00 C ATOM 1943 C ALA B 423 3.601 -4.225 2.882 1.00 0.00 C ATOM 1944 O ALA B 423 4.233 -3.208 3.172 1.00 0.00 O ATOM 1945 CB ALA B 423 4.448 -6.524 2.361 1.00 0.00 C ATOM 0 H ALA B 423 2.431 -6.959 3.721 1.00 0.00 H new ATOM 0 HA ALA B 423 4.806 -5.466 4.157 1.00 0.00 H new ATOM 0 HB1 ALA B 423 5.315 -6.095 1.858 1.00 0.00 H new ATOM 0 HB2 ALA B 423 4.721 -7.484 2.799 1.00 0.00 H new ATOM 0 HB3 ALA B 423 3.645 -6.670 1.639 1.00 0.00 H new ATOM 1951 N GLY B 424 2.544 -4.228 2.075 1.00 0.00 N ATOM 1952 CA GLY B 424 2.061 -3.008 1.465 1.00 0.00 C ATOM 1953 C GLY B 424 1.594 -1.972 2.475 1.00 0.00 C ATOM 1954 O GLY B 424 2.061 -0.829 2.464 1.00 0.00 O ATOM 0 H GLY B 424 2.011 -5.063 1.833 1.00 0.00 H new ATOM 0 HA2 GLY B 424 2.854 -2.577 0.854 1.00 0.00 H new ATOM 0 HA3 GLY B 424 1.236 -3.248 0.794 1.00 0.00 H new ATOM 1958 N ILE B 425 0.662 -2.359 3.346 1.00 0.00 N ATOM 1959 CA ILE B 425 0.142 -1.425 4.340 1.00 0.00 C ATOM 1960 C ILE B 425 1.213 -1.056 5.361 1.00 0.00 C ATOM 1961 O ILE B 425 1.540 0.119 5.521 1.00 0.00 O ATOM 1962 CB ILE B 425 -1.074 -2.020 5.076 1.00 0.00 C ATOM 1963 CG1 ILE B 425 -2.132 -2.477 4.069 1.00 0.00 C ATOM 1964 CG2 ILE B 425 -1.661 -1.005 6.045 1.00 0.00 C ATOM 1965 CD1 ILE B 425 -2.564 -3.916 4.255 1.00 0.00 C ATOM 0 H ILE B 425 0.259 -3.295 3.383 1.00 0.00 H new ATOM 0 HA ILE B 425 -0.167 -0.526 3.806 1.00 0.00 H new ATOM 0 HB ILE B 425 -0.743 -2.887 5.648 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -3.005 -1.830 4.154 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -1.739 -2.352 3.060 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -2.519 -1.443 6.555 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -0.906 -0.724 6.779 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -1.979 -0.119 5.495 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -3.315 -4.170 3.507 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -1.701 -4.572 4.141 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -2.987 -4.043 5.251 1.00 0.00 H new ATOM 1977 N ARG B 426 1.739 -2.048 6.075 1.00 0.00 N ATOM 1978 CA ARG B 426 2.741 -1.763 7.095 1.00 0.00 C ATOM 1979 C ARG B 426 3.876 -0.938 6.495 1.00 0.00 C ATOM 1980 O ARG B 426 4.528 -0.170 7.201 1.00 0.00 O ATOM 1981 CB ARG B 426 3.264 -3.048 7.760 1.00 0.00 C ATOM 1982 CG ARG B 426 4.614 -3.526 7.245 1.00 0.00 C ATOM 1983 CD ARG B 426 5.725 -3.224 8.239 1.00 0.00 C ATOM 1984 NE ARG B 426 5.854 -4.272 9.249 1.00 0.00 N ATOM 1985 CZ ARG B 426 6.344 -4.065 10.467 1.00 0.00 C ATOM 1986 NH1 ARG B 426 6.747 -2.855 10.826 1.00 0.00 N ATOM 1987 NH2 ARG B 426 6.430 -5.070 11.328 1.00 0.00 N ATOM 0 H ARG B 426 1.495 -3.033 5.970 1.00 0.00 H new ATOM 0 HA ARG B 426 2.268 -1.178 7.884 1.00 0.00 H new ATOM 0 HB2 ARG B 426 3.339 -2.880 8.834 1.00 0.00 H new ATOM 0 HB3 ARG B 426 2.532 -3.842 7.611 1.00 0.00 H new ATOM 0 HG2 ARG B 426 4.574 -4.599 7.056 1.00 0.00 H new ATOM 0 HG3 ARG B 426 4.834 -3.043 6.293 1.00 0.00 H new ATOM 0 HD2 ARG B 426 6.669 -3.116 7.706 1.00 0.00 H new ATOM 0 HD3 ARG B 426 5.525 -2.271 8.729 1.00 0.00 H new ATOM 0 HE ARG B 426 5.551 -5.215 9.006 1.00 0.00 H new ATOM 0 HH11 ARG B 426 6.682 -2.079 10.167 1.00 0.00 H new ATOM 0 HH12 ARG B 426 7.123 -2.699 11.761 1.00 0.00 H new ATOM 0 HH21 ARG B 426 6.120 -6.003 11.056 1.00 0.00 H new ATOM 0 HH22 ARG B 426 6.806 -4.910 12.263 1.00 0.00 H new ATOM 2001 N ALA B 427 4.079 -1.053 5.179 1.00 0.00 N ATOM 2002 CA ALA B 427 5.103 -0.254 4.518 1.00 0.00 C ATOM 2003 C ALA B 427 4.708 1.209 4.625 1.00 0.00 C ATOM 2004 O ALA B 427 5.471 2.052 5.103 1.00 0.00 O ATOM 2005 CB ALA B 427 5.264 -0.647 3.056 1.00 0.00 C ATOM 0 H ALA B 427 3.558 -1.679 4.565 1.00 0.00 H new ATOM 0 HA ALA B 427 6.062 -0.429 5.006 1.00 0.00 H new ATOM 0 HB1 ALA B 427 6.036 -0.030 2.596 1.00 0.00 H new ATOM 0 HB2 ALA B 427 5.552 -1.696 2.991 1.00 0.00 H new ATOM 0 HB3 ALA B 427 4.320 -0.497 2.533 1.00 0.00 H new ATOM 2011 N ALA B 428 3.483 1.491 4.199 1.00 0.00 N ATOM 2012 CA ALA B 428 2.957 2.843 4.272 1.00 0.00 C ATOM 2013 C ALA B 428 3.094 3.347 5.704 1.00 0.00 C ATOM 2014 O ALA B 428 3.592 4.448 5.950 1.00 0.00 O ATOM 2015 CB ALA B 428 1.505 2.892 3.819 1.00 0.00 C ATOM 0 H ALA B 428 2.841 0.805 3.802 1.00 0.00 H new ATOM 0 HA ALA B 428 3.526 3.487 3.601 1.00 0.00 H new ATOM 0 HB1 ALA B 428 1.138 3.916 3.884 1.00 0.00 H new ATOM 0 HB2 ALA B 428 1.434 2.546 2.788 1.00 0.00 H new ATOM 0 HB3 ALA B 428 0.902 2.249 4.460 1.00 0.00 H new ATOM 2021 N GLU B 429 2.672 2.509 6.650 1.00 0.00 N ATOM 2022 CA GLU B 429 2.765 2.838 8.066 1.00 0.00 C ATOM 2023 C GLU B 429 4.210 3.112 8.448 1.00 0.00 C ATOM 2024 O GLU B 429 4.487 3.899 9.354 1.00 0.00 O ATOM 2025 CB GLU B 429 2.231 1.686 8.914 1.00 0.00 C ATOM 2026 CG GLU B 429 0.724 1.713 9.104 1.00 0.00 C ATOM 2027 CD GLU B 429 -0.023 1.122 7.927 1.00 0.00 C ATOM 2028 OE1 GLU B 429 0.223 1.564 6.786 1.00 0.00 O ATOM 2029 OE2 GLU B 429 -0.855 0.218 8.148 1.00 0.00 O ATOM 0 H GLU B 429 2.262 1.595 6.457 1.00 0.00 H new ATOM 0 HA GLU B 429 2.166 3.730 8.250 1.00 0.00 H new ATOM 0 HB2 GLU B 429 2.512 0.742 8.447 1.00 0.00 H new ATOM 0 HB3 GLU B 429 2.712 1.713 9.892 1.00 0.00 H new ATOM 0 HG2 GLU B 429 0.466 1.161 10.008 1.00 0.00 H new ATOM 0 HG3 GLU B 429 0.399 2.742 9.256 1.00 0.00 H new ATOM 2036 N ASN B 430 5.132 2.468 7.739 1.00 0.00 N ATOM 2037 CA ASN B 430 6.545 2.660 7.998 1.00 0.00 C ATOM 2038 C ASN B 430 6.923 4.103 7.715 1.00 0.00 C ATOM 2039 O ASN B 430 7.612 4.740 8.508 1.00 0.00 O ATOM 2040 CB ASN B 430 7.386 1.704 7.163 1.00 0.00 C ATOM 2041 CG ASN B 430 8.123 0.708 8.031 1.00 0.00 C ATOM 2042 OD1 ASN B 430 9.342 0.563 7.937 1.00 0.00 O ATOM 2043 ND2 ASN B 430 7.378 0.016 8.881 1.00 0.00 N ATOM 0 H ASN B 430 4.922 1.813 6.986 1.00 0.00 H new ATOM 0 HA ASN B 430 6.744 2.442 9.047 1.00 0.00 H new ATOM 0 HB2 ASN B 430 6.744 1.171 6.462 1.00 0.00 H new ATOM 0 HB3 ASN B 430 8.103 2.272 6.570 1.00 0.00 H new ATOM 0 HD21 ASN B 430 7.812 -0.673 9.495 1.00 0.00 H new ATOM 0 HD22 ASN B 430 6.371 0.173 8.921 1.00 0.00 H new ATOM 2050 N ALA B 431 6.437 4.638 6.600 1.00 0.00 N ATOM 2051 CA ALA B 431 6.710 6.028 6.282 1.00 0.00 C ATOM 2052 C ALA B 431 6.195 6.880 7.431 1.00 0.00 C ATOM 2053 O ALA B 431 6.859 7.817 7.878 1.00 0.00 O ATOM 2054 CB ALA B 431 6.073 6.445 4.965 1.00 0.00 C ATOM 0 H ALA B 431 5.865 4.141 5.917 1.00 0.00 H new ATOM 0 HA ALA B 431 7.784 6.168 6.158 1.00 0.00 H new ATOM 0 HB1 ALA B 431 6.302 7.492 4.765 1.00 0.00 H new ATOM 0 HB2 ALA B 431 6.467 5.827 4.158 1.00 0.00 H new ATOM 0 HB3 ALA B 431 4.992 6.315 5.026 1.00 0.00 H new ATOM 2060 N LEU B 432 5.011 6.517 7.924 1.00 0.00 N ATOM 2061 CA LEU B 432 4.393 7.206 9.050 1.00 0.00 C ATOM 2062 C LEU B 432 5.257 7.061 10.299 1.00 0.00 C ATOM 2063 O LEU B 432 5.080 7.785 11.278 1.00 0.00 O ATOM 2064 CB LEU B 432 2.995 6.640 9.312 1.00 0.00 C ATOM 2065 CG LEU B 432 1.858 7.659 9.241 1.00 0.00 C ATOM 2066 CD1 LEU B 432 0.510 6.957 9.276 1.00 0.00 C ATOM 2067 CD2 LEU B 432 1.973 8.659 10.381 1.00 0.00 C ATOM 0 H LEU B 432 4.459 5.743 7.555 1.00 0.00 H new ATOM 0 HA LEU B 432 4.306 8.264 8.805 1.00 0.00 H new ATOM 0 HB2 LEU B 432 2.799 5.849 8.588 1.00 0.00 H new ATOM 0 HB3 LEU B 432 2.986 6.178 10.299 1.00 0.00 H new ATOM 0 HG LEU B 432 1.935 8.201 8.298 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -0.288 7.698 9.225 1.00 0.00 H new ATOM 0 HD12 LEU B 432 0.431 6.279 8.426 1.00 0.00 H new ATOM 0 HD13 LEU B 432 0.419 6.390 10.202 1.00 0.00 H new ATOM 0 HD21 LEU B 432 1.157 9.379 10.318 1.00 0.00 H new ATOM 0 HD22 LEU B 432 1.919 8.132 11.334 1.00 0.00 H new ATOM 0 HD23 LEU B 432 2.926 9.184 10.310 1.00 0.00 H new ATOM 2079 N ARG B 433 6.222 6.146 10.237 1.00 0.00 N ATOM 2080 CA ARG B 433 7.146 5.940 11.343 1.00 0.00 C ATOM 2081 C ARG B 433 8.326 6.888 11.178 1.00 0.00 C ATOM 2082 O ARG B 433 9.020 7.217 12.141 1.00 0.00 O ATOM 2083 CB ARG B 433 7.622 4.485 11.409 1.00 0.00 C ATOM 2084 CG ARG B 433 6.524 3.508 11.800 1.00 0.00 C ATOM 2085 CD ARG B 433 7.026 2.073 11.809 1.00 0.00 C ATOM 2086 NE ARG B 433 8.482 1.998 11.897 1.00 0.00 N ATOM 2087 CZ ARG B 433 9.152 1.984 13.044 1.00 0.00 C ATOM 2088 NH1 ARG B 433 8.500 2.052 14.197 1.00 0.00 N ATOM 2089 NH2 ARG B 433 10.476 1.903 13.041 1.00 0.00 N ATOM 0 H ARG B 433 6.382 5.538 9.434 1.00 0.00 H new ATOM 0 HA ARG B 433 6.633 6.151 12.281 1.00 0.00 H new ATOM 0 HB2 ARG B 433 8.025 4.198 10.438 1.00 0.00 H new ATOM 0 HB3 ARG B 433 8.438 4.410 12.128 1.00 0.00 H new ATOM 0 HG2 ARG B 433 6.142 3.766 12.788 1.00 0.00 H new ATOM 0 HG3 ARG B 433 5.691 3.598 11.102 1.00 0.00 H new ATOM 0 HD2 ARG B 433 6.585 1.541 12.652 1.00 0.00 H new ATOM 0 HD3 ARG B 433 6.692 1.567 10.903 1.00 0.00 H new ATOM 0 HE ARG B 433 9.015 1.954 11.028 1.00 0.00 H new ATOM 0 HH11 ARG B 433 7.482 2.115 14.204 1.00 0.00 H new ATOM 0 HH12 ARG B 433 9.017 2.041 15.076 1.00 0.00 H new ATOM 0 HH21 ARG B 433 10.982 1.851 12.157 1.00 0.00 H new ATOM 0 HH22 ARG B 433 10.988 1.892 13.923 1.00 0.00 H new ATOM 2103 N ASP B 434 8.513 7.352 9.942 1.00 0.00 N ATOM 2104 CA ASP B 434 9.570 8.301 9.622 1.00 0.00 C ATOM 2105 C ASP B 434 9.029 9.717 9.791 1.00 0.00 C ATOM 2106 O ASP B 434 9.204 10.578 8.929 1.00 0.00 O ATOM 2107 CB ASP B 434 10.061 8.086 8.188 1.00 0.00 C ATOM 2108 CG ASP B 434 11.573 8.006 8.100 1.00 0.00 C ATOM 2109 OD1 ASP B 434 12.239 8.218 9.135 1.00 0.00 O ATOM 2110 OD2 ASP B 434 12.090 7.732 6.997 1.00 0.00 O ATOM 0 H ASP B 434 7.939 7.081 9.143 1.00 0.00 H new ATOM 0 HA ASP B 434 10.414 8.150 10.295 1.00 0.00 H new ATOM 0 HB2 ASP B 434 9.628 7.167 7.793 1.00 0.00 H new ATOM 0 HB3 ASP B 434 9.706 8.902 7.559 1.00 0.00 H new ATOM 2115 N LYS B 435 8.365 9.932 10.920 1.00 0.00 N ATOM 2116 CA LYS B 435 7.781 11.230 11.227 1.00 0.00 C ATOM 2117 C LYS B 435 8.805 12.333 10.982 1.00 0.00 C ATOM 2118 O LYS B 435 8.572 13.236 10.179 1.00 0.00 O ATOM 2119 CB LYS B 435 7.244 11.264 12.660 1.00 0.00 C ATOM 2120 CG LYS B 435 8.214 11.837 13.680 1.00 0.00 C ATOM 2121 CD LYS B 435 7.585 11.906 15.060 1.00 0.00 C ATOM 2122 CE LYS B 435 7.652 10.559 15.765 1.00 0.00 C ATOM 2123 NZ LYS B 435 8.392 10.641 17.055 1.00 0.00 N ATOM 0 H LYS B 435 8.218 9.223 11.638 1.00 0.00 H new ATOM 0 HA LYS B 435 6.933 11.401 10.564 1.00 0.00 H new ATOM 0 HB2 LYS B 435 6.327 11.853 12.678 1.00 0.00 H new ATOM 0 HB3 LYS B 435 6.977 10.250 12.959 1.00 0.00 H new ATOM 0 HG2 LYS B 435 9.112 11.220 13.718 1.00 0.00 H new ATOM 0 HG3 LYS B 435 8.525 12.834 13.369 1.00 0.00 H new ATOM 0 HD2 LYS B 435 8.098 12.658 15.659 1.00 0.00 H new ATOM 0 HD3 LYS B 435 6.546 12.222 14.973 1.00 0.00 H new ATOM 0 HE2 LYS B 435 6.641 10.196 15.949 1.00 0.00 H new ATOM 0 HE3 LYS B 435 8.138 9.833 15.114 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 8.414 9.703 17.503 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 9.365 10.963 16.877 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 7.914 11.315 17.687 1.00 0.00 H new ATOM 2137 N LYS B 436 9.943 12.255 11.667 1.00 0.00 N ATOM 2138 CA LYS B 436 10.986 13.258 11.495 1.00 0.00 C ATOM 2139 C LYS B 436 11.261 13.452 10.012 1.00 0.00 C ATOM 2140 O LYS B 436 11.461 14.575 9.549 1.00 0.00 O ATOM 2141 CB LYS B 436 12.287 12.865 12.212 1.00 0.00 C ATOM 2142 CG LYS B 436 12.170 11.661 13.134 1.00 0.00 C ATOM 2143 CD LYS B 436 11.275 11.958 14.327 1.00 0.00 C ATOM 2144 CE LYS B 436 12.085 12.414 15.528 1.00 0.00 C ATOM 2145 NZ LYS B 436 12.708 11.268 16.247 1.00 0.00 N ATOM 0 H LYS B 436 10.163 11.518 12.337 1.00 0.00 H new ATOM 0 HA LYS B 436 10.631 14.188 11.940 1.00 0.00 H new ATOM 0 HB2 LYS B 436 13.050 12.657 11.462 1.00 0.00 H new ATOM 0 HB3 LYS B 436 12.636 13.718 12.794 1.00 0.00 H new ATOM 0 HG2 LYS B 436 11.768 10.814 12.578 1.00 0.00 H new ATOM 0 HG3 LYS B 436 13.161 11.372 13.484 1.00 0.00 H new ATOM 0 HD2 LYS B 436 10.553 12.730 14.059 1.00 0.00 H new ATOM 0 HD3 LYS B 436 10.706 11.066 14.588 1.00 0.00 H new ATOM 0 HE2 LYS B 436 12.863 13.103 15.200 1.00 0.00 H new ATOM 0 HE3 LYS B 436 11.440 12.964 16.213 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 13.252 11.622 17.060 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 11.964 10.623 16.583 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 13.344 10.757 15.601 1.00 0.00 H new ATOM 2159 N MET B 437 11.253 12.350 9.264 1.00 0.00 N ATOM 2160 CA MET B 437 11.486 12.414 7.829 1.00 0.00 C ATOM 2161 C MET B 437 10.345 13.172 7.159 1.00 0.00 C ATOM 2162 O MET B 437 10.577 14.138 6.432 1.00 0.00 O ATOM 2163 CB MET B 437 11.624 11.001 7.252 1.00 0.00 C ATOM 2164 CG MET B 437 11.479 10.928 5.743 1.00 0.00 C ATOM 2165 SD MET B 437 10.454 9.541 5.221 1.00 0.00 S ATOM 2166 CE MET B 437 9.487 10.310 3.929 1.00 0.00 C ATOM 0 H MET B 437 11.089 11.411 9.627 1.00 0.00 H new ATOM 0 HA MET B 437 12.417 12.947 7.635 1.00 0.00 H new ATOM 0 HB2 MET B 437 12.598 10.600 7.532 1.00 0.00 H new ATOM 0 HB3 MET B 437 10.871 10.359 7.710 1.00 0.00 H new ATOM 0 HG2 MET B 437 11.043 11.857 5.377 1.00 0.00 H new ATOM 0 HG3 MET B 437 12.466 10.839 5.289 1.00 0.00 H new ATOM 0 HE1 MET B 437 8.561 9.753 3.787 1.00 0.00 H new ATOM 0 HE2 MET B 437 9.253 11.336 4.212 1.00 0.00 H new ATOM 0 HE3 MET B 437 10.057 10.311 3.000 1.00 0.00 H new ATOM 2176 N LEU B 438 9.110 12.740 7.409 1.00 0.00 N ATOM 2177 CA LEU B 438 7.962 13.414 6.815 1.00 0.00 C ATOM 2178 C LEU B 438 8.111 14.913 7.029 1.00 0.00 C ATOM 2179 O LEU B 438 7.978 15.698 6.093 1.00 0.00 O ATOM 2180 CB LEU B 438 6.644 12.926 7.423 1.00 0.00 C ATOM 2181 CG LEU B 438 6.516 11.409 7.571 1.00 0.00 C ATOM 2182 CD1 LEU B 438 5.205 11.047 8.249 1.00 0.00 C ATOM 2183 CD2 LEU B 438 6.623 10.732 6.214 1.00 0.00 C ATOM 0 H LEU B 438 8.883 11.944 8.005 1.00 0.00 H new ATOM 0 HA LEU B 438 7.934 13.184 5.750 1.00 0.00 H new ATOM 0 HB2 LEU B 438 6.525 13.382 8.406 1.00 0.00 H new ATOM 0 HB3 LEU B 438 5.822 13.285 6.804 1.00 0.00 H new ATOM 0 HG LEU B 438 7.334 11.053 8.198 1.00 0.00 H new ATOM 0 HD11 LEU B 438 5.132 9.964 8.345 1.00 0.00 H new ATOM 0 HD12 LEU B 438 5.169 11.503 9.239 1.00 0.00 H new ATOM 0 HD13 LEU B 438 4.372 11.415 7.650 1.00 0.00 H new ATOM 0 HD21 LEU B 438 6.530 9.653 6.337 1.00 0.00 H new ATOM 0 HD22 LEU B 438 5.826 11.093 5.563 1.00 0.00 H new ATOM 0 HD23 LEU B 438 7.590 10.964 5.767 1.00 0.00 H new ATOM 2195 N ASP B 439 8.419 15.305 8.263 1.00 0.00 N ATOM 2196 CA ASP B 439 8.618 16.709 8.582 1.00 0.00 C ATOM 2197 C ASP B 439 9.738 17.270 7.711 1.00 0.00 C ATOM 2198 O ASP B 439 9.575 18.289 7.041 1.00 0.00 O ATOM 2199 CB ASP B 439 8.966 16.867 10.066 1.00 0.00 C ATOM 2200 CG ASP B 439 9.405 18.276 10.413 1.00 0.00 C ATOM 2201 OD1 ASP B 439 10.571 18.624 10.126 1.00 0.00 O ATOM 2202 OD2 ASP B 439 8.584 19.033 10.973 1.00 0.00 O ATOM 0 H ASP B 439 8.535 14.670 9.053 1.00 0.00 H new ATOM 0 HA ASP B 439 7.699 17.261 8.384 1.00 0.00 H new ATOM 0 HB2 ASP B 439 8.098 16.601 10.670 1.00 0.00 H new ATOM 0 HB3 ASP B 439 9.761 16.168 10.326 1.00 0.00 H new ATOM 2207 N PHE B 440 10.872 16.578 7.722 1.00 0.00 N ATOM 2208 CA PHE B 440 12.022 16.990 6.927 1.00 0.00 C ATOM 2209 C PHE B 440 11.571 17.287 5.499 1.00 0.00 C ATOM 2210 O PHE B 440 11.836 18.364 4.963 1.00 0.00 O ATOM 2211 CB PHE B 440 13.116 15.903 6.961 1.00 0.00 C ATOM 2212 CG PHE B 440 13.577 15.413 5.609 1.00 0.00 C ATOM 2213 CD1 PHE B 440 14.023 16.302 4.642 1.00 0.00 C ATOM 2214 CD2 PHE B 440 13.568 14.059 5.312 1.00 0.00 C ATOM 2215 CE1 PHE B 440 14.450 15.848 3.407 1.00 0.00 C ATOM 2216 CE2 PHE B 440 13.992 13.601 4.079 1.00 0.00 C ATOM 2217 CZ PHE B 440 14.433 14.497 3.126 1.00 0.00 C ATOM 0 H PHE B 440 11.019 15.731 8.271 1.00 0.00 H new ATOM 0 HA PHE B 440 12.452 17.899 7.349 1.00 0.00 H new ATOM 0 HB2 PHE B 440 13.978 16.294 7.501 1.00 0.00 H new ATOM 0 HB3 PHE B 440 12.743 15.052 7.530 1.00 0.00 H new ATOM 0 HD1 PHE B 440 14.037 17.361 4.856 1.00 0.00 H new ATOM 0 HD2 PHE B 440 13.225 13.353 6.054 1.00 0.00 H new ATOM 0 HE1 PHE B 440 14.796 16.550 2.663 1.00 0.00 H new ATOM 0 HE2 PHE B 440 13.978 12.543 3.861 1.00 0.00 H new ATOM 0 HZ PHE B 440 14.764 14.141 2.162 1.00 0.00 H new ATOM 2227 N TYR B 441 10.875 16.329 4.894 1.00 0.00 N ATOM 2228 CA TYR B 441 10.371 16.498 3.538 1.00 0.00 C ATOM 2229 C TYR B 441 9.368 17.640 3.489 1.00 0.00 C ATOM 2230 O TYR B 441 9.264 18.352 2.492 1.00 0.00 O ATOM 2231 CB TYR B 441 9.714 15.208 3.053 1.00 0.00 C ATOM 2232 CG TYR B 441 10.663 14.292 2.323 1.00 0.00 C ATOM 2233 CD1 TYR B 441 10.940 14.482 0.980 1.00 0.00 C ATOM 2234 CD2 TYR B 441 11.287 13.244 2.983 1.00 0.00 C ATOM 2235 CE1 TYR B 441 11.815 13.651 0.307 1.00 0.00 C ATOM 2236 CE2 TYR B 441 12.163 12.405 2.320 1.00 0.00 C ATOM 2237 CZ TYR B 441 12.423 12.613 0.982 1.00 0.00 C ATOM 2238 OH TYR B 441 13.295 11.782 0.317 1.00 0.00 O ATOM 0 H TYR B 441 10.648 15.431 5.321 1.00 0.00 H new ATOM 0 HA TYR B 441 11.209 16.735 2.883 1.00 0.00 H new ATOM 0 HB2 TYR B 441 9.295 14.678 3.908 1.00 0.00 H new ATOM 0 HB3 TYR B 441 8.882 15.458 2.394 1.00 0.00 H new ATOM 0 HD1 TYR B 441 10.464 15.293 0.449 1.00 0.00 H new ATOM 0 HD2 TYR B 441 11.085 13.081 4.031 1.00 0.00 H new ATOM 0 HE1 TYR B 441 12.022 13.813 -0.741 1.00 0.00 H new ATOM 0 HE2 TYR B 441 12.641 11.592 2.847 1.00 0.00 H new ATOM 0 HH TYR B 441 13.737 12.280 -0.403 1.00 0.00 H new ATOM 2248 N ALA B 442 8.640 17.809 4.583 1.00 0.00 N ATOM 2249 CA ALA B 442 7.652 18.875 4.671 1.00 0.00 C ATOM 2250 C ALA B 442 8.342 20.220 4.479 1.00 0.00 C ATOM 2251 O ALA B 442 7.987 20.994 3.588 1.00 0.00 O ATOM 2252 CB ALA B 442 6.915 18.839 6.001 1.00 0.00 C ATOM 0 H ALA B 442 8.713 17.226 5.417 1.00 0.00 H new ATOM 0 HA ALA B 442 6.912 18.730 3.884 1.00 0.00 H new ATOM 0 HB1 ALA B 442 6.185 19.648 6.034 1.00 0.00 H new ATOM 0 HB2 ALA B 442 6.403 17.883 6.107 1.00 0.00 H new ATOM 0 HB3 ALA B 442 7.629 18.961 6.816 1.00 0.00 H new ATOM 2258 N LYS B 443 9.320 20.498 5.335 1.00 0.00 N ATOM 2259 CA LYS B 443 10.048 21.758 5.277 1.00 0.00 C ATOM 2260 C LYS B 443 10.709 21.929 3.917 1.00 0.00 C ATOM 2261 O LYS B 443 10.864 23.048 3.432 1.00 0.00 O ATOM 2262 CB LYS B 443 11.100 21.820 6.391 1.00 0.00 C ATOM 2263 CG LYS B 443 12.471 21.310 5.974 1.00 0.00 C ATOM 2264 CD LYS B 443 13.226 20.712 7.150 1.00 0.00 C ATOM 2265 CE LYS B 443 14.669 20.403 6.784 1.00 0.00 C ATOM 2266 NZ LYS B 443 15.498 21.639 6.709 1.00 0.00 N ATOM 0 H LYS B 443 9.626 19.867 6.076 1.00 0.00 H new ATOM 0 HA LYS B 443 9.339 22.573 5.423 1.00 0.00 H new ATOM 0 HB2 LYS B 443 11.195 22.851 6.731 1.00 0.00 H new ATOM 0 HB3 LYS B 443 10.749 21.235 7.241 1.00 0.00 H new ATOM 0 HG2 LYS B 443 12.358 20.558 5.193 1.00 0.00 H new ATOM 0 HG3 LYS B 443 13.050 22.129 5.547 1.00 0.00 H new ATOM 0 HD2 LYS B 443 13.203 21.406 7.990 1.00 0.00 H new ATOM 0 HD3 LYS B 443 12.729 19.799 7.477 1.00 0.00 H new ATOM 0 HE2 LYS B 443 15.094 19.725 7.524 1.00 0.00 H new ATOM 0 HE3 LYS B 443 14.698 19.887 5.824 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 16.496 21.380 6.575 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 15.181 22.222 5.908 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 15.396 22.179 7.592 1.00 0.00 H new ATOM 2280 N GLN B 444 11.074 20.817 3.292 1.00 0.00 N ATOM 2281 CA GLN B 444 11.688 20.864 1.975 1.00 0.00 C ATOM 2282 C GLN B 444 10.623 21.246 0.946 1.00 0.00 C ATOM 2283 O GLN B 444 10.804 22.171 0.158 1.00 0.00 O ATOM 2284 CB GLN B 444 12.366 19.517 1.652 1.00 0.00 C ATOM 2285 CG GLN B 444 11.779 18.746 0.477 1.00 0.00 C ATOM 2286 CD GLN B 444 12.367 19.149 -0.867 1.00 0.00 C ATOM 2287 OE1 GLN B 444 13.123 20.245 -0.900 1.00 0.00 O flip ATOM 2288 NE2 GLN B 444 12.142 18.477 -1.873 1.00 0.00 N flip ATOM 0 H GLN B 444 10.956 19.879 3.674 1.00 0.00 H new ATOM 0 HA GLN B 444 12.472 21.621 1.948 1.00 0.00 H new ATOM 0 HB2 GLN B 444 13.421 19.702 1.451 1.00 0.00 H new ATOM 0 HB3 GLN B 444 12.317 18.885 2.539 1.00 0.00 H new ATOM 0 HG2 GLN B 444 11.945 17.680 0.633 1.00 0.00 H new ATOM 0 HG3 GLN B 444 10.700 18.900 0.454 1.00 0.00 H new ATOM 0 HE21 GLN B 444 11.558 17.643 -1.809 1.00 0.00 H new ATOM 0 HE22 GLN B 444 12.540 18.754 -2.771 1.00 0.00 H new ATOM 2297 N ARG B 445 9.515 20.518 0.957 1.00 0.00 N ATOM 2298 CA ARG B 445 8.437 20.765 0.011 1.00 0.00 C ATOM 2299 C ARG B 445 8.084 22.246 0.000 1.00 0.00 C ATOM 2300 O ARG B 445 7.718 22.796 -1.040 1.00 0.00 O ATOM 2301 CB ARG B 445 7.212 19.931 0.388 1.00 0.00 C ATOM 2302 CG ARG B 445 6.053 20.072 -0.583 1.00 0.00 C ATOM 2303 CD ARG B 445 5.254 21.337 -0.318 1.00 0.00 C ATOM 2304 NE ARG B 445 3.905 21.043 0.156 1.00 0.00 N ATOM 2305 CZ ARG B 445 2.992 21.976 0.403 1.00 0.00 C ATOM 2306 NH1 ARG B 445 3.286 23.257 0.231 1.00 0.00 N ATOM 2307 NH2 ARG B 445 1.783 21.629 0.825 1.00 0.00 N ATOM 0 H ARG B 445 9.340 19.753 1.609 1.00 0.00 H new ATOM 0 HA ARG B 445 8.765 20.476 -0.987 1.00 0.00 H new ATOM 0 HB2 ARG B 445 7.502 18.882 0.444 1.00 0.00 H new ATOM 0 HB3 ARG B 445 6.878 20.223 1.384 1.00 0.00 H new ATOM 0 HG2 ARG B 445 6.433 20.088 -1.605 1.00 0.00 H new ATOM 0 HG3 ARG B 445 5.399 19.204 -0.499 1.00 0.00 H new ATOM 0 HD2 ARG B 445 5.774 21.946 0.422 1.00 0.00 H new ATOM 0 HD3 ARG B 445 5.196 21.927 -1.232 1.00 0.00 H new ATOM 0 HE ARG B 445 3.649 20.067 0.306 1.00 0.00 H new ATOM 0 HH11 ARG B 445 4.215 23.528 -0.092 1.00 0.00 H new ATOM 0 HH12 ARG B 445 2.583 23.972 0.421 1.00 0.00 H new ATOM 0 HH21 ARG B 445 1.553 20.644 0.960 1.00 0.00 H new ATOM 0 HH22 ARG B 445 1.083 22.347 1.014 1.00 0.00 H new ATOM 2321 N ALA B 446 8.221 22.899 1.148 1.00 0.00 N ATOM 2322 CA ALA B 446 7.943 24.325 1.242 1.00 0.00 C ATOM 2323 C ALA B 446 9.198 25.129 0.901 1.00 0.00 C ATOM 2324 O ALA B 446 9.122 26.186 0.274 1.00 0.00 O ATOM 2325 CB ALA B 446 7.437 24.696 2.628 1.00 0.00 C ATOM 0 H ALA B 446 8.521 22.466 2.021 1.00 0.00 H new ATOM 0 HA ALA B 446 7.160 24.567 0.523 1.00 0.00 H new ATOM 0 HB1 ALA B 446 7.238 25.767 2.668 1.00 0.00 H new ATOM 0 HB2 ALA B 446 6.519 24.148 2.839 1.00 0.00 H new ATOM 0 HB3 ALA B 446 8.191 24.439 3.372 1.00 0.00 H new ATOM 2331 N ALA B 447 10.351 24.617 1.330 1.00 0.00 N ATOM 2332 CA ALA B 447 11.631 25.277 1.085 1.00 0.00 C ATOM 2333 C ALA B 447 12.526 24.443 0.168 1.00 0.00 C ATOM 2334 O ALA B 447 13.695 24.208 0.474 1.00 0.00 O ATOM 2335 CB ALA B 447 12.349 25.554 2.396 1.00 0.00 C ATOM 0 H ALA B 447 10.424 23.743 1.851 1.00 0.00 H new ATOM 0 HA ALA B 447 11.420 26.223 0.586 1.00 0.00 H new ATOM 0 HB1 ALA B 447 13.300 26.046 2.193 1.00 0.00 H new ATOM 0 HB2 ALA B 447 11.732 26.201 3.019 1.00 0.00 H new ATOM 0 HB3 ALA B 447 12.531 24.614 2.917 1.00 0.00 H new ATOM 2341 N ILE B 448 11.971 24.001 -0.955 1.00 0.00 N ATOM 2342 CA ILE B 448 12.716 23.196 -1.917 1.00 0.00 C ATOM 2343 C ILE B 448 13.782 24.027 -2.622 1.00 0.00 C ATOM 2344 O ILE B 448 13.603 25.225 -2.846 1.00 0.00 O ATOM 2345 CB ILE B 448 11.785 22.585 -2.985 1.00 0.00 C ATOM 2346 CG1 ILE B 448 11.079 23.692 -3.768 1.00 0.00 C ATOM 2347 CG2 ILE B 448 10.767 21.653 -2.344 1.00 0.00 C ATOM 2348 CD1 ILE B 448 9.795 23.239 -4.428 1.00 0.00 C ATOM 0 H ILE B 448 11.004 24.187 -1.222 1.00 0.00 H new ATOM 0 HA ILE B 448 13.190 22.395 -1.351 1.00 0.00 H new ATOM 0 HB ILE B 448 12.392 22.001 -3.677 1.00 0.00 H new ATOM 0 HG12 ILE B 448 10.859 24.520 -3.094 1.00 0.00 H new ATOM 0 HG13 ILE B 448 11.756 24.074 -4.532 1.00 0.00 H new ATOM 0 HG21 ILE B 448 10.121 21.234 -3.116 1.00 0.00 H new ATOM 0 HG22 ILE B 448 11.287 20.846 -1.828 1.00 0.00 H new ATOM 0 HG23 ILE B 448 10.163 22.211 -1.629 1.00 0.00 H new ATOM 0 HD11 ILE B 448 9.348 24.075 -4.966 1.00 0.00 H new ATOM 0 HD12 ILE B 448 10.011 22.431 -5.127 1.00 0.00 H new ATOM 0 HD13 ILE B 448 9.100 22.884 -3.667 1.00 0.00 H new