USER MOD reduce.3.24.130724 H: found=0, std=0, add=642, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 643 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 368 MET CE :methyl -151:sc= -3.66 (180deg=-2.56!) USER MOD Set 1.2: B 369 ASN : amide:sc= -2.23 K(o=-5.9,f=-12!) USER MOD Single : B 371 LYS NZ :NH3+ -148:sc= -0.127 (180deg=-1.02) USER MOD Single : B 373 GLN : amide:sc= -14.2! C(o=-14!,f=-16!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 140:sc= 0.476 USER MOD Single : B 380 TYR OH : rot 180:sc= 0 USER MOD Single : B 382 SER OG : rot -83:sc= 0.413 USER MOD Single : B 386 HIS : no HE2:sc= -0.568 X(o=-0.57,f=-0.78) USER MOD Single : B 387 TYR OH : rot 78:sc= -3.17! USER MOD Single : B 389 THR OG1 : rot 180:sc= 0 USER MOD Single : B 391 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot -150:sc= 0.292 USER MOD Single : B 399 ASN : amide:sc= -3.23! C(o=-3.2!,f=-5.5!) USER MOD Single : B 400 SER OG : rot 180:sc= -0.0075 USER MOD Single : B 404 CYS SG : rot -175:sc= -2.36! USER MOD Single : B 410 THR OG1 : rot 180:sc= 0 USER MOD Single : B 414 THR OG1 : rot 66:sc= 0.204 USER MOD Single : B 419 ASN : amide:sc= -3.37! C(o=-3.4!,f=-9.9!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -0.318 K(o=-0.32,f=-1.1) USER MOD Single : B 435 LYS NZ :NH3+ -113:sc= -1.34 (180deg=-3.74!) USER MOD Single : B 436 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0241) USER MOD Single : B 437 MET CE :methyl -158:sc= -7.15! (180deg=-11.5!) USER MOD Single : B 441 TYR OH : rot 180:sc= 0 USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN : amide:sc= -1.02 K(o=-1,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 1069 N ASP B 367 -5.012 4.166 -15.972 1.00 0.00 N ATOM 1070 CA ASP B 367 -3.651 3.990 -15.475 1.00 0.00 C ATOM 1071 C ASP B 367 -2.654 4.615 -16.444 1.00 0.00 C ATOM 1072 O ASP B 367 -2.016 5.623 -16.133 1.00 0.00 O ATOM 1073 CB ASP B 367 -3.336 2.506 -15.286 1.00 0.00 C ATOM 1074 CG ASP B 367 -4.436 1.768 -14.546 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -5.530 2.347 -14.378 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -4.201 0.614 -14.133 1.00 0.00 O ATOM 0 HA ASP B 367 -3.569 4.489 -14.509 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -3.185 2.043 -16.261 1.00 0.00 H new ATOM 0 HB3 ASP B 367 -2.401 2.404 -14.736 1.00 0.00 H new ATOM 1081 N MET B 368 -2.529 4.002 -17.618 1.00 0.00 N ATOM 1082 CA MET B 368 -1.618 4.488 -18.646 1.00 0.00 C ATOM 1083 C MET B 368 -1.550 6.010 -18.620 1.00 0.00 C ATOM 1084 O MET B 368 -0.466 6.597 -18.670 1.00 0.00 O ATOM 1085 CB MET B 368 -2.067 4.007 -20.027 1.00 0.00 C ATOM 1086 CG MET B 368 -3.578 3.986 -20.206 1.00 0.00 C ATOM 1087 SD MET B 368 -4.095 4.610 -21.816 1.00 0.00 S ATOM 1088 CE MET B 368 -3.127 6.114 -21.924 1.00 0.00 C ATOM 0 H MET B 368 -3.050 3.165 -17.880 1.00 0.00 H new ATOM 0 HA MET B 368 -0.624 4.089 -18.441 1.00 0.00 H new ATOM 0 HB2 MET B 368 -1.629 4.654 -20.787 1.00 0.00 H new ATOM 0 HB3 MET B 368 -1.676 3.004 -20.198 1.00 0.00 H new ATOM 0 HG2 MET B 368 -3.940 2.965 -20.083 1.00 0.00 H new ATOM 0 HG3 MET B 368 -4.041 4.586 -19.422 1.00 0.00 H new ATOM 0 HE1 MET B 368 -3.656 6.844 -22.536 1.00 0.00 H new ATOM 0 HE2 MET B 368 -2.974 6.521 -20.924 1.00 0.00 H new ATOM 0 HE3 MET B 368 -2.161 5.893 -22.378 1.00 0.00 H new ATOM 1098 N ASN B 369 -2.714 6.643 -18.530 1.00 0.00 N ATOM 1099 CA ASN B 369 -2.786 8.096 -18.487 1.00 0.00 C ATOM 1100 C ASN B 369 -2.012 8.633 -17.292 1.00 0.00 C ATOM 1101 O ASN B 369 -1.208 9.558 -17.420 1.00 0.00 O ATOM 1102 CB ASN B 369 -4.238 8.553 -18.410 1.00 0.00 C ATOM 1103 CG ASN B 369 -4.948 8.423 -19.740 1.00 0.00 C ATOM 1104 OD1 ASN B 369 -4.314 8.301 -20.786 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -6.273 8.449 -19.708 1.00 0.00 N ATOM 0 H ASN B 369 -3.618 6.173 -18.486 1.00 0.00 H new ATOM 0 HA ASN B 369 -2.339 8.488 -19.401 1.00 0.00 H new ATOM 0 HB2 ASN B 369 -4.764 7.963 -17.660 1.00 0.00 H new ATOM 0 HB3 ASN B 369 -4.274 9.591 -18.081 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -6.806 8.366 -20.574 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -6.760 8.552 -18.818 1.00 0.00 H new ATOM 1112 N ALA B 370 -2.257 8.039 -16.128 1.00 0.00 N ATOM 1113 CA ALA B 370 -1.582 8.447 -14.906 1.00 0.00 C ATOM 1114 C ALA B 370 -0.081 8.227 -15.025 1.00 0.00 C ATOM 1115 O ALA B 370 0.680 9.179 -15.189 1.00 0.00 O ATOM 1116 CB ALA B 370 -2.129 7.697 -13.701 1.00 0.00 C ATOM 0 H ALA B 370 -2.919 7.273 -16.008 1.00 0.00 H new ATOM 0 HA ALA B 370 -1.770 9.511 -14.760 1.00 0.00 H new ATOM 0 HB1 ALA B 370 -1.606 8.022 -12.802 1.00 0.00 H new ATOM 0 HB2 ALA B 370 -3.194 7.904 -13.596 1.00 0.00 H new ATOM 0 HB3 ALA B 370 -1.980 6.626 -13.840 1.00 0.00 H new ATOM 1122 N LYS B 371 0.339 6.967 -14.928 1.00 0.00 N ATOM 1123 CA LYS B 371 1.757 6.619 -15.018 1.00 0.00 C ATOM 1124 C LYS B 371 2.501 7.580 -15.940 1.00 0.00 C ATOM 1125 O LYS B 371 3.618 8.008 -15.639 1.00 0.00 O ATOM 1126 CB LYS B 371 1.942 5.180 -15.517 1.00 0.00 C ATOM 1127 CG LYS B 371 0.642 4.454 -15.834 1.00 0.00 C ATOM 1128 CD LYS B 371 0.897 3.078 -16.427 1.00 0.00 C ATOM 1129 CE LYS B 371 0.406 1.974 -15.504 1.00 0.00 C ATOM 1130 NZ LYS B 371 0.856 2.182 -14.099 1.00 0.00 N ATOM 0 H LYS B 371 -0.282 6.170 -14.787 1.00 0.00 H new ATOM 0 HA LYS B 371 2.174 6.700 -14.014 1.00 0.00 H new ATOM 0 HB2 LYS B 371 2.563 5.196 -16.412 1.00 0.00 H new ATOM 0 HB3 LYS B 371 2.486 4.613 -14.761 1.00 0.00 H new ATOM 0 HG2 LYS B 371 0.050 4.354 -14.924 1.00 0.00 H new ATOM 0 HG3 LYS B 371 0.054 5.049 -16.533 1.00 0.00 H new ATOM 0 HD2 LYS B 371 0.395 2.998 -17.391 1.00 0.00 H new ATOM 0 HD3 LYS B 371 1.964 2.952 -16.611 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -0.683 1.933 -15.534 1.00 0.00 H new ATOM 0 HE3 LYS B 371 0.771 1.012 -15.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 1.001 1.260 -13.641 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 1.749 2.715 -14.096 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 0.132 2.717 -13.578 1.00 0.00 H new ATOM 1144 N ARG B 372 1.876 7.917 -17.064 1.00 0.00 N ATOM 1145 CA ARG B 372 2.482 8.826 -18.028 1.00 0.00 C ATOM 1146 C ARG B 372 2.644 10.229 -17.444 1.00 0.00 C ATOM 1147 O ARG B 372 3.691 10.849 -17.583 1.00 0.00 O ATOM 1148 CB ARG B 372 1.646 8.882 -19.306 1.00 0.00 C ATOM 1149 CG ARG B 372 2.454 9.250 -20.541 1.00 0.00 C ATOM 1150 CD ARG B 372 2.334 10.731 -20.861 1.00 0.00 C ATOM 1151 NE ARG B 372 3.434 11.203 -21.694 1.00 0.00 N ATOM 1152 CZ ARG B 372 3.336 12.230 -22.533 1.00 0.00 C ATOM 1153 NH1 ARG B 372 2.191 12.890 -22.644 1.00 0.00 N ATOM 1154 NH2 ARG B 372 4.382 12.600 -23.260 1.00 0.00 N ATOM 0 H ARG B 372 0.952 7.575 -17.328 1.00 0.00 H new ATOM 0 HA ARG B 372 3.474 8.443 -18.268 1.00 0.00 H new ATOM 0 HB2 ARG B 372 1.174 7.912 -19.465 1.00 0.00 H new ATOM 0 HB3 ARG B 372 0.844 9.609 -19.175 1.00 0.00 H new ATOM 0 HG2 ARG B 372 3.502 8.994 -20.382 1.00 0.00 H new ATOM 0 HG3 ARG B 372 2.108 8.663 -21.392 1.00 0.00 H new ATOM 0 HD2 ARG B 372 1.389 10.916 -21.371 1.00 0.00 H new ATOM 0 HD3 ARG B 372 2.312 11.302 -19.932 1.00 0.00 H new ATOM 0 HE ARG B 372 4.329 10.718 -21.629 1.00 0.00 H new ATOM 0 HH11 ARG B 372 1.385 12.610 -22.086 1.00 0.00 H new ATOM 0 HH12 ARG B 372 2.117 13.678 -23.288 1.00 0.00 H new ATOM 0 HH21 ARG B 372 5.265 12.096 -23.176 1.00 0.00 H new ATOM 0 HH22 ARG B 372 4.303 13.388 -23.903 1.00 0.00 H new ATOM 1168 N GLN B 373 1.606 10.730 -16.790 1.00 0.00 N ATOM 1169 CA GLN B 373 1.663 12.061 -16.202 1.00 0.00 C ATOM 1170 C GLN B 373 2.795 12.166 -15.188 1.00 0.00 C ATOM 1171 O GLN B 373 3.477 13.188 -15.097 1.00 0.00 O ATOM 1172 CB GLN B 373 0.328 12.403 -15.533 1.00 0.00 C ATOM 1173 CG GLN B 373 -0.045 13.873 -15.658 1.00 0.00 C ATOM 1174 CD GLN B 373 0.786 14.801 -14.779 1.00 0.00 C ATOM 1175 OE1 GLN B 373 0.804 16.012 -14.997 1.00 0.00 O ATOM 1176 NE2 GLN B 373 1.478 14.251 -13.785 1.00 0.00 N ATOM 0 H GLN B 373 0.722 10.240 -16.654 1.00 0.00 H new ATOM 0 HA GLN B 373 1.855 12.774 -17.003 1.00 0.00 H new ATOM 0 HB2 GLN B 373 -0.460 11.796 -15.978 1.00 0.00 H new ATOM 0 HB3 GLN B 373 0.379 12.136 -14.477 1.00 0.00 H new ATOM 0 HG2 GLN B 373 0.067 14.178 -16.698 1.00 0.00 H new ATOM 0 HG3 GLN B 373 -1.098 13.993 -15.402 1.00 0.00 H new ATOM 0 HE21 GLN B 373 1.440 13.243 -13.633 1.00 0.00 H new ATOM 0 HE22 GLN B 373 2.047 14.837 -13.174 1.00 0.00 H new ATOM 1185 N LEU B 374 2.978 11.109 -14.414 1.00 0.00 N ATOM 1186 CA LEU B 374 4.004 11.082 -13.385 1.00 0.00 C ATOM 1187 C LEU B 374 5.424 11.085 -13.951 1.00 0.00 C ATOM 1188 O LEU B 374 6.154 12.067 -13.802 1.00 0.00 O ATOM 1189 CB LEU B 374 3.810 9.856 -12.494 1.00 0.00 C ATOM 1190 CG LEU B 374 2.702 9.992 -11.450 1.00 0.00 C ATOM 1191 CD1 LEU B 374 3.213 10.737 -10.231 1.00 0.00 C ATOM 1192 CD2 LEU B 374 1.498 10.704 -12.046 1.00 0.00 C ATOM 0 H LEU B 374 2.426 10.254 -14.480 1.00 0.00 H new ATOM 0 HA LEU B 374 3.892 11.998 -12.805 1.00 0.00 H new ATOM 0 HB2 LEU B 374 3.591 8.996 -13.126 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.749 9.644 -11.982 1.00 0.00 H new ATOM 0 HG LEU B 374 2.393 8.994 -11.139 1.00 0.00 H new ATOM 0 HD11 LEU B 374 2.412 10.826 -9.497 1.00 0.00 H new ATOM 0 HD12 LEU B 374 4.048 10.189 -9.793 1.00 0.00 H new ATOM 0 HD13 LEU B 374 3.547 11.732 -10.526 1.00 0.00 H new ATOM 0 HD21 LEU B 374 0.717 10.793 -11.291 1.00 0.00 H new ATOM 0 HD22 LEU B 374 1.793 11.698 -12.382 1.00 0.00 H new ATOM 0 HD23 LEU B 374 1.119 10.132 -12.893 1.00 0.00 H new ATOM 1204 N TYR B 375 5.832 9.972 -14.553 1.00 0.00 N ATOM 1205 CA TYR B 375 7.191 9.850 -15.077 1.00 0.00 C ATOM 1206 C TYR B 375 7.347 10.366 -16.506 1.00 0.00 C ATOM 1207 O TYR B 375 8.418 10.232 -17.098 1.00 0.00 O ATOM 1208 CB TYR B 375 7.651 8.395 -14.997 1.00 0.00 C ATOM 1209 CG TYR B 375 8.065 7.975 -13.606 1.00 0.00 C ATOM 1210 CD1 TYR B 375 7.431 8.499 -12.487 1.00 0.00 C ATOM 1211 CD2 TYR B 375 9.090 7.059 -13.411 1.00 0.00 C ATOM 1212 CE1 TYR B 375 7.805 8.121 -11.211 1.00 0.00 C ATOM 1213 CE2 TYR B 375 9.471 6.676 -12.138 1.00 0.00 C ATOM 1214 CZ TYR B 375 8.826 7.210 -11.043 1.00 0.00 C ATOM 1215 OH TYR B 375 9.204 6.831 -9.775 1.00 0.00 O ATOM 0 H TYR B 375 5.248 9.147 -14.690 1.00 0.00 H new ATOM 0 HA TYR B 375 7.819 10.483 -14.451 1.00 0.00 H new ATOM 0 HB2 TYR B 375 6.845 7.747 -15.340 1.00 0.00 H new ATOM 0 HB3 TYR B 375 8.489 8.248 -15.678 1.00 0.00 H new ATOM 0 HD1 TYR B 375 6.632 9.214 -12.616 1.00 0.00 H new ATOM 0 HD2 TYR B 375 9.598 6.639 -14.267 1.00 0.00 H new ATOM 0 HE1 TYR B 375 7.301 8.537 -10.351 1.00 0.00 H new ATOM 0 HE2 TYR B 375 10.270 5.962 -12.002 1.00 0.00 H new ATOM 0 HH TYR B 375 9.936 6.182 -9.832 1.00 0.00 H new ATOM 1225 N SER B 376 6.301 10.962 -17.058 1.00 0.00 N ATOM 1226 CA SER B 376 6.382 11.493 -18.415 1.00 0.00 C ATOM 1227 C SER B 376 6.057 12.982 -18.442 1.00 0.00 C ATOM 1228 O SER B 376 6.426 13.684 -19.385 1.00 0.00 O ATOM 1229 CB SER B 376 5.453 10.728 -19.362 1.00 0.00 C ATOM 1230 OG SER B 376 6.054 10.552 -20.634 1.00 0.00 O ATOM 0 H SER B 376 5.399 11.090 -16.599 1.00 0.00 H new ATOM 0 HA SER B 376 7.408 11.360 -18.759 1.00 0.00 H new ATOM 0 HB2 SER B 376 5.211 9.756 -18.933 1.00 0.00 H new ATOM 0 HB3 SER B 376 4.514 11.270 -19.472 1.00 0.00 H new ATOM 0 HG SER B 376 5.855 9.653 -20.968 1.00 0.00 H new ATOM 1236 N LEU B 377 5.372 13.468 -17.410 1.00 0.00 N ATOM 1237 CA LEU B 377 5.019 14.876 -17.342 1.00 0.00 C ATOM 1238 C LEU B 377 5.692 15.564 -16.156 1.00 0.00 C ATOM 1239 O LEU B 377 5.932 16.771 -16.194 1.00 0.00 O ATOM 1240 CB LEU B 377 3.504 15.041 -17.252 1.00 0.00 C ATOM 1241 CG LEU B 377 2.810 15.390 -18.568 1.00 0.00 C ATOM 1242 CD1 LEU B 377 2.393 14.125 -19.303 1.00 0.00 C ATOM 1243 CD2 LEU B 377 1.605 16.279 -18.311 1.00 0.00 C ATOM 0 H LEU B 377 5.054 12.910 -16.617 1.00 0.00 H new ATOM 0 HA LEU B 377 5.377 15.351 -18.255 1.00 0.00 H new ATOM 0 HB2 LEU B 377 3.076 14.115 -16.868 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.282 15.821 -16.524 1.00 0.00 H new ATOM 0 HG LEU B 377 3.514 15.935 -19.196 1.00 0.00 H new ATOM 0 HD11 LEU B 377 1.900 14.393 -20.238 1.00 0.00 H new ATOM 0 HD12 LEU B 377 3.275 13.521 -19.518 1.00 0.00 H new ATOM 0 HD13 LEU B 377 1.704 13.553 -18.681 1.00 0.00 H new ATOM 0 HD21 LEU B 377 1.121 16.519 -19.258 1.00 0.00 H new ATOM 0 HD22 LEU B 377 0.899 15.757 -17.665 1.00 0.00 H new ATOM 0 HD23 LEU B 377 1.929 17.200 -17.826 1.00 0.00 H new ATOM 1255 N ILE B 378 5.990 14.808 -15.097 1.00 0.00 N ATOM 1256 CA ILE B 378 6.622 15.385 -13.915 1.00 0.00 C ATOM 1257 C ILE B 378 7.653 14.441 -13.303 1.00 0.00 C ATOM 1258 O ILE B 378 7.830 14.412 -12.085 1.00 0.00 O ATOM 1259 CB ILE B 378 5.576 15.723 -12.839 1.00 0.00 C ATOM 1260 CG1 ILE B 378 4.296 16.240 -13.491 1.00 0.00 C ATOM 1261 CG2 ILE B 378 6.134 16.740 -11.856 1.00 0.00 C ATOM 1262 CD1 ILE B 378 4.423 17.639 -14.052 1.00 0.00 C ATOM 0 H ILE B 378 5.805 13.807 -15.036 1.00 0.00 H new ATOM 0 HA ILE B 378 7.123 16.294 -14.248 1.00 0.00 H new ATOM 0 HB ILE B 378 5.336 14.815 -12.286 1.00 0.00 H new ATOM 0 HG12 ILE B 378 4.007 15.561 -14.293 1.00 0.00 H new ATOM 0 HG13 ILE B 378 3.492 16.224 -12.755 1.00 0.00 H new ATOM 0 HG21 ILE B 378 5.381 16.968 -11.102 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.020 16.330 -11.372 1.00 0.00 H new ATOM 0 HG23 ILE B 378 6.401 17.652 -12.389 1.00 0.00 H new ATOM 0 HD11 ILE B 378 3.475 17.939 -14.499 1.00 0.00 H new ATOM 0 HD12 ILE B 378 4.681 18.331 -13.250 1.00 0.00 H new ATOM 0 HD13 ILE B 378 5.204 17.657 -14.812 1.00 0.00 H new ATOM 1274 N GLY B 379 8.329 13.670 -14.144 1.00 0.00 N ATOM 1275 CA GLY B 379 9.326 12.741 -13.646 1.00 0.00 C ATOM 1276 C GLY B 379 10.697 12.979 -14.243 1.00 0.00 C ATOM 1277 O GLY B 379 11.066 12.352 -15.235 1.00 0.00 O ATOM 0 H GLY B 379 8.207 13.670 -15.157 1.00 0.00 H new ATOM 0 HA2 GLY B 379 9.387 12.827 -12.561 1.00 0.00 H new ATOM 0 HA3 GLY B 379 9.010 11.722 -13.868 1.00 0.00 H new ATOM 1281 N TYR B 380 11.458 13.879 -13.632 1.00 0.00 N ATOM 1282 CA TYR B 380 12.800 14.186 -14.107 1.00 0.00 C ATOM 1283 C TYR B 380 13.840 13.416 -13.302 1.00 0.00 C ATOM 1284 O TYR B 380 13.526 12.830 -12.267 1.00 0.00 O ATOM 1285 CB TYR B 380 13.068 15.691 -14.032 1.00 0.00 C ATOM 1286 CG TYR B 380 12.973 16.266 -12.637 1.00 0.00 C ATOM 1287 CD1 TYR B 380 13.886 15.907 -11.651 1.00 0.00 C ATOM 1288 CD2 TYR B 380 11.973 17.172 -12.306 1.00 0.00 C ATOM 1289 CE1 TYR B 380 13.803 16.437 -10.377 1.00 0.00 C ATOM 1290 CE2 TYR B 380 11.886 17.706 -11.035 1.00 0.00 C ATOM 1291 CZ TYR B 380 12.802 17.335 -10.074 1.00 0.00 C ATOM 1292 OH TYR B 380 12.718 17.864 -8.807 1.00 0.00 O ATOM 0 H TYR B 380 11.169 14.407 -12.809 1.00 0.00 H new ATOM 0 HA TYR B 380 12.874 13.877 -15.150 1.00 0.00 H new ATOM 0 HB2 TYR B 380 14.063 15.892 -14.429 1.00 0.00 H new ATOM 0 HB3 TYR B 380 12.357 16.208 -14.676 1.00 0.00 H new ATOM 0 HD1 TYR B 380 14.672 15.204 -11.884 1.00 0.00 H new ATOM 0 HD2 TYR B 380 11.252 17.464 -13.055 1.00 0.00 H new ATOM 0 HE1 TYR B 380 14.520 16.149 -9.622 1.00 0.00 H new ATOM 0 HE2 TYR B 380 11.104 18.411 -10.795 1.00 0.00 H new ATOM 0 HH TYR B 380 11.958 18.481 -8.760 1.00 0.00 H new ATOM 1302 N ALA B 381 15.074 13.406 -13.790 1.00 0.00 N ATOM 1303 CA ALA B 381 16.153 12.690 -13.120 1.00 0.00 C ATOM 1304 C ALA B 381 16.498 13.320 -11.774 1.00 0.00 C ATOM 1305 O ALA B 381 16.981 14.451 -11.710 1.00 0.00 O ATOM 1306 CB ALA B 381 17.391 12.625 -14.002 1.00 0.00 C ATOM 0 H ALA B 381 15.353 13.885 -14.646 1.00 0.00 H new ATOM 0 HA ALA B 381 15.800 11.675 -12.935 1.00 0.00 H new ATOM 0 HB1 ALA B 381 18.182 12.086 -13.480 1.00 0.00 H new ATOM 0 HB2 ALA B 381 17.150 12.106 -14.930 1.00 0.00 H new ATOM 0 HB3 ALA B 381 17.730 13.636 -14.229 1.00 0.00 H new ATOM 1312 N SER B 382 16.255 12.566 -10.704 1.00 0.00 N ATOM 1313 CA SER B 382 16.546 13.023 -9.345 1.00 0.00 C ATOM 1314 C SER B 382 15.355 13.743 -8.720 1.00 0.00 C ATOM 1315 O SER B 382 15.513 14.797 -8.104 1.00 0.00 O ATOM 1316 CB SER B 382 17.768 13.944 -9.339 1.00 0.00 C ATOM 1317 OG SER B 382 17.380 15.305 -9.421 1.00 0.00 O ATOM 0 H SER B 382 15.854 11.629 -10.752 1.00 0.00 H new ATOM 0 HA SER B 382 16.757 12.137 -8.746 1.00 0.00 H new ATOM 0 HB2 SER B 382 18.346 13.781 -8.429 1.00 0.00 H new ATOM 0 HB3 SER B 382 18.418 13.697 -10.178 1.00 0.00 H new ATOM 0 HG SER B 382 17.215 15.542 -10.357 1.00 0.00 H new ATOM 1323 N LEU B 383 14.166 13.171 -8.874 1.00 0.00 N ATOM 1324 CA LEU B 383 12.959 13.766 -8.313 1.00 0.00 C ATOM 1325 C LEU B 383 12.675 13.201 -6.923 1.00 0.00 C ATOM 1326 O LEU B 383 12.277 13.928 -6.014 1.00 0.00 O ATOM 1327 CB LEU B 383 11.762 13.513 -9.231 1.00 0.00 C ATOM 1328 CG LEU B 383 10.721 14.634 -9.263 1.00 0.00 C ATOM 1329 CD1 LEU B 383 9.549 14.249 -10.153 1.00 0.00 C ATOM 1330 CD2 LEU B 383 10.241 14.951 -7.856 1.00 0.00 C ATOM 0 H LEU B 383 14.012 12.299 -9.381 1.00 0.00 H new ATOM 0 HA LEU B 383 13.119 14.841 -8.228 1.00 0.00 H new ATOM 0 HB2 LEU B 383 12.129 13.350 -10.244 1.00 0.00 H new ATOM 0 HB3 LEU B 383 11.272 12.591 -8.917 1.00 0.00 H new ATOM 0 HG LEU B 383 11.188 15.527 -9.678 1.00 0.00 H new ATOM 0 HD11 LEU B 383 8.819 15.058 -10.163 1.00 0.00 H new ATOM 0 HD12 LEU B 383 9.906 14.069 -11.167 1.00 0.00 H new ATOM 0 HD13 LEU B 383 9.081 13.343 -9.767 1.00 0.00 H new ATOM 0 HD21 LEU B 383 9.501 15.750 -7.895 1.00 0.00 H new ATOM 0 HD22 LEU B 383 9.791 14.061 -7.416 1.00 0.00 H new ATOM 0 HD23 LEU B 383 11.087 15.269 -7.246 1.00 0.00 H new ATOM 1342 N ARG B 384 12.883 11.896 -6.772 1.00 0.00 N ATOM 1343 CA ARG B 384 12.652 11.219 -5.499 1.00 0.00 C ATOM 1344 C ARG B 384 11.177 10.885 -5.315 1.00 0.00 C ATOM 1345 O ARG B 384 10.804 10.169 -4.385 1.00 0.00 O ATOM 1346 CB ARG B 384 13.135 12.084 -4.335 1.00 0.00 C ATOM 1347 CG ARG B 384 13.612 11.276 -3.138 1.00 0.00 C ATOM 1348 CD ARG B 384 14.651 10.241 -3.539 1.00 0.00 C ATOM 1349 NE ARG B 384 15.640 10.028 -2.487 1.00 0.00 N ATOM 1350 CZ ARG B 384 16.523 9.036 -2.491 1.00 0.00 C ATOM 1351 NH1 ARG B 384 16.537 8.157 -3.484 1.00 0.00 N ATOM 1352 NH2 ARG B 384 17.394 8.919 -1.499 1.00 0.00 N ATOM 0 H ARG B 384 13.212 11.284 -7.519 1.00 0.00 H new ATOM 0 HA ARG B 384 13.219 10.288 -5.511 1.00 0.00 H new ATOM 0 HB2 ARG B 384 13.948 12.723 -4.680 1.00 0.00 H new ATOM 0 HB3 ARG B 384 12.325 12.742 -4.020 1.00 0.00 H new ATOM 0 HG2 ARG B 384 14.036 11.947 -2.391 1.00 0.00 H new ATOM 0 HG3 ARG B 384 12.762 10.777 -2.673 1.00 0.00 H new ATOM 0 HD2 ARG B 384 14.155 9.298 -3.767 1.00 0.00 H new ATOM 0 HD3 ARG B 384 15.154 10.565 -4.450 1.00 0.00 H new ATOM 0 HE ARG B 384 15.654 10.680 -1.702 1.00 0.00 H new ATOM 0 HH11 ARG B 384 15.868 8.241 -4.249 1.00 0.00 H new ATOM 0 HH12 ARG B 384 17.217 7.397 -3.483 1.00 0.00 H new ATOM 0 HH21 ARG B 384 17.386 9.591 -0.732 1.00 0.00 H new ATOM 0 HH22 ARG B 384 18.072 8.157 -1.503 1.00 0.00 H new ATOM 1366 N LEU B 385 10.342 11.405 -6.206 1.00 0.00 N ATOM 1367 CA LEU B 385 8.910 11.160 -6.143 1.00 0.00 C ATOM 1368 C LEU B 385 8.634 9.712 -5.780 1.00 0.00 C ATOM 1369 O LEU B 385 9.269 8.797 -6.305 1.00 0.00 O ATOM 1370 CB LEU B 385 8.257 11.506 -7.482 1.00 0.00 C ATOM 1371 CG LEU B 385 6.731 11.585 -7.463 1.00 0.00 C ATOM 1372 CD1 LEU B 385 6.233 12.451 -8.610 1.00 0.00 C ATOM 1373 CD2 LEU B 385 6.124 10.192 -7.539 1.00 0.00 C ATOM 0 H LEU B 385 10.634 12.000 -6.981 1.00 0.00 H new ATOM 0 HA LEU B 385 8.482 11.797 -5.369 1.00 0.00 H new ATOM 0 HB2 LEU B 385 8.650 12.464 -7.822 1.00 0.00 H new ATOM 0 HB3 LEU B 385 8.557 10.759 -8.217 1.00 0.00 H new ATOM 0 HG LEU B 385 6.418 12.042 -6.524 1.00 0.00 H new ATOM 0 HD11 LEU B 385 5.144 12.498 -8.584 1.00 0.00 H new ATOM 0 HD12 LEU B 385 6.642 13.456 -8.511 1.00 0.00 H new ATOM 0 HD13 LEU B 385 6.555 12.020 -9.558 1.00 0.00 H new ATOM 0 HD21 LEU B 385 5.037 10.268 -7.524 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.442 9.707 -8.462 1.00 0.00 H new ATOM 0 HD23 LEU B 385 6.458 9.602 -6.685 1.00 0.00 H new ATOM 1385 N HIS B 386 7.687 9.507 -4.876 1.00 0.00 N ATOM 1386 CA HIS B 386 7.347 8.154 -4.452 1.00 0.00 C ATOM 1387 C HIS B 386 6.013 8.088 -3.724 1.00 0.00 C ATOM 1388 O HIS B 386 5.605 9.029 -3.037 1.00 0.00 O ATOM 1389 CB HIS B 386 8.457 7.581 -3.566 1.00 0.00 C ATOM 1390 CG HIS B 386 8.535 8.206 -2.208 1.00 0.00 C ATOM 1391 ND1 HIS B 386 9.548 9.066 -1.833 1.00 0.00 N ATOM 1392 CD2 HIS B 386 7.727 8.087 -1.127 1.00 0.00 C ATOM 1393 CE1 HIS B 386 9.359 9.447 -0.582 1.00 0.00 C ATOM 1394 NE2 HIS B 386 8.261 8.869 -0.132 1.00 0.00 N ATOM 0 H HIS B 386 7.147 10.247 -4.427 1.00 0.00 H new ATOM 0 HA HIS B 386 7.251 7.552 -5.356 1.00 0.00 H new ATOM 0 HB2 HIS B 386 8.300 6.508 -3.453 1.00 0.00 H new ATOM 0 HB3 HIS B 386 9.414 7.712 -4.070 1.00 0.00 H new ATOM 0 HD1 HIS B 386 10.322 9.361 -2.429 1.00 0.00 H new ATOM 0 HD2 HIS B 386 6.830 7.489 -1.060 1.00 0.00 H new ATOM 0 HE1 HIS B 386 9.995 10.117 -0.023 1.00 0.00 H new ATOM 1403 N TYR B 387 5.349 6.948 -3.881 1.00 0.00 N ATOM 1404 CA TYR B 387 4.068 6.704 -3.243 1.00 0.00 C ATOM 1405 C TYR B 387 4.257 5.829 -2.018 1.00 0.00 C ATOM 1406 O TYR B 387 5.072 4.907 -2.023 1.00 0.00 O ATOM 1407 CB TYR B 387 3.111 6.018 -4.213 1.00 0.00 C ATOM 1408 CG TYR B 387 2.651 6.908 -5.334 1.00 0.00 C ATOM 1409 CD1 TYR B 387 3.568 7.577 -6.132 1.00 0.00 C ATOM 1410 CD2 TYR B 387 1.302 7.083 -5.593 1.00 0.00 C ATOM 1411 CE1 TYR B 387 3.151 8.398 -7.159 1.00 0.00 C ATOM 1412 CE2 TYR B 387 0.874 7.901 -6.616 1.00 0.00 C ATOM 1413 CZ TYR B 387 1.802 8.558 -7.399 1.00 0.00 C ATOM 1414 OH TYR B 387 1.379 9.377 -8.420 1.00 0.00 O ATOM 0 H TYR B 387 5.685 6.172 -4.452 1.00 0.00 H new ATOM 0 HA TYR B 387 3.644 7.663 -2.944 1.00 0.00 H new ATOM 0 HB2 TYR B 387 3.601 5.140 -4.635 1.00 0.00 H new ATOM 0 HB3 TYR B 387 2.241 5.663 -3.662 1.00 0.00 H new ATOM 0 HD1 TYR B 387 4.625 7.453 -5.946 1.00 0.00 H new ATOM 0 HD2 TYR B 387 0.573 6.570 -4.983 1.00 0.00 H new ATOM 0 HE1 TYR B 387 3.876 8.913 -7.772 1.00 0.00 H new ATOM 0 HE2 TYR B 387 -0.182 8.027 -6.804 1.00 0.00 H new ATOM 0 HH TYR B 387 1.480 8.911 -9.276 1.00 0.00 H new ATOM 1424 N VAL B 388 3.504 6.114 -0.969 1.00 0.00 N ATOM 1425 CA VAL B 388 3.605 5.335 0.251 1.00 0.00 C ATOM 1426 C VAL B 388 2.273 4.706 0.616 1.00 0.00 C ATOM 1427 O VAL B 388 1.279 5.399 0.830 1.00 0.00 O ATOM 1428 CB VAL B 388 4.118 6.177 1.429 1.00 0.00 C ATOM 1429 CG1 VAL B 388 5.542 5.769 1.759 1.00 0.00 C ATOM 1430 CG2 VAL B 388 4.041 7.663 1.110 1.00 0.00 C ATOM 0 H VAL B 388 2.822 6.872 -0.938 1.00 0.00 H new ATOM 0 HA VAL B 388 4.329 4.544 0.054 1.00 0.00 H new ATOM 0 HB VAL B 388 3.485 5.995 2.297 1.00 0.00 H new ATOM 0 HG11 VAL B 388 5.907 6.366 2.595 1.00 0.00 H new ATOM 0 HG12 VAL B 388 5.565 4.713 2.030 1.00 0.00 H new ATOM 0 HG13 VAL B 388 6.179 5.934 0.890 1.00 0.00 H new ATOM 0 HG21 VAL B 388 4.410 8.237 1.960 1.00 0.00 H new ATOM 0 HG22 VAL B 388 4.652 7.879 0.233 1.00 0.00 H new ATOM 0 HG23 VAL B 388 3.006 7.939 0.908 1.00 0.00 H new ATOM 1440 N THR B 389 2.267 3.383 0.681 1.00 0.00 N ATOM 1441 CA THR B 389 1.063 2.642 1.016 1.00 0.00 C ATOM 1442 C THR B 389 0.779 2.721 2.506 1.00 0.00 C ATOM 1443 O THR B 389 1.675 2.549 3.332 1.00 0.00 O ATOM 1444 CB THR B 389 1.171 1.163 0.604 1.00 0.00 C ATOM 1445 OG1 THR B 389 1.069 1.007 -0.817 1.00 0.00 O ATOM 1446 CG2 THR B 389 0.072 0.336 1.259 1.00 0.00 C ATOM 0 H THR B 389 3.086 2.800 0.505 1.00 0.00 H new ATOM 0 HA THR B 389 0.245 3.101 0.461 1.00 0.00 H new ATOM 0 HB THR B 389 2.148 0.813 0.937 1.00 0.00 H new ATOM 0 HG1 THR B 389 1.143 0.057 -1.048 1.00 0.00 H new ATOM 0 HG21 THR B 389 0.169 -0.706 0.953 1.00 0.00 H new ATOM 0 HG22 THR B 389 0.162 0.405 2.343 1.00 0.00 H new ATOM 0 HG23 THR B 389 -0.902 0.716 0.950 1.00 0.00 H new ATOM 1454 N VAL B 390 -0.474 2.981 2.843 1.00 0.00 N ATOM 1455 CA VAL B 390 -0.874 3.080 4.232 1.00 0.00 C ATOM 1456 C VAL B 390 -2.242 2.452 4.448 1.00 0.00 C ATOM 1457 O VAL B 390 -3.033 2.305 3.509 1.00 0.00 O ATOM 1458 CB VAL B 390 -0.898 4.544 4.703 1.00 0.00 C ATOM 1459 CG1 VAL B 390 0.512 5.111 4.733 1.00 0.00 C ATOM 1460 CG2 VAL B 390 -1.790 5.377 3.801 1.00 0.00 C ATOM 0 H VAL B 390 -1.229 3.127 2.173 1.00 0.00 H new ATOM 0 HA VAL B 390 -0.136 2.536 4.822 1.00 0.00 H new ATOM 0 HB VAL B 390 -1.306 4.578 5.713 1.00 0.00 H new ATOM 0 HG11 VAL B 390 0.480 6.148 5.068 1.00 0.00 H new ATOM 0 HG12 VAL B 390 1.125 4.526 5.419 1.00 0.00 H new ATOM 0 HG13 VAL B 390 0.944 5.066 3.733 1.00 0.00 H new ATOM 0 HG21 VAL B 390 -1.796 6.410 4.148 1.00 0.00 H new ATOM 0 HG22 VAL B 390 -1.411 5.340 2.780 1.00 0.00 H new ATOM 0 HG23 VAL B 390 -2.805 4.980 3.826 1.00 0.00 H new ATOM 1470 N LYS B 391 -2.508 2.073 5.688 1.00 0.00 N ATOM 1471 CA LYS B 391 -3.768 1.449 6.045 1.00 0.00 C ATOM 1472 C LYS B 391 -3.697 -0.054 5.807 1.00 0.00 C ATOM 1473 O LYS B 391 -4.429 -0.595 4.978 1.00 0.00 O ATOM 1474 CB LYS B 391 -4.905 2.064 5.234 1.00 0.00 C ATOM 1475 CG LYS B 391 -6.205 2.209 6.008 1.00 0.00 C ATOM 1476 CD LYS B 391 -6.798 0.854 6.354 1.00 0.00 C ATOM 1477 CE LYS B 391 -7.952 0.988 7.334 1.00 0.00 C ATOM 1478 NZ LYS B 391 -8.343 -0.325 7.915 1.00 0.00 N ATOM 0 H LYS B 391 -1.861 2.189 6.468 1.00 0.00 H new ATOM 0 HA LYS B 391 -3.961 1.623 7.104 1.00 0.00 H new ATOM 0 HB2 LYS B 391 -4.594 3.046 4.878 1.00 0.00 H new ATOM 0 HB3 LYS B 391 -5.085 1.448 4.353 1.00 0.00 H new ATOM 0 HG2 LYS B 391 -6.024 2.773 6.923 1.00 0.00 H new ATOM 0 HG3 LYS B 391 -6.920 2.781 5.417 1.00 0.00 H new ATOM 0 HD2 LYS B 391 -7.146 0.364 5.444 1.00 0.00 H new ATOM 0 HD3 LYS B 391 -6.026 0.216 6.784 1.00 0.00 H new ATOM 0 HE2 LYS B 391 -7.670 1.670 8.136 1.00 0.00 H new ATOM 0 HE3 LYS B 391 -8.809 1.430 6.827 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 -9.133 -0.190 8.578 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 -8.637 -0.968 7.153 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 -7.533 -0.736 8.421 1.00 0.00 H new ATOM 1492 N LYS B 392 -2.796 -0.714 6.537 1.00 0.00 N ATOM 1493 CA LYS B 392 -2.600 -2.156 6.416 1.00 0.00 C ATOM 1494 C LYS B 392 -3.894 -2.851 6.001 1.00 0.00 C ATOM 1495 O LYS B 392 -4.932 -2.677 6.637 1.00 0.00 O ATOM 1496 CB LYS B 392 -2.096 -2.734 7.740 1.00 0.00 C ATOM 1497 CG LYS B 392 -0.693 -2.278 8.109 1.00 0.00 C ATOM 1498 CD LYS B 392 0.343 -2.804 7.127 1.00 0.00 C ATOM 1499 CE LYS B 392 0.856 -1.703 6.212 1.00 0.00 C ATOM 1500 NZ LYS B 392 2.226 -1.257 6.590 1.00 0.00 N ATOM 0 H LYS B 392 -2.187 -0.267 7.223 1.00 0.00 H new ATOM 0 HA LYS B 392 -1.853 -2.333 5.642 1.00 0.00 H new ATOM 0 HB2 LYS B 392 -2.783 -2.448 8.536 1.00 0.00 H new ATOM 0 HB3 LYS B 392 -2.111 -3.822 7.681 1.00 0.00 H new ATOM 0 HG2 LYS B 392 -0.657 -1.189 8.128 1.00 0.00 H new ATOM 0 HG3 LYS B 392 -0.450 -2.623 9.114 1.00 0.00 H new ATOM 0 HD2 LYS B 392 1.178 -3.240 7.676 1.00 0.00 H new ATOM 0 HD3 LYS B 392 -0.095 -3.602 6.527 1.00 0.00 H new ATOM 0 HE2 LYS B 392 0.862 -2.061 5.182 1.00 0.00 H new ATOM 0 HE3 LYS B 392 0.175 -0.853 6.250 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 2.538 -0.506 5.942 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 2.216 -0.892 7.564 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 2.882 -2.062 6.529 1.00 0.00 H new ATOM 1514 N PRO B 393 -3.853 -3.640 4.915 1.00 0.00 N ATOM 1515 CA PRO B 393 -5.029 -4.346 4.411 1.00 0.00 C ATOM 1516 C PRO B 393 -5.473 -5.488 5.318 1.00 0.00 C ATOM 1517 O PRO B 393 -4.716 -5.969 6.161 1.00 0.00 O ATOM 1518 CB PRO B 393 -4.589 -4.900 3.051 1.00 0.00 C ATOM 1519 CG PRO B 393 -3.261 -4.281 2.762 1.00 0.00 C ATOM 1520 CD PRO B 393 -2.668 -3.896 4.087 1.00 0.00 C ATOM 0 HA PRO B 393 -5.886 -3.675 4.355 1.00 0.00 H new ATOM 0 HB2 PRO B 393 -4.515 -5.987 3.079 1.00 0.00 H new ATOM 0 HB3 PRO B 393 -5.313 -4.650 2.275 1.00 0.00 H new ATOM 0 HG2 PRO B 393 -2.613 -4.983 2.237 1.00 0.00 H new ATOM 0 HG3 PRO B 393 -3.372 -3.408 2.119 1.00 0.00 H new ATOM 0 HD2 PRO B 393 -2.051 -4.694 4.500 1.00 0.00 H new ATOM 0 HD3 PRO B 393 -2.034 -3.013 4.005 1.00 0.00 H new ATOM 1528 N THR B 394 -6.718 -5.897 5.132 1.00 0.00 N ATOM 1529 CA THR B 394 -7.304 -6.972 5.925 1.00 0.00 C ATOM 1530 C THR B 394 -8.086 -7.954 5.062 1.00 0.00 C ATOM 1531 O THR B 394 -8.410 -7.666 3.910 1.00 0.00 O ATOM 1532 CB THR B 394 -8.242 -6.413 7.010 1.00 0.00 C ATOM 1533 OG1 THR B 394 -9.568 -6.217 6.502 1.00 0.00 O ATOM 1534 CG2 THR B 394 -7.727 -5.084 7.541 1.00 0.00 C ATOM 0 H THR B 394 -7.348 -5.499 4.435 1.00 0.00 H new ATOM 0 HA THR B 394 -6.472 -7.498 6.393 1.00 0.00 H new ATOM 0 HB THR B 394 -8.268 -7.147 7.815 1.00 0.00 H new ATOM 0 HG1 THR B 394 -9.994 -5.474 6.978 1.00 0.00 H new ATOM 0 HG21 THR B 394 -8.407 -4.710 8.306 1.00 0.00 H new ATOM 0 HG22 THR B 394 -6.736 -5.224 7.973 1.00 0.00 H new ATOM 0 HG23 THR B 394 -7.668 -4.364 6.725 1.00 0.00 H new ATOM 1542 N ALA B 395 -8.399 -9.114 5.638 1.00 0.00 N ATOM 1543 CA ALA B 395 -9.158 -10.139 4.933 1.00 0.00 C ATOM 1544 C ALA B 395 -10.650 -9.960 5.178 1.00 0.00 C ATOM 1545 O ALA B 395 -11.447 -10.875 4.973 1.00 0.00 O ATOM 1546 CB ALA B 395 -8.720 -11.531 5.346 1.00 0.00 C ATOM 0 H ALA B 395 -8.137 -9.365 6.591 1.00 0.00 H new ATOM 0 HA ALA B 395 -8.960 -10.026 3.867 1.00 0.00 H new ATOM 0 HB1 ALA B 395 -9.305 -12.273 4.802 1.00 0.00 H new ATOM 0 HB2 ALA B 395 -7.663 -11.663 5.116 1.00 0.00 H new ATOM 0 HB3 ALA B 395 -8.877 -11.659 6.417 1.00 0.00 H new ATOM 1552 N VAL B 396 -11.011 -8.756 5.592 1.00 0.00 N ATOM 1553 CA VAL B 396 -12.398 -8.392 5.843 1.00 0.00 C ATOM 1554 C VAL B 396 -12.648 -6.978 5.335 1.00 0.00 C ATOM 1555 O VAL B 396 -13.650 -6.342 5.661 1.00 0.00 O ATOM 1556 CB VAL B 396 -12.736 -8.461 7.341 1.00 0.00 C ATOM 1557 CG1 VAL B 396 -12.777 -9.906 7.810 1.00 0.00 C ATOM 1558 CG2 VAL B 396 -11.728 -7.656 8.147 1.00 0.00 C ATOM 0 H VAL B 396 -10.348 -8.000 5.764 1.00 0.00 H new ATOM 0 HA VAL B 396 -13.036 -9.103 5.317 1.00 0.00 H new ATOM 0 HB VAL B 396 -13.723 -8.026 7.498 1.00 0.00 H new ATOM 0 HG11 VAL B 396 -13.018 -9.937 8.873 1.00 0.00 H new ATOM 0 HG12 VAL B 396 -13.538 -10.449 7.250 1.00 0.00 H new ATOM 0 HG13 VAL B 396 -11.805 -10.370 7.644 1.00 0.00 H new ATOM 0 HG21 VAL B 396 -11.980 -7.714 9.206 1.00 0.00 H new ATOM 0 HG22 VAL B 396 -10.729 -8.061 7.989 1.00 0.00 H new ATOM 0 HG23 VAL B 396 -11.752 -6.615 7.825 1.00 0.00 H new ATOM 1568 N ASP B 397 -11.700 -6.505 4.536 1.00 0.00 N ATOM 1569 CA ASP B 397 -11.739 -5.174 3.952 1.00 0.00 C ATOM 1570 C ASP B 397 -10.348 -4.820 3.441 1.00 0.00 C ATOM 1571 O ASP B 397 -9.773 -3.797 3.814 1.00 0.00 O ATOM 1572 CB ASP B 397 -12.207 -4.145 4.984 1.00 0.00 C ATOM 1573 CG ASP B 397 -13.669 -3.778 4.815 1.00 0.00 C ATOM 1574 OD1 ASP B 397 -14.245 -4.107 3.756 1.00 0.00 O ATOM 1575 OD2 ASP B 397 -14.237 -3.161 5.741 1.00 0.00 O ATOM 0 H ASP B 397 -10.874 -7.042 4.273 1.00 0.00 H new ATOM 0 HA ASP B 397 -12.448 -5.162 3.124 1.00 0.00 H new ATOM 0 HB2 ASP B 397 -12.049 -4.543 5.987 1.00 0.00 H new ATOM 0 HB3 ASP B 397 -11.597 -3.245 4.898 1.00 0.00 H new ATOM 1580 N PRO B 398 -9.788 -5.689 2.584 1.00 0.00 N ATOM 1581 CA PRO B 398 -8.457 -5.514 2.015 1.00 0.00 C ATOM 1582 C PRO B 398 -8.164 -4.073 1.634 1.00 0.00 C ATOM 1583 O PRO B 398 -7.006 -3.666 1.565 1.00 0.00 O ATOM 1584 CB PRO B 398 -8.473 -6.398 0.759 1.00 0.00 C ATOM 1585 CG PRO B 398 -9.798 -7.100 0.744 1.00 0.00 C ATOM 1586 CD PRO B 398 -10.408 -6.925 2.106 1.00 0.00 C ATOM 0 HA PRO B 398 -7.683 -5.782 2.734 1.00 0.00 H new ATOM 0 HB2 PRO B 398 -8.344 -5.796 -0.140 1.00 0.00 H new ATOM 0 HB3 PRO B 398 -7.654 -7.117 0.781 1.00 0.00 H new ATOM 0 HG2 PRO B 398 -10.447 -6.681 -0.025 1.00 0.00 H new ATOM 0 HG3 PRO B 398 -9.671 -8.157 0.512 1.00 0.00 H new ATOM 0 HD2 PRO B 398 -11.493 -6.839 2.055 1.00 0.00 H new ATOM 0 HD3 PRO B 398 -10.185 -7.768 2.760 1.00 0.00 H new ATOM 1594 N ASN B 399 -9.217 -3.315 1.359 1.00 0.00 N ATOM 1595 CA ASN B 399 -9.075 -1.929 0.956 1.00 0.00 C ATOM 1596 C ASN B 399 -7.850 -1.274 1.580 1.00 0.00 C ATOM 1597 O ASN B 399 -7.439 -1.612 2.691 1.00 0.00 O ATOM 1598 CB ASN B 399 -10.327 -1.139 1.326 1.00 0.00 C ATOM 1599 CG ASN B 399 -10.489 -0.994 2.821 1.00 0.00 C ATOM 1600 OD1 ASN B 399 -9.563 -1.258 3.588 1.00 0.00 O ATOM 1601 ND2 ASN B 399 -11.669 -0.572 3.243 1.00 0.00 N ATOM 0 H ASN B 399 -10.182 -3.642 1.409 1.00 0.00 H new ATOM 0 HA ASN B 399 -8.942 -1.920 -0.126 1.00 0.00 H new ATOM 0 HB2 ASN B 399 -10.279 -0.150 0.870 1.00 0.00 H new ATOM 0 HB3 ASN B 399 -11.204 -1.638 0.914 1.00 0.00 H new ATOM 0 HD21 ASN B 399 -11.841 -0.453 4.241 1.00 0.00 H new ATOM 0 HD22 ASN B 399 -12.407 -0.365 2.570 1.00 0.00 H new ATOM 1608 N SER B 400 -7.276 -0.336 0.843 1.00 0.00 N ATOM 1609 CA SER B 400 -6.095 0.383 1.299 1.00 0.00 C ATOM 1610 C SER B 400 -5.985 1.747 0.629 1.00 0.00 C ATOM 1611 O SER B 400 -6.517 1.962 -0.461 1.00 0.00 O ATOM 1612 CB SER B 400 -4.833 -0.437 1.020 1.00 0.00 C ATOM 1613 OG SER B 400 -3.833 0.357 0.402 1.00 0.00 O ATOM 0 H SER B 400 -7.610 -0.053 -0.078 1.00 0.00 H new ATOM 0 HA SER B 400 -6.193 0.537 2.374 1.00 0.00 H new ATOM 0 HB2 SER B 400 -4.449 -0.848 1.954 1.00 0.00 H new ATOM 0 HB3 SER B 400 -5.080 -1.282 0.377 1.00 0.00 H new ATOM 0 HG SER B 400 -3.037 -0.190 0.236 1.00 0.00 H new ATOM 1619 N ILE B 401 -5.285 2.661 1.292 1.00 0.00 N ATOM 1620 CA ILE B 401 -5.088 4.003 0.777 1.00 0.00 C ATOM 1621 C ILE B 401 -3.636 4.169 0.332 1.00 0.00 C ATOM 1622 O ILE B 401 -2.744 3.504 0.858 1.00 0.00 O ATOM 1623 CB ILE B 401 -5.462 5.045 1.854 1.00 0.00 C ATOM 1624 CG1 ILE B 401 -4.991 6.453 1.483 1.00 0.00 C ATOM 1625 CG2 ILE B 401 -4.898 4.636 3.200 1.00 0.00 C ATOM 1626 CD1 ILE B 401 -6.108 7.472 1.461 1.00 0.00 C ATOM 0 H ILE B 401 -4.843 2.490 2.195 1.00 0.00 H new ATOM 0 HA ILE B 401 -5.736 4.163 -0.085 1.00 0.00 H new ATOM 0 HB ILE B 401 -6.550 5.074 1.915 1.00 0.00 H new ATOM 0 HG12 ILE B 401 -4.231 6.773 2.195 1.00 0.00 H new ATOM 0 HG13 ILE B 401 -4.517 6.423 0.502 1.00 0.00 H new ATOM 0 HG21 ILE B 401 -5.169 5.380 3.949 1.00 0.00 H new ATOM 0 HG22 ILE B 401 -5.306 3.667 3.486 1.00 0.00 H new ATOM 0 HG23 ILE B 401 -3.812 4.567 3.134 1.00 0.00 H new ATOM 0 HD11 ILE B 401 -5.705 8.448 1.191 1.00 0.00 H new ATOM 0 HD12 ILE B 401 -6.858 7.174 0.728 1.00 0.00 H new ATOM 0 HD13 ILE B 401 -6.567 7.530 2.448 1.00 0.00 H new ATOM 1638 N VAL B 402 -3.395 5.054 -0.626 1.00 0.00 N ATOM 1639 CA VAL B 402 -2.044 5.295 -1.121 1.00 0.00 C ATOM 1640 C VAL B 402 -1.687 6.764 -0.982 1.00 0.00 C ATOM 1641 O VAL B 402 -2.531 7.633 -1.198 1.00 0.00 O ATOM 1642 CB VAL B 402 -1.905 4.896 -2.607 1.00 0.00 C ATOM 1643 CG1 VAL B 402 -0.543 4.277 -2.874 1.00 0.00 C ATOM 1644 CG2 VAL B 402 -3.021 3.947 -3.014 1.00 0.00 C ATOM 0 H VAL B 402 -4.116 5.617 -1.076 1.00 0.00 H new ATOM 0 HA VAL B 402 -1.368 4.683 -0.524 1.00 0.00 H new ATOM 0 HB VAL B 402 -1.989 5.799 -3.212 1.00 0.00 H new ATOM 0 HG11 VAL B 402 -0.468 4.004 -3.926 1.00 0.00 H new ATOM 0 HG12 VAL B 402 0.238 4.997 -2.629 1.00 0.00 H new ATOM 0 HG13 VAL B 402 -0.421 3.386 -2.258 1.00 0.00 H new ATOM 0 HG21 VAL B 402 -2.905 3.678 -4.064 1.00 0.00 H new ATOM 0 HG22 VAL B 402 -2.974 3.047 -2.401 1.00 0.00 H new ATOM 0 HG23 VAL B 402 -3.985 4.435 -2.869 1.00 0.00 H new ATOM 1654 N GLU B 403 -0.436 7.048 -0.644 1.00 0.00 N ATOM 1655 CA GLU B 403 0.011 8.424 -0.503 1.00 0.00 C ATOM 1656 C GLU B 403 0.930 8.787 -1.658 1.00 0.00 C ATOM 1657 O GLU B 403 1.901 8.087 -1.934 1.00 0.00 O ATOM 1658 CB GLU B 403 0.739 8.614 0.830 1.00 0.00 C ATOM 1659 CG GLU B 403 -0.197 8.829 2.007 1.00 0.00 C ATOM 1660 CD GLU B 403 0.189 10.031 2.846 1.00 0.00 C ATOM 1661 OE1 GLU B 403 0.834 10.953 2.303 1.00 0.00 O ATOM 1662 OE2 GLU B 403 -0.155 10.050 4.047 1.00 0.00 O ATOM 0 H GLU B 403 0.282 6.347 -0.464 1.00 0.00 H new ATOM 0 HA GLU B 403 -0.859 9.081 -0.519 1.00 0.00 H new ATOM 0 HB2 GLU B 403 1.359 7.739 1.024 1.00 0.00 H new ATOM 0 HB3 GLU B 403 1.411 9.469 0.749 1.00 0.00 H new ATOM 0 HG2 GLU B 403 -1.214 8.959 1.638 1.00 0.00 H new ATOM 0 HG3 GLU B 403 -0.197 7.938 2.634 1.00 0.00 H new ATOM 1669 N CYS B 404 0.627 9.894 -2.315 1.00 0.00 N ATOM 1670 CA CYS B 404 1.436 10.363 -3.427 1.00 0.00 C ATOM 1671 C CYS B 404 2.207 11.594 -2.992 1.00 0.00 C ATOM 1672 O CYS B 404 1.615 12.649 -2.771 1.00 0.00 O ATOM 1673 CB CYS B 404 0.559 10.692 -4.637 1.00 0.00 C ATOM 1674 SG CYS B 404 -0.993 9.769 -4.699 1.00 0.00 S ATOM 0 H CYS B 404 -0.175 10.486 -2.097 1.00 0.00 H new ATOM 0 HA CYS B 404 2.131 9.576 -3.719 1.00 0.00 H new ATOM 0 HB2 CYS B 404 0.334 11.759 -4.630 1.00 0.00 H new ATOM 0 HB3 CYS B 404 1.125 10.492 -5.547 1.00 0.00 H new ATOM 0 HG CYS B 404 -1.618 10.045 -5.805 1.00 0.00 H new ATOM 1680 N ARG B 405 3.518 11.460 -2.840 1.00 0.00 N ATOM 1681 CA ARG B 405 4.326 12.583 -2.403 1.00 0.00 C ATOM 1682 C ARG B 405 5.705 12.568 -3.046 1.00 0.00 C ATOM 1683 O ARG B 405 5.904 11.989 -4.114 1.00 0.00 O ATOM 1684 CB ARG B 405 4.460 12.573 -0.877 1.00 0.00 C ATOM 1685 CG ARG B 405 5.429 11.523 -0.359 1.00 0.00 C ATOM 1686 CD ARG B 405 6.356 12.096 0.701 1.00 0.00 C ATOM 1687 NE ARG B 405 6.304 11.329 1.945 1.00 0.00 N ATOM 1688 CZ ARG B 405 5.541 11.650 2.988 1.00 0.00 C ATOM 1689 NH1 ARG B 405 4.750 12.715 2.941 1.00 0.00 N ATOM 1690 NH2 ARG B 405 5.562 10.897 4.080 1.00 0.00 N ATOM 0 H ARG B 405 4.035 10.598 -3.011 1.00 0.00 H new ATOM 0 HA ARG B 405 3.821 13.496 -2.718 1.00 0.00 H new ATOM 0 HB2 ARG B 405 4.790 13.557 -0.543 1.00 0.00 H new ATOM 0 HB3 ARG B 405 3.479 12.399 -0.435 1.00 0.00 H new ATOM 0 HG2 ARG B 405 4.870 10.685 0.059 1.00 0.00 H new ATOM 0 HG3 ARG B 405 6.020 11.131 -1.187 1.00 0.00 H new ATOM 0 HD2 ARG B 405 7.378 12.105 0.323 1.00 0.00 H new ATOM 0 HD3 ARG B 405 6.081 13.132 0.902 1.00 0.00 H new ATOM 0 HE ARG B 405 6.889 10.496 2.018 1.00 0.00 H new ATOM 0 HH11 ARG B 405 4.724 13.294 2.102 1.00 0.00 H new ATOM 0 HH12 ARG B 405 4.169 12.954 3.744 1.00 0.00 H new ATOM 0 HH21 ARG B 405 6.162 10.073 4.120 1.00 0.00 H new ATOM 0 HH22 ARG B 405 4.978 11.142 4.880 1.00 0.00 H new ATOM 1704 N VAL B 406 6.648 13.223 -2.385 1.00 0.00 N ATOM 1705 CA VAL B 406 8.012 13.306 -2.883 1.00 0.00 C ATOM 1706 C VAL B 406 9.009 13.461 -1.741 1.00 0.00 C ATOM 1707 O VAL B 406 8.725 14.131 -0.744 1.00 0.00 O ATOM 1708 CB VAL B 406 8.163 14.485 -3.858 1.00 0.00 C ATOM 1709 CG1 VAL B 406 7.998 14.017 -5.293 1.00 0.00 C ATOM 1710 CG2 VAL B 406 7.146 15.561 -3.534 1.00 0.00 C ATOM 0 H VAL B 406 6.492 13.706 -1.500 1.00 0.00 H new ATOM 0 HA VAL B 406 8.225 12.375 -3.408 1.00 0.00 H new ATOM 0 HB VAL B 406 9.164 14.901 -3.747 1.00 0.00 H new ATOM 0 HG11 VAL B 406 8.108 14.866 -5.968 1.00 0.00 H new ATOM 0 HG12 VAL B 406 8.758 13.270 -5.522 1.00 0.00 H new ATOM 0 HG13 VAL B 406 7.009 13.578 -5.421 1.00 0.00 H new ATOM 0 HG21 VAL B 406 7.261 16.392 -4.230 1.00 0.00 H new ATOM 0 HG22 VAL B 406 6.140 15.150 -3.623 1.00 0.00 H new ATOM 0 HG23 VAL B 406 7.304 15.916 -2.516 1.00 0.00 H new ATOM 1720 N GLY B 407 10.170 12.827 -1.900 1.00 0.00 N ATOM 1721 CA GLY B 407 11.211 12.878 -0.887 1.00 0.00 C ATOM 1722 C GLY B 407 11.336 14.233 -0.222 1.00 0.00 C ATOM 1723 O GLY B 407 11.764 14.330 0.928 1.00 0.00 O ATOM 0 H GLY B 407 10.409 12.273 -2.723 1.00 0.00 H new ATOM 0 HA2 GLY B 407 11.004 12.125 -0.126 1.00 0.00 H new ATOM 0 HA3 GLY B 407 12.165 12.616 -1.344 1.00 0.00 H new ATOM 1727 N ASP B 408 10.965 15.284 -0.943 1.00 0.00 N ATOM 1728 CA ASP B 408 11.042 16.637 -0.409 1.00 0.00 C ATOM 1729 C ASP B 408 10.006 16.847 0.692 1.00 0.00 C ATOM 1730 O ASP B 408 9.967 17.899 1.328 1.00 0.00 O ATOM 1731 CB ASP B 408 10.834 17.660 -1.524 1.00 0.00 C ATOM 1732 CG ASP B 408 9.414 17.656 -2.055 1.00 0.00 C ATOM 1733 OD1 ASP B 408 8.548 17.007 -1.429 1.00 0.00 O ATOM 1734 OD2 ASP B 408 9.167 18.300 -3.096 1.00 0.00 O ATOM 0 H ASP B 408 10.609 15.225 -1.897 1.00 0.00 H new ATOM 0 HA ASP B 408 12.034 16.776 0.020 1.00 0.00 H new ATOM 0 HB2 ASP B 408 11.076 18.655 -1.150 1.00 0.00 H new ATOM 0 HB3 ASP B 408 11.525 17.449 -2.340 1.00 0.00 H new ATOM 1739 N GLY B 409 9.167 15.839 0.910 1.00 0.00 N ATOM 1740 CA GLY B 409 8.143 15.934 1.928 1.00 0.00 C ATOM 1741 C GLY B 409 6.891 16.617 1.417 1.00 0.00 C ATOM 1742 O GLY B 409 6.273 17.406 2.131 1.00 0.00 O ATOM 0 H GLY B 409 9.180 14.957 0.397 1.00 0.00 H new ATOM 0 HA2 GLY B 409 7.891 14.934 2.282 1.00 0.00 H new ATOM 0 HA3 GLY B 409 8.533 16.486 2.783 1.00 0.00 H new ATOM 1746 N THR B 410 6.520 16.319 0.176 1.00 0.00 N ATOM 1747 CA THR B 410 5.331 16.925 -0.422 1.00 0.00 C ATOM 1748 C THR B 410 4.384 15.870 -0.985 1.00 0.00 C ATOM 1749 O THR B 410 4.741 15.129 -1.899 1.00 0.00 O ATOM 1750 CB THR B 410 5.706 17.916 -1.544 1.00 0.00 C ATOM 1751 OG1 THR B 410 6.266 19.122 -1.009 1.00 0.00 O ATOM 1752 CG2 THR B 410 4.488 18.284 -2.380 1.00 0.00 C ATOM 0 H THR B 410 7.018 15.669 -0.432 1.00 0.00 H new ATOM 0 HA THR B 410 4.824 17.465 0.378 1.00 0.00 H new ATOM 0 HB THR B 410 6.446 17.416 -2.169 1.00 0.00 H new ATOM 0 HG1 THR B 410 6.495 19.730 -1.743 1.00 0.00 H new ATOM 0 HG21 THR B 410 4.782 18.983 -3.163 1.00 0.00 H new ATOM 0 HG22 THR B 410 4.073 17.384 -2.834 1.00 0.00 H new ATOM 0 HG23 THR B 410 3.736 18.748 -1.742 1.00 0.00 H new ATOM 1760 N VAL B 411 3.171 15.826 -0.434 1.00 0.00 N ATOM 1761 CA VAL B 411 2.148 14.880 -0.874 1.00 0.00 C ATOM 1762 C VAL B 411 1.255 15.505 -1.940 1.00 0.00 C ATOM 1763 O VAL B 411 0.483 16.422 -1.656 1.00 0.00 O ATOM 1764 CB VAL B 411 1.264 14.422 0.302 1.00 0.00 C ATOM 1765 CG1 VAL B 411 0.048 13.662 -0.206 1.00 0.00 C ATOM 1766 CG2 VAL B 411 2.068 13.569 1.271 1.00 0.00 C ATOM 0 H VAL B 411 2.872 16.440 0.324 1.00 0.00 H new ATOM 0 HA VAL B 411 2.669 14.017 -1.288 1.00 0.00 H new ATOM 0 HB VAL B 411 0.913 15.306 0.835 1.00 0.00 H new ATOM 0 HG11 VAL B 411 -0.564 13.347 0.640 1.00 0.00 H new ATOM 0 HG12 VAL B 411 -0.539 14.309 -0.858 1.00 0.00 H new ATOM 0 HG13 VAL B 411 0.374 12.785 -0.764 1.00 0.00 H new ATOM 0 HG21 VAL B 411 1.428 13.254 2.096 1.00 0.00 H new ATOM 0 HG22 VAL B 411 2.450 12.690 0.752 1.00 0.00 H new ATOM 0 HG23 VAL B 411 2.903 14.151 1.661 1.00 0.00 H new ATOM 1776 N LEU B 412 1.354 14.997 -3.163 1.00 0.00 N ATOM 1777 CA LEU B 412 0.543 15.502 -4.264 1.00 0.00 C ATOM 1778 C LEU B 412 -0.926 15.173 -4.035 1.00 0.00 C ATOM 1779 O LEU B 412 -1.807 15.974 -4.345 1.00 0.00 O ATOM 1780 CB LEU B 412 1.011 14.903 -5.595 1.00 0.00 C ATOM 1781 CG LEU B 412 2.441 15.267 -6.008 1.00 0.00 C ATOM 1782 CD1 LEU B 412 2.867 16.584 -5.375 1.00 0.00 C ATOM 1783 CD2 LEU B 412 3.406 14.154 -5.624 1.00 0.00 C ATOM 0 H LEU B 412 1.986 14.238 -3.417 1.00 0.00 H new ATOM 0 HA LEU B 412 0.660 16.585 -4.306 1.00 0.00 H new ATOM 0 HB2 LEU B 412 0.933 13.818 -5.534 1.00 0.00 H new ATOM 0 HB3 LEU B 412 0.329 15.228 -6.381 1.00 0.00 H new ATOM 0 HG LEU B 412 2.463 15.386 -7.091 1.00 0.00 H new ATOM 0 HD11 LEU B 412 3.885 16.823 -5.682 1.00 0.00 H new ATOM 0 HD12 LEU B 412 2.195 17.378 -5.700 1.00 0.00 H new ATOM 0 HD13 LEU B 412 2.827 16.496 -4.289 1.00 0.00 H new ATOM 0 HD21 LEU B 412 4.417 14.429 -5.925 1.00 0.00 H new ATOM 0 HD22 LEU B 412 3.377 14.003 -4.545 1.00 0.00 H new ATOM 0 HD23 LEU B 412 3.116 13.232 -6.127 1.00 0.00 H new ATOM 1795 N GLY B 413 -1.184 13.990 -3.486 1.00 0.00 N ATOM 1796 CA GLY B 413 -2.551 13.578 -3.224 1.00 0.00 C ATOM 1797 C GLY B 413 -2.627 12.263 -2.474 1.00 0.00 C ATOM 1798 O GLY B 413 -1.729 11.928 -1.701 1.00 0.00 O ATOM 0 H GLY B 413 -0.472 13.310 -3.218 1.00 0.00 H new ATOM 0 HA2 GLY B 413 -3.056 14.352 -2.646 1.00 0.00 H new ATOM 0 HA3 GLY B 413 -3.087 13.485 -4.169 1.00 0.00 H new ATOM 1802 N THR B 414 -3.703 11.517 -2.699 1.00 0.00 N ATOM 1803 CA THR B 414 -3.896 10.231 -2.036 1.00 0.00 C ATOM 1804 C THR B 414 -5.250 9.628 -2.395 1.00 0.00 C ATOM 1805 O THR B 414 -6.183 10.347 -2.754 1.00 0.00 O ATOM 1806 CB THR B 414 -3.795 10.372 -0.504 1.00 0.00 C ATOM 1807 OG1 THR B 414 -3.737 9.094 0.142 1.00 0.00 O ATOM 1808 CG2 THR B 414 -4.989 11.135 0.048 1.00 0.00 C ATOM 0 H THR B 414 -4.455 11.780 -3.335 1.00 0.00 H new ATOM 0 HA THR B 414 -3.104 9.569 -2.385 1.00 0.00 H new ATOM 0 HB THR B 414 -2.875 10.919 -0.300 1.00 0.00 H new ATOM 0 HG1 THR B 414 -2.907 8.638 -0.109 1.00 0.00 H new ATOM 0 HG21 THR B 414 -4.896 11.222 1.131 1.00 0.00 H new ATOM 0 HG22 THR B 414 -5.021 12.130 -0.395 1.00 0.00 H new ATOM 0 HG23 THR B 414 -5.907 10.600 -0.196 1.00 0.00 H new ATOM 1816 N GLY B 415 -5.353 8.305 -2.299 1.00 0.00 N ATOM 1817 CA GLY B 415 -6.602 7.639 -2.620 1.00 0.00 C ATOM 1818 C GLY B 415 -6.803 6.357 -1.835 1.00 0.00 C ATOM 1819 O GLY B 415 -5.986 6.005 -0.984 1.00 0.00 O ATOM 0 H GLY B 415 -4.597 7.686 -2.006 1.00 0.00 H new ATOM 0 HA2 GLY B 415 -7.432 8.317 -2.419 1.00 0.00 H new ATOM 0 HA3 GLY B 415 -6.625 7.414 -3.686 1.00 0.00 H new ATOM 1823 N VAL B 416 -7.900 5.665 -2.122 1.00 0.00 N ATOM 1824 CA VAL B 416 -8.229 4.417 -1.448 1.00 0.00 C ATOM 1825 C VAL B 416 -9.088 3.526 -2.340 1.00 0.00 C ATOM 1826 O VAL B 416 -9.698 3.996 -3.299 1.00 0.00 O ATOM 1827 CB VAL B 416 -8.981 4.692 -0.130 1.00 0.00 C ATOM 1828 CG1 VAL B 416 -10.466 4.923 -0.383 1.00 0.00 C ATOM 1829 CG2 VAL B 416 -8.772 3.553 0.859 1.00 0.00 C ATOM 0 H VAL B 416 -8.582 5.952 -2.824 1.00 0.00 H new ATOM 0 HA VAL B 416 -7.292 3.904 -1.229 1.00 0.00 H new ATOM 0 HB VAL B 416 -8.570 5.602 0.306 1.00 0.00 H new ATOM 0 HG11 VAL B 416 -10.971 5.114 0.564 1.00 0.00 H new ATOM 0 HG12 VAL B 416 -10.594 5.782 -1.042 1.00 0.00 H new ATOM 0 HG13 VAL B 416 -10.897 4.038 -0.852 1.00 0.00 H new ATOM 0 HG21 VAL B 416 -9.311 3.768 1.781 1.00 0.00 H new ATOM 0 HG22 VAL B 416 -9.146 2.624 0.428 1.00 0.00 H new ATOM 0 HG23 VAL B 416 -7.709 3.450 1.076 1.00 0.00 H new ATOM 1839 N GLY B 417 -9.137 2.241 -2.012 1.00 0.00 N ATOM 1840 CA GLY B 417 -9.932 1.306 -2.789 1.00 0.00 C ATOM 1841 C GLY B 417 -10.120 -0.014 -2.067 1.00 0.00 C ATOM 1842 O GLY B 417 -9.504 -0.236 -1.032 1.00 0.00 O ATOM 0 H GLY B 417 -8.641 1.828 -1.222 1.00 0.00 H new ATOM 0 HA2 GLY B 417 -10.907 1.746 -3.000 1.00 0.00 H new ATOM 0 HA3 GLY B 417 -9.448 1.129 -3.749 1.00 0.00 H new ATOM 1846 N ARG B 418 -10.974 -0.885 -2.607 1.00 0.00 N ATOM 1847 CA ARG B 418 -11.235 -2.190 -1.992 1.00 0.00 C ATOM 1848 C ARG B 418 -10.178 -3.218 -2.397 1.00 0.00 C ATOM 1849 O ARG B 418 -9.729 -4.015 -1.572 1.00 0.00 O ATOM 1850 CB ARG B 418 -12.628 -2.700 -2.374 1.00 0.00 C ATOM 1851 CG ARG B 418 -13.088 -2.254 -3.751 1.00 0.00 C ATOM 1852 CD ARG B 418 -13.929 -0.989 -3.676 1.00 0.00 C ATOM 1853 NE ARG B 418 -15.342 -1.282 -3.452 1.00 0.00 N ATOM 1854 CZ ARG B 418 -16.160 -1.736 -4.397 1.00 0.00 C ATOM 1855 NH1 ARG B 418 -15.708 -1.949 -5.624 1.00 0.00 N ATOM 1856 NH2 ARG B 418 -17.433 -1.977 -4.112 1.00 0.00 N ATOM 0 H ARG B 418 -11.496 -0.712 -3.466 1.00 0.00 H new ATOM 0 HA ARG B 418 -11.189 -2.057 -0.911 1.00 0.00 H new ATOM 0 HB2 ARG B 418 -12.629 -3.789 -2.336 1.00 0.00 H new ATOM 0 HB3 ARG B 418 -13.347 -2.355 -1.631 1.00 0.00 H new ATOM 0 HG2 ARG B 418 -12.220 -2.078 -4.386 1.00 0.00 H new ATOM 0 HG3 ARG B 418 -13.668 -3.050 -4.218 1.00 0.00 H new ATOM 0 HD2 ARG B 418 -13.558 -0.355 -2.871 1.00 0.00 H new ATOM 0 HD3 ARG B 418 -13.818 -0.425 -4.602 1.00 0.00 H new ATOM 0 HE ARG B 418 -15.723 -1.130 -2.518 1.00 0.00 H new ATOM 0 HH11 ARG B 418 -14.730 -1.765 -5.846 1.00 0.00 H new ATOM 0 HH12 ARG B 418 -16.338 -2.297 -6.346 1.00 0.00 H new ATOM 0 HH21 ARG B 418 -17.784 -1.814 -3.168 1.00 0.00 H new ATOM 0 HH22 ARG B 418 -18.061 -2.325 -4.837 1.00 0.00 H new ATOM 1870 N ASN B 419 -9.771 -3.184 -3.662 1.00 0.00 N ATOM 1871 CA ASN B 419 -8.754 -4.098 -4.163 1.00 0.00 C ATOM 1872 C ASN B 419 -7.437 -3.352 -4.318 1.00 0.00 C ATOM 1873 O ASN B 419 -6.623 -3.678 -5.177 1.00 0.00 O ATOM 1874 CB ASN B 419 -9.179 -4.702 -5.503 1.00 0.00 C ATOM 1875 CG ASN B 419 -10.132 -3.806 -6.270 1.00 0.00 C ATOM 1876 OD1 ASN B 419 -11.129 -3.330 -5.728 1.00 0.00 O ATOM 1877 ND2 ASN B 419 -9.827 -3.571 -7.543 1.00 0.00 N ATOM 0 H ASN B 419 -10.131 -2.532 -4.359 1.00 0.00 H new ATOM 0 HA ASN B 419 -8.629 -4.912 -3.449 1.00 0.00 H new ATOM 0 HB2 ASN B 419 -8.293 -4.889 -6.110 1.00 0.00 H new ATOM 0 HB3 ASN B 419 -9.655 -5.667 -5.328 1.00 0.00 H new ATOM 0 HD21 ASN B 419 -10.430 -2.975 -8.110 1.00 0.00 H new ATOM 0 HD22 ASN B 419 -8.990 -3.986 -7.952 1.00 0.00 H new ATOM 1884 N ILE B 420 -7.250 -2.371 -3.435 1.00 0.00 N ATOM 1885 CA ILE B 420 -6.049 -1.528 -3.370 1.00 0.00 C ATOM 1886 C ILE B 420 -5.588 -0.938 -4.709 1.00 0.00 C ATOM 1887 O ILE B 420 -5.261 0.245 -4.771 1.00 0.00 O ATOM 1888 CB ILE B 420 -4.869 -2.260 -2.702 1.00 0.00 C ATOM 1889 CG1 ILE B 420 -4.016 -3.018 -3.725 1.00 0.00 C ATOM 1890 CG2 ILE B 420 -5.381 -3.208 -1.627 1.00 0.00 C ATOM 1891 CD1 ILE B 420 -2.930 -2.171 -4.359 1.00 0.00 C ATOM 0 H ILE B 420 -7.944 -2.132 -2.727 1.00 0.00 H new ATOM 0 HA ILE B 420 -6.365 -0.684 -2.756 1.00 0.00 H new ATOM 0 HB ILE B 420 -4.230 -1.508 -2.240 1.00 0.00 H new ATOM 0 HG12 ILE B 420 -3.556 -3.877 -3.236 1.00 0.00 H new ATOM 0 HG13 ILE B 420 -4.665 -3.407 -4.509 1.00 0.00 H new ATOM 0 HG21 ILE B 420 -4.538 -3.720 -1.162 1.00 0.00 H new ATOM 0 HG22 ILE B 420 -5.924 -2.641 -0.871 1.00 0.00 H new ATOM 0 HG23 ILE B 420 -6.048 -3.943 -2.078 1.00 0.00 H new ATOM 0 HD11 ILE B 420 -2.368 -2.774 -5.072 1.00 0.00 H new ATOM 0 HD12 ILE B 420 -3.384 -1.326 -4.877 1.00 0.00 H new ATOM 0 HD13 ILE B 420 -2.257 -1.803 -3.585 1.00 0.00 H new ATOM 1903 N LYS B 421 -5.535 -1.737 -5.774 1.00 0.00 N ATOM 1904 CA LYS B 421 -5.091 -1.228 -7.057 1.00 0.00 C ATOM 1905 C LYS B 421 -5.774 0.096 -7.326 1.00 0.00 C ATOM 1906 O LYS B 421 -5.121 1.088 -7.645 1.00 0.00 O ATOM 1907 CB LYS B 421 -5.364 -2.245 -8.168 1.00 0.00 C ATOM 1908 CG LYS B 421 -5.794 -1.633 -9.488 1.00 0.00 C ATOM 1909 CD LYS B 421 -7.269 -1.283 -9.472 1.00 0.00 C ATOM 1910 CE LYS B 421 -7.933 -1.612 -10.801 1.00 0.00 C ATOM 1911 NZ LYS B 421 -8.231 -0.389 -11.596 1.00 0.00 N ATOM 0 H LYS B 421 -5.791 -2.724 -5.769 1.00 0.00 H new ATOM 0 HA LYS B 421 -4.013 -1.066 -7.036 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -4.463 -2.836 -8.332 1.00 0.00 H new ATOM 0 HB3 LYS B 421 -6.139 -2.933 -7.831 1.00 0.00 H new ATOM 0 HG2 LYS B 421 -5.206 -0.736 -9.685 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -5.592 -2.332 -10.300 1.00 0.00 H new ATOM 0 HD2 LYS B 421 -7.765 -1.830 -8.670 1.00 0.00 H new ATOM 0 HD3 LYS B 421 -7.390 -0.221 -9.256 1.00 0.00 H new ATOM 0 HE2 LYS B 421 -7.282 -2.269 -11.378 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -8.858 -2.159 -10.618 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 -8.683 -0.659 -12.493 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 -8.873 0.227 -11.057 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 -7.346 0.121 -11.794 1.00 0.00 H new ATOM 1925 N ILE B 422 -7.091 0.122 -7.159 1.00 0.00 N ATOM 1926 CA ILE B 422 -7.824 1.361 -7.351 1.00 0.00 C ATOM 1927 C ILE B 422 -7.098 2.454 -6.606 1.00 0.00 C ATOM 1928 O ILE B 422 -6.946 3.559 -7.107 1.00 0.00 O ATOM 1929 CB ILE B 422 -9.278 1.320 -6.843 1.00 0.00 C ATOM 1930 CG1 ILE B 422 -9.722 -0.109 -6.543 1.00 0.00 C ATOM 1931 CG2 ILE B 422 -10.199 1.976 -7.859 1.00 0.00 C ATOM 1932 CD1 ILE B 422 -9.155 -0.641 -5.246 1.00 0.00 C ATOM 0 H ILE B 422 -7.660 -0.683 -6.897 1.00 0.00 H new ATOM 0 HA ILE B 422 -7.871 1.536 -8.426 1.00 0.00 H new ATOM 0 HB ILE B 422 -9.333 1.878 -5.908 1.00 0.00 H new ATOM 0 HG12 ILE B 422 -10.811 -0.144 -6.499 1.00 0.00 H new ATOM 0 HG13 ILE B 422 -9.414 -0.759 -7.362 1.00 0.00 H new ATOM 0 HG21 ILE B 422 -11.225 1.944 -7.494 1.00 0.00 H new ATOM 0 HG22 ILE B 422 -9.899 3.013 -8.006 1.00 0.00 H new ATOM 0 HG23 ILE B 422 -10.134 1.442 -8.807 1.00 0.00 H new ATOM 0 HD11 ILE B 422 -9.506 -1.661 -5.087 1.00 0.00 H new ATOM 0 HD12 ILE B 422 -8.066 -0.635 -5.295 1.00 0.00 H new ATOM 0 HD13 ILE B 422 -9.484 -0.011 -4.420 1.00 0.00 H new ATOM 1944 N ALA B 423 -6.619 2.118 -5.411 1.00 0.00 N ATOM 1945 CA ALA B 423 -5.871 3.061 -4.605 1.00 0.00 C ATOM 1946 C ALA B 423 -4.564 3.388 -5.310 1.00 0.00 C ATOM 1947 O ALA B 423 -4.134 4.541 -5.346 1.00 0.00 O ATOM 1948 CB ALA B 423 -5.613 2.503 -3.214 1.00 0.00 C ATOM 0 H ALA B 423 -6.739 1.199 -4.985 1.00 0.00 H new ATOM 0 HA ALA B 423 -6.454 3.974 -4.485 1.00 0.00 H new ATOM 0 HB1 ALA B 423 -5.050 3.230 -2.629 1.00 0.00 H new ATOM 0 HB2 ALA B 423 -6.564 2.299 -2.722 1.00 0.00 H new ATOM 0 HB3 ALA B 423 -5.040 1.579 -3.293 1.00 0.00 H new ATOM 1954 N GLY B 424 -3.946 2.361 -5.894 1.00 0.00 N ATOM 1955 CA GLY B 424 -2.707 2.562 -6.618 1.00 0.00 C ATOM 1956 C GLY B 424 -2.905 3.494 -7.796 1.00 0.00 C ATOM 1957 O GLY B 424 -2.411 4.625 -7.797 1.00 0.00 O ATOM 0 H GLY B 424 -4.283 1.398 -5.877 1.00 0.00 H new ATOM 0 HA2 GLY B 424 -1.954 2.975 -5.947 1.00 0.00 H new ATOM 0 HA3 GLY B 424 -2.329 1.602 -6.970 1.00 0.00 H new ATOM 1961 N ILE B 425 -3.653 3.029 -8.793 1.00 0.00 N ATOM 1962 CA ILE B 425 -3.931 3.849 -9.963 1.00 0.00 C ATOM 1963 C ILE B 425 -4.489 5.196 -9.522 1.00 0.00 C ATOM 1964 O ILE B 425 -4.041 6.248 -9.980 1.00 0.00 O ATOM 1965 CB ILE B 425 -4.931 3.166 -10.919 1.00 0.00 C ATOM 1966 CG1 ILE B 425 -4.252 2.011 -11.658 1.00 0.00 C ATOM 1967 CG2 ILE B 425 -5.500 4.172 -11.911 1.00 0.00 C ATOM 1968 CD1 ILE B 425 -3.374 1.161 -10.768 1.00 0.00 C ATOM 0 H ILE B 425 -4.072 2.099 -8.813 1.00 0.00 H new ATOM 0 HA ILE B 425 -2.994 3.988 -10.502 1.00 0.00 H new ATOM 0 HB ILE B 425 -5.755 2.766 -10.328 1.00 0.00 H new ATOM 0 HG12 ILE B 425 -5.017 1.380 -12.111 1.00 0.00 H new ATOM 0 HG13 ILE B 425 -3.649 2.415 -12.472 1.00 0.00 H new ATOM 0 HG21 ILE B 425 -6.203 3.670 -12.576 1.00 0.00 H new ATOM 0 HG22 ILE B 425 -6.016 4.965 -11.370 1.00 0.00 H new ATOM 0 HG23 ILE B 425 -4.689 4.602 -12.499 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -2.924 0.362 -11.357 1.00 0.00 H new ATOM 0 HD12 ILE B 425 -2.587 1.779 -10.335 1.00 0.00 H new ATOM 0 HD13 ILE B 425 -3.976 0.728 -9.969 1.00 0.00 H new ATOM 1980 N ARG B 426 -5.459 5.155 -8.612 1.00 0.00 N ATOM 1981 CA ARG B 426 -6.066 6.370 -8.088 1.00 0.00 C ATOM 1982 C ARG B 426 -4.980 7.320 -7.607 1.00 0.00 C ATOM 1983 O ARG B 426 -4.980 8.503 -7.944 1.00 0.00 O ATOM 1984 CB ARG B 426 -7.022 6.043 -6.939 1.00 0.00 C ATOM 1985 CG ARG B 426 -7.591 7.268 -6.245 1.00 0.00 C ATOM 1986 CD ARG B 426 -8.295 8.185 -7.228 1.00 0.00 C ATOM 1987 NE ARG B 426 -9.065 9.223 -6.546 1.00 0.00 N ATOM 1988 CZ ARG B 426 -10.152 8.977 -5.822 1.00 0.00 C ATOM 1989 NH1 ARG B 426 -10.596 7.734 -5.694 1.00 0.00 N ATOM 1990 NH2 ARG B 426 -10.798 9.971 -5.227 1.00 0.00 N ATOM 0 H ARG B 426 -5.840 4.292 -8.224 1.00 0.00 H new ATOM 0 HA ARG B 426 -6.636 6.847 -8.885 1.00 0.00 H new ATOM 0 HB2 ARG B 426 -7.845 5.441 -7.324 1.00 0.00 H new ATOM 0 HB3 ARG B 426 -6.497 5.433 -6.205 1.00 0.00 H new ATOM 0 HG2 ARG B 426 -8.291 6.956 -5.470 1.00 0.00 H new ATOM 0 HG3 ARG B 426 -6.788 7.812 -5.748 1.00 0.00 H new ATOM 0 HD2 ARG B 426 -7.558 8.650 -7.883 1.00 0.00 H new ATOM 0 HD3 ARG B 426 -8.959 7.597 -7.862 1.00 0.00 H new ATOM 0 HE ARG B 426 -8.751 10.190 -6.630 1.00 0.00 H new ATOM 0 HH11 ARG B 426 -10.103 6.967 -6.151 1.00 0.00 H new ATOM 0 HH12 ARG B 426 -11.430 7.545 -5.138 1.00 0.00 H new ATOM 0 HH21 ARG B 426 -10.461 10.929 -5.324 1.00 0.00 H new ATOM 0 HH22 ARG B 426 -11.632 9.778 -4.672 1.00 0.00 H new ATOM 2004 N ALA B 427 -4.041 6.785 -6.830 1.00 0.00 N ATOM 2005 CA ALA B 427 -2.938 7.584 -6.326 1.00 0.00 C ATOM 2006 C ALA B 427 -2.341 8.396 -7.462 1.00 0.00 C ATOM 2007 O ALA B 427 -2.164 9.609 -7.350 1.00 0.00 O ATOM 2008 CB ALA B 427 -1.878 6.708 -5.677 1.00 0.00 C ATOM 0 H ALA B 427 -4.025 5.807 -6.540 1.00 0.00 H new ATOM 0 HA ALA B 427 -3.317 8.261 -5.561 1.00 0.00 H new ATOM 0 HB1 ALA B 427 -1.065 7.333 -5.309 1.00 0.00 H new ATOM 0 HB2 ALA B 427 -2.319 6.159 -4.845 1.00 0.00 H new ATOM 0 HB3 ALA B 427 -1.489 6.002 -6.411 1.00 0.00 H new ATOM 2014 N ALA B 428 -2.053 7.723 -8.572 1.00 0.00 N ATOM 2015 CA ALA B 428 -1.504 8.402 -9.736 1.00 0.00 C ATOM 2016 C ALA B 428 -2.447 9.524 -10.146 1.00 0.00 C ATOM 2017 O ALA B 428 -2.062 10.696 -10.196 1.00 0.00 O ATOM 2018 CB ALA B 428 -1.285 7.435 -10.889 1.00 0.00 C ATOM 0 H ALA B 428 -2.190 6.719 -8.688 1.00 0.00 H new ATOM 0 HA ALA B 428 -0.531 8.819 -9.476 1.00 0.00 H new ATOM 0 HB1 ALA B 428 -0.874 7.974 -11.743 1.00 0.00 H new ATOM 0 HB2 ALA B 428 -0.588 6.655 -10.582 1.00 0.00 H new ATOM 0 HB3 ALA B 428 -2.236 6.982 -11.169 1.00 0.00 H new ATOM 2024 N GLU B 429 -3.695 9.154 -10.426 1.00 0.00 N ATOM 2025 CA GLU B 429 -4.713 10.119 -10.817 1.00 0.00 C ATOM 2026 C GLU B 429 -4.741 11.297 -9.847 1.00 0.00 C ATOM 2027 O GLU B 429 -5.248 12.370 -10.171 1.00 0.00 O ATOM 2028 CB GLU B 429 -6.088 9.449 -10.862 1.00 0.00 C ATOM 2029 CG GLU B 429 -7.002 10.004 -11.943 1.00 0.00 C ATOM 2030 CD GLU B 429 -8.402 10.295 -11.431 1.00 0.00 C ATOM 2031 OE1 GLU B 429 -8.523 10.931 -10.363 1.00 0.00 O ATOM 2032 OE2 GLU B 429 -9.375 9.886 -12.099 1.00 0.00 O ATOM 0 H GLU B 429 -4.023 8.189 -10.388 1.00 0.00 H new ATOM 0 HA GLU B 429 -4.466 10.492 -11.811 1.00 0.00 H new ATOM 0 HB2 GLU B 429 -5.956 8.379 -11.024 1.00 0.00 H new ATOM 0 HB3 GLU B 429 -6.572 9.568 -9.893 1.00 0.00 H new ATOM 0 HG2 GLU B 429 -6.569 10.920 -12.345 1.00 0.00 H new ATOM 0 HG3 GLU B 429 -7.061 9.291 -12.765 1.00 0.00 H new ATOM 2039 N ASN B 430 -4.196 11.087 -8.650 1.00 0.00 N ATOM 2040 CA ASN B 430 -4.158 12.129 -7.634 1.00 0.00 C ATOM 2041 C ASN B 430 -2.959 13.052 -7.844 1.00 0.00 C ATOM 2042 O ASN B 430 -3.049 14.259 -7.615 1.00 0.00 O ATOM 2043 CB ASN B 430 -4.099 11.508 -6.237 1.00 0.00 C ATOM 2044 CG ASN B 430 -5.455 11.468 -5.562 1.00 0.00 C ATOM 2045 OD1 ASN B 430 -5.875 12.435 -4.925 1.00 0.00 O ATOM 2046 ND2 ASN B 430 -6.148 10.344 -5.695 1.00 0.00 N ATOM 0 H ASN B 430 -3.775 10.203 -8.363 1.00 0.00 H new ATOM 0 HA ASN B 430 -5.069 12.720 -7.723 1.00 0.00 H new ATOM 0 HB2 ASN B 430 -3.703 10.495 -6.310 1.00 0.00 H new ATOM 0 HB3 ASN B 430 -3.406 12.078 -5.619 1.00 0.00 H new ATOM 0 HD21 ASN B 430 -7.067 10.257 -5.261 1.00 0.00 H new ATOM 0 HD22 ASN B 430 -5.762 9.567 -6.232 1.00 0.00 H new ATOM 2053 N ALA B 431 -1.831 12.481 -8.270 1.00 0.00 N ATOM 2054 CA ALA B 431 -0.621 13.264 -8.491 1.00 0.00 C ATOM 2055 C ALA B 431 -0.808 14.254 -9.630 1.00 0.00 C ATOM 2056 O ALA B 431 -0.361 15.397 -9.552 1.00 0.00 O ATOM 2057 CB ALA B 431 0.573 12.366 -8.777 1.00 0.00 C ATOM 0 H ALA B 431 -1.733 11.485 -8.467 1.00 0.00 H new ATOM 0 HA ALA B 431 -0.425 13.820 -7.574 1.00 0.00 H new ATOM 0 HB1 ALA B 431 1.460 12.980 -8.937 1.00 0.00 H new ATOM 0 HB2 ALA B 431 0.740 11.702 -7.929 1.00 0.00 H new ATOM 0 HB3 ALA B 431 0.376 11.772 -9.670 1.00 0.00 H new ATOM 2063 N LEU B 432 -1.474 13.810 -10.689 1.00 0.00 N ATOM 2064 CA LEU B 432 -1.712 14.677 -11.836 1.00 0.00 C ATOM 2065 C LEU B 432 -3.018 15.448 -11.676 1.00 0.00 C ATOM 2066 O LEU B 432 -3.485 16.097 -12.612 1.00 0.00 O ATOM 2067 CB LEU B 432 -1.716 13.885 -13.149 1.00 0.00 C ATOM 2068 CG LEU B 432 -2.641 12.663 -13.204 1.00 0.00 C ATOM 2069 CD1 LEU B 432 -1.927 11.418 -12.698 1.00 0.00 C ATOM 2070 CD2 LEU B 432 -3.910 12.914 -12.409 1.00 0.00 C ATOM 0 H LEU B 432 -1.854 12.868 -10.778 1.00 0.00 H new ATOM 0 HA LEU B 432 -0.891 15.392 -11.878 1.00 0.00 H new ATOM 0 HB2 LEU B 432 -1.996 14.562 -13.956 1.00 0.00 H new ATOM 0 HB3 LEU B 432 -0.698 13.552 -13.351 1.00 0.00 H new ATOM 0 HG LEU B 432 -2.917 12.495 -14.245 1.00 0.00 H new ATOM 0 HD11 LEU B 432 -2.604 10.565 -12.747 1.00 0.00 H new ATOM 0 HD12 LEU B 432 -1.052 11.223 -13.318 1.00 0.00 H new ATOM 0 HD13 LEU B 432 -1.613 11.573 -11.666 1.00 0.00 H new ATOM 0 HD21 LEU B 432 -4.552 12.035 -12.461 1.00 0.00 H new ATOM 0 HD22 LEU B 432 -3.654 13.115 -11.369 1.00 0.00 H new ATOM 0 HD23 LEU B 432 -4.436 13.773 -12.825 1.00 0.00 H new ATOM 2082 N ARG B 433 -3.608 15.369 -10.485 1.00 0.00 N ATOM 2083 CA ARG B 433 -4.862 16.057 -10.209 1.00 0.00 C ATOM 2084 C ARG B 433 -4.610 17.462 -9.671 1.00 0.00 C ATOM 2085 O ARG B 433 -5.546 18.177 -9.310 1.00 0.00 O ATOM 2086 CB ARG B 433 -5.690 15.254 -9.205 1.00 0.00 C ATOM 2087 CG ARG B 433 -6.765 16.070 -8.509 1.00 0.00 C ATOM 2088 CD ARG B 433 -7.782 15.175 -7.823 1.00 0.00 C ATOM 2089 NE ARG B 433 -8.782 14.669 -8.758 1.00 0.00 N ATOM 2090 CZ ARG B 433 -9.551 13.613 -8.514 1.00 0.00 C ATOM 2091 NH1 ARG B 433 -9.438 12.959 -7.365 1.00 0.00 N ATOM 2092 NH2 ARG B 433 -10.433 13.212 -9.418 1.00 0.00 N ATOM 0 H ARG B 433 -3.237 14.836 -9.699 1.00 0.00 H new ATOM 0 HA ARG B 433 -5.415 16.144 -11.144 1.00 0.00 H new ATOM 0 HB2 ARG B 433 -6.159 14.417 -9.722 1.00 0.00 H new ATOM 0 HB3 ARG B 433 -5.023 14.831 -8.453 1.00 0.00 H new ATOM 0 HG2 ARG B 433 -6.304 16.730 -7.774 1.00 0.00 H new ATOM 0 HG3 ARG B 433 -7.270 16.706 -9.236 1.00 0.00 H new ATOM 0 HD2 ARG B 433 -7.268 14.337 -7.352 1.00 0.00 H new ATOM 0 HD3 ARG B 433 -8.278 15.732 -7.028 1.00 0.00 H new ATOM 0 HE ARG B 433 -8.897 15.153 -9.648 1.00 0.00 H new ATOM 0 HH11 ARG B 433 -8.760 13.267 -6.668 1.00 0.00 H new ATOM 0 HH12 ARG B 433 -10.029 12.149 -7.179 1.00 0.00 H new ATOM 0 HH21 ARG B 433 -10.522 13.714 -10.302 1.00 0.00 H new ATOM 0 HH22 ARG B 433 -11.023 12.401 -9.230 1.00 0.00 H new ATOM 2106 N ASP B 434 -3.342 17.854 -9.615 1.00 0.00 N ATOM 2107 CA ASP B 434 -2.976 19.173 -9.115 1.00 0.00 C ATOM 2108 C ASP B 434 -2.353 20.021 -10.212 1.00 0.00 C ATOM 2109 O ASP B 434 -1.132 20.052 -10.371 1.00 0.00 O ATOM 2110 CB ASP B 434 -1.999 19.044 -7.949 1.00 0.00 C ATOM 2111 CG ASP B 434 -2.687 18.671 -6.651 1.00 0.00 C ATOM 2112 OD1 ASP B 434 -3.827 19.130 -6.432 1.00 0.00 O ATOM 2113 OD2 ASP B 434 -2.085 17.921 -5.856 1.00 0.00 O ATOM 0 H ASP B 434 -2.553 17.279 -9.909 1.00 0.00 H new ATOM 0 HA ASP B 434 -3.886 19.665 -8.772 1.00 0.00 H new ATOM 0 HB2 ASP B 434 -1.250 18.289 -8.189 1.00 0.00 H new ATOM 0 HB3 ASP B 434 -1.470 19.988 -7.817 1.00 0.00 H new ATOM 2118 N LYS B 435 -3.197 20.715 -10.963 1.00 0.00 N ATOM 2119 CA LYS B 435 -2.724 21.573 -12.039 1.00 0.00 C ATOM 2120 C LYS B 435 -1.620 22.492 -11.526 1.00 0.00 C ATOM 2121 O LYS B 435 -0.541 22.575 -12.113 1.00 0.00 O ATOM 2122 CB LYS B 435 -3.882 22.397 -12.615 1.00 0.00 C ATOM 2123 CG LYS B 435 -4.035 23.773 -11.984 1.00 0.00 C ATOM 2124 CD LYS B 435 -5.045 24.622 -12.737 1.00 0.00 C ATOM 2125 CE LYS B 435 -4.500 25.073 -14.082 1.00 0.00 C ATOM 2126 NZ LYS B 435 -4.701 24.045 -15.142 1.00 0.00 N ATOM 0 H LYS B 435 -4.210 20.700 -10.847 1.00 0.00 H new ATOM 0 HA LYS B 435 -2.319 20.948 -12.835 1.00 0.00 H new ATOM 0 HB2 LYS B 435 -3.732 22.515 -13.688 1.00 0.00 H new ATOM 0 HB3 LYS B 435 -4.811 21.842 -12.482 1.00 0.00 H new ATOM 0 HG2 LYS B 435 -4.350 23.665 -10.946 1.00 0.00 H new ATOM 0 HG3 LYS B 435 -3.069 24.279 -11.973 1.00 0.00 H new ATOM 0 HD2 LYS B 435 -5.962 24.051 -12.887 1.00 0.00 H new ATOM 0 HD3 LYS B 435 -5.307 25.494 -12.138 1.00 0.00 H new ATOM 0 HE2 LYS B 435 -4.991 26.000 -14.379 1.00 0.00 H new ATOM 0 HE3 LYS B 435 -3.436 25.292 -13.987 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 -3.778 23.671 -15.442 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 -5.284 23.269 -14.767 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 -5.181 24.476 -15.957 1.00 0.00 H new ATOM 2140 N LYS B 436 -1.903 23.174 -10.421 1.00 0.00 N ATOM 2141 CA LYS B 436 -0.941 24.083 -9.813 1.00 0.00 C ATOM 2142 C LYS B 436 0.346 23.346 -9.463 1.00 0.00 C ATOM 2143 O LYS B 436 1.444 23.841 -9.716 1.00 0.00 O ATOM 2144 CB LYS B 436 -1.540 24.727 -8.562 1.00 0.00 C ATOM 2145 CG LYS B 436 -3.037 24.976 -8.664 1.00 0.00 C ATOM 2146 CD LYS B 436 -3.424 26.302 -8.031 1.00 0.00 C ATOM 2147 CE LYS B 436 -3.470 27.418 -9.063 1.00 0.00 C ATOM 2148 NZ LYS B 436 -2.161 28.115 -9.189 1.00 0.00 N ATOM 0 H LYS B 436 -2.794 23.113 -9.928 1.00 0.00 H new ATOM 0 HA LYS B 436 -0.704 24.867 -10.532 1.00 0.00 H new ATOM 0 HB2 LYS B 436 -1.344 24.085 -7.703 1.00 0.00 H new ATOM 0 HB3 LYS B 436 -1.034 25.674 -8.373 1.00 0.00 H new ATOM 0 HG2 LYS B 436 -3.338 24.970 -9.712 1.00 0.00 H new ATOM 0 HG3 LYS B 436 -3.576 24.166 -8.173 1.00 0.00 H new ATOM 0 HD2 LYS B 436 -4.398 26.207 -7.552 1.00 0.00 H new ATOM 0 HD3 LYS B 436 -2.708 26.556 -7.250 1.00 0.00 H new ATOM 0 HE2 LYS B 436 -3.756 27.005 -10.031 1.00 0.00 H new ATOM 0 HE3 LYS B 436 -4.239 28.138 -8.784 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 -2.250 28.900 -9.865 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 -1.875 28.487 -8.261 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 -1.442 27.445 -9.529 1.00 0.00 H new ATOM 2162 N MET B 437 0.205 22.154 -8.890 1.00 0.00 N ATOM 2163 CA MET B 437 1.363 21.347 -8.523 1.00 0.00 C ATOM 2164 C MET B 437 2.107 20.897 -9.775 1.00 0.00 C ATOM 2165 O MET B 437 3.321 21.057 -9.880 1.00 0.00 O ATOM 2166 CB MET B 437 0.934 20.129 -7.703 1.00 0.00 C ATOM 2167 CG MET B 437 2.092 19.436 -7.002 1.00 0.00 C ATOM 2168 SD MET B 437 2.777 18.077 -7.969 1.00 0.00 S ATOM 2169 CE MET B 437 1.319 17.065 -8.219 1.00 0.00 C ATOM 0 H MET B 437 -0.695 21.728 -8.671 1.00 0.00 H new ATOM 0 HA MET B 437 2.029 21.958 -7.913 1.00 0.00 H new ATOM 0 HB2 MET B 437 0.202 20.441 -6.958 1.00 0.00 H new ATOM 0 HB3 MET B 437 0.436 19.415 -8.359 1.00 0.00 H new ATOM 0 HG2 MET B 437 2.877 20.164 -6.799 1.00 0.00 H new ATOM 0 HG3 MET B 437 1.753 19.056 -6.038 1.00 0.00 H new ATOM 0 HE1 MET B 437 1.620 16.041 -8.440 1.00 0.00 H new ATOM 0 HE2 MET B 437 0.709 17.077 -7.316 1.00 0.00 H new ATOM 0 HE3 MET B 437 0.740 17.461 -9.054 1.00 0.00 H new ATOM 2179 N LEU B 438 1.363 20.345 -10.729 1.00 0.00 N ATOM 2180 CA LEU B 438 1.949 19.887 -11.982 1.00 0.00 C ATOM 2181 C LEU B 438 2.721 21.022 -12.643 1.00 0.00 C ATOM 2182 O LEU B 438 3.940 20.950 -12.802 1.00 0.00 O ATOM 2183 CB LEU B 438 0.857 19.379 -12.922 1.00 0.00 C ATOM 2184 CG LEU B 438 0.235 18.038 -12.529 1.00 0.00 C ATOM 2185 CD1 LEU B 438 -0.815 17.622 -13.545 1.00 0.00 C ATOM 2186 CD2 LEU B 438 1.312 16.970 -12.405 1.00 0.00 C ATOM 0 H LEU B 438 0.355 20.205 -10.657 1.00 0.00 H new ATOM 0 HA LEU B 438 2.636 19.068 -11.769 1.00 0.00 H new ATOM 0 HB2 LEU B 438 0.066 20.128 -12.973 1.00 0.00 H new ATOM 0 HB3 LEU B 438 1.275 19.288 -13.924 1.00 0.00 H new ATOM 0 HG LEU B 438 -0.251 18.152 -11.560 1.00 0.00 H new ATOM 0 HD11 LEU B 438 -1.248 16.666 -13.250 1.00 0.00 H new ATOM 0 HD12 LEU B 438 -1.600 18.378 -13.588 1.00 0.00 H new ATOM 0 HD13 LEU B 438 -0.352 17.524 -14.527 1.00 0.00 H new ATOM 0 HD21 LEU B 438 0.853 16.022 -12.125 1.00 0.00 H new ATOM 0 HD22 LEU B 438 1.824 16.857 -13.361 1.00 0.00 H new ATOM 0 HD23 LEU B 438 2.031 17.265 -11.641 1.00 0.00 H new ATOM 2198 N ASP B 439 2.001 22.077 -13.010 1.00 0.00 N ATOM 2199 CA ASP B 439 2.617 23.237 -13.636 1.00 0.00 C ATOM 2200 C ASP B 439 3.718 23.787 -12.740 1.00 0.00 C ATOM 2201 O ASP B 439 4.712 24.336 -13.216 1.00 0.00 O ATOM 2202 CB ASP B 439 1.567 24.320 -13.897 1.00 0.00 C ATOM 2203 CG ASP B 439 2.150 25.534 -14.595 1.00 0.00 C ATOM 2204 OD1 ASP B 439 3.073 25.359 -15.417 1.00 0.00 O ATOM 2205 OD2 ASP B 439 1.684 26.658 -14.318 1.00 0.00 O ATOM 0 H ASP B 439 0.991 22.151 -12.884 1.00 0.00 H new ATOM 0 HA ASP B 439 3.050 22.932 -14.589 1.00 0.00 H new ATOM 0 HB2 ASP B 439 0.764 23.905 -14.506 1.00 0.00 H new ATOM 0 HB3 ASP B 439 1.123 24.627 -12.950 1.00 0.00 H new ATOM 2210 N PHE B 440 3.528 23.627 -11.433 1.00 0.00 N ATOM 2211 CA PHE B 440 4.501 24.098 -10.456 1.00 0.00 C ATOM 2212 C PHE B 440 5.852 23.430 -10.697 1.00 0.00 C ATOM 2213 O PHE B 440 6.902 24.063 -10.579 1.00 0.00 O ATOM 2214 CB PHE B 440 3.997 23.816 -9.034 1.00 0.00 C ATOM 2215 CG PHE B 440 5.085 23.502 -8.044 1.00 0.00 C ATOM 2216 CD1 PHE B 440 6.181 24.340 -7.912 1.00 0.00 C ATOM 2217 CD2 PHE B 440 5.009 22.371 -7.248 1.00 0.00 C ATOM 2218 CE1 PHE B 440 7.182 24.054 -7.002 1.00 0.00 C ATOM 2219 CE2 PHE B 440 6.006 22.080 -6.336 1.00 0.00 C ATOM 2220 CZ PHE B 440 7.094 22.923 -6.213 1.00 0.00 C ATOM 0 H PHE B 440 2.709 23.175 -11.028 1.00 0.00 H new ATOM 0 HA PHE B 440 4.628 25.175 -10.568 1.00 0.00 H new ATOM 0 HB2 PHE B 440 3.439 24.683 -8.680 1.00 0.00 H new ATOM 0 HB3 PHE B 440 3.299 22.979 -9.067 1.00 0.00 H new ATOM 0 HD1 PHE B 440 6.254 25.225 -8.526 1.00 0.00 H new ATOM 0 HD2 PHE B 440 4.161 21.709 -7.341 1.00 0.00 H new ATOM 0 HE1 PHE B 440 8.032 24.714 -6.908 1.00 0.00 H new ATOM 0 HE2 PHE B 440 5.935 21.195 -5.721 1.00 0.00 H new ATOM 0 HZ PHE B 440 7.874 22.698 -5.501 1.00 0.00 H new ATOM 2230 N TYR B 441 5.814 22.149 -11.043 1.00 0.00 N ATOM 2231 CA TYR B 441 7.032 21.398 -11.307 1.00 0.00 C ATOM 2232 C TYR B 441 7.515 21.637 -12.725 1.00 0.00 C ATOM 2233 O TYR B 441 8.691 21.456 -13.027 1.00 0.00 O ATOM 2234 CB TYR B 441 6.809 19.914 -11.049 1.00 0.00 C ATOM 2235 CG TYR B 441 6.874 19.587 -9.583 1.00 0.00 C ATOM 2236 CD1 TYR B 441 8.094 19.396 -8.954 1.00 0.00 C ATOM 2237 CD2 TYR B 441 5.720 19.502 -8.825 1.00 0.00 C ATOM 2238 CE1 TYR B 441 8.162 19.119 -7.606 1.00 0.00 C ATOM 2239 CE2 TYR B 441 5.775 19.230 -7.475 1.00 0.00 C ATOM 2240 CZ TYR B 441 7.000 19.038 -6.866 1.00 0.00 C ATOM 2241 OH TYR B 441 7.062 18.765 -5.518 1.00 0.00 O ATOM 0 H TYR B 441 4.954 21.611 -11.147 1.00 0.00 H new ATOM 0 HA TYR B 441 7.808 21.749 -10.626 1.00 0.00 H new ATOM 0 HB2 TYR B 441 5.837 19.618 -11.445 1.00 0.00 H new ATOM 0 HB3 TYR B 441 7.561 19.335 -11.584 1.00 0.00 H new ATOM 0 HD1 TYR B 441 9.005 19.465 -9.529 1.00 0.00 H new ATOM 0 HD2 TYR B 441 4.761 19.651 -9.299 1.00 0.00 H new ATOM 0 HE1 TYR B 441 9.120 18.966 -7.131 1.00 0.00 H new ATOM 0 HE2 TYR B 441 4.865 19.167 -6.896 1.00 0.00 H new ATOM 0 HH TYR B 441 6.155 18.744 -5.146 1.00 0.00 H new ATOM 2251 N ALA B 442 6.610 22.076 -13.586 1.00 0.00 N ATOM 2252 CA ALA B 442 6.974 22.377 -14.962 1.00 0.00 C ATOM 2253 C ALA B 442 7.896 23.588 -14.968 1.00 0.00 C ATOM 2254 O ALA B 442 9.004 23.552 -15.514 1.00 0.00 O ATOM 2255 CB ALA B 442 5.744 22.633 -15.820 1.00 0.00 C ATOM 0 H ALA B 442 5.627 22.231 -13.360 1.00 0.00 H new ATOM 0 HA ALA B 442 7.488 21.517 -15.391 1.00 0.00 H new ATOM 0 HB1 ALA B 442 6.053 22.855 -16.842 1.00 0.00 H new ATOM 0 HB2 ALA B 442 5.108 21.748 -15.817 1.00 0.00 H new ATOM 0 HB3 ALA B 442 5.189 23.480 -15.417 1.00 0.00 H new ATOM 2261 N LYS B 443 7.440 24.654 -14.314 1.00 0.00 N ATOM 2262 CA LYS B 443 8.224 25.873 -14.198 1.00 0.00 C ATOM 2263 C LYS B 443 9.516 25.577 -13.449 1.00 0.00 C ATOM 2264 O LYS B 443 10.596 25.999 -13.862 1.00 0.00 O ATOM 2265 CB LYS B 443 7.427 26.955 -13.465 1.00 0.00 C ATOM 2266 CG LYS B 443 8.296 28.047 -12.863 1.00 0.00 C ATOM 2267 CD LYS B 443 7.454 29.149 -12.243 1.00 0.00 C ATOM 2268 CE LYS B 443 8.308 30.332 -11.818 1.00 0.00 C ATOM 2269 NZ LYS B 443 7.781 31.616 -12.356 1.00 0.00 N ATOM 0 H LYS B 443 6.529 24.694 -13.857 1.00 0.00 H new ATOM 0 HA LYS B 443 8.461 26.239 -15.197 1.00 0.00 H new ATOM 0 HB2 LYS B 443 6.719 27.407 -14.160 1.00 0.00 H new ATOM 0 HB3 LYS B 443 6.842 26.489 -12.672 1.00 0.00 H new ATOM 0 HG2 LYS B 443 8.950 27.617 -12.104 1.00 0.00 H new ATOM 0 HG3 LYS B 443 8.939 28.469 -13.635 1.00 0.00 H new ATOM 0 HD2 LYS B 443 6.702 29.481 -12.960 1.00 0.00 H new ATOM 0 HD3 LYS B 443 6.919 28.756 -11.378 1.00 0.00 H new ATOM 0 HE2 LYS B 443 8.344 30.382 -10.730 1.00 0.00 H new ATOM 0 HE3 LYS B 443 9.331 30.185 -12.165 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 8.390 32.399 -12.044 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 7.770 31.578 -13.395 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 6.814 31.769 -12.005 1.00 0.00 H new ATOM 2283 N GLN B 444 9.399 24.828 -12.350 1.00 0.00 N ATOM 2284 CA GLN B 444 10.564 24.456 -11.556 1.00 0.00 C ATOM 2285 C GLN B 444 11.544 23.666 -12.411 1.00 0.00 C ATOM 2286 O GLN B 444 12.721 24.010 -12.507 1.00 0.00 O ATOM 2287 CB GLN B 444 10.149 23.628 -10.334 1.00 0.00 C ATOM 2288 CG GLN B 444 9.888 24.464 -9.093 1.00 0.00 C ATOM 2289 CD GLN B 444 10.506 23.859 -7.848 1.00 0.00 C ATOM 2290 OE1 GLN B 444 10.864 24.571 -6.909 1.00 0.00 O ATOM 2291 NE2 GLN B 444 10.633 22.537 -7.833 1.00 0.00 N ATOM 0 H GLN B 444 8.513 24.471 -11.994 1.00 0.00 H new ATOM 0 HA GLN B 444 11.047 25.368 -11.205 1.00 0.00 H new ATOM 0 HB2 GLN B 444 9.249 23.063 -10.577 1.00 0.00 H new ATOM 0 HB3 GLN B 444 10.932 22.902 -10.115 1.00 0.00 H new ATOM 0 HG2 GLN B 444 10.288 25.467 -9.243 1.00 0.00 H new ATOM 0 HG3 GLN B 444 8.813 24.568 -8.948 1.00 0.00 H new ATOM 0 HE21 GLN B 444 10.323 21.986 -8.633 1.00 0.00 H new ATOM 0 HE22 GLN B 444 11.041 22.073 -7.021 1.00 0.00 H new ATOM 2300 N ARG B 445 11.045 22.611 -13.049 1.00 0.00 N ATOM 2301 CA ARG B 445 11.872 21.782 -13.913 1.00 0.00 C ATOM 2302 C ARG B 445 12.806 22.661 -14.725 1.00 0.00 C ATOM 2303 O ARG B 445 14.017 22.447 -14.747 1.00 0.00 O ATOM 2304 CB ARG B 445 11.001 20.943 -14.847 1.00 0.00 C ATOM 2305 CG ARG B 445 11.126 19.447 -14.612 1.00 0.00 C ATOM 2306 CD ARG B 445 12.523 18.948 -14.942 1.00 0.00 C ATOM 2307 NE ARG B 445 12.699 18.722 -16.373 1.00 0.00 N ATOM 2308 CZ ARG B 445 13.793 18.188 -16.905 1.00 0.00 C ATOM 2309 NH1 ARG B 445 14.806 17.829 -16.129 1.00 0.00 N ATOM 2310 NH2 ARG B 445 13.873 18.012 -18.217 1.00 0.00 N ATOM 0 H ARG B 445 10.072 22.312 -12.982 1.00 0.00 H new ATOM 0 HA ARG B 445 12.461 21.107 -13.291 1.00 0.00 H new ATOM 0 HB2 ARG B 445 9.959 21.237 -14.720 1.00 0.00 H new ATOM 0 HB3 ARG B 445 11.271 21.164 -15.879 1.00 0.00 H new ATOM 0 HG2 ARG B 445 10.893 19.220 -13.572 1.00 0.00 H new ATOM 0 HG3 ARG B 445 10.395 18.919 -15.225 1.00 0.00 H new ATOM 0 HD2 ARG B 445 13.258 19.675 -14.597 1.00 0.00 H new ATOM 0 HD3 ARG B 445 12.714 18.020 -14.402 1.00 0.00 H new ATOM 0 HE ARG B 445 11.940 18.989 -17.000 1.00 0.00 H new ATOM 0 HH11 ARG B 445 14.747 17.962 -15.119 1.00 0.00 H new ATOM 0 HH12 ARG B 445 15.644 17.419 -16.541 1.00 0.00 H new ATOM 0 HH21 ARG B 445 13.095 18.287 -18.817 1.00 0.00 H new ATOM 0 HH22 ARG B 445 14.713 17.602 -18.626 1.00 0.00 H new