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+ 143:sc= -0.447 (180deg=0) USER MOD Set 1.2: B 436 LYS NZ :NH3+ 140:sc= -2.01 (180deg=-4.53!) USER MOD Set 2.1: B 389 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 365 SER OG : rot 49:sc= 1.16 USER MOD Single : B 368 MET CE :methyl -121:sc= -3.67! (180deg=-9.07!) USER MOD Single : B 369 ASN : amide:sc= -0.314 X(o=-0.31,f=-0.31) USER MOD Single : B 371 LYS NZ :NH3+ -143:sc= 0.623 (180deg=-1.13) USER MOD Single : B 373 GLN : amide:sc= -17.3! C(o=-17!,f=-20!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 58:sc= -0.195 USER MOD Single : B 380 TYR OH : rot -165:sc= -6.48! USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS : no HE2:sc= -3.87 K(o=-3.9,f=-4.8!) USER MOD Single : B 387 TYR OH : rot -50:sc= -2.32! USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot 180:sc= 0 USER MOD Single : B 399 ASN :FLIP amide:sc= -0.457 F(o=-1,f=-0.46) USER MOD Single : B 400 SER OG : rot 140:sc= 0 USER MOD Single : B 404 CYS SG : rot 102:sc= 0.168 USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 180:sc= 0 USER MOD Single : B 419 ASN : amide:sc= -0.822 K(o=-0.82,f=-1.7!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= 0.502 K(o=0.5,f=0) USER MOD Single : B 437 MET CE :methyl -134:sc= -9.84! (180deg=-13!) USER MOD Single : B 441 TYR OH : rot 180:sc= -5.27! USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN :FLIP amide:sc= -2.87! C(o=-4.1!,f=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 1036 N SER B 365 -1.701 -2.072 11.394 1.00 0.00 N ATOM 1037 CA SER B 365 -3.099 -1.909 11.010 1.00 0.00 C ATOM 1038 C SER B 365 -3.472 -0.431 10.994 1.00 0.00 C ATOM 1039 O SER B 365 -4.051 0.085 11.950 1.00 0.00 O ATOM 1040 CB SER B 365 -4.010 -2.668 11.977 1.00 0.00 C ATOM 1041 OG SER B 365 -3.960 -2.105 13.276 1.00 0.00 O ATOM 0 HA SER B 365 -3.233 -2.318 10.009 1.00 0.00 H new ATOM 0 HB2 SER B 365 -5.035 -2.647 11.608 1.00 0.00 H new ATOM 0 HB3 SER B 365 -3.708 -3.715 12.019 1.00 0.00 H new ATOM 0 HG SER B 365 -4.072 -1.133 13.216 1.00 0.00 H new ATOM 1047 N LEU B 366 -3.126 0.247 9.905 1.00 0.00 N ATOM 1048 CA LEU B 366 -3.413 1.669 9.772 1.00 0.00 C ATOM 1049 C LEU B 366 -2.929 2.203 8.429 1.00 0.00 C ATOM 1050 O LEU B 366 -2.335 3.281 8.350 1.00 0.00 O ATOM 1051 CB LEU B 366 -2.738 2.441 10.898 1.00 0.00 C ATOM 1052 CG LEU B 366 -1.238 2.653 10.707 1.00 0.00 C ATOM 1053 CD1 LEU B 366 -0.931 4.125 10.493 1.00 0.00 C ATOM 1054 CD2 LEU B 366 -0.465 2.108 11.899 1.00 0.00 C ATOM 0 H LEU B 366 -2.648 -0.165 9.104 1.00 0.00 H new ATOM 0 HA LEU B 366 -4.493 1.803 9.829 1.00 0.00 H new ATOM 0 HB2 LEU B 366 -3.220 3.414 10.995 1.00 0.00 H new ATOM 0 HB3 LEU B 366 -2.901 1.909 11.835 1.00 0.00 H new ATOM 0 HG LEU B 366 -0.923 2.106 9.818 1.00 0.00 H new ATOM 0 HD11 LEU B 366 0.143 4.257 10.359 1.00 0.00 H new ATOM 0 HD12 LEU B 366 -1.454 4.480 9.605 1.00 0.00 H new ATOM 0 HD13 LEU B 366 -1.261 4.695 11.361 1.00 0.00 H new ATOM 0 HD21 LEU B 366 0.602 2.268 11.745 1.00 0.00 H new ATOM 0 HD22 LEU B 366 -0.782 2.624 12.805 1.00 0.00 H new ATOM 0 HD23 LEU B 366 -0.660 1.041 12.002 1.00 0.00 H new ATOM 1066 N ASP B 367 -3.227 1.465 7.371 1.00 0.00 N ATOM 1067 CA ASP B 367 -2.855 1.893 6.030 1.00 0.00 C ATOM 1068 C ASP B 367 -3.553 3.210 5.713 1.00 0.00 C ATOM 1069 O ASP B 367 -3.156 3.944 4.811 1.00 0.00 O ATOM 1070 CB ASP B 367 -3.237 0.831 5.002 1.00 0.00 C ATOM 1071 CG ASP B 367 -4.739 0.674 4.860 1.00 0.00 C ATOM 1072 OD1 ASP B 367 -5.443 1.704 4.828 1.00 0.00 O ATOM 1073 OD2 ASP B 367 -5.210 -0.481 4.784 1.00 0.00 O ATOM 0 H ASP B 367 -3.721 0.574 7.413 1.00 0.00 H new ATOM 0 HA ASP B 367 -1.775 2.033 5.986 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -2.810 1.096 4.035 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -2.801 -0.125 5.292 1.00 0.00 H new ATOM 1078 N MET B 368 -4.591 3.493 6.494 1.00 0.00 N ATOM 1079 CA MET B 368 -5.361 4.716 6.343 1.00 0.00 C ATOM 1080 C MET B 368 -4.494 5.923 6.698 1.00 0.00 C ATOM 1081 O MET B 368 -4.257 6.797 5.865 1.00 0.00 O ATOM 1082 CB MET B 368 -6.631 4.653 7.215 1.00 0.00 C ATOM 1083 CG MET B 368 -6.861 5.863 8.114 1.00 0.00 C ATOM 1084 SD MET B 368 -7.012 7.408 7.195 1.00 0.00 S ATOM 1085 CE MET B 368 -6.074 8.515 8.245 1.00 0.00 C ATOM 0 H MET B 368 -4.918 2.883 7.244 1.00 0.00 H new ATOM 0 HA MET B 368 -5.676 4.823 5.305 1.00 0.00 H new ATOM 0 HB2 MET B 368 -7.496 4.536 6.562 1.00 0.00 H new ATOM 0 HB3 MET B 368 -6.580 3.761 7.839 1.00 0.00 H new ATOM 0 HG2 MET B 368 -7.766 5.706 8.700 1.00 0.00 H new ATOM 0 HG3 MET B 368 -6.035 5.946 8.820 1.00 0.00 H new ATOM 0 HE1 MET B 368 -6.714 9.334 8.573 1.00 0.00 H new ATOM 0 HE2 MET B 368 -5.708 7.969 9.115 1.00 0.00 H new ATOM 0 HE3 MET B 368 -5.228 8.917 7.687 1.00 0.00 H new ATOM 1095 N ASN B 369 -4.041 5.968 7.943 1.00 0.00 N ATOM 1096 CA ASN B 369 -3.217 7.072 8.418 1.00 0.00 C ATOM 1097 C ASN B 369 -1.943 7.244 7.592 1.00 0.00 C ATOM 1098 O ASN B 369 -1.597 8.363 7.214 1.00 0.00 O ATOM 1099 CB ASN B 369 -2.853 6.865 9.888 1.00 0.00 C ATOM 1100 CG ASN B 369 -3.626 7.788 10.809 1.00 0.00 C ATOM 1101 OD1 ASN B 369 -3.390 8.995 10.836 1.00 0.00 O ATOM 1102 ND2 ASN B 369 -4.556 7.223 11.569 1.00 0.00 N ATOM 0 H ASN B 369 -4.230 5.252 8.644 1.00 0.00 H new ATOM 0 HA ASN B 369 -3.807 7.982 8.307 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -3.050 5.830 10.166 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -1.784 7.033 10.022 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -5.109 7.794 12.208 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -4.718 6.217 11.514 1.00 0.00 H new ATOM 1109 N ALA B 370 -1.229 6.149 7.326 1.00 0.00 N ATOM 1110 CA ALA B 370 0.015 6.248 6.561 1.00 0.00 C ATOM 1111 C ALA B 370 -0.236 6.788 5.156 1.00 0.00 C ATOM 1112 O ALA B 370 0.265 7.854 4.798 1.00 0.00 O ATOM 1113 CB ALA B 370 0.718 4.903 6.482 1.00 0.00 C ATOM 0 H ALA B 370 -1.482 5.206 7.620 1.00 0.00 H new ATOM 0 HA ALA B 370 0.661 6.950 7.088 1.00 0.00 H new ATOM 0 HB1 ALA B 370 1.639 5.007 5.908 1.00 0.00 H new ATOM 0 HB2 ALA B 370 0.955 4.556 7.488 1.00 0.00 H new ATOM 0 HB3 ALA B 370 0.065 4.180 5.993 1.00 0.00 H new ATOM 1119 N LYS B 371 -0.986 6.042 4.351 1.00 0.00 N ATOM 1120 CA LYS B 371 -1.262 6.455 2.977 1.00 0.00 C ATOM 1121 C LYS B 371 -1.676 7.918 2.929 1.00 0.00 C ATOM 1122 O LYS B 371 -1.312 8.645 2.004 1.00 0.00 O ATOM 1123 CB LYS B 371 -2.358 5.585 2.358 1.00 0.00 C ATOM 1124 CG LYS B 371 -3.704 5.705 3.057 1.00 0.00 C ATOM 1125 CD LYS B 371 -4.579 6.768 2.415 1.00 0.00 C ATOM 1126 CE LYS B 371 -6.042 6.582 2.787 1.00 0.00 C ATOM 1127 NZ LYS B 371 -6.340 7.106 4.149 1.00 0.00 N ATOM 0 H LYS B 371 -1.411 5.155 4.622 1.00 0.00 H new ATOM 0 HA LYS B 371 -0.346 6.328 2.399 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -2.478 5.859 1.310 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -2.039 4.543 2.381 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -4.217 4.744 3.025 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -3.548 5.949 4.108 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -4.245 7.756 2.731 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -4.469 6.726 1.331 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -6.670 7.092 2.056 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -6.296 5.523 2.742 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -7.032 6.486 4.616 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -5.465 7.132 4.710 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -6.731 8.067 4.073 1.00 0.00 H new ATOM 1141 N ARG B 372 -2.423 8.350 3.934 1.00 0.00 N ATOM 1142 CA ARG B 372 -2.867 9.733 4.008 1.00 0.00 C ATOM 1143 C ARG B 372 -1.693 10.653 4.325 1.00 0.00 C ATOM 1144 O ARG B 372 -1.510 11.689 3.691 1.00 0.00 O ATOM 1145 CB ARG B 372 -3.950 9.887 5.076 1.00 0.00 C ATOM 1146 CG ARG B 372 -5.044 10.871 4.691 1.00 0.00 C ATOM 1147 CD ARG B 372 -5.653 11.555 5.907 1.00 0.00 C ATOM 1148 NE ARG B 372 -4.697 11.701 7.003 1.00 0.00 N ATOM 1149 CZ ARG B 372 -3.585 12.425 6.923 1.00 0.00 C ATOM 1150 NH1 ARG B 372 -3.295 13.083 5.808 1.00 0.00 N ATOM 1151 NH2 ARG B 372 -2.765 12.496 7.962 1.00 0.00 N ATOM 0 H ARG B 372 -2.734 7.763 4.708 1.00 0.00 H new ATOM 0 HA ARG B 372 -3.282 10.012 3.040 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -4.400 8.913 5.270 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -3.488 10.215 6.007 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -4.633 11.625 4.020 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -5.826 10.347 4.141 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -6.024 12.539 5.619 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -6.512 10.979 6.252 1.00 0.00 H new ATOM 0 HE ARG B 372 -4.895 11.219 7.880 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -3.926 13.034 5.008 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -2.441 13.637 5.751 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -2.987 11.995 8.822 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -1.912 13.051 7.901 1.00 0.00 H new ATOM 1165 N GLN B 373 -0.911 10.267 5.324 1.00 0.00 N ATOM 1166 CA GLN B 373 0.239 11.048 5.755 1.00 0.00 C ATOM 1167 C GLN B 373 1.277 11.221 4.647 1.00 0.00 C ATOM 1168 O GLN B 373 1.783 12.318 4.431 1.00 0.00 O ATOM 1169 CB GLN B 373 0.891 10.367 6.954 1.00 0.00 C ATOM 1170 CG GLN B 373 1.490 11.334 7.958 1.00 0.00 C ATOM 1171 CD GLN B 373 1.969 12.626 7.323 1.00 0.00 C ATOM 1172 OE1 GLN B 373 1.381 13.688 7.530 1.00 0.00 O ATOM 1173 NE2 GLN B 373 3.041 12.542 6.543 1.00 0.00 N ATOM 0 H GLN B 373 -1.055 9.408 5.856 1.00 0.00 H new ATOM 0 HA GLN B 373 -0.122 12.041 6.023 1.00 0.00 H new ATOM 0 HB2 GLN B 373 0.147 9.750 7.458 1.00 0.00 H new ATOM 0 HB3 GLN B 373 1.673 9.697 6.598 1.00 0.00 H new ATOM 0 HG2 GLN B 373 0.746 11.564 8.721 1.00 0.00 H new ATOM 0 HG3 GLN B 373 2.327 10.852 8.464 1.00 0.00 H new ATOM 0 HE21 GLN B 373 3.498 11.641 6.399 1.00 0.00 H new ATOM 0 HE22 GLN B 373 3.408 13.378 6.088 1.00 0.00 H new ATOM 1182 N LEU B 374 1.610 10.133 3.965 1.00 0.00 N ATOM 1183 CA LEU B 374 2.617 10.192 2.908 1.00 0.00 C ATOM 1184 C LEU B 374 2.114 10.935 1.674 1.00 0.00 C ATOM 1185 O LEU B 374 2.747 11.884 1.210 1.00 0.00 O ATOM 1186 CB LEU B 374 3.047 8.776 2.519 1.00 0.00 C ATOM 1187 CG LEU B 374 3.444 7.878 3.691 1.00 0.00 C ATOM 1188 CD1 LEU B 374 4.359 6.759 3.220 1.00 0.00 C ATOM 1189 CD2 LEU B 374 4.118 8.698 4.779 1.00 0.00 C ATOM 0 H LEU B 374 1.205 9.210 4.120 1.00 0.00 H new ATOM 0 HA LEU B 374 3.470 10.746 3.301 1.00 0.00 H new ATOM 0 HB2 LEU B 374 2.230 8.300 1.976 1.00 0.00 H new ATOM 0 HB3 LEU B 374 3.890 8.844 1.831 1.00 0.00 H new ATOM 0 HG LEU B 374 2.541 7.429 4.105 1.00 0.00 H new ATOM 0 HD11 LEU B 374 4.631 6.130 4.068 1.00 0.00 H new ATOM 0 HD12 LEU B 374 3.842 6.157 2.473 1.00 0.00 H new ATOM 0 HD13 LEU B 374 5.261 7.187 2.781 1.00 0.00 H new ATOM 0 HD21 LEU B 374 4.395 8.046 5.607 1.00 0.00 H new ATOM 0 HD22 LEU B 374 5.013 9.172 4.376 1.00 0.00 H new ATOM 0 HD23 LEU B 374 3.430 9.465 5.136 1.00 0.00 H new ATOM 1201 N TYR B 375 1.000 10.477 1.122 1.00 0.00 N ATOM 1202 CA TYR B 375 0.451 11.083 -0.087 1.00 0.00 C ATOM 1203 C TYR B 375 -0.151 12.465 0.166 1.00 0.00 C ATOM 1204 O TYR B 375 -0.019 13.356 -0.668 1.00 0.00 O ATOM 1205 CB TYR B 375 -0.581 10.153 -0.724 1.00 0.00 C ATOM 1206 CG TYR B 375 -0.004 9.284 -1.823 1.00 0.00 C ATOM 1207 CD1 TYR B 375 1.372 9.116 -1.955 1.00 0.00 C ATOM 1208 CD2 TYR B 375 -0.831 8.638 -2.732 1.00 0.00 C ATOM 1209 CE1 TYR B 375 1.902 8.328 -2.960 1.00 0.00 C ATOM 1210 CE2 TYR B 375 -0.308 7.849 -3.739 1.00 0.00 C ATOM 1211 CZ TYR B 375 1.058 7.697 -3.848 1.00 0.00 C ATOM 1212 OH TYR B 375 1.582 6.912 -4.850 1.00 0.00 O ATOM 0 H TYR B 375 0.460 9.693 1.487 1.00 0.00 H new ATOM 0 HA TYR B 375 1.281 11.226 -0.778 1.00 0.00 H new ATOM 0 HB2 TYR B 375 -1.010 9.514 0.048 1.00 0.00 H new ATOM 0 HB3 TYR B 375 -1.396 10.751 -1.132 1.00 0.00 H new ATOM 0 HD1 TYR B 375 2.036 9.609 -1.261 1.00 0.00 H new ATOM 0 HD2 TYR B 375 -1.902 8.754 -2.651 1.00 0.00 H new ATOM 0 HE1 TYR B 375 2.972 8.208 -3.049 1.00 0.00 H new ATOM 0 HE2 TYR B 375 -0.966 7.354 -4.437 1.00 0.00 H new ATOM 0 HH TYR B 375 0.853 6.539 -5.388 1.00 0.00 H new ATOM 1222 N SER B 376 -0.806 12.661 1.300 1.00 0.00 N ATOM 1223 CA SER B 376 -1.388 13.963 1.594 1.00 0.00 C ATOM 1224 C SER B 376 -0.298 14.953 1.986 1.00 0.00 C ATOM 1225 O SER B 376 -0.200 16.047 1.430 1.00 0.00 O ATOM 1226 CB SER B 376 -2.431 13.853 2.710 1.00 0.00 C ATOM 1227 OG SER B 376 -3.265 12.722 2.519 1.00 0.00 O ATOM 0 H SER B 376 -0.947 11.952 2.019 1.00 0.00 H new ATOM 0 HA SER B 376 -1.886 14.326 0.695 1.00 0.00 H new ATOM 0 HB2 SER B 376 -1.929 13.780 3.675 1.00 0.00 H new ATOM 0 HB3 SER B 376 -3.039 14.757 2.734 1.00 0.00 H new ATOM 0 HG SER B 376 -2.715 11.911 2.493 1.00 0.00 H new ATOM 1233 N LEU B 377 0.500 14.563 2.975 1.00 0.00 N ATOM 1234 CA LEU B 377 1.569 15.411 3.490 1.00 0.00 C ATOM 1235 C LEU B 377 2.690 15.648 2.472 1.00 0.00 C ATOM 1236 O LEU B 377 2.977 16.791 2.120 1.00 0.00 O ATOM 1237 CB LEU B 377 2.145 14.796 4.765 1.00 0.00 C ATOM 1238 CG LEU B 377 2.678 15.800 5.778 1.00 0.00 C ATOM 1239 CD1 LEU B 377 3.305 16.976 5.056 1.00 0.00 C ATOM 1240 CD2 LEU B 377 1.565 16.268 6.705 1.00 0.00 C ATOM 0 H LEU B 377 0.425 13.658 3.439 1.00 0.00 H new ATOM 0 HA LEU B 377 1.128 16.385 3.705 1.00 0.00 H new ATOM 0 HB2 LEU B 377 1.371 14.196 5.243 1.00 0.00 H new ATOM 0 HB3 LEU B 377 2.951 14.116 4.491 1.00 0.00 H new ATOM 0 HG LEU B 377 3.441 15.315 6.387 1.00 0.00 H new ATOM 0 HD11 LEU B 377 3.684 17.691 5.786 1.00 0.00 H new ATOM 0 HD12 LEU B 377 4.126 16.624 4.432 1.00 0.00 H new ATOM 0 HD13 LEU B 377 2.556 17.460 4.430 1.00 0.00 H new ATOM 0 HD21 LEU B 377 1.966 16.985 7.422 1.00 0.00 H new ATOM 0 HD22 LEU B 377 0.778 16.742 6.118 1.00 0.00 H new ATOM 0 HD23 LEU B 377 1.153 15.412 7.240 1.00 0.00 H new ATOM 1252 N ILE B 378 3.345 14.577 2.028 1.00 0.00 N ATOM 1253 CA ILE B 378 4.455 14.706 1.083 1.00 0.00 C ATOM 1254 C ILE B 378 4.079 14.290 -0.336 1.00 0.00 C ATOM 1255 O ILE B 378 4.905 13.743 -1.066 1.00 0.00 O ATOM 1256 CB ILE B 378 5.669 13.873 1.537 1.00 0.00 C ATOM 1257 CG1 ILE B 378 5.968 14.137 3.013 1.00 0.00 C ATOM 1258 CG2 ILE B 378 6.884 14.191 0.677 1.00 0.00 C ATOM 1259 CD1 ILE B 378 6.137 15.605 3.341 1.00 0.00 C ATOM 0 H ILE B 378 3.130 13.619 2.303 1.00 0.00 H new ATOM 0 HA ILE B 378 4.710 15.766 1.071 1.00 0.00 H new ATOM 0 HB ILE B 378 5.433 12.816 1.416 1.00 0.00 H new ATOM 0 HG12 ILE B 378 5.159 13.728 3.618 1.00 0.00 H new ATOM 0 HG13 ILE B 378 6.876 13.603 3.293 1.00 0.00 H new ATOM 0 HG21 ILE B 378 7.733 13.594 1.011 1.00 0.00 H new ATOM 0 HG22 ILE B 378 6.664 13.957 -0.365 1.00 0.00 H new ATOM 0 HG23 ILE B 378 7.127 15.250 0.768 1.00 0.00 H new ATOM 0 HD11 ILE B 378 6.347 15.718 4.405 1.00 0.00 H new ATOM 0 HD12 ILE B 378 6.965 16.014 2.762 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.221 16.141 3.093 1.00 0.00 H new ATOM 1271 N GLY B 379 2.838 14.550 -0.729 1.00 0.00 N ATOM 1272 CA GLY B 379 2.405 14.189 -2.067 1.00 0.00 C ATOM 1273 C GLY B 379 2.555 15.321 -3.062 1.00 0.00 C ATOM 1274 O GLY B 379 2.720 15.080 -4.258 1.00 0.00 O ATOM 0 H GLY B 379 2.128 15.001 -0.151 1.00 0.00 H new ATOM 0 HA2 GLY B 379 2.983 13.331 -2.411 1.00 0.00 H new ATOM 0 HA3 GLY B 379 1.361 13.878 -2.034 1.00 0.00 H new ATOM 1278 N TYR B 380 2.515 16.559 -2.571 1.00 0.00 N ATOM 1279 CA TYR B 380 2.659 17.734 -3.425 1.00 0.00 C ATOM 1280 C TYR B 380 2.020 17.518 -4.796 1.00 0.00 C ATOM 1281 O TYR B 380 1.195 16.622 -4.980 1.00 0.00 O ATOM 1282 CB TYR B 380 4.138 18.079 -3.590 1.00 0.00 C ATOM 1283 CG TYR B 380 4.947 17.878 -2.328 1.00 0.00 C ATOM 1284 CD1 TYR B 380 4.401 18.153 -1.079 1.00 0.00 C ATOM 1285 CD2 TYR B 380 6.252 17.408 -2.384 1.00 0.00 C ATOM 1286 CE1 TYR B 380 5.136 17.967 0.076 1.00 0.00 C ATOM 1287 CE2 TYR B 380 6.993 17.219 -1.232 1.00 0.00 C ATOM 1288 CZ TYR B 380 6.430 17.500 -0.005 1.00 0.00 C ATOM 1289 OH TYR B 380 7.164 17.312 1.143 1.00 0.00 O ATOM 0 H TYR B 380 2.384 16.773 -1.582 1.00 0.00 H new ATOM 0 HA TYR B 380 2.140 18.562 -2.942 1.00 0.00 H new ATOM 0 HB2 TYR B 380 4.560 17.464 -4.385 1.00 0.00 H new ATOM 0 HB3 TYR B 380 4.228 19.118 -3.908 1.00 0.00 H new ATOM 0 HD1 TYR B 380 3.387 18.518 -1.011 1.00 0.00 H new ATOM 0 HD2 TYR B 380 6.696 17.186 -3.343 1.00 0.00 H new ATOM 0 HE1 TYR B 380 4.698 18.187 1.039 1.00 0.00 H new ATOM 0 HE2 TYR B 380 8.007 16.853 -1.293 1.00 0.00 H new ATOM 0 HH TYR B 380 8.111 17.212 0.913 1.00 0.00 H new ATOM 1299 N ALA B 381 2.414 18.347 -5.757 1.00 0.00 N ATOM 1300 CA ALA B 381 1.896 18.249 -7.116 1.00 0.00 C ATOM 1301 C ALA B 381 2.630 17.159 -7.891 1.00 0.00 C ATOM 1302 O ALA B 381 2.210 16.761 -8.978 1.00 0.00 O ATOM 1303 CB ALA B 381 2.011 19.583 -7.840 1.00 0.00 C ATOM 0 H ALA B 381 3.092 19.096 -5.619 1.00 0.00 H new ATOM 0 HA ALA B 381 0.840 17.984 -7.057 1.00 0.00 H new ATOM 0 HB1 ALA B 381 1.618 19.483 -8.852 1.00 0.00 H new ATOM 0 HB2 ALA B 381 1.440 20.339 -7.302 1.00 0.00 H new ATOM 0 HB3 ALA B 381 3.058 19.883 -7.886 1.00 0.00 H new ATOM 1309 N SER B 382 3.733 16.684 -7.319 1.00 0.00 N ATOM 1310 CA SER B 382 4.546 15.643 -7.935 1.00 0.00 C ATOM 1311 C SER B 382 5.923 15.611 -7.279 1.00 0.00 C ATOM 1312 O SER B 382 6.677 16.582 -7.358 1.00 0.00 O ATOM 1313 CB SER B 382 4.683 15.886 -9.440 1.00 0.00 C ATOM 1314 OG SER B 382 6.033 15.771 -9.856 1.00 0.00 O ATOM 0 H SER B 382 4.086 17.009 -6.419 1.00 0.00 H new ATOM 0 HA SER B 382 4.056 14.681 -7.788 1.00 0.00 H new ATOM 0 HB2 SER B 382 4.069 15.168 -9.984 1.00 0.00 H new ATOM 0 HB3 SER B 382 4.307 16.879 -9.687 1.00 0.00 H new ATOM 0 HG SER B 382 6.092 15.929 -10.821 1.00 0.00 H new ATOM 1320 N LEU B 383 6.243 14.503 -6.615 1.00 0.00 N ATOM 1321 CA LEU B 383 7.527 14.375 -5.934 1.00 0.00 C ATOM 1322 C LEU B 383 8.433 13.359 -6.629 1.00 0.00 C ATOM 1323 O LEU B 383 8.445 13.268 -7.856 1.00 0.00 O ATOM 1324 CB LEU B 383 7.309 13.989 -4.469 1.00 0.00 C ATOM 1325 CG LEU B 383 8.365 14.521 -3.494 1.00 0.00 C ATOM 1326 CD1 LEU B 383 8.742 15.953 -3.838 1.00 0.00 C ATOM 1327 CD2 LEU B 383 7.857 14.432 -2.063 1.00 0.00 C ATOM 0 H LEU B 383 5.636 13.687 -6.535 1.00 0.00 H new ATOM 0 HA LEU B 383 8.028 15.342 -5.976 1.00 0.00 H new ATOM 0 HB2 LEU B 383 6.331 14.353 -4.155 1.00 0.00 H new ATOM 0 HB3 LEU B 383 7.284 12.902 -4.395 1.00 0.00 H new ATOM 0 HG LEU B 383 9.258 13.903 -3.584 1.00 0.00 H new ATOM 0 HD11 LEU B 383 9.493 16.311 -3.133 1.00 0.00 H new ATOM 0 HD12 LEU B 383 9.147 15.990 -4.849 1.00 0.00 H new ATOM 0 HD13 LEU B 383 7.857 16.587 -3.778 1.00 0.00 H new ATOM 0 HD21 LEU B 383 8.618 14.813 -1.382 1.00 0.00 H new ATOM 0 HD22 LEU B 383 6.949 15.026 -1.962 1.00 0.00 H new ATOM 0 HD23 LEU B 383 7.639 13.392 -1.818 1.00 0.00 H new ATOM 1339 N ARG B 384 9.206 12.607 -5.843 1.00 0.00 N ATOM 1340 CA ARG B 384 10.120 11.625 -6.400 1.00 0.00 C ATOM 1341 C ARG B 384 10.301 10.428 -5.471 1.00 0.00 C ATOM 1342 O ARG B 384 11.417 9.937 -5.302 1.00 0.00 O ATOM 1343 CB ARG B 384 11.480 12.273 -6.670 1.00 0.00 C ATOM 1344 CG ARG B 384 12.233 11.656 -7.837 1.00 0.00 C ATOM 1345 CD ARG B 384 11.890 12.352 -9.142 1.00 0.00 C ATOM 1346 NE ARG B 384 13.035 12.425 -10.044 1.00 0.00 N ATOM 1347 CZ ARG B 384 13.035 13.127 -11.172 1.00 0.00 C ATOM 1348 NH1 ARG B 384 11.954 13.802 -11.535 1.00 0.00 N ATOM 1349 NH2 ARG B 384 14.116 13.151 -11.939 1.00 0.00 N ATOM 0 H ARG B 384 9.213 12.663 -4.825 1.00 0.00 H new ATOM 0 HA ARG B 384 9.688 11.265 -7.333 1.00 0.00 H new ATOM 0 HB2 ARG B 384 11.333 13.335 -6.865 1.00 0.00 H new ATOM 0 HB3 ARG B 384 12.093 12.196 -5.772 1.00 0.00 H new ATOM 0 HG2 ARG B 384 13.306 11.723 -7.657 1.00 0.00 H new ATOM 0 HG3 ARG B 384 11.988 10.596 -7.912 1.00 0.00 H new ATOM 0 HD2 ARG B 384 11.076 11.819 -9.633 1.00 0.00 H new ATOM 0 HD3 ARG B 384 11.530 13.359 -8.931 1.00 0.00 H new ATOM 0 HE ARG B 384 13.880 11.910 -9.795 1.00 0.00 H new ATOM 0 HH11 ARG B 384 11.120 13.783 -10.948 1.00 0.00 H new ATOM 0 HH12 ARG B 384 11.956 14.340 -12.401 1.00 0.00 H new ATOM 0 HH21 ARG B 384 14.949 12.630 -11.663 1.00 0.00 H new ATOM 0 HH22 ARG B 384 14.115 13.690 -12.805 1.00 0.00 H new ATOM 1363 N LEU B 385 9.207 9.929 -4.900 1.00 0.00 N ATOM 1364 CA LEU B 385 9.253 8.759 -4.032 1.00 0.00 C ATOM 1365 C LEU B 385 8.156 7.801 -4.475 1.00 0.00 C ATOM 1366 O LEU B 385 6.995 8.201 -4.562 1.00 0.00 O ATOM 1367 CB LEU B 385 9.067 9.168 -2.565 1.00 0.00 C ATOM 1368 CG LEU B 385 7.638 9.084 -2.029 1.00 0.00 C ATOM 1369 CD1 LEU B 385 7.641 9.203 -0.513 1.00 0.00 C ATOM 1370 CD2 LEU B 385 6.772 10.171 -2.645 1.00 0.00 C ATOM 0 H LEU B 385 8.274 10.321 -5.025 1.00 0.00 H new ATOM 0 HA LEU B 385 10.224 8.270 -4.109 1.00 0.00 H new ATOM 0 HB2 LEU B 385 9.705 8.536 -1.947 1.00 0.00 H new ATOM 0 HB3 LEU B 385 9.421 10.192 -2.445 1.00 0.00 H new ATOM 0 HG LEU B 385 7.219 8.116 -2.304 1.00 0.00 H new ATOM 0 HD11 LEU B 385 6.618 9.142 -0.141 1.00 0.00 H new ATOM 0 HD12 LEU B 385 8.231 8.393 -0.086 1.00 0.00 H new ATOM 0 HD13 LEU B 385 8.076 10.160 -0.224 1.00 0.00 H new ATOM 0 HD21 LEU B 385 5.758 10.095 -2.251 1.00 0.00 H new ATOM 0 HD22 LEU B 385 7.185 11.149 -2.398 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.751 10.049 -3.728 1.00 0.00 H new ATOM 1382 N HIS B 386 8.486 6.541 -4.740 1.00 0.00 N ATOM 1383 CA HIS B 386 7.478 5.569 -5.144 1.00 0.00 C ATOM 1384 C HIS B 386 7.575 4.312 -4.282 1.00 0.00 C ATOM 1385 O HIS B 386 8.537 4.146 -3.528 1.00 0.00 O ATOM 1386 CB HIS B 386 7.647 5.211 -6.623 1.00 0.00 C ATOM 1387 CG HIS B 386 8.899 4.446 -6.917 1.00 0.00 C ATOM 1388 ND1 HIS B 386 9.112 3.779 -8.105 1.00 0.00 N ATOM 1389 CD2 HIS B 386 10.012 4.245 -6.170 1.00 0.00 C ATOM 1390 CE1 HIS B 386 10.299 3.201 -8.076 1.00 0.00 C ATOM 1391 NE2 HIS B 386 10.865 3.469 -6.914 1.00 0.00 N ATOM 0 H HIS B 386 9.435 6.172 -4.683 1.00 0.00 H new ATOM 0 HA HIS B 386 6.493 6.013 -5.002 1.00 0.00 H new ATOM 0 HB2 HIS B 386 6.788 4.623 -6.946 1.00 0.00 H new ATOM 0 HB3 HIS B 386 7.645 6.128 -7.212 1.00 0.00 H new ATOM 0 HD1 HIS B 386 8.455 3.738 -8.884 1.00 0.00 H new ATOM 0 HD2 HIS B 386 10.194 4.625 -5.175 1.00 0.00 H new ATOM 0 HE1 HIS B 386 10.733 2.609 -8.869 1.00 0.00 H new ATOM 1400 N TYR B 387 6.605 3.412 -4.414 1.00 0.00 N ATOM 1401 CA TYR B 387 6.629 2.163 -3.661 1.00 0.00 C ATOM 1402 C TYR B 387 7.190 1.033 -4.519 1.00 0.00 C ATOM 1403 O TYR B 387 6.529 0.555 -5.441 1.00 0.00 O ATOM 1404 CB TYR B 387 5.226 1.798 -3.191 1.00 0.00 C ATOM 1405 CG TYR B 387 4.688 2.751 -2.158 1.00 0.00 C ATOM 1406 CD1 TYR B 387 4.010 3.898 -2.537 1.00 0.00 C ATOM 1407 CD2 TYR B 387 4.869 2.510 -0.805 1.00 0.00 C ATOM 1408 CE1 TYR B 387 3.526 4.779 -1.596 1.00 0.00 C ATOM 1409 CE2 TYR B 387 4.386 3.389 0.142 1.00 0.00 C ATOM 1410 CZ TYR B 387 3.715 4.521 -0.257 1.00 0.00 C ATOM 1411 OH TYR B 387 3.232 5.399 0.685 1.00 0.00 O ATOM 0 H TYR B 387 5.799 3.523 -5.030 1.00 0.00 H new ATOM 0 HA TYR B 387 7.272 2.303 -2.792 1.00 0.00 H new ATOM 0 HB2 TYR B 387 4.554 1.782 -4.049 1.00 0.00 H new ATOM 0 HB3 TYR B 387 5.238 0.790 -2.777 1.00 0.00 H new ATOM 0 HD1 TYR B 387 3.859 4.104 -3.586 1.00 0.00 H new ATOM 0 HD2 TYR B 387 5.395 1.622 -0.488 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.000 5.669 -1.907 1.00 0.00 H new ATOM 0 HE2 TYR B 387 4.534 3.189 1.193 1.00 0.00 H new ATOM 0 HH TYR B 387 3.516 6.310 0.459 1.00 0.00 H new ATOM 1421 N VAL B 388 8.407 0.607 -4.204 1.00 0.00 N ATOM 1422 CA VAL B 388 9.047 -0.474 -4.943 1.00 0.00 C ATOM 1423 C VAL B 388 8.654 -1.820 -4.353 1.00 0.00 C ATOM 1424 O VAL B 388 8.774 -2.040 -3.147 1.00 0.00 O ATOM 1425 CB VAL B 388 10.580 -0.338 -4.933 1.00 0.00 C ATOM 1426 CG1 VAL B 388 11.005 0.971 -5.580 1.00 0.00 C ATOM 1427 CG2 VAL B 388 11.118 -0.438 -3.516 1.00 0.00 C ATOM 0 H VAL B 388 8.969 0.992 -3.445 1.00 0.00 H new ATOM 0 HA VAL B 388 8.705 -0.411 -5.976 1.00 0.00 H new ATOM 0 HB VAL B 388 11.001 -1.158 -5.515 1.00 0.00 H new ATOM 0 HG11 VAL B 388 12.092 1.049 -5.563 1.00 0.00 H new ATOM 0 HG12 VAL B 388 10.655 0.997 -6.612 1.00 0.00 H new ATOM 0 HG13 VAL B 388 10.573 1.806 -5.029 1.00 0.00 H new ATOM 0 HG21 VAL B 388 12.203 -0.339 -3.531 1.00 0.00 H new ATOM 0 HG22 VAL B 388 10.690 0.358 -2.907 1.00 0.00 H new ATOM 0 HG23 VAL B 388 10.847 -1.405 -3.091 1.00 0.00 H new ATOM 1437 N THR B 389 8.160 -2.715 -5.200 1.00 0.00 N ATOM 1438 CA THR B 389 7.727 -4.028 -4.742 1.00 0.00 C ATOM 1439 C THR B 389 8.755 -5.114 -5.045 1.00 0.00 C ATOM 1440 O THR B 389 9.051 -5.401 -6.205 1.00 0.00 O ATOM 1441 CB THR B 389 6.374 -4.420 -5.371 1.00 0.00 C ATOM 1442 OG1 THR B 389 5.674 -5.365 -4.553 1.00 0.00 O ATOM 1443 CG2 THR B 389 6.565 -5.030 -6.754 1.00 0.00 C ATOM 0 H THR B 389 8.050 -2.557 -6.202 1.00 0.00 H new ATOM 0 HA THR B 389 7.617 -3.952 -3.660 1.00 0.00 H new ATOM 0 HB THR B 389 5.790 -3.503 -5.452 1.00 0.00 H new ATOM 0 HG1 THR B 389 4.820 -5.594 -4.975 1.00 0.00 H new ATOM 0 HG21 THR B 389 5.594 -5.296 -7.172 1.00 0.00 H new ATOM 0 HG22 THR B 389 7.055 -4.307 -7.406 1.00 0.00 H new ATOM 0 HG23 THR B 389 7.183 -5.924 -6.675 1.00 0.00 H new ATOM 1451 N VAL B 390 9.272 -5.731 -3.989 1.00 0.00 N ATOM 1452 CA VAL B 390 10.240 -6.810 -4.123 1.00 0.00 C ATOM 1453 C VAL B 390 9.791 -8.008 -3.295 1.00 0.00 C ATOM 1454 O VAL B 390 9.557 -7.890 -2.089 1.00 0.00 O ATOM 1455 CB VAL B 390 11.653 -6.380 -3.684 1.00 0.00 C ATOM 1456 CG1 VAL B 390 12.312 -5.530 -4.760 1.00 0.00 C ATOM 1457 CG2 VAL B 390 11.601 -5.631 -2.364 1.00 0.00 C ATOM 0 H VAL B 390 9.034 -5.499 -3.025 1.00 0.00 H new ATOM 0 HA VAL B 390 10.289 -7.078 -5.178 1.00 0.00 H new ATOM 0 HB VAL B 390 12.255 -7.278 -3.541 1.00 0.00 H new ATOM 0 HG11 VAL B 390 13.309 -5.236 -4.432 1.00 0.00 H new ATOM 0 HG12 VAL B 390 12.389 -6.106 -5.682 1.00 0.00 H new ATOM 0 HG13 VAL B 390 11.711 -4.638 -4.938 1.00 0.00 H new ATOM 0 HG21 VAL B 390 12.609 -5.337 -2.073 1.00 0.00 H new ATOM 0 HG22 VAL B 390 10.981 -4.741 -2.475 1.00 0.00 H new ATOM 0 HG23 VAL B 390 11.175 -6.277 -1.596 1.00 0.00 H new ATOM 1467 N LYS B 391 9.634 -9.153 -3.947 1.00 0.00 N ATOM 1468 CA LYS B 391 9.180 -10.345 -3.255 1.00 0.00 C ATOM 1469 C LYS B 391 9.142 -11.560 -4.179 1.00 0.00 C ATOM 1470 O LYS B 391 9.150 -11.430 -5.403 1.00 0.00 O ATOM 1471 CB LYS B 391 7.808 -10.085 -2.626 1.00 0.00 C ATOM 1472 CG LYS B 391 6.640 -10.727 -3.361 1.00 0.00 C ATOM 1473 CD LYS B 391 6.499 -10.182 -4.773 1.00 0.00 C ATOM 1474 CE LYS B 391 6.019 -8.740 -4.771 1.00 0.00 C ATOM 1475 NZ LYS B 391 4.558 -8.640 -4.504 1.00 0.00 N ATOM 0 H LYS B 391 9.813 -9.278 -4.943 1.00 0.00 H new ATOM 0 HA LYS B 391 9.895 -10.575 -2.465 1.00 0.00 H new ATOM 0 HB2 LYS B 391 7.819 -10.451 -1.599 1.00 0.00 H new ATOM 0 HB3 LYS B 391 7.643 -9.009 -2.579 1.00 0.00 H new ATOM 0 HG2 LYS B 391 6.783 -11.807 -3.400 1.00 0.00 H new ATOM 0 HG3 LYS B 391 5.718 -10.548 -2.807 1.00 0.00 H new ATOM 0 HD2 LYS B 391 7.459 -10.246 -5.286 1.00 0.00 H new ATOM 0 HD3 LYS B 391 5.797 -10.799 -5.333 1.00 0.00 H new ATOM 0 HE2 LYS B 391 6.565 -8.177 -4.014 1.00 0.00 H new ATOM 0 HE3 LYS B 391 6.244 -8.281 -5.734 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 4.271 -7.640 -4.511 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 4.035 -9.156 -5.240 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 4.346 -9.054 -3.574 1.00 0.00 H new ATOM 1489 N LYS B 392 9.064 -12.738 -3.574 1.00 0.00 N ATOM 1490 CA LYS B 392 8.977 -13.990 -4.312 1.00 0.00 C ATOM 1491 C LYS B 392 7.893 -14.856 -3.684 1.00 0.00 C ATOM 1492 O LYS B 392 8.177 -15.724 -2.859 1.00 0.00 O ATOM 1493 CB LYS B 392 10.320 -14.720 -4.292 1.00 0.00 C ATOM 1494 CG LYS B 392 11.450 -13.916 -4.912 1.00 0.00 C ATOM 1495 CD LYS B 392 11.236 -13.706 -6.404 1.00 0.00 C ATOM 1496 CE LYS B 392 10.610 -14.928 -7.059 1.00 0.00 C ATOM 1497 NZ LYS B 392 10.886 -14.980 -8.521 1.00 0.00 N ATOM 0 H LYS B 392 9.059 -12.852 -2.560 1.00 0.00 H new ATOM 0 HA LYS B 392 8.724 -13.782 -5.352 1.00 0.00 H new ATOM 0 HB2 LYS B 392 10.579 -14.962 -3.261 1.00 0.00 H new ATOM 0 HB3 LYS B 392 10.220 -15.665 -4.826 1.00 0.00 H new ATOM 0 HG2 LYS B 392 11.524 -12.949 -4.415 1.00 0.00 H new ATOM 0 HG3 LYS B 392 12.396 -14.432 -4.749 1.00 0.00 H new ATOM 0 HD2 LYS B 392 10.594 -12.839 -6.561 1.00 0.00 H new ATOM 0 HD3 LYS B 392 12.191 -13.486 -6.881 1.00 0.00 H new ATOM 0 HE2 LYS B 392 10.995 -15.831 -6.585 1.00 0.00 H new ATOM 0 HE3 LYS B 392 9.533 -14.916 -6.894 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 10.442 -15.828 -8.928 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 10.496 -14.131 -8.978 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 11.913 -15.018 -8.679 1.00 0.00 H new ATOM 1511 N PRO B 393 6.623 -14.605 -4.042 1.00 0.00 N ATOM 1512 CA PRO B 393 5.486 -15.331 -3.488 1.00 0.00 C ATOM 1513 C PRO B 393 5.227 -16.663 -4.178 1.00 0.00 C ATOM 1514 O PRO B 393 4.601 -16.719 -5.237 1.00 0.00 O ATOM 1515 CB PRO B 393 4.301 -14.377 -3.716 1.00 0.00 C ATOM 1516 CG PRO B 393 4.854 -13.175 -4.427 1.00 0.00 C ATOM 1517 CD PRO B 393 6.190 -13.577 -4.984 1.00 0.00 C ATOM 0 HA PRO B 393 5.657 -15.590 -2.443 1.00 0.00 H new ATOM 0 HB2 PRO B 393 3.525 -14.857 -4.312 1.00 0.00 H new ATOM 0 HB3 PRO B 393 3.844 -14.092 -2.768 1.00 0.00 H new ATOM 0 HG2 PRO B 393 4.183 -12.855 -5.224 1.00 0.00 H new ATOM 0 HG3 PRO B 393 4.958 -12.334 -3.741 1.00 0.00 H new ATOM 0 HD2 PRO B 393 6.107 -13.965 -5.999 1.00 0.00 H new ATOM 0 HD3 PRO B 393 6.885 -12.738 -5.019 1.00 0.00 H new ATOM 1525 N THR B 394 5.708 -17.735 -3.562 1.00 0.00 N ATOM 1526 CA THR B 394 5.529 -19.075 -4.099 1.00 0.00 C ATOM 1527 C THR B 394 4.697 -19.929 -3.149 1.00 0.00 C ATOM 1528 O THR B 394 4.439 -19.536 -2.012 1.00 0.00 O ATOM 1529 CB THR B 394 6.884 -19.771 -4.334 1.00 0.00 C ATOM 1530 OG1 THR B 394 7.959 -19.033 -3.743 1.00 0.00 O ATOM 1531 CG2 THR B 394 7.168 -19.926 -5.820 1.00 0.00 C ATOM 0 H THR B 394 6.228 -17.700 -2.685 1.00 0.00 H new ATOM 0 HA THR B 394 5.011 -18.972 -5.052 1.00 0.00 H new ATOM 0 HB THR B 394 6.818 -20.753 -3.866 1.00 0.00 H new ATOM 0 HG1 THR B 394 8.805 -19.500 -3.907 1.00 0.00 H new ATOM 0 HG21 THR B 394 8.130 -20.420 -5.957 1.00 0.00 H new ATOM 0 HG22 THR B 394 6.383 -20.526 -6.280 1.00 0.00 H new ATOM 0 HG23 THR B 394 7.195 -18.943 -6.290 1.00 0.00 H new ATOM 1539 N ALA B 395 4.296 -21.105 -3.618 1.00 0.00 N ATOM 1540 CA ALA B 395 3.507 -22.022 -2.803 1.00 0.00 C ATOM 1541 C ALA B 395 4.381 -22.711 -1.755 1.00 0.00 C ATOM 1542 O ALA B 395 3.906 -23.547 -0.988 1.00 0.00 O ATOM 1543 CB ALA B 395 2.821 -23.061 -3.674 1.00 0.00 C ATOM 0 H ALA B 395 4.504 -21.446 -4.557 1.00 0.00 H new ATOM 0 HA ALA B 395 2.744 -21.438 -2.288 1.00 0.00 H new ATOM 0 HB1 ALA B 395 2.238 -23.735 -3.046 1.00 0.00 H new ATOM 0 HB2 ALA B 395 2.160 -22.562 -4.383 1.00 0.00 H new ATOM 0 HB3 ALA B 395 3.572 -23.632 -4.219 1.00 0.00 H new ATOM 1549 N VAL B 396 5.659 -22.344 -1.728 1.00 0.00 N ATOM 1550 CA VAL B 396 6.602 -22.914 -0.776 1.00 0.00 C ATOM 1551 C VAL B 396 7.062 -21.857 0.228 1.00 0.00 C ATOM 1552 O VAL B 396 7.148 -22.118 1.428 1.00 0.00 O ATOM 1553 CB VAL B 396 7.825 -23.551 -1.501 1.00 0.00 C ATOM 1554 CG1 VAL B 396 7.610 -23.559 -3.007 1.00 0.00 C ATOM 1555 CG2 VAL B 396 9.135 -22.842 -1.162 1.00 0.00 C ATOM 0 H VAL B 396 6.065 -21.652 -2.358 1.00 0.00 H new ATOM 0 HA VAL B 396 6.087 -23.706 -0.233 1.00 0.00 H new ATOM 0 HB VAL B 396 7.906 -24.577 -1.143 1.00 0.00 H new ATOM 0 HG11 VAL B 396 8.475 -24.008 -3.496 1.00 0.00 H new ATOM 0 HG12 VAL B 396 6.718 -24.139 -3.244 1.00 0.00 H new ATOM 0 HG13 VAL B 396 7.483 -22.536 -3.362 1.00 0.00 H new ATOM 0 HG21 VAL B 396 9.957 -23.323 -1.692 1.00 0.00 H new ATOM 0 HG22 VAL B 396 9.072 -21.797 -1.464 1.00 0.00 H new ATOM 0 HG23 VAL B 396 9.313 -22.900 -0.088 1.00 0.00 H new ATOM 1565 N ASP B 397 7.372 -20.669 -0.283 1.00 0.00 N ATOM 1566 CA ASP B 397 7.844 -19.574 0.556 1.00 0.00 C ATOM 1567 C ASP B 397 7.192 -18.250 0.160 1.00 0.00 C ATOM 1568 O ASP B 397 7.668 -17.556 -0.738 1.00 0.00 O ATOM 1569 CB ASP B 397 9.363 -19.460 0.441 1.00 0.00 C ATOM 1570 CG ASP B 397 9.954 -18.507 1.462 1.00 0.00 C ATOM 1571 OD1 ASP B 397 9.293 -18.255 2.491 1.00 0.00 O ATOM 1572 OD2 ASP B 397 11.078 -18.013 1.232 1.00 0.00 O ATOM 0 H ASP B 397 7.304 -20.441 -1.275 1.00 0.00 H new ATOM 0 HA ASP B 397 7.567 -19.790 1.588 1.00 0.00 H new ATOM 0 HB2 ASP B 397 9.809 -20.446 0.569 1.00 0.00 H new ATOM 0 HB3 ASP B 397 9.624 -19.120 -0.561 1.00 0.00 H new ATOM 1577 N PRO B 398 6.092 -17.883 0.835 1.00 0.00 N ATOM 1578 CA PRO B 398 5.365 -16.646 0.572 1.00 0.00 C ATOM 1579 C PRO B 398 5.887 -15.483 1.404 1.00 0.00 C ATOM 1580 O PRO B 398 5.579 -15.360 2.589 1.00 0.00 O ATOM 1581 CB PRO B 398 3.957 -17.013 0.999 1.00 0.00 C ATOM 1582 CG PRO B 398 4.167 -17.906 2.173 1.00 0.00 C ATOM 1583 CD PRO B 398 5.459 -18.650 1.920 1.00 0.00 C ATOM 0 HA PRO B 398 5.454 -16.312 -0.462 1.00 0.00 H new ATOM 0 HB2 PRO B 398 3.376 -16.130 1.266 1.00 0.00 H new ATOM 0 HB3 PRO B 398 3.416 -17.521 0.201 1.00 0.00 H new ATOM 0 HG2 PRO B 398 4.226 -17.327 3.095 1.00 0.00 H new ATOM 0 HG3 PRO B 398 3.335 -18.601 2.286 1.00 0.00 H new ATOM 0 HD2 PRO B 398 6.087 -18.678 2.811 1.00 0.00 H new ATOM 0 HD3 PRO B 398 5.276 -19.684 1.627 1.00 0.00 H new ATOM 1591 N ASN B 399 6.678 -14.639 0.768 1.00 0.00 N ATOM 1592 CA ASN B 399 7.258 -13.476 1.432 1.00 0.00 C ATOM 1593 C ASN B 399 6.992 -12.202 0.634 1.00 0.00 C ATOM 1594 O ASN B 399 7.133 -12.183 -0.589 1.00 0.00 O ATOM 1595 CB ASN B 399 8.764 -13.671 1.615 1.00 0.00 C ATOM 1596 CG ASN B 399 9.404 -14.360 0.426 1.00 0.00 C ATOM 1597 OD1 ASN B 399 9.719 -13.587 -0.607 1.00 0.00 O flip ATOM 1598 ND2 ASN B 399 9.612 -15.573 0.434 1.00 0.00 N flip ATOM 0 H ASN B 399 6.938 -14.734 -0.214 1.00 0.00 H new ATOM 0 HA ASN B 399 6.787 -13.374 2.410 1.00 0.00 H new ATOM 0 HB2 ASN B 399 9.238 -12.701 1.768 1.00 0.00 H new ATOM 0 HB3 ASN B 399 8.945 -14.260 2.514 1.00 0.00 H new ATOM 0 HD21 ASN B 399 9.354 -16.129 1.249 1.00 0.00 H new ATOM 0 HD22 ASN B 399 10.042 -16.022 -0.374 1.00 0.00 H new ATOM 1605 N SER B 400 6.606 -11.139 1.335 1.00 0.00 N ATOM 1606 CA SER B 400 6.321 -9.859 0.692 1.00 0.00 C ATOM 1607 C SER B 400 7.079 -8.723 1.376 1.00 0.00 C ATOM 1608 O SER B 400 6.843 -8.427 2.547 1.00 0.00 O ATOM 1609 CB SER B 400 4.814 -9.579 0.711 1.00 0.00 C ATOM 1610 OG SER B 400 4.169 -10.200 -0.388 1.00 0.00 O ATOM 0 H SER B 400 6.483 -11.138 2.348 1.00 0.00 H new ATOM 0 HA SER B 400 6.656 -9.917 -0.344 1.00 0.00 H new ATOM 0 HB2 SER B 400 4.384 -9.944 1.644 1.00 0.00 H new ATOM 0 HB3 SER B 400 4.640 -8.503 0.679 1.00 0.00 H new ATOM 0 HG SER B 400 3.313 -10.576 -0.095 1.00 0.00 H new ATOM 1616 N ILE B 401 7.986 -8.082 0.636 1.00 0.00 N ATOM 1617 CA ILE B 401 8.772 -6.975 1.168 1.00 0.00 C ATOM 1618 C ILE B 401 8.682 -5.776 0.232 1.00 0.00 C ATOM 1619 O ILE B 401 8.816 -5.917 -0.981 1.00 0.00 O ATOM 1620 CB ILE B 401 10.253 -7.373 1.351 1.00 0.00 C ATOM 1621 CG1 ILE B 401 11.121 -6.132 1.570 1.00 0.00 C ATOM 1622 CG2 ILE B 401 10.744 -8.164 0.150 1.00 0.00 C ATOM 1623 CD1 ILE B 401 12.519 -6.453 2.053 1.00 0.00 C ATOM 0 H ILE B 401 8.192 -8.314 -0.336 1.00 0.00 H new ATOM 0 HA ILE B 401 8.363 -6.714 2.144 1.00 0.00 H new ATOM 0 HB ILE B 401 10.332 -8.006 2.235 1.00 0.00 H new ATOM 0 HG12 ILE B 401 11.187 -5.574 0.636 1.00 0.00 H new ATOM 0 HG13 ILE B 401 10.634 -5.481 2.296 1.00 0.00 H new ATOM 0 HG21 ILE B 401 11.789 -8.436 0.296 1.00 0.00 H new ATOM 0 HG22 ILE B 401 10.146 -9.068 0.041 1.00 0.00 H new ATOM 0 HG23 ILE B 401 10.650 -7.556 -0.750 1.00 0.00 H new ATOM 0 HD11 ILE B 401 13.079 -5.528 2.187 1.00 0.00 H new ATOM 0 HD12 ILE B 401 12.463 -6.984 3.003 1.00 0.00 H new ATOM 0 HD13 ILE B 401 13.024 -7.079 1.317 1.00 0.00 H new ATOM 1635 N VAL B 402 8.435 -4.601 0.795 1.00 0.00 N ATOM 1636 CA VAL B 402 8.314 -3.388 -0.003 1.00 0.00 C ATOM 1637 C VAL B 402 9.287 -2.321 0.469 1.00 0.00 C ATOM 1638 O VAL B 402 9.662 -2.281 1.641 1.00 0.00 O ATOM 1639 CB VAL B 402 6.887 -2.816 0.049 1.00 0.00 C ATOM 1640 CG1 VAL B 402 6.106 -3.210 -1.191 1.00 0.00 C ATOM 1641 CG2 VAL B 402 6.175 -3.284 1.304 1.00 0.00 C ATOM 0 H VAL B 402 8.315 -4.462 1.798 1.00 0.00 H new ATOM 0 HA VAL B 402 8.549 -3.666 -1.030 1.00 0.00 H new ATOM 0 HB VAL B 402 6.952 -1.728 0.076 1.00 0.00 H new ATOM 0 HG11 VAL B 402 5.100 -2.795 -1.134 1.00 0.00 H new ATOM 0 HG12 VAL B 402 6.609 -2.822 -2.077 1.00 0.00 H new ATOM 0 HG13 VAL B 402 6.048 -4.297 -1.254 1.00 0.00 H new ATOM 0 HG21 VAL B 402 5.167 -2.871 1.326 1.00 0.00 H new ATOM 0 HG22 VAL B 402 6.121 -4.373 1.307 1.00 0.00 H new ATOM 0 HG23 VAL B 402 6.725 -2.945 2.182 1.00 0.00 H new ATOM 1651 N GLU B 403 9.690 -1.455 -0.454 1.00 0.00 N ATOM 1652 CA GLU B 403 10.620 -0.384 -0.134 1.00 0.00 C ATOM 1653 C GLU B 403 10.104 0.958 -0.644 1.00 0.00 C ATOM 1654 O GLU B 403 10.037 1.197 -1.850 1.00 0.00 O ATOM 1655 CB GLU B 403 12.001 -0.678 -0.725 1.00 0.00 C ATOM 1656 CG GLU B 403 12.130 -2.078 -1.307 1.00 0.00 C ATOM 1657 CD GLU B 403 13.417 -2.271 -2.087 1.00 0.00 C ATOM 1658 OE1 GLU B 403 13.828 -1.329 -2.796 1.00 0.00 O ATOM 1659 OE2 GLU B 403 14.011 -3.364 -1.989 1.00 0.00 O ATOM 0 H GLU B 403 9.387 -1.475 -1.428 1.00 0.00 H new ATOM 0 HA GLU B 403 10.707 -0.328 0.951 1.00 0.00 H new ATOM 0 HB2 GLU B 403 12.216 0.052 -1.506 1.00 0.00 H new ATOM 0 HB3 GLU B 403 12.755 -0.546 0.051 1.00 0.00 H new ATOM 0 HG2 GLU B 403 12.086 -2.808 -0.499 1.00 0.00 H new ATOM 0 HG3 GLU B 403 11.280 -2.275 -1.961 1.00 0.00 H new ATOM 1666 N CYS B 404 9.767 1.836 0.291 1.00 0.00 N ATOM 1667 CA CYS B 404 9.287 3.165 -0.037 1.00 0.00 C ATOM 1668 C CYS B 404 10.478 4.073 -0.297 1.00 0.00 C ATOM 1669 O CYS B 404 11.069 4.616 0.644 1.00 0.00 O ATOM 1670 CB CYS B 404 8.433 3.724 1.102 1.00 0.00 C ATOM 1671 SG CYS B 404 7.572 5.261 0.695 1.00 0.00 S ATOM 0 H CYS B 404 9.819 1.646 1.292 1.00 0.00 H new ATOM 0 HA CYS B 404 8.666 3.113 -0.931 1.00 0.00 H new ATOM 0 HB2 CYS B 404 7.697 2.974 1.392 1.00 0.00 H new ATOM 0 HB3 CYS B 404 9.071 3.896 1.969 1.00 0.00 H new ATOM 0 HG CYS B 404 6.324 5.004 0.438 1.00 0.00 H new ATOM 1677 N ARG B 405 10.838 4.203 -1.575 1.00 0.00 N ATOM 1678 CA ARG B 405 11.978 5.018 -1.981 1.00 0.00 C ATOM 1679 C ARG B 405 11.560 6.457 -2.252 1.00 0.00 C ATOM 1680 O ARG B 405 10.438 6.719 -2.686 1.00 0.00 O ATOM 1681 CB ARG B 405 12.633 4.422 -3.230 1.00 0.00 C ATOM 1682 CG ARG B 405 13.746 5.283 -3.802 1.00 0.00 C ATOM 1683 CD ARG B 405 14.278 4.708 -5.104 1.00 0.00 C ATOM 1684 NE ARG B 405 14.545 5.749 -6.093 1.00 0.00 N ATOM 1685 CZ ARG B 405 15.182 5.528 -7.238 1.00 0.00 C ATOM 1686 NH1 ARG B 405 15.607 4.308 -7.536 1.00 0.00 N ATOM 1687 NH2 ARG B 405 15.391 6.524 -8.087 1.00 0.00 N ATOM 0 H ARG B 405 10.351 3.750 -2.349 1.00 0.00 H new ATOM 0 HA ARG B 405 12.697 5.021 -1.162 1.00 0.00 H new ATOM 0 HB2 ARG B 405 13.035 3.439 -2.985 1.00 0.00 H new ATOM 0 HB3 ARG B 405 11.870 4.274 -3.994 1.00 0.00 H new ATOM 0 HG2 ARG B 405 13.375 6.293 -3.973 1.00 0.00 H new ATOM 0 HG3 ARG B 405 14.557 5.360 -3.078 1.00 0.00 H new ATOM 0 HD2 ARG B 405 15.194 4.152 -4.907 1.00 0.00 H new ATOM 0 HD3 ARG B 405 13.556 3.999 -5.509 1.00 0.00 H new ATOM 0 HE ARG B 405 14.225 6.697 -5.894 1.00 0.00 H new ATOM 0 HH11 ARG B 405 15.445 3.539 -6.886 1.00 0.00 H new ATOM 0 HH12 ARG B 405 16.096 4.139 -8.415 1.00 0.00 H new ATOM 0 HH21 ARG B 405 15.063 7.463 -7.862 1.00 0.00 H new ATOM 0 HH22 ARG B 405 15.880 6.351 -8.965 1.00 0.00 H new ATOM 1701 N VAL B 406 12.474 7.386 -1.985 1.00 0.00 N ATOM 1702 CA VAL B 406 12.208 8.802 -2.184 1.00 0.00 C ATOM 1703 C VAL B 406 13.371 9.501 -2.874 1.00 0.00 C ATOM 1704 O VAL B 406 14.340 8.867 -3.296 1.00 0.00 O ATOM 1705 CB VAL B 406 11.901 9.501 -0.836 1.00 0.00 C ATOM 1706 CG1 VAL B 406 11.369 8.492 0.162 1.00 0.00 C ATOM 1707 CG2 VAL B 406 13.132 10.201 -0.266 1.00 0.00 C ATOM 0 H VAL B 406 13.407 7.180 -1.629 1.00 0.00 H new ATOM 0 HA VAL B 406 11.334 8.876 -2.831 1.00 0.00 H new ATOM 0 HB VAL B 406 11.144 10.263 -1.023 1.00 0.00 H new ATOM 0 HG11 VAL B 406 11.156 8.992 1.107 1.00 0.00 H new ATOM 0 HG12 VAL B 406 10.454 8.044 -0.226 1.00 0.00 H new ATOM 0 HG13 VAL B 406 12.114 7.713 0.324 1.00 0.00 H new ATOM 0 HG21 VAL B 406 12.874 10.678 0.679 1.00 0.00 H new ATOM 0 HG22 VAL B 406 13.922 9.469 -0.099 1.00 0.00 H new ATOM 0 HG23 VAL B 406 13.480 10.956 -0.971 1.00 0.00 H new ATOM 1717 N GLY B 407 13.262 10.821 -2.974 1.00 0.00 N ATOM 1718 CA GLY B 407 14.296 11.610 -3.601 1.00 0.00 C ATOM 1719 C GLY B 407 14.838 10.970 -4.859 1.00 0.00 C ATOM 1720 O GLY B 407 14.126 10.842 -5.855 1.00 0.00 O ATOM 0 H GLY B 407 12.467 11.359 -2.628 1.00 0.00 H new ATOM 0 HA2 GLY B 407 13.899 12.596 -3.842 1.00 0.00 H new ATOM 0 HA3 GLY B 407 15.112 11.759 -2.894 1.00 0.00 H new ATOM 1724 N ASP B 408 16.107 10.586 -4.821 1.00 0.00 N ATOM 1725 CA ASP B 408 16.753 9.977 -5.977 1.00 0.00 C ATOM 1726 C ASP B 408 17.334 8.605 -5.648 1.00 0.00 C ATOM 1727 O ASP B 408 18.163 8.086 -6.395 1.00 0.00 O ATOM 1728 CB ASP B 408 17.860 10.892 -6.500 1.00 0.00 C ATOM 1729 CG ASP B 408 18.681 11.500 -5.380 1.00 0.00 C ATOM 1730 OD1 ASP B 408 18.102 12.233 -4.550 1.00 0.00 O ATOM 1731 OD2 ASP B 408 19.903 11.243 -5.332 1.00 0.00 O ATOM 0 H ASP B 408 16.709 10.685 -4.004 1.00 0.00 H new ATOM 0 HA ASP B 408 15.991 9.842 -6.745 1.00 0.00 H new ATOM 0 HB2 ASP B 408 18.515 10.325 -7.161 1.00 0.00 H new ATOM 0 HB3 ASP B 408 17.417 11.689 -7.097 1.00 0.00 H new ATOM 1736 N GLY B 409 16.903 8.013 -4.540 1.00 0.00 N ATOM 1737 CA GLY B 409 17.412 6.706 -4.170 1.00 0.00 C ATOM 1738 C GLY B 409 17.523 6.515 -2.669 1.00 0.00 C ATOM 1739 O GLY B 409 18.508 5.963 -2.182 1.00 0.00 O ATOM 0 H GLY B 409 16.217 8.410 -3.897 1.00 0.00 H new ATOM 0 HA2 GLY B 409 16.757 5.938 -4.581 1.00 0.00 H new ATOM 0 HA3 GLY B 409 18.393 6.563 -4.622 1.00 0.00 H new ATOM 1743 N THR B 410 16.506 6.957 -1.937 1.00 0.00 N ATOM 1744 CA THR B 410 16.495 6.812 -0.485 1.00 0.00 C ATOM 1745 C THR B 410 15.273 6.023 -0.039 1.00 0.00 C ATOM 1746 O THR B 410 14.145 6.486 -0.182 1.00 0.00 O ATOM 1747 CB THR B 410 16.484 8.184 0.216 1.00 0.00 C ATOM 1748 OG1 THR B 410 17.706 8.897 -0.010 1.00 0.00 O ATOM 1749 CG2 THR B 410 16.288 8.026 1.716 1.00 0.00 C ATOM 0 H THR B 410 15.681 7.417 -2.323 1.00 0.00 H new ATOM 0 HA THR B 410 17.404 6.279 -0.206 1.00 0.00 H new ATOM 0 HB THR B 410 15.653 8.748 -0.208 1.00 0.00 H new ATOM 0 HG1 THR B 410 17.668 9.764 0.446 1.00 0.00 H new ATOM 0 HG21 THR B 410 16.284 9.009 2.188 1.00 0.00 H new ATOM 0 HG22 THR B 410 15.338 7.527 1.908 1.00 0.00 H new ATOM 0 HG23 THR B 410 17.101 7.429 2.128 1.00 0.00 H new ATOM 1757 N VAL B 411 15.493 4.831 0.504 1.00 0.00 N ATOM 1758 CA VAL B 411 14.393 3.995 0.959 1.00 0.00 C ATOM 1759 C VAL B 411 14.129 4.208 2.442 1.00 0.00 C ATOM 1760 O VAL B 411 14.966 3.890 3.286 1.00 0.00 O ATOM 1761 CB VAL B 411 14.682 2.505 0.704 1.00 0.00 C ATOM 1762 CG1 VAL B 411 13.665 1.630 1.420 1.00 0.00 C ATOM 1763 CG2 VAL B 411 14.689 2.215 -0.789 1.00 0.00 C ATOM 0 H VAL B 411 16.419 4.425 0.639 1.00 0.00 H new ATOM 0 HA VAL B 411 13.510 4.285 0.390 1.00 0.00 H new ATOM 0 HB VAL B 411 15.669 2.271 1.104 1.00 0.00 H new ATOM 0 HG11 VAL B 411 13.888 0.581 1.227 1.00 0.00 H new ATOM 0 HG12 VAL B 411 13.713 1.819 2.492 1.00 0.00 H new ATOM 0 HG13 VAL B 411 12.664 1.862 1.055 1.00 0.00 H new ATOM 0 HG21 VAL B 411 14.895 1.157 -0.953 1.00 0.00 H new ATOM 0 HG22 VAL B 411 13.717 2.466 -1.213 1.00 0.00 H new ATOM 0 HG23 VAL B 411 15.461 2.814 -1.272 1.00 0.00 H new ATOM 1773 N LEU B 412 12.961 4.754 2.751 1.00 0.00 N ATOM 1774 CA LEU B 412 12.587 5.018 4.131 1.00 0.00 C ATOM 1775 C LEU B 412 11.567 4.002 4.628 1.00 0.00 C ATOM 1776 O LEU B 412 11.559 3.650 5.808 1.00 0.00 O ATOM 1777 CB LEU B 412 12.017 6.432 4.262 1.00 0.00 C ATOM 1778 CG LEU B 412 13.038 7.556 4.093 1.00 0.00 C ATOM 1779 CD1 LEU B 412 12.478 8.655 3.204 1.00 0.00 C ATOM 1780 CD2 LEU B 412 13.440 8.118 5.447 1.00 0.00 C ATOM 0 H LEU B 412 12.257 5.022 2.064 1.00 0.00 H new ATOM 0 HA LEU B 412 13.484 4.932 4.745 1.00 0.00 H new ATOM 0 HB2 LEU B 412 11.230 6.561 3.519 1.00 0.00 H new ATOM 0 HB3 LEU B 412 11.549 6.530 5.242 1.00 0.00 H new ATOM 0 HG LEU B 412 13.927 7.145 3.614 1.00 0.00 H new ATOM 0 HD11 LEU B 412 13.219 9.447 3.095 1.00 0.00 H new ATOM 0 HD12 LEU B 412 12.239 8.243 2.223 1.00 0.00 H new ATOM 0 HD13 LEU B 412 11.574 9.063 3.656 1.00 0.00 H new ATOM 0 HD21 LEU B 412 14.168 8.917 5.308 1.00 0.00 H new ATOM 0 HD22 LEU B 412 12.559 8.513 5.953 1.00 0.00 H new ATOM 0 HD23 LEU B 412 13.882 7.327 6.053 1.00 0.00 H new ATOM 1792 N GLY B 413 10.693 3.546 3.736 1.00 0.00 N ATOM 1793 CA GLY B 413 9.675 2.591 4.142 1.00 0.00 C ATOM 1794 C GLY B 413 10.002 1.152 3.779 1.00 0.00 C ATOM 1795 O GLY B 413 10.307 0.847 2.631 1.00 0.00 O ATOM 0 H GLY B 413 10.670 3.815 2.752 1.00 0.00 H new ATOM 0 HA2 GLY B 413 9.535 2.661 5.221 1.00 0.00 H new ATOM 0 HA3 GLY B 413 8.727 2.866 3.679 1.00 0.00 H new ATOM 1799 N THR B 414 9.929 0.259 4.759 1.00 0.00 N ATOM 1800 CA THR B 414 10.206 -1.151 4.512 1.00 0.00 C ATOM 1801 C THR B 414 9.182 -2.050 5.181 1.00 0.00 C ATOM 1802 O THR B 414 9.223 -2.264 6.394 1.00 0.00 O ATOM 1803 CB THR B 414 11.600 -1.580 4.996 1.00 0.00 C ATOM 1804 OG1 THR B 414 12.106 -0.693 6.003 1.00 0.00 O ATOM 1805 CG2 THR B 414 12.587 -1.621 3.842 1.00 0.00 C ATOM 0 H THR B 414 9.683 0.483 5.723 1.00 0.00 H new ATOM 0 HA THR B 414 10.156 -1.263 3.429 1.00 0.00 H new ATOM 0 HB THR B 414 11.491 -2.577 5.423 1.00 0.00 H new ATOM 0 HG1 THR B 414 12.993 -0.996 6.290 1.00 0.00 H new ATOM 0 HG21 THR B 414 13.566 -1.927 4.211 1.00 0.00 H new ATOM 0 HG22 THR B 414 12.242 -2.334 3.093 1.00 0.00 H new ATOM 0 HG23 THR B 414 12.662 -0.631 3.392 1.00 0.00 H new ATOM 1813 N GLY B 415 8.279 -2.595 4.382 1.00 0.00 N ATOM 1814 CA GLY B 415 7.273 -3.491 4.908 1.00 0.00 C ATOM 1815 C GLY B 415 7.547 -4.907 4.468 1.00 0.00 C ATOM 1816 O GLY B 415 7.613 -5.180 3.274 1.00 0.00 O ATOM 0 H GLY B 415 8.225 -2.432 3.377 1.00 0.00 H new ATOM 0 HA2 GLY B 415 7.263 -3.437 5.997 1.00 0.00 H new ATOM 0 HA3 GLY B 415 6.286 -3.181 4.564 1.00 0.00 H new ATOM 1820 N VAL B 416 7.722 -5.811 5.423 1.00 0.00 N ATOM 1821 CA VAL B 416 8.010 -7.200 5.100 1.00 0.00 C ATOM 1822 C VAL B 416 7.123 -8.151 5.891 1.00 0.00 C ATOM 1823 O VAL B 416 7.106 -8.124 7.123 1.00 0.00 O ATOM 1824 CB VAL B 416 9.489 -7.534 5.380 1.00 0.00 C ATOM 1825 CG1 VAL B 416 9.890 -8.822 4.677 1.00 0.00 C ATOM 1826 CG2 VAL B 416 10.383 -6.381 4.951 1.00 0.00 C ATOM 0 H VAL B 416 7.670 -5.608 6.421 1.00 0.00 H new ATOM 0 HA VAL B 416 7.805 -7.330 4.038 1.00 0.00 H new ATOM 0 HB VAL B 416 9.614 -7.682 6.453 1.00 0.00 H new ATOM 0 HG11 VAL B 416 10.937 -9.040 4.887 1.00 0.00 H new ATOM 0 HG12 VAL B 416 9.269 -9.642 5.038 1.00 0.00 H new ATOM 0 HG13 VAL B 416 9.752 -8.708 3.602 1.00 0.00 H new ATOM 0 HG21 VAL B 416 11.424 -6.632 5.155 1.00 0.00 H new ATOM 0 HG22 VAL B 416 10.256 -6.200 3.884 1.00 0.00 H new ATOM 0 HG23 VAL B 416 10.111 -5.483 5.506 1.00 0.00 H new ATOM 1836 N GLY B 417 6.386 -8.991 5.175 1.00 0.00 N ATOM 1837 CA GLY B 417 5.503 -9.941 5.823 1.00 0.00 C ATOM 1838 C GLY B 417 5.423 -11.260 5.081 1.00 0.00 C ATOM 1839 O GLY B 417 6.398 -11.699 4.471 1.00 0.00 O ATOM 0 H GLY B 417 6.384 -9.031 4.156 1.00 0.00 H new ATOM 0 HA2 GLY B 417 5.852 -10.121 6.840 1.00 0.00 H new ATOM 0 HA3 GLY B 417 4.505 -9.510 5.900 1.00 0.00 H new ATOM 1843 N ARG B 418 4.256 -11.891 5.136 1.00 0.00 N ATOM 1844 CA ARG B 418 4.048 -13.171 4.468 1.00 0.00 C ATOM 1845 C ARG B 418 2.770 -13.161 3.632 1.00 0.00 C ATOM 1846 O ARG B 418 2.688 -13.834 2.605 1.00 0.00 O ATOM 1847 CB ARG B 418 3.987 -14.300 5.500 1.00 0.00 C ATOM 1848 CG ARG B 418 4.858 -14.054 6.722 1.00 0.00 C ATOM 1849 CD ARG B 418 4.181 -13.120 7.712 1.00 0.00 C ATOM 1850 NE ARG B 418 3.775 -13.815 8.930 1.00 0.00 N ATOM 1851 CZ ARG B 418 3.528 -13.200 10.082 1.00 0.00 C ATOM 1852 NH1 ARG B 418 3.649 -11.882 10.170 1.00 0.00 N ATOM 1853 NH2 ARG B 418 3.159 -13.900 11.146 1.00 0.00 N ATOM 0 H ARG B 418 3.440 -11.538 5.636 1.00 0.00 H new ATOM 0 HA ARG B 418 4.890 -13.339 3.797 1.00 0.00 H new ATOM 0 HB2 ARG B 418 2.954 -14.432 5.821 1.00 0.00 H new ATOM 0 HB3 ARG B 418 4.295 -15.232 5.026 1.00 0.00 H new ATOM 0 HG2 ARG B 418 5.079 -15.004 7.209 1.00 0.00 H new ATOM 0 HG3 ARG B 418 5.811 -13.626 6.410 1.00 0.00 H new ATOM 0 HD2 ARG B 418 4.862 -12.308 7.968 1.00 0.00 H new ATOM 0 HD3 ARG B 418 3.307 -12.668 7.244 1.00 0.00 H new ATOM 0 HE ARG B 418 3.675 -14.830 8.895 1.00 0.00 H new ATOM 0 HH11 ARG B 418 3.932 -11.340 9.353 1.00 0.00 H new ATOM 0 HH12 ARG B 418 3.459 -11.410 11.054 1.00 0.00 H new ATOM 0 HH21 ARG B 418 3.064 -14.914 11.082 1.00 0.00 H new ATOM 0 HH22 ARG B 418 2.970 -13.425 12.029 1.00 0.00 H new ATOM 1867 N ASN B 419 1.773 -12.403 4.079 1.00 0.00 N ATOM 1868 CA ASN B 419 0.503 -12.321 3.369 1.00 0.00 C ATOM 1869 C ASN B 419 0.603 -11.415 2.147 1.00 0.00 C ATOM 1870 O ASN B 419 0.410 -11.867 1.019 1.00 0.00 O ATOM 1871 CB ASN B 419 -0.601 -11.814 4.298 1.00 0.00 C ATOM 1872 CG ASN B 419 -0.282 -12.043 5.763 1.00 0.00 C ATOM 1873 OD1 ASN B 419 0.308 -13.058 6.130 1.00 0.00 O ATOM 1874 ND2 ASN B 419 -0.673 -11.096 6.609 1.00 0.00 N ATOM 0 H ASN B 419 1.821 -11.839 4.927 1.00 0.00 H new ATOM 0 HA ASN B 419 0.254 -13.327 3.030 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -0.755 -10.749 4.126 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -1.537 -12.315 4.051 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -0.486 -11.195 7.607 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -1.160 -10.270 6.261 1.00 0.00 H new ATOM 1881 N ILE B 420 0.887 -10.133 2.379 1.00 0.00 N ATOM 1882 CA ILE B 420 0.996 -9.140 1.315 1.00 0.00 C ATOM 1883 C ILE B 420 0.518 -7.791 1.843 1.00 0.00 C ATOM 1884 O ILE B 420 0.892 -6.734 1.338 1.00 0.00 O ATOM 1885 CB ILE B 420 0.170 -9.515 0.074 1.00 0.00 C ATOM 1886 CG1 ILE B 420 0.117 -8.338 -0.902 1.00 0.00 C ATOM 1887 CG2 ILE B 420 -1.229 -9.939 0.484 1.00 0.00 C ATOM 1888 CD1 ILE B 420 1.481 -7.767 -1.225 1.00 0.00 C ATOM 0 H ILE B 420 1.048 -9.755 3.313 1.00 0.00 H new ATOM 0 HA ILE B 420 2.042 -9.095 1.012 1.00 0.00 H new ATOM 0 HB ILE B 420 0.649 -10.355 -0.429 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -0.362 -8.662 -1.826 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -0.508 -7.551 -0.478 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -1.804 -10.202 -0.404 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -1.168 -10.803 1.146 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -1.720 -9.117 1.004 1.00 0.00 H new ATOM 0 HD11 ILE B 420 1.372 -6.936 -1.922 1.00 0.00 H new ATOM 0 HD12 ILE B 420 1.953 -7.413 -0.309 1.00 0.00 H new ATOM 0 HD13 ILE B 420 2.102 -8.541 -1.677 1.00 0.00 H new ATOM 1900 N LYS B 421 -0.288 -7.852 2.900 1.00 0.00 N ATOM 1901 CA LYS B 421 -0.800 -6.654 3.549 1.00 0.00 C ATOM 1902 C LYS B 421 0.289 -6.060 4.428 1.00 0.00 C ATOM 1903 O LYS B 421 0.647 -4.891 4.294 1.00 0.00 O ATOM 1904 CB LYS B 421 -2.039 -6.978 4.385 1.00 0.00 C ATOM 1905 CG LYS B 421 -3.330 -6.990 3.583 1.00 0.00 C ATOM 1906 CD LYS B 421 -3.405 -8.200 2.666 1.00 0.00 C ATOM 1907 CE LYS B 421 -4.318 -9.273 3.235 1.00 0.00 C ATOM 1908 NZ LYS B 421 -5.473 -9.552 2.338 1.00 0.00 N ATOM 0 H LYS B 421 -0.600 -8.725 3.325 1.00 0.00 H new ATOM 0 HA LYS B 421 -1.090 -5.931 2.787 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -1.905 -7.952 4.855 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -2.127 -6.246 5.188 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -4.182 -6.994 4.263 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -3.400 -6.078 2.990 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -3.769 -7.893 1.686 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -2.406 -8.610 2.521 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -3.749 -10.190 3.390 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -4.685 -8.957 4.212 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -6.072 -10.289 2.762 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -6.031 -8.684 2.211 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -5.124 -9.878 1.414 1.00 0.00 H new ATOM 1922 N ILE B 422 0.807 -6.880 5.337 1.00 0.00 N ATOM 1923 CA ILE B 422 1.851 -6.430 6.244 1.00 0.00 C ATOM 1924 C ILE B 422 2.942 -5.740 5.447 1.00 0.00 C ATOM 1925 O ILE B 422 3.384 -4.650 5.792 1.00 0.00 O ATOM 1926 CB ILE B 422 2.479 -7.600 7.030 1.00 0.00 C ATOM 1927 CG1 ILE B 422 1.401 -8.437 7.721 1.00 0.00 C ATOM 1928 CG2 ILE B 422 3.479 -7.075 8.049 1.00 0.00 C ATOM 1929 CD1 ILE B 422 1.917 -9.755 8.251 1.00 0.00 C ATOM 0 H ILE B 422 0.522 -7.851 5.463 1.00 0.00 H new ATOM 0 HA ILE B 422 1.395 -5.745 6.959 1.00 0.00 H new ATOM 0 HB ILE B 422 3.004 -8.242 6.323 1.00 0.00 H new ATOM 0 HG12 ILE B 422 0.977 -7.863 8.545 1.00 0.00 H new ATOM 0 HG13 ILE B 422 0.592 -8.628 7.016 1.00 0.00 H new ATOM 0 HG21 ILE B 422 3.914 -7.911 8.596 1.00 0.00 H new ATOM 0 HG22 ILE B 422 4.269 -6.527 7.535 1.00 0.00 H new ATOM 0 HG23 ILE B 422 2.972 -6.409 8.747 1.00 0.00 H new ATOM 0 HD11 ILE B 422 1.102 -10.299 8.729 1.00 0.00 H new ATOM 0 HD12 ILE B 422 2.315 -10.348 7.427 1.00 0.00 H new ATOM 0 HD13 ILE B 422 2.706 -9.570 8.980 1.00 0.00 H new ATOM 1941 N ALA B 423 3.340 -6.351 4.346 1.00 0.00 N ATOM 1942 CA ALA B 423 4.344 -5.748 3.492 1.00 0.00 C ATOM 1943 C ALA B 423 3.824 -4.406 2.990 1.00 0.00 C ATOM 1944 O ALA B 423 4.431 -3.361 3.224 1.00 0.00 O ATOM 1945 CB ALA B 423 4.692 -6.660 2.326 1.00 0.00 C ATOM 0 H ALA B 423 2.988 -7.253 4.026 1.00 0.00 H new ATOM 0 HA ALA B 423 5.257 -5.594 4.067 1.00 0.00 H new ATOM 0 HB1 ALA B 423 5.447 -6.182 1.703 1.00 0.00 H new ATOM 0 HB2 ALA B 423 5.081 -7.605 2.706 1.00 0.00 H new ATOM 0 HB3 ALA B 423 3.798 -6.848 1.732 1.00 0.00 H new ATOM 1951 N GLY B 424 2.688 -4.454 2.303 1.00 0.00 N ATOM 1952 CA GLY B 424 2.078 -3.251 1.767 1.00 0.00 C ATOM 1953 C GLY B 424 1.769 -2.185 2.815 1.00 0.00 C ATOM 1954 O GLY B 424 2.250 -1.051 2.717 1.00 0.00 O ATOM 0 H GLY B 424 2.175 -5.313 2.106 1.00 0.00 H new ATOM 0 HA2 GLY B 424 2.743 -2.824 1.016 1.00 0.00 H new ATOM 0 HA3 GLY B 424 1.153 -3.522 1.257 1.00 0.00 H new ATOM 1958 N ILE B 425 0.955 -2.539 3.808 1.00 0.00 N ATOM 1959 CA ILE B 425 0.575 -1.584 4.852 1.00 0.00 C ATOM 1960 C ILE B 425 1.732 -1.253 5.788 1.00 0.00 C ATOM 1961 O ILE B 425 2.058 -0.086 5.983 1.00 0.00 O ATOM 1962 CB ILE B 425 -0.607 -2.107 5.688 1.00 0.00 C ATOM 1963 CG1 ILE B 425 -1.847 -2.275 4.809 1.00 0.00 C ATOM 1964 CG2 ILE B 425 -0.896 -1.160 6.843 1.00 0.00 C ATOM 1965 CD1 ILE B 425 -2.000 -3.669 4.242 1.00 0.00 C ATOM 0 H ILE B 425 0.549 -3.469 3.913 1.00 0.00 H new ATOM 0 HA ILE B 425 0.281 -0.674 4.330 1.00 0.00 H new ATOM 0 HB ILE B 425 -0.341 -3.081 6.098 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -2.733 -2.030 5.394 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -1.800 -1.560 3.987 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -1.734 -1.542 7.426 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -0.015 -1.084 7.481 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -1.146 -0.174 6.451 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -2.900 -3.716 3.629 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -1.131 -3.910 3.630 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -2.079 -4.387 5.058 1.00 0.00 H new ATOM 1977 N ARG B 426 2.314 -2.272 6.408 1.00 0.00 N ATOM 1978 CA ARG B 426 3.389 -2.031 7.364 1.00 0.00 C ATOM 1979 C ARG B 426 4.463 -1.140 6.745 1.00 0.00 C ATOM 1980 O ARG B 426 5.020 -0.281 7.425 1.00 0.00 O ATOM 1981 CB ARG B 426 3.979 -3.344 7.903 1.00 0.00 C ATOM 1982 CG ARG B 426 5.286 -3.778 7.253 1.00 0.00 C ATOM 1983 CD ARG B 426 6.432 -3.744 8.254 1.00 0.00 C ATOM 1984 NE ARG B 426 6.835 -5.087 8.663 1.00 0.00 N ATOM 1985 CZ ARG B 426 7.427 -5.356 9.821 1.00 0.00 C ATOM 1986 NH1 ARG B 426 7.680 -4.378 10.681 1.00 0.00 N ATOM 1987 NH2 ARG B 426 7.764 -6.601 10.122 1.00 0.00 N ATOM 0 H ARG B 426 2.068 -3.252 6.271 1.00 0.00 H new ATOM 0 HA ARG B 426 2.966 -1.505 8.220 1.00 0.00 H new ATOM 0 HB2 ARG B 426 4.142 -3.238 8.976 1.00 0.00 H new ATOM 0 HB3 ARG B 426 3.243 -4.137 7.769 1.00 0.00 H new ATOM 0 HG2 ARG B 426 5.179 -4.786 6.851 1.00 0.00 H new ATOM 0 HG3 ARG B 426 5.513 -3.122 6.412 1.00 0.00 H new ATOM 0 HD2 ARG B 426 7.284 -3.227 7.813 1.00 0.00 H new ATOM 0 HD3 ARG B 426 6.131 -3.172 9.132 1.00 0.00 H new ATOM 0 HE ARG B 426 6.652 -5.861 8.024 1.00 0.00 H new ATOM 0 HH11 ARG B 426 7.420 -3.418 10.453 1.00 0.00 H new ATOM 0 HH12 ARG B 426 8.135 -4.586 11.570 1.00 0.00 H new ATOM 0 HH21 ARG B 426 7.569 -7.355 9.464 1.00 0.00 H new ATOM 0 HH22 ARG B 426 8.219 -6.805 11.012 1.00 0.00 H new ATOM 2001 N ALA B 427 4.728 -1.305 5.448 1.00 0.00 N ATOM 2002 CA ALA B 427 5.706 -0.453 4.778 1.00 0.00 C ATOM 2003 C ALA B 427 5.197 0.984 4.810 1.00 0.00 C ATOM 2004 O ALA B 427 5.889 1.909 5.250 1.00 0.00 O ATOM 2005 CB ALA B 427 5.935 -0.902 3.341 1.00 0.00 C ATOM 0 H ALA B 427 4.288 -2.006 4.852 1.00 0.00 H new ATOM 0 HA ALA B 427 6.662 -0.525 5.297 1.00 0.00 H new ATOM 0 HB1 ALA B 427 6.668 -0.249 2.868 1.00 0.00 H new ATOM 0 HB2 ALA B 427 6.305 -1.927 3.335 1.00 0.00 H new ATOM 0 HB3 ALA B 427 4.996 -0.852 2.790 1.00 0.00 H new ATOM 2011 N ALA B 428 3.962 1.152 4.354 1.00 0.00 N ATOM 2012 CA ALA B 428 3.338 2.466 4.347 1.00 0.00 C ATOM 2013 C ALA B 428 3.434 3.063 5.748 1.00 0.00 C ATOM 2014 O ALA B 428 3.874 4.199 5.927 1.00 0.00 O ATOM 2015 CB ALA B 428 1.886 2.388 3.898 1.00 0.00 C ATOM 0 H ALA B 428 3.378 0.401 3.987 1.00 0.00 H new ATOM 0 HA ALA B 428 3.862 3.104 3.635 1.00 0.00 H new ATOM 0 HB1 ALA B 428 1.449 3.387 3.904 1.00 0.00 H new ATOM 0 HB2 ALA B 428 1.839 1.977 2.889 1.00 0.00 H new ATOM 0 HB3 ALA B 428 1.329 1.744 4.579 1.00 0.00 H new ATOM 2021 N GLU B 429 3.028 2.272 6.737 1.00 0.00 N ATOM 2022 CA GLU B 429 3.074 2.688 8.131 1.00 0.00 C ATOM 2023 C GLU B 429 4.510 2.956 8.575 1.00 0.00 C ATOM 2024 O GLU B 429 4.748 3.755 9.480 1.00 0.00 O ATOM 2025 CB GLU B 429 2.451 1.611 9.026 1.00 0.00 C ATOM 2026 CG GLU B 429 1.147 1.038 8.495 1.00 0.00 C ATOM 2027 CD GLU B 429 0.432 1.981 7.551 1.00 0.00 C ATOM 2028 OE1 GLU B 429 -0.060 3.023 8.023 1.00 0.00 O ATOM 2029 OE2 GLU B 429 0.363 1.675 6.342 1.00 0.00 O ATOM 0 H GLU B 429 2.661 1.331 6.594 1.00 0.00 H new ATOM 0 HA GLU B 429 2.503 3.612 8.225 1.00 0.00 H new ATOM 0 HB2 GLU B 429 3.167 0.799 9.151 1.00 0.00 H new ATOM 0 HB3 GLU B 429 2.273 2.034 10.015 1.00 0.00 H new ATOM 0 HG2 GLU B 429 1.351 0.100 7.978 1.00 0.00 H new ATOM 0 HG3 GLU B 429 0.491 0.804 9.333 1.00 0.00 H new ATOM 2036 N ASN B 430 5.465 2.281 7.936 1.00 0.00 N ATOM 2037 CA ASN B 430 6.871 2.459 8.279 1.00 0.00 C ATOM 2038 C ASN B 430 7.278 3.911 8.076 1.00 0.00 C ATOM 2039 O ASN B 430 7.841 4.538 8.973 1.00 0.00 O ATOM 2040 CB ASN B 430 7.753 1.536 7.435 1.00 0.00 C ATOM 2041 CG ASN B 430 8.365 0.417 8.251 1.00 0.00 C ATOM 2042 OD1 ASN B 430 9.427 0.579 8.851 1.00 0.00 O ATOM 2043 ND2 ASN B 430 7.695 -0.730 8.274 1.00 0.00 N ATOM 0 H ASN B 430 5.291 1.613 7.185 1.00 0.00 H new ATOM 0 HA ASN B 430 7.008 2.198 9.328 1.00 0.00 H new ATOM 0 HB2 ASN B 430 7.159 1.110 6.627 1.00 0.00 H new ATOM 0 HB3 ASN B 430 8.548 2.121 6.972 1.00 0.00 H new ATOM 0 HD21 ASN B 430 8.058 -1.522 8.805 1.00 0.00 H new ATOM 0 HD22 ASN B 430 6.818 -0.819 7.761 1.00 0.00 H new ATOM 2050 N ALA B 431 6.972 4.452 6.900 1.00 0.00 N ATOM 2051 CA ALA B 431 7.297 5.846 6.616 1.00 0.00 C ATOM 2052 C ALA B 431 6.525 6.750 7.568 1.00 0.00 C ATOM 2053 O ALA B 431 7.076 7.693 8.135 1.00 0.00 O ATOM 2054 CB ALA B 431 6.999 6.212 5.171 1.00 0.00 C ATOM 0 H ALA B 431 6.507 3.956 6.140 1.00 0.00 H new ATOM 0 HA ALA B 431 8.367 5.986 6.767 1.00 0.00 H new ATOM 0 HB1 ALA B 431 7.255 7.258 5.000 1.00 0.00 H new ATOM 0 HB2 ALA B 431 7.589 5.581 4.507 1.00 0.00 H new ATOM 0 HB3 ALA B 431 5.939 6.060 4.968 1.00 0.00 H new ATOM 2060 N LEU B 432 5.243 6.437 7.748 1.00 0.00 N ATOM 2061 CA LEU B 432 4.361 7.189 8.640 1.00 0.00 C ATOM 2062 C LEU B 432 4.906 7.249 10.070 1.00 0.00 C ATOM 2063 O LEU B 432 4.411 8.020 10.893 1.00 0.00 O ATOM 2064 CB LEU B 432 2.966 6.561 8.646 1.00 0.00 C ATOM 2065 CG LEU B 432 2.127 6.853 9.891 1.00 0.00 C ATOM 2066 CD1 LEU B 432 0.653 6.609 9.609 1.00 0.00 C ATOM 2067 CD2 LEU B 432 2.595 6.000 11.060 1.00 0.00 C ATOM 0 H LEU B 432 4.786 5.655 7.280 1.00 0.00 H new ATOM 0 HA LEU B 432 4.307 8.210 8.262 1.00 0.00 H new ATOM 0 HB2 LEU B 432 2.422 6.914 7.770 1.00 0.00 H new ATOM 0 HB3 LEU B 432 3.071 5.481 8.543 1.00 0.00 H new ATOM 0 HG LEU B 432 2.257 7.902 10.157 1.00 0.00 H new ATOM 0 HD11 LEU B 432 0.071 6.822 10.506 1.00 0.00 H new ATOM 0 HD12 LEU B 432 0.324 7.261 8.800 1.00 0.00 H new ATOM 0 HD13 LEU B 432 0.505 5.569 9.319 1.00 0.00 H new ATOM 0 HD21 LEU B 432 1.987 6.221 11.938 1.00 0.00 H new ATOM 0 HD22 LEU B 432 2.494 4.945 10.804 1.00 0.00 H new ATOM 0 HD23 LEU B 432 3.640 6.222 11.277 1.00 0.00 H new ATOM 2079 N ARG B 433 5.941 6.463 10.353 1.00 0.00 N ATOM 2080 CA ARG B 433 6.556 6.468 11.674 1.00 0.00 C ATOM 2081 C ARG B 433 7.605 7.573 11.748 1.00 0.00 C ATOM 2082 O ARG B 433 8.067 7.940 12.828 1.00 0.00 O ATOM 2083 CB ARG B 433 7.185 5.107 11.981 1.00 0.00 C ATOM 2084 CG ARG B 433 6.353 3.933 11.490 1.00 0.00 C ATOM 2085 CD ARG B 433 6.599 2.679 12.316 1.00 0.00 C ATOM 2086 NE ARG B 433 7.805 2.781 13.135 1.00 0.00 N ATOM 2087 CZ ARG B 433 7.807 3.158 14.412 1.00 0.00 C ATOM 2088 NH1 ARG B 433 6.677 3.514 15.010 1.00 0.00 N ATOM 2089 NH2 ARG B 433 8.946 3.187 15.091 1.00 0.00 N ATOM 0 H ARG B 433 6.369 5.818 9.688 1.00 0.00 H new ATOM 0 HA ARG B 433 5.786 6.659 12.422 1.00 0.00 H new ATOM 0 HB2 ARG B 433 8.173 5.060 11.522 1.00 0.00 H new ATOM 0 HB3 ARG B 433 7.329 5.016 13.058 1.00 0.00 H new ATOM 0 HG2 ARG B 433 5.296 4.194 11.533 1.00 0.00 H new ATOM 0 HG3 ARG B 433 6.590 3.732 10.445 1.00 0.00 H new ATOM 0 HD2 ARG B 433 5.739 2.497 12.961 1.00 0.00 H new ATOM 0 HD3 ARG B 433 6.686 1.820 11.651 1.00 0.00 H new ATOM 0 HE ARG B 433 8.699 2.549 12.702 1.00 0.00 H new ATOM 0 HH11 ARG B 433 5.799 3.500 14.491 1.00 0.00 H new ATOM 0 HH12 ARG B 433 6.687 3.802 15.989 1.00 0.00 H new ATOM 0 HH21 ARG B 433 9.819 2.921 14.635 1.00 0.00 H new ATOM 0 HH22 ARG B 433 8.949 3.476 16.069 1.00 0.00 H new ATOM 2103 N ASP B 434 7.962 8.111 10.581 1.00 0.00 N ATOM 2104 CA ASP B 434 8.938 9.188 10.491 1.00 0.00 C ATOM 2105 C ASP B 434 8.226 10.512 10.223 1.00 0.00 C ATOM 2106 O ASP B 434 8.652 11.302 9.382 1.00 0.00 O ATOM 2107 CB ASP B 434 9.942 8.898 9.373 1.00 0.00 C ATOM 2108 CG ASP B 434 11.356 9.300 9.742 1.00 0.00 C ATOM 2109 OD1 ASP B 434 11.534 9.954 10.791 1.00 0.00 O ATOM 2110 OD2 ASP B 434 12.287 8.962 8.980 1.00 0.00 O ATOM 0 H ASP B 434 7.584 7.813 9.681 1.00 0.00 H new ATOM 0 HA ASP B 434 9.476 9.257 11.436 1.00 0.00 H new ATOM 0 HB2 ASP B 434 9.920 7.834 9.137 1.00 0.00 H new ATOM 0 HB3 ASP B 434 9.640 9.431 8.471 1.00 0.00 H new ATOM 2115 N LYS B 435 7.133 10.738 10.944 1.00 0.00 N ATOM 2116 CA LYS B 435 6.358 11.958 10.778 1.00 0.00 C ATOM 2117 C LYS B 435 7.281 13.170 10.720 1.00 0.00 C ATOM 2118 O LYS B 435 7.265 13.926 9.749 1.00 0.00 O ATOM 2119 CB LYS B 435 5.321 12.095 11.899 1.00 0.00 C ATOM 2120 CG LYS B 435 5.718 13.043 13.018 1.00 0.00 C ATOM 2121 CD LYS B 435 4.634 13.124 14.076 1.00 0.00 C ATOM 2122 CE LYS B 435 4.597 11.863 14.924 1.00 0.00 C ATOM 2123 NZ LYS B 435 4.697 12.168 16.378 1.00 0.00 N ATOM 0 H LYS B 435 6.767 10.094 11.645 1.00 0.00 H new ATOM 0 HA LYS B 435 5.817 11.904 9.833 1.00 0.00 H new ATOM 0 HB2 LYS B 435 4.381 12.438 11.466 1.00 0.00 H new ATOM 0 HB3 LYS B 435 5.134 11.109 12.325 1.00 0.00 H new ATOM 0 HG2 LYS B 435 6.649 12.704 13.472 1.00 0.00 H new ATOM 0 HG3 LYS B 435 5.906 14.036 12.608 1.00 0.00 H new ATOM 0 HD2 LYS B 435 4.810 13.990 14.715 1.00 0.00 H new ATOM 0 HD3 LYS B 435 3.666 13.272 13.598 1.00 0.00 H new ATOM 0 HE2 LYS B 435 3.671 11.322 14.730 1.00 0.00 H new ATOM 0 HE3 LYS B 435 5.417 11.206 14.634 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 4.091 11.513 16.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 5.683 12.058 16.689 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 4.387 13.146 16.550 1.00 0.00 H new ATOM 2137 N LYS B 436 8.087 13.354 11.761 1.00 0.00 N ATOM 2138 CA LYS B 436 9.007 14.468 11.815 1.00 0.00 C ATOM 2139 C LYS B 436 9.816 14.536 10.527 1.00 0.00 C ATOM 2140 O LYS B 436 10.148 15.619 10.041 1.00 0.00 O ATOM 2141 CB LYS B 436 9.924 14.315 13.025 1.00 0.00 C ATOM 2142 CG LYS B 436 9.391 14.991 14.278 1.00 0.00 C ATOM 2143 CD LYS B 436 7.914 14.692 14.484 1.00 0.00 C ATOM 2144 CE LYS B 436 7.328 15.525 15.613 1.00 0.00 C ATOM 2145 NZ LYS B 436 6.287 14.779 16.372 1.00 0.00 N ATOM 0 H LYS B 436 8.116 12.741 12.576 1.00 0.00 H new ATOM 0 HA LYS B 436 8.448 15.398 11.917 1.00 0.00 H new ATOM 0 HB2 LYS B 436 10.071 13.254 13.228 1.00 0.00 H new ATOM 0 HB3 LYS B 436 10.902 14.732 12.785 1.00 0.00 H new ATOM 0 HG2 LYS B 436 9.957 14.651 15.145 1.00 0.00 H new ATOM 0 HG3 LYS B 436 9.539 16.068 14.203 1.00 0.00 H new ATOM 0 HD2 LYS B 436 7.369 14.893 13.562 1.00 0.00 H new ATOM 0 HD3 LYS B 436 7.784 13.633 14.707 1.00 0.00 H new ATOM 0 HE2 LYS B 436 8.125 15.828 16.292 1.00 0.00 H new ATOM 0 HE3 LYS B 436 6.895 16.437 15.203 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 6.386 14.981 17.387 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 5.343 15.076 16.051 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 6.403 13.758 16.209 1.00 0.00 H new ATOM 2159 N MET B 437 10.099 13.368 9.958 1.00 0.00 N ATOM 2160 CA MET B 437 10.837 13.296 8.708 1.00 0.00 C ATOM 2161 C MET B 437 9.952 13.781 7.569 1.00 0.00 C ATOM 2162 O MET B 437 10.349 14.637 6.779 1.00 0.00 O ATOM 2163 CB MET B 437 11.310 11.866 8.433 1.00 0.00 C ATOM 2164 CG MET B 437 12.138 11.735 7.164 1.00 0.00 C ATOM 2165 SD MET B 437 11.122 11.457 5.699 1.00 0.00 S ATOM 2166 CE MET B 437 10.717 9.722 5.889 1.00 0.00 C ATOM 0 H MET B 437 9.828 12.463 10.343 1.00 0.00 H new ATOM 0 HA MET B 437 11.717 13.934 8.785 1.00 0.00 H new ATOM 0 HB2 MET B 437 11.901 11.518 9.280 1.00 0.00 H new ATOM 0 HB3 MET B 437 10.441 11.212 8.360 1.00 0.00 H new ATOM 0 HG2 MET B 437 12.729 12.640 7.025 1.00 0.00 H new ATOM 0 HG3 MET B 437 12.841 10.909 7.277 1.00 0.00 H new ATOM 0 HE1 MET B 437 10.861 9.209 4.938 1.00 0.00 H new ATOM 0 HE2 MET B 437 11.366 9.277 6.643 1.00 0.00 H new ATOM 0 HE3 MET B 437 9.677 9.623 6.201 1.00 0.00 H new ATOM 2176 N LEU B 438 8.743 13.228 7.497 1.00 0.00 N ATOM 2177 CA LEU B 438 7.796 13.608 6.457 1.00 0.00 C ATOM 2178 C LEU B 438 7.652 15.123 6.396 1.00 0.00 C ATOM 2179 O LEU B 438 7.743 15.717 5.323 1.00 0.00 O ATOM 2180 CB LEU B 438 6.433 12.966 6.719 1.00 0.00 C ATOM 2181 CG LEU B 438 6.458 11.449 6.916 1.00 0.00 C ATOM 2182 CD1 LEU B 438 5.262 10.995 7.738 1.00 0.00 C ATOM 2183 CD2 LEU B 438 6.483 10.737 5.574 1.00 0.00 C ATOM 0 H LEU B 438 8.399 12.519 8.144 1.00 0.00 H new ATOM 0 HA LEU B 438 8.177 13.252 5.500 1.00 0.00 H new ATOM 0 HB2 LEU B 438 5.997 13.425 7.606 1.00 0.00 H new ATOM 0 HB3 LEU B 438 5.773 13.198 5.883 1.00 0.00 H new ATOM 0 HG LEU B 438 7.366 11.190 7.460 1.00 0.00 H new ATOM 0 HD11 LEU B 438 5.298 9.913 7.867 1.00 0.00 H new ATOM 0 HD12 LEU B 438 5.288 11.478 8.715 1.00 0.00 H new ATOM 0 HD13 LEU B 438 4.341 11.268 7.222 1.00 0.00 H new ATOM 0 HD21 LEU B 438 6.501 9.659 5.734 1.00 0.00 H new ATOM 0 HD22 LEU B 438 5.594 11.005 5.004 1.00 0.00 H new ATOM 0 HD23 LEU B 438 7.373 11.036 5.020 1.00 0.00 H new ATOM 2195 N ASP B 439 7.441 15.752 7.550 1.00 0.00 N ATOM 2196 CA ASP B 439 7.297 17.201 7.600 1.00 0.00 C ATOM 2197 C ASP B 439 8.523 17.856 6.978 1.00 0.00 C ATOM 2198 O ASP B 439 8.408 18.700 6.088 1.00 0.00 O ATOM 2199 CB ASP B 439 7.122 17.659 9.050 1.00 0.00 C ATOM 2200 CG ASP B 439 7.310 19.155 9.214 1.00 0.00 C ATOM 2201 OD1 ASP B 439 8.464 19.622 9.113 1.00 0.00 O ATOM 2202 OD2 ASP B 439 6.304 19.857 9.444 1.00 0.00 O ATOM 0 H ASP B 439 7.367 15.285 8.454 1.00 0.00 H new ATOM 0 HA ASP B 439 6.413 17.498 7.035 1.00 0.00 H new ATOM 0 HB2 ASP B 439 6.127 17.381 9.398 1.00 0.00 H new ATOM 0 HB3 ASP B 439 7.839 17.135 9.682 1.00 0.00 H new ATOM 2207 N PHE B 440 9.696 17.470 7.463 1.00 0.00 N ATOM 2208 CA PHE B 440 10.936 18.040 6.953 1.00 0.00 C ATOM 2209 C PHE B 440 10.862 18.096 5.432 1.00 0.00 C ATOM 2210 O PHE B 440 11.282 19.074 4.813 1.00 0.00 O ATOM 2211 CB PHE B 440 12.152 17.214 7.417 1.00 0.00 C ATOM 2212 CG PHE B 440 12.840 16.427 6.325 1.00 0.00 C ATOM 2213 CD1 PHE B 440 13.443 17.073 5.254 1.00 0.00 C ATOM 2214 CD2 PHE B 440 12.883 15.043 6.374 1.00 0.00 C ATOM 2215 CE1 PHE B 440 14.073 16.352 4.257 1.00 0.00 C ATOM 2216 CE2 PHE B 440 13.512 14.318 5.380 1.00 0.00 C ATOM 2217 CZ PHE B 440 14.107 14.973 4.321 1.00 0.00 C ATOM 0 H PHE B 440 9.815 16.774 8.199 1.00 0.00 H new ATOM 0 HA PHE B 440 11.062 19.049 7.346 1.00 0.00 H new ATOM 0 HB2 PHE B 440 12.878 17.887 7.872 1.00 0.00 H new ATOM 0 HB3 PHE B 440 11.828 16.522 8.194 1.00 0.00 H new ATOM 0 HD1 PHE B 440 13.420 18.151 5.199 1.00 0.00 H new ATOM 0 HD2 PHE B 440 12.419 14.524 7.200 1.00 0.00 H new ATOM 0 HE1 PHE B 440 14.538 16.867 3.429 1.00 0.00 H new ATOM 0 HE2 PHE B 440 13.538 13.240 5.432 1.00 0.00 H new ATOM 0 HZ PHE B 440 14.599 14.408 3.543 1.00 0.00 H new ATOM 2227 N TYR B 441 10.310 17.045 4.840 1.00 0.00 N ATOM 2228 CA TYR B 441 10.159 16.975 3.395 1.00 0.00 C ATOM 2229 C TYR B 441 9.209 18.059 2.903 1.00 0.00 C ATOM 2230 O TYR B 441 9.446 18.692 1.875 1.00 0.00 O ATOM 2231 CB TYR B 441 9.637 15.600 2.990 1.00 0.00 C ATOM 2232 CG TYR B 441 10.730 14.664 2.548 1.00 0.00 C ATOM 2233 CD1 TYR B 441 11.187 14.684 1.241 1.00 0.00 C ATOM 2234 CD2 TYR B 441 11.310 13.769 3.436 1.00 0.00 C ATOM 2235 CE1 TYR B 441 12.194 13.840 0.826 1.00 0.00 C ATOM 2236 CE2 TYR B 441 12.320 12.918 3.030 1.00 0.00 C ATOM 2237 CZ TYR B 441 12.759 12.958 1.723 1.00 0.00 C ATOM 2238 OH TYR B 441 13.768 12.117 1.314 1.00 0.00 O ATOM 0 H TYR B 441 9.959 16.228 5.341 1.00 0.00 H new ATOM 0 HA TYR B 441 11.135 17.135 2.937 1.00 0.00 H new ATOM 0 HB2 TYR B 441 9.105 15.157 3.832 1.00 0.00 H new ATOM 0 HB3 TYR B 441 8.915 15.715 2.181 1.00 0.00 H new ATOM 0 HD1 TYR B 441 10.747 15.373 0.535 1.00 0.00 H new ATOM 0 HD2 TYR B 441 10.967 13.737 4.460 1.00 0.00 H new ATOM 0 HE1 TYR B 441 12.539 13.869 -0.197 1.00 0.00 H new ATOM 0 HE2 TYR B 441 12.763 12.226 3.731 1.00 0.00 H new ATOM 0 HH TYR B 441 14.056 11.561 2.068 1.00 0.00 H new ATOM 2248 N ALA B 442 8.133 18.268 3.653 1.00 0.00 N ATOM 2249 CA ALA B 442 7.152 19.282 3.288 1.00 0.00 C ATOM 2250 C ALA B 442 7.843 20.633 3.145 1.00 0.00 C ATOM 2251 O ALA B 442 7.776 21.270 2.094 1.00 0.00 O ATOM 2252 CB ALA B 442 6.034 19.363 4.317 1.00 0.00 C ATOM 0 H ALA B 442 7.919 17.755 4.508 1.00 0.00 H new ATOM 0 HA ALA B 442 6.704 19.003 2.335 1.00 0.00 H new ATOM 0 HB1 ALA B 442 5.318 20.128 4.017 1.00 0.00 H new ATOM 0 HB2 ALA B 442 5.529 18.399 4.382 1.00 0.00 H new ATOM 0 HB3 ALA B 442 6.453 19.620 5.290 1.00 0.00 H new ATOM 2258 N LYS B 443 8.499 21.065 4.217 1.00 0.00 N ATOM 2259 CA LYS B 443 9.198 22.344 4.228 1.00 0.00 C ATOM 2260 C LYS B 443 10.276 22.379 3.152 1.00 0.00 C ATOM 2261 O LYS B 443 10.620 23.443 2.644 1.00 0.00 O ATOM 2262 CB LYS B 443 9.819 22.594 5.606 1.00 0.00 C ATOM 2263 CG LYS B 443 10.856 23.708 5.625 1.00 0.00 C ATOM 2264 CD LYS B 443 12.136 23.264 6.315 1.00 0.00 C ATOM 2265 CE LYS B 443 13.154 22.736 5.317 1.00 0.00 C ATOM 2266 NZ LYS B 443 14.134 23.783 4.914 1.00 0.00 N ATOM 0 H LYS B 443 8.561 20.545 5.093 1.00 0.00 H new ATOM 0 HA LYS B 443 8.476 23.132 4.016 1.00 0.00 H new ATOM 0 HB2 LYS B 443 9.025 22.838 6.312 1.00 0.00 H new ATOM 0 HB3 LYS B 443 10.284 21.673 5.956 1.00 0.00 H new ATOM 0 HG2 LYS B 443 11.080 24.016 4.604 1.00 0.00 H new ATOM 0 HG3 LYS B 443 10.447 24.578 6.138 1.00 0.00 H new ATOM 0 HD2 LYS B 443 12.564 24.103 6.864 1.00 0.00 H new ATOM 0 HD3 LYS B 443 11.906 22.489 7.046 1.00 0.00 H new ATOM 0 HE2 LYS B 443 13.686 21.891 5.754 1.00 0.00 H new ATOM 0 HE3 LYS B 443 12.636 22.364 4.433 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 14.810 23.382 4.233 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 13.630 24.579 4.474 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 14.647 24.120 5.754 1.00 0.00 H new ATOM 2280 N GLN B 444 10.804 21.212 2.807 1.00 0.00 N ATOM 2281 CA GLN B 444 11.838 21.119 1.784 1.00 0.00 C ATOM 2282 C GLN B 444 11.240 21.359 0.399 1.00 0.00 C ATOM 2283 O GLN B 444 11.684 22.242 -0.335 1.00 0.00 O ATOM 2284 CB GLN B 444 12.534 19.749 1.865 1.00 0.00 C ATOM 2285 CG GLN B 444 12.445 18.897 0.604 1.00 0.00 C ATOM 2286 CD GLN B 444 13.096 19.546 -0.608 1.00 0.00 C ATOM 2287 OE1 GLN B 444 13.993 20.498 -0.372 1.00 0.00 O flip ATOM 2288 NE2 GLN B 444 12.794 19.191 -1.748 1.00 0.00 N flip ATOM 0 H GLN B 444 10.534 20.319 3.219 1.00 0.00 H new ATOM 0 HA GLN B 444 12.587 21.892 1.960 1.00 0.00 H new ATOM 0 HB2 GLN B 444 13.586 19.908 2.103 1.00 0.00 H new ATOM 0 HB3 GLN B 444 12.101 19.188 2.694 1.00 0.00 H new ATOM 0 HG2 GLN B 444 12.920 17.934 0.790 1.00 0.00 H new ATOM 0 HG3 GLN B 444 11.397 18.698 0.382 1.00 0.00 H new ATOM 0 HE21 GLN B 444 12.100 18.456 -1.886 1.00 0.00 H new ATOM 0 HE22 GLN B 444 13.238 19.632 -2.554 1.00 0.00 H new ATOM 2297 N ARG B 445 10.249 20.549 0.041 1.00 0.00 N ATOM 2298 CA ARG B 445 9.613 20.657 -1.266 1.00 0.00 C ATOM 2299 C ARG B 445 9.124 22.083 -1.518 1.00 0.00 C ATOM 2300 O ARG B 445 9.124 22.553 -2.653 1.00 0.00 O ATOM 2301 CB ARG B 445 8.456 19.648 -1.375 1.00 0.00 C ATOM 2302 CG ARG B 445 7.072 20.275 -1.493 1.00 0.00 C ATOM 2303 CD ARG B 445 6.875 20.926 -2.852 1.00 0.00 C ATOM 2304 NE ARG B 445 5.497 20.813 -3.321 1.00 0.00 N ATOM 2305 CZ ARG B 445 5.095 21.211 -4.523 1.00 0.00 C ATOM 2306 NH1 ARG B 445 5.960 21.754 -5.369 1.00 0.00 N ATOM 2307 NH2 ARG B 445 3.826 21.068 -4.880 1.00 0.00 N ATOM 0 H ARG B 445 9.870 19.813 0.636 1.00 0.00 H new ATOM 0 HA ARG B 445 10.350 20.421 -2.033 1.00 0.00 H new ATOM 0 HB2 ARG B 445 8.627 19.012 -2.244 1.00 0.00 H new ATOM 0 HB3 ARG B 445 8.473 19.001 -0.498 1.00 0.00 H new ATOM 0 HG2 ARG B 445 6.310 19.511 -1.339 1.00 0.00 H new ATOM 0 HG3 ARG B 445 6.940 21.020 -0.708 1.00 0.00 H new ATOM 0 HD2 ARG B 445 7.152 21.979 -2.793 1.00 0.00 H new ATOM 0 HD3 ARG B 445 7.543 20.461 -3.577 1.00 0.00 H new ATOM 0 HE ARG B 445 4.805 20.406 -2.691 1.00 0.00 H new ATOM 0 HH11 ARG B 445 6.937 21.867 -5.097 1.00 0.00 H new ATOM 0 HH12 ARG B 445 5.649 22.059 -6.291 1.00 0.00 H new ATOM 0 HH21 ARG B 445 3.158 20.652 -4.231 1.00 0.00 H new ATOM 0 HH22 ARG B 445 3.518 21.374 -5.803 1.00 0.00 H new ATOM 2321 N ALA B 446 8.716 22.769 -0.457 1.00 0.00 N ATOM 2322 CA ALA B 446 8.241 24.141 -0.584 1.00 0.00 C ATOM 2323 C ALA B 446 9.402 25.125 -0.487 1.00 0.00 C ATOM 2324 O ALA B 446 9.509 26.057 -1.284 1.00 0.00 O ATOM 2325 CB ALA B 446 7.196 24.456 0.478 1.00 0.00 C ATOM 0 H ALA B 446 8.704 22.401 0.494 1.00 0.00 H new ATOM 0 HA ALA B 446 7.777 24.244 -1.565 1.00 0.00 H new ATOM 0 HB1 ALA B 446 6.858 25.486 0.362 1.00 0.00 H new ATOM 0 HB2 ALA B 446 6.348 23.781 0.366 1.00 0.00 H new ATOM 0 HB3 ALA B 446 7.633 24.328 1.468 1.00 0.00 H new ATOM 2331 N ALA B 447 10.263 24.911 0.501 1.00 0.00 N ATOM 2332 CA ALA B 447 11.415 25.778 0.719 1.00 0.00 C ATOM 2333 C ALA B 447 12.184 26.016 -0.577 1.00 0.00 C ATOM 2334 O ALA B 447 12.745 27.092 -0.785 1.00 0.00 O ATOM 2335 CB ALA B 447 12.341 25.196 1.776 1.00 0.00 C ATOM 0 H ALA B 447 10.185 24.142 1.166 1.00 0.00 H new ATOM 0 HA ALA B 447 11.038 26.737 1.074 1.00 0.00 H new ATOM 0 HB1 ALA B 447 13.192 25.861 1.920 1.00 0.00 H new ATOM 0 HB2 ALA B 447 11.799 25.091 2.716 1.00 0.00 H new ATOM 0 HB3 ALA B 447 12.696 24.218 1.450 1.00 0.00 H new ATOM 2341 N ILE B 448 12.211 25.008 -1.440 1.00 0.00 N ATOM 2342 CA ILE B 448 12.917 25.110 -2.709 1.00 0.00 C ATOM 2343 C ILE B 448 12.649 26.453 -3.381 1.00 0.00 C ATOM 2344 O ILE B 448 11.521 26.946 -3.382 1.00 0.00 O ATOM 2345 CB ILE B 448 12.509 23.972 -3.660 1.00 0.00 C ATOM 2346 CG1 ILE B 448 11.021 24.063 -3.983 1.00 0.00 C ATOM 2347 CG2 ILE B 448 12.831 22.621 -3.039 1.00 0.00 C ATOM 2348 CD1 ILE B 448 10.507 22.884 -4.780 1.00 0.00 C ATOM 0 H ILE B 448 11.752 24.111 -1.283 1.00 0.00 H new ATOM 0 HA ILE B 448 13.982 25.029 -2.494 1.00 0.00 H new ATOM 0 HB ILE B 448 13.076 24.073 -4.586 1.00 0.00 H new ATOM 0 HG12 ILE B 448 10.458 24.136 -3.052 1.00 0.00 H new ATOM 0 HG13 ILE B 448 10.833 24.980 -4.542 1.00 0.00 H new ATOM 0 HG21 ILE B 448 12.536 21.826 -3.724 1.00 0.00 H new ATOM 0 HG22 ILE B 448 13.902 22.555 -2.846 1.00 0.00 H new ATOM 0 HG23 ILE B 448 12.286 22.512 -2.101 1.00 0.00 H new ATOM 0 HD11 ILE B 448 9.442 23.013 -4.975 1.00 0.00 H new ATOM 0 HD12 ILE B 448 11.044 22.823 -5.726 1.00 0.00 H new ATOM 0 HD13 ILE B 448 10.664 21.966 -4.214 1.00 0.00 H new