USER MOD reduce.3.24.130724 H: found=0, std=0, add=663, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 664 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 387 TYR OH : rot -146:sc= -1.12 USER MOD Set 1.2: B 404 CYS SG : rot 63:sc= -3.09 USER MOD Set 2.1: B 368 MET CE :methyl -161:sc= -12.5! (180deg=-9.3!) USER MOD Set 2.2: B 369 ASN : amide:sc= -4.56! K(o=-17!,f=-13) USER MOD Single : B 371 LYS NZ :NH3+ -174:sc= -3.78! (180deg=-4.16!) USER MOD Single : B 373 GLN : amide:sc= -18.5! C(o=-18!,f=-29!) USER MOD Single : B 375 TYR OH : rot 180:sc= 0 USER MOD Single : B 376 SER OG : rot 180:sc= 0 USER MOD Single : B 380 TYR OH : rot -134:sc= -4.23! USER MOD Single : B 382 SER OG : rot 180:sc= 0 USER MOD Single : B 386 HIS : no HD1:sc= -0.904 K(o=-0.9,f=-1.7!) USER MOD Single : B 389 THR OG1 : rot 180:sc= 0 USER MOD Single : B 391 LYS NZ :NH3+ -141:sc= -0.0807 (180deg=-0.49) USER MOD Single : B 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 394 THR OG1 : rot -150:sc= -0.703 USER MOD Single : B 399 ASN : amide:sc= -3.93! C(o=-3.9!,f=-6.6!) USER MOD Single : B 400 SER OG : rot -100:sc= -2.82! USER MOD Single : B 410 THR OG1 : rot 75:sc= 0.527 USER MOD Single : B 414 THR OG1 : rot 84:sc= -1.42! USER MOD Single : B 419 ASN : amide:sc= -1.49 K(o=-1.5,f=-2.9!) USER MOD Single : B 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 430 ASN : amide:sc= -4.61! C(o=-4.6!,f=-16!) USER MOD Single : B 435 LYS NZ :NH3+ 160:sc= -0.143 (180deg=-0.756) USER MOD Single : B 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 437 MET CE :methyl 153:sc= -1.57 (180deg=-2.33) USER MOD Single : B 441 TYR OH : rot -50:sc= -5.9! USER MOD Single : B 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 444 GLN : amide:sc= -1.2 K(o=-1.2,f=-0.15) USER MOD ----------------------------------------------------------------- ATOM 1050 N LEU B 366 1.089 1.247 12.487 1.00 0.00 N ATOM 1051 CA LEU B 366 1.213 2.619 12.012 1.00 0.00 C ATOM 1052 C LEU B 366 1.014 2.709 10.506 1.00 0.00 C ATOM 1053 O LEU B 366 1.081 3.793 9.926 1.00 0.00 O ATOM 1054 CB LEU B 366 2.585 3.160 12.360 1.00 0.00 C ATOM 1055 CG LEU B 366 2.598 4.570 12.952 1.00 0.00 C ATOM 1056 CD1 LEU B 366 1.548 4.702 14.046 1.00 0.00 C ATOM 1057 CD2 LEU B 366 3.981 4.907 13.493 1.00 0.00 C ATOM 0 HA LEU B 366 0.438 3.210 12.500 1.00 0.00 H new ATOM 0 HB2 LEU B 366 3.056 2.481 13.070 1.00 0.00 H new ATOM 0 HB3 LEU B 366 3.199 3.156 11.459 1.00 0.00 H new ATOM 0 HG LEU B 366 2.356 5.278 12.160 1.00 0.00 H new ATOM 0 HD11 LEU B 366 1.573 5.712 14.455 1.00 0.00 H new ATOM 0 HD12 LEU B 366 0.561 4.504 13.629 1.00 0.00 H new ATOM 0 HD13 LEU B 366 1.757 3.985 14.839 1.00 0.00 H new ATOM 0 HD21 LEU B 366 3.973 5.914 13.911 1.00 0.00 H new ATOM 0 HD22 LEU B 366 4.251 4.193 14.271 1.00 0.00 H new ATOM 0 HD23 LEU B 366 4.710 4.855 12.685 1.00 0.00 H new ATOM 1069 N ASP B 367 0.756 1.570 9.881 1.00 0.00 N ATOM 1070 CA ASP B 367 0.522 1.526 8.439 1.00 0.00 C ATOM 1071 C ASP B 367 -0.250 2.775 8.028 1.00 0.00 C ATOM 1072 O ASP B 367 0.314 3.724 7.478 1.00 0.00 O ATOM 1073 CB ASP B 367 -0.268 0.271 8.066 1.00 0.00 C ATOM 1074 CG ASP B 367 -1.064 -0.279 9.235 1.00 0.00 C ATOM 1075 OD1 ASP B 367 -1.576 0.529 10.037 1.00 0.00 O ATOM 1076 OD2 ASP B 367 -1.175 -1.519 9.346 1.00 0.00 O ATOM 0 H ASP B 367 0.703 0.664 10.346 1.00 0.00 H new ATOM 0 HA ASP B 367 1.477 1.494 7.915 1.00 0.00 H new ATOM 0 HB2 ASP B 367 -0.946 0.502 7.245 1.00 0.00 H new ATOM 0 HB3 ASP B 367 0.419 -0.494 7.706 1.00 0.00 H new ATOM 1081 N MET B 368 -1.545 2.757 8.311 1.00 0.00 N ATOM 1082 CA MET B 368 -2.411 3.885 8.000 1.00 0.00 C ATOM 1083 C MET B 368 -1.653 5.198 8.204 1.00 0.00 C ATOM 1084 O MET B 368 -1.763 6.120 7.395 1.00 0.00 O ATOM 1085 CB MET B 368 -3.658 3.845 8.887 1.00 0.00 C ATOM 1086 CG MET B 368 -4.358 5.187 9.036 1.00 0.00 C ATOM 1087 SD MET B 368 -4.428 5.742 10.752 1.00 0.00 S ATOM 1088 CE MET B 368 -2.706 5.611 11.231 1.00 0.00 C ATOM 0 H MET B 368 -2.020 1.972 8.756 1.00 0.00 H new ATOM 0 HA MET B 368 -2.721 3.821 6.957 1.00 0.00 H new ATOM 0 HB2 MET B 368 -4.363 3.124 8.472 1.00 0.00 H new ATOM 0 HB3 MET B 368 -3.376 3.483 9.876 1.00 0.00 H new ATOM 0 HG2 MET B 368 -3.837 5.934 8.437 1.00 0.00 H new ATOM 0 HG3 MET B 368 -5.371 5.111 8.640 1.00 0.00 H new ATOM 0 HE1 MET B 368 -2.632 5.588 12.318 1.00 0.00 H new ATOM 0 HE2 MET B 368 -2.282 4.695 10.819 1.00 0.00 H new ATOM 0 HE3 MET B 368 -2.155 6.470 10.848 1.00 0.00 H new ATOM 1098 N ASN B 369 -0.869 5.269 9.282 1.00 0.00 N ATOM 1099 CA ASN B 369 -0.083 6.463 9.573 1.00 0.00 C ATOM 1100 C ASN B 369 0.919 6.724 8.457 1.00 0.00 C ATOM 1101 O ASN B 369 1.062 7.857 7.991 1.00 0.00 O ATOM 1102 CB ASN B 369 0.648 6.320 10.909 1.00 0.00 C ATOM 1103 CG ASN B 369 0.067 7.215 11.980 1.00 0.00 C ATOM 1104 OD1 ASN B 369 0.297 8.425 11.992 1.00 0.00 O ATOM 1105 ND2 ASN B 369 -0.693 6.621 12.889 1.00 0.00 N ATOM 0 H ASN B 369 -0.764 4.517 9.963 1.00 0.00 H new ATOM 0 HA ASN B 369 -0.766 7.310 9.641 1.00 0.00 H new ATOM 0 HB2 ASN B 369 0.597 5.282 11.239 1.00 0.00 H new ATOM 0 HB3 ASN B 369 1.702 6.560 10.771 1.00 0.00 H new ATOM 0 HD21 ASN B 369 -1.115 7.170 13.638 1.00 0.00 H new ATOM 0 HD22 ASN B 369 -0.856 5.615 12.839 1.00 0.00 H new ATOM 1112 N ALA B 370 1.595 5.671 8.004 1.00 0.00 N ATOM 1113 CA ALA B 370 2.554 5.803 6.921 1.00 0.00 C ATOM 1114 C ALA B 370 1.864 6.399 5.708 1.00 0.00 C ATOM 1115 O ALA B 370 2.151 7.528 5.319 1.00 0.00 O ATOM 1116 CB ALA B 370 3.180 4.461 6.572 1.00 0.00 C ATOM 0 H ALA B 370 1.495 4.724 8.370 1.00 0.00 H new ATOM 0 HA ALA B 370 3.357 6.465 7.244 1.00 0.00 H new ATOM 0 HB1 ALA B 370 3.893 4.593 5.758 1.00 0.00 H new ATOM 0 HB2 ALA B 370 3.696 4.062 7.445 1.00 0.00 H new ATOM 0 HB3 ALA B 370 2.400 3.765 6.262 1.00 0.00 H new ATOM 1122 N LYS B 371 0.959 5.630 5.104 1.00 0.00 N ATOM 1123 CA LYS B 371 0.230 6.097 3.923 1.00 0.00 C ATOM 1124 C LYS B 371 -0.034 7.598 4.021 1.00 0.00 C ATOM 1125 O LYS B 371 0.215 8.351 3.075 1.00 0.00 O ATOM 1126 CB LYS B 371 -1.106 5.354 3.766 1.00 0.00 C ATOM 1127 CG LYS B 371 -1.169 4.016 4.490 1.00 0.00 C ATOM 1128 CD LYS B 371 -2.365 3.191 4.041 1.00 0.00 C ATOM 1129 CE LYS B 371 -3.636 3.579 4.786 1.00 0.00 C ATOM 1130 NZ LYS B 371 -3.638 5.012 5.195 1.00 0.00 N ATOM 0 H LYS B 371 0.714 4.688 5.409 1.00 0.00 H new ATOM 0 HA LYS B 371 0.849 5.892 3.049 1.00 0.00 H new ATOM 0 HB2 LYS B 371 -1.909 5.992 4.136 1.00 0.00 H new ATOM 0 HB3 LYS B 371 -1.294 5.189 2.705 1.00 0.00 H new ATOM 0 HG2 LYS B 371 -0.251 3.458 4.304 1.00 0.00 H new ATOM 0 HG3 LYS B 371 -1.227 4.186 5.565 1.00 0.00 H new ATOM 0 HD2 LYS B 371 -2.517 3.325 2.970 1.00 0.00 H new ATOM 0 HD3 LYS B 371 -2.158 2.133 4.203 1.00 0.00 H new ATOM 0 HE2 LYS B 371 -4.500 3.384 4.151 1.00 0.00 H new ATOM 0 HE3 LYS B 371 -3.742 2.951 5.671 1.00 0.00 H new ATOM 0 HZ1 LYS B 371 -4.473 5.204 5.785 1.00 0.00 H new ATOM 0 HZ2 LYS B 371 -2.776 5.219 5.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 371 -3.667 5.615 4.348 1.00 0.00 H new ATOM 1144 N ARG B 372 -0.531 8.020 5.182 1.00 0.00 N ATOM 1145 CA ARG B 372 -0.830 9.426 5.434 1.00 0.00 C ATOM 1146 C ARG B 372 0.407 10.296 5.219 1.00 0.00 C ATOM 1147 O ARG B 372 0.323 11.387 4.665 1.00 0.00 O ATOM 1148 CB ARG B 372 -1.352 9.603 6.861 1.00 0.00 C ATOM 1149 CG ARG B 372 -2.465 10.630 6.983 1.00 0.00 C ATOM 1150 CD ARG B 372 -1.921 12.049 6.929 1.00 0.00 C ATOM 1151 NE ARG B 372 -1.796 12.639 8.258 1.00 0.00 N ATOM 1152 CZ ARG B 372 -1.366 13.878 8.476 1.00 0.00 C ATOM 1153 NH1 ARG B 372 -1.014 14.650 7.456 1.00 0.00 N ATOM 1154 NH2 ARG B 372 -1.286 14.346 9.714 1.00 0.00 N ATOM 0 H ARG B 372 -0.736 7.402 5.967 1.00 0.00 H new ATOM 0 HA ARG B 372 -1.598 9.743 4.728 1.00 0.00 H new ATOM 0 HB2 ARG B 372 -1.715 8.643 7.227 1.00 0.00 H new ATOM 0 HB3 ARG B 372 -0.525 9.899 7.507 1.00 0.00 H new ATOM 0 HG2 ARG B 372 -3.186 10.484 6.178 1.00 0.00 H new ATOM 0 HG3 ARG B 372 -3.000 10.479 7.921 1.00 0.00 H new ATOM 0 HD2 ARG B 372 -0.946 12.045 6.441 1.00 0.00 H new ATOM 0 HD3 ARG B 372 -2.580 12.667 6.319 1.00 0.00 H new ATOM 0 HE ARG B 372 -2.053 12.069 9.064 1.00 0.00 H new ATOM 0 HH11 ARG B 372 -1.073 14.293 6.502 1.00 0.00 H new ATOM 0 HH12 ARG B 372 -0.684 15.600 7.626 1.00 0.00 H new ATOM 0 HH21 ARG B 372 -1.555 13.755 10.501 1.00 0.00 H new ATOM 0 HH22 ARG B 372 -0.956 15.297 9.879 1.00 0.00 H new ATOM 1168 N GLN B 373 1.559 9.803 5.646 1.00 0.00 N ATOM 1169 CA GLN B 373 2.804 10.541 5.479 1.00 0.00 C ATOM 1170 C GLN B 373 3.129 10.724 4.002 1.00 0.00 C ATOM 1171 O GLN B 373 3.257 11.842 3.504 1.00 0.00 O ATOM 1172 CB GLN B 373 3.965 9.803 6.158 1.00 0.00 C ATOM 1173 CG GLN B 373 5.119 10.715 6.538 1.00 0.00 C ATOM 1174 CD GLN B 373 5.837 11.286 5.330 1.00 0.00 C ATOM 1175 OE1 GLN B 373 6.162 12.472 5.291 1.00 0.00 O ATOM 1176 NE2 GLN B 373 6.091 10.441 4.336 1.00 0.00 N ATOM 0 H GLN B 373 1.659 8.900 6.109 1.00 0.00 H new ATOM 0 HA GLN B 373 2.674 11.518 5.944 1.00 0.00 H new ATOM 0 HB2 GLN B 373 3.595 9.305 7.054 1.00 0.00 H new ATOM 0 HB3 GLN B 373 4.332 9.024 5.489 1.00 0.00 H new ATOM 0 HG2 GLN B 373 4.743 11.533 7.152 1.00 0.00 H new ATOM 0 HG3 GLN B 373 5.830 10.159 7.149 1.00 0.00 H new ATOM 0 HE21 GLN B 373 5.804 9.465 4.410 1.00 0.00 H new ATOM 0 HE22 GLN B 373 6.573 10.768 3.499 1.00 0.00 H new ATOM 1185 N LEU B 374 3.285 9.605 3.320 1.00 0.00 N ATOM 1186 CA LEU B 374 3.632 9.603 1.905 1.00 0.00 C ATOM 1187 C LEU B 374 2.755 10.529 1.063 1.00 0.00 C ATOM 1188 O LEU B 374 3.221 11.556 0.567 1.00 0.00 O ATOM 1189 CB LEU B 374 3.559 8.184 1.329 1.00 0.00 C ATOM 1190 CG LEU B 374 3.686 7.044 2.344 1.00 0.00 C ATOM 1191 CD1 LEU B 374 3.758 5.701 1.635 1.00 0.00 C ATOM 1192 CD2 LEU B 374 4.907 7.247 3.227 1.00 0.00 C ATOM 0 H LEU B 374 3.176 8.675 3.725 1.00 0.00 H new ATOM 0 HA LEU B 374 4.653 9.981 1.852 1.00 0.00 H new ATOM 0 HB2 LEU B 374 2.610 8.074 0.804 1.00 0.00 H new ATOM 0 HB3 LEU B 374 4.349 8.073 0.586 1.00 0.00 H new ATOM 0 HG LEU B 374 2.799 7.050 2.978 1.00 0.00 H new ATOM 0 HD11 LEU B 374 3.848 4.904 2.373 1.00 0.00 H new ATOM 0 HD12 LEU B 374 2.852 5.551 1.047 1.00 0.00 H new ATOM 0 HD13 LEU B 374 4.625 5.684 0.975 1.00 0.00 H new ATOM 0 HD21 LEU B 374 4.980 6.427 3.941 1.00 0.00 H new ATOM 0 HD22 LEU B 374 5.804 7.270 2.608 1.00 0.00 H new ATOM 0 HD23 LEU B 374 4.814 8.190 3.766 1.00 0.00 H new ATOM 1204 N TYR B 375 1.503 10.132 0.852 1.00 0.00 N ATOM 1205 CA TYR B 375 0.596 10.899 -0.001 1.00 0.00 C ATOM 1206 C TYR B 375 -0.198 11.980 0.729 1.00 0.00 C ATOM 1207 O TYR B 375 -0.946 12.723 0.093 1.00 0.00 O ATOM 1208 CB TYR B 375 -0.371 9.947 -0.704 1.00 0.00 C ATOM 1209 CG TYR B 375 0.235 9.242 -1.895 1.00 0.00 C ATOM 1210 CD1 TYR B 375 1.480 8.635 -1.805 1.00 0.00 C ATOM 1211 CD2 TYR B 375 -0.438 9.183 -3.109 1.00 0.00 C ATOM 1212 CE1 TYR B 375 2.040 7.989 -2.891 1.00 0.00 C ATOM 1213 CE2 TYR B 375 0.114 8.538 -4.200 1.00 0.00 C ATOM 1214 CZ TYR B 375 1.353 7.944 -4.085 1.00 0.00 C ATOM 1215 OH TYR B 375 1.906 7.302 -5.170 1.00 0.00 O ATOM 0 H TYR B 375 1.094 9.290 1.256 1.00 0.00 H new ATOM 0 HA TYR B 375 1.230 11.422 -0.717 1.00 0.00 H new ATOM 0 HB2 TYR B 375 -0.718 9.201 0.011 1.00 0.00 H new ATOM 0 HB3 TYR B 375 -1.247 10.508 -1.031 1.00 0.00 H new ATOM 0 HD1 TYR B 375 2.020 8.668 -0.870 1.00 0.00 H new ATOM 0 HD2 TYR B 375 -1.408 9.649 -3.202 1.00 0.00 H new ATOM 0 HE1 TYR B 375 3.010 7.522 -2.805 1.00 0.00 H new ATOM 0 HE2 TYR B 375 -0.422 8.500 -5.137 1.00 0.00 H new ATOM 0 HH TYR B 375 1.293 7.361 -5.932 1.00 0.00 H new ATOM 1225 N SER B 376 -0.052 12.090 2.040 1.00 0.00 N ATOM 1226 CA SER B 376 -0.792 13.115 2.772 1.00 0.00 C ATOM 1227 C SER B 376 0.149 14.090 3.468 1.00 0.00 C ATOM 1228 O SER B 376 -0.291 14.968 4.210 1.00 0.00 O ATOM 1229 CB SER B 376 -1.753 12.484 3.780 1.00 0.00 C ATOM 1230 OG SER B 376 -3.097 12.791 3.458 1.00 0.00 O ATOM 0 H SER B 376 0.555 11.501 2.610 1.00 0.00 H new ATOM 0 HA SER B 376 -1.378 13.676 2.044 1.00 0.00 H new ATOM 0 HB2 SER B 376 -1.616 11.403 3.792 1.00 0.00 H new ATOM 0 HB3 SER B 376 -1.523 12.845 4.782 1.00 0.00 H new ATOM 0 HG SER B 376 -3.694 12.376 4.115 1.00 0.00 H new ATOM 1236 N LEU B 377 1.445 13.942 3.216 1.00 0.00 N ATOM 1237 CA LEU B 377 2.438 14.825 3.810 1.00 0.00 C ATOM 1238 C LEU B 377 3.588 15.103 2.845 1.00 0.00 C ATOM 1239 O LEU B 377 4.167 16.190 2.860 1.00 0.00 O ATOM 1240 CB LEU B 377 2.978 14.228 5.107 1.00 0.00 C ATOM 1241 CG LEU B 377 3.879 15.160 5.909 1.00 0.00 C ATOM 1242 CD1 LEU B 377 3.051 16.078 6.794 1.00 0.00 C ATOM 1243 CD2 LEU B 377 4.861 14.353 6.739 1.00 0.00 C ATOM 0 H LEU B 377 1.830 13.221 2.606 1.00 0.00 H new ATOM 0 HA LEU B 377 1.945 15.772 4.031 1.00 0.00 H new ATOM 0 HB2 LEU B 377 2.136 13.931 5.733 1.00 0.00 H new ATOM 0 HB3 LEU B 377 3.535 13.321 4.870 1.00 0.00 H new ATOM 0 HG LEU B 377 4.443 15.782 5.214 1.00 0.00 H new ATOM 0 HD11 LEU B 377 3.714 16.735 7.358 1.00 0.00 H new ATOM 0 HD12 LEU B 377 2.386 16.679 6.174 1.00 0.00 H new ATOM 0 HD13 LEU B 377 2.459 15.479 7.486 1.00 0.00 H new ATOM 0 HD21 LEU B 377 5.499 15.030 7.307 1.00 0.00 H new ATOM 0 HD22 LEU B 377 4.313 13.708 7.426 1.00 0.00 H new ATOM 0 HD23 LEU B 377 5.477 13.741 6.080 1.00 0.00 H new ATOM 1255 N ILE B 378 3.926 14.123 2.008 1.00 0.00 N ATOM 1256 CA ILE B 378 5.013 14.286 1.053 1.00 0.00 C ATOM 1257 C ILE B 378 4.618 13.781 -0.330 1.00 0.00 C ATOM 1258 O ILE B 378 5.433 13.201 -1.046 1.00 0.00 O ATOM 1259 CB ILE B 378 6.275 13.542 1.520 1.00 0.00 C ATOM 1260 CG1 ILE B 378 6.433 13.673 3.034 1.00 0.00 C ATOM 1261 CG2 ILE B 378 7.501 14.081 0.804 1.00 0.00 C ATOM 1262 CD1 ILE B 378 6.915 15.040 3.471 1.00 0.00 C ATOM 0 H ILE B 378 3.464 13.214 1.974 1.00 0.00 H new ATOM 0 HA ILE B 378 5.226 15.353 0.993 1.00 0.00 H new ATOM 0 HB ILE B 378 6.172 12.485 1.273 1.00 0.00 H new ATOM 0 HG12 ILE B 378 5.476 13.463 3.511 1.00 0.00 H new ATOM 0 HG13 ILE B 378 7.136 12.918 3.385 1.00 0.00 H new ATOM 0 HG21 ILE B 378 8.387 13.545 1.145 1.00 0.00 H new ATOM 0 HG22 ILE B 378 7.385 13.943 -0.271 1.00 0.00 H new ATOM 0 HG23 ILE B 378 7.613 15.143 1.023 1.00 0.00 H new ATOM 0 HD11 ILE B 378 7.005 15.064 4.557 1.00 0.00 H new ATOM 0 HD12 ILE B 378 7.887 15.244 3.021 1.00 0.00 H new ATOM 0 HD13 ILE B 378 6.200 15.798 3.150 1.00 0.00 H new ATOM 1274 N GLY B 379 3.361 14.005 -0.698 1.00 0.00 N ATOM 1275 CA GLY B 379 2.881 13.565 -1.993 1.00 0.00 C ATOM 1276 C GLY B 379 2.369 14.711 -2.846 1.00 0.00 C ATOM 1277 O GLY B 379 1.199 15.083 -2.757 1.00 0.00 O ATOM 0 H GLY B 379 2.667 14.483 -0.123 1.00 0.00 H new ATOM 0 HA2 GLY B 379 3.687 13.056 -2.521 1.00 0.00 H new ATOM 0 HA3 GLY B 379 2.082 12.837 -1.852 1.00 0.00 H new ATOM 1281 N TYR B 380 3.245 15.266 -3.679 1.00 0.00 N ATOM 1282 CA TYR B 380 2.867 16.370 -4.555 1.00 0.00 C ATOM 1283 C TYR B 380 3.224 16.062 -6.009 1.00 0.00 C ATOM 1284 O TYR B 380 2.483 15.363 -6.700 1.00 0.00 O ATOM 1285 CB TYR B 380 3.535 17.674 -4.109 1.00 0.00 C ATOM 1286 CG TYR B 380 4.840 17.479 -3.374 1.00 0.00 C ATOM 1287 CD1 TYR B 380 4.866 16.930 -2.098 1.00 0.00 C ATOM 1288 CD2 TYR B 380 6.048 17.846 -3.955 1.00 0.00 C ATOM 1289 CE1 TYR B 380 6.058 16.753 -1.422 1.00 0.00 C ATOM 1290 CE2 TYR B 380 7.243 17.671 -3.286 1.00 0.00 C ATOM 1291 CZ TYR B 380 7.243 17.125 -2.021 1.00 0.00 C ATOM 1292 OH TYR B 380 8.433 16.950 -1.351 1.00 0.00 O ATOM 0 H TYR B 380 4.217 14.971 -3.766 1.00 0.00 H new ATOM 0 HA TYR B 380 1.786 16.494 -4.486 1.00 0.00 H new ATOM 0 HB2 TYR B 380 3.714 18.296 -4.986 1.00 0.00 H new ATOM 0 HB3 TYR B 380 2.846 18.221 -3.465 1.00 0.00 H new ATOM 0 HD1 TYR B 380 3.939 16.637 -1.627 1.00 0.00 H new ATOM 0 HD2 TYR B 380 6.052 18.275 -4.946 1.00 0.00 H new ATOM 0 HE1 TYR B 380 6.062 16.326 -0.430 1.00 0.00 H new ATOM 0 HE2 TYR B 380 8.173 17.961 -3.752 1.00 0.00 H new ATOM 0 HH TYR B 380 8.976 17.762 -1.431 1.00 0.00 H new ATOM 1302 N ALA B 381 4.358 16.585 -6.474 1.00 0.00 N ATOM 1303 CA ALA B 381 4.790 16.356 -7.847 1.00 0.00 C ATOM 1304 C ALA B 381 6.302 16.506 -7.988 1.00 0.00 C ATOM 1305 O ALA B 381 6.950 15.722 -8.681 1.00 0.00 O ATOM 1306 CB ALA B 381 4.077 17.297 -8.807 1.00 0.00 C ATOM 0 H ALA B 381 4.989 17.166 -5.922 1.00 0.00 H new ATOM 0 HA ALA B 381 4.525 15.330 -8.104 1.00 0.00 H new ATOM 0 HB1 ALA B 381 4.417 17.105 -9.825 1.00 0.00 H new ATOM 0 HB2 ALA B 381 3.001 17.131 -8.747 1.00 0.00 H new ATOM 0 HB3 ALA B 381 4.301 18.329 -8.538 1.00 0.00 H new ATOM 1312 N SER B 382 6.862 17.515 -7.329 1.00 0.00 N ATOM 1313 CA SER B 382 8.300 17.757 -7.389 1.00 0.00 C ATOM 1314 C SER B 382 9.072 16.519 -6.949 1.00 0.00 C ATOM 1315 O SER B 382 9.976 16.057 -7.645 1.00 0.00 O ATOM 1316 CB SER B 382 8.680 18.949 -6.511 1.00 0.00 C ATOM 1317 OG SER B 382 9.332 19.953 -7.270 1.00 0.00 O ATOM 0 H SER B 382 6.345 18.176 -6.749 1.00 0.00 H new ATOM 0 HA SER B 382 8.563 17.984 -8.422 1.00 0.00 H new ATOM 0 HB2 SER B 382 7.785 19.363 -6.047 1.00 0.00 H new ATOM 0 HB3 SER B 382 9.333 18.617 -5.704 1.00 0.00 H new ATOM 0 HG SER B 382 9.563 20.706 -6.687 1.00 0.00 H new ATOM 1323 N LEU B 383 8.707 15.985 -5.787 1.00 0.00 N ATOM 1324 CA LEU B 383 9.364 14.796 -5.254 1.00 0.00 C ATOM 1325 C LEU B 383 8.632 13.529 -5.689 1.00 0.00 C ATOM 1326 O LEU B 383 8.513 12.575 -4.926 1.00 0.00 O ATOM 1327 CB LEU B 383 9.466 14.884 -3.721 1.00 0.00 C ATOM 1328 CG LEU B 383 8.272 14.358 -2.902 1.00 0.00 C ATOM 1329 CD1 LEU B 383 6.967 14.418 -3.686 1.00 0.00 C ATOM 1330 CD2 LEU B 383 8.546 12.942 -2.413 1.00 0.00 C ATOM 0 H LEU B 383 7.962 16.356 -5.198 1.00 0.00 H new ATOM 0 HA LEU B 383 10.375 14.747 -5.659 1.00 0.00 H new ATOM 0 HB2 LEU B 383 10.356 14.336 -3.410 1.00 0.00 H new ATOM 0 HB3 LEU B 383 9.625 15.929 -3.453 1.00 0.00 H new ATOM 0 HG LEU B 383 8.155 15.012 -2.038 1.00 0.00 H new ATOM 0 HD11 LEU B 383 6.154 14.037 -3.068 1.00 0.00 H new ATOM 0 HD12 LEU B 383 6.758 15.451 -3.965 1.00 0.00 H new ATOM 0 HD13 LEU B 383 7.055 13.809 -4.586 1.00 0.00 H new ATOM 0 HD21 LEU B 383 7.693 12.585 -1.836 1.00 0.00 H new ATOM 0 HD22 LEU B 383 8.706 12.286 -3.269 1.00 0.00 H new ATOM 0 HD23 LEU B 383 9.436 12.940 -1.784 1.00 0.00 H new ATOM 1342 N ARG B 384 8.140 13.543 -6.926 1.00 0.00 N ATOM 1343 CA ARG B 384 7.407 12.412 -7.489 1.00 0.00 C ATOM 1344 C ARG B 384 7.808 11.093 -6.838 1.00 0.00 C ATOM 1345 O ARG B 384 8.809 10.485 -7.214 1.00 0.00 O ATOM 1346 CB ARG B 384 7.637 12.328 -9.000 1.00 0.00 C ATOM 1347 CG ARG B 384 9.043 11.899 -9.389 1.00 0.00 C ATOM 1348 CD ARG B 384 9.566 12.717 -10.557 1.00 0.00 C ATOM 1349 NE ARG B 384 8.561 12.878 -11.604 1.00 0.00 N ATOM 1350 CZ ARG B 384 8.534 13.902 -12.450 1.00 0.00 C ATOM 1351 NH1 ARG B 384 9.457 14.851 -12.376 1.00 0.00 N ATOM 1352 NH2 ARG B 384 7.584 13.978 -13.373 1.00 0.00 N ATOM 0 H ARG B 384 8.237 14.334 -7.563 1.00 0.00 H new ATOM 0 HA ARG B 384 6.349 12.580 -7.287 1.00 0.00 H new ATOM 0 HB2 ARG B 384 6.922 11.625 -9.427 1.00 0.00 H new ATOM 0 HB3 ARG B 384 7.430 13.302 -9.443 1.00 0.00 H new ATOM 0 HG2 ARG B 384 9.710 12.013 -8.535 1.00 0.00 H new ATOM 0 HG3 ARG B 384 9.043 10.842 -9.654 1.00 0.00 H new ATOM 0 HD2 ARG B 384 9.879 13.698 -10.201 1.00 0.00 H new ATOM 0 HD3 ARG B 384 10.449 12.232 -10.973 1.00 0.00 H new ATOM 0 HE ARG B 384 7.838 12.163 -11.691 1.00 0.00 H new ATOM 0 HH11 ARG B 384 10.190 14.796 -11.669 1.00 0.00 H new ATOM 0 HH12 ARG B 384 9.434 15.636 -13.027 1.00 0.00 H new ATOM 0 HH21 ARG B 384 6.873 13.249 -13.434 1.00 0.00 H new ATOM 0 HH22 ARG B 384 7.565 14.765 -14.022 1.00 0.00 H new ATOM 1366 N LEU B 385 7.013 10.649 -5.867 1.00 0.00 N ATOM 1367 CA LEU B 385 7.284 9.399 -5.182 1.00 0.00 C ATOM 1368 C LEU B 385 7.282 8.254 -6.175 1.00 0.00 C ATOM 1369 O LEU B 385 6.790 8.394 -7.295 1.00 0.00 O ATOM 1370 CB LEU B 385 6.251 9.144 -4.088 1.00 0.00 C ATOM 1371 CG LEU B 385 6.665 9.615 -2.695 1.00 0.00 C ATOM 1372 CD1 LEU B 385 5.519 10.353 -2.032 1.00 0.00 C ATOM 1373 CD2 LEU B 385 7.109 8.437 -1.843 1.00 0.00 C ATOM 0 H LEU B 385 6.180 11.139 -5.541 1.00 0.00 H new ATOM 0 HA LEU B 385 8.267 9.468 -4.716 1.00 0.00 H new ATOM 0 HB2 LEU B 385 5.321 9.641 -4.363 1.00 0.00 H new ATOM 0 HB3 LEU B 385 6.041 8.075 -4.048 1.00 0.00 H new ATOM 0 HG LEU B 385 7.508 10.299 -2.794 1.00 0.00 H new ATOM 0 HD11 LEU B 385 5.825 10.684 -1.040 1.00 0.00 H new ATOM 0 HD12 LEU B 385 5.246 11.219 -2.635 1.00 0.00 H new ATOM 0 HD13 LEU B 385 4.660 9.687 -1.943 1.00 0.00 H new ATOM 0 HD21 LEU B 385 7.400 8.792 -0.854 1.00 0.00 H new ATOM 0 HD22 LEU B 385 6.287 7.728 -1.746 1.00 0.00 H new ATOM 0 HD23 LEU B 385 7.959 7.945 -2.317 1.00 0.00 H new ATOM 1385 N HIS B 386 7.844 7.130 -5.775 1.00 0.00 N ATOM 1386 CA HIS B 386 7.905 5.978 -6.670 1.00 0.00 C ATOM 1387 C HIS B 386 8.132 4.650 -5.947 1.00 0.00 C ATOM 1388 O HIS B 386 9.259 4.153 -5.881 1.00 0.00 O ATOM 1389 CB HIS B 386 9.015 6.178 -7.701 1.00 0.00 C ATOM 1390 CG HIS B 386 8.528 6.155 -9.116 1.00 0.00 C ATOM 1391 ND1 HIS B 386 8.965 7.045 -10.075 1.00 0.00 N ATOM 1392 CD2 HIS B 386 7.641 5.342 -9.739 1.00 0.00 C ATOM 1393 CE1 HIS B 386 8.367 6.782 -11.222 1.00 0.00 C ATOM 1394 NE2 HIS B 386 7.559 5.754 -11.047 1.00 0.00 N ATOM 0 H HIS B 386 8.259 6.985 -4.855 1.00 0.00 H new ATOM 0 HA HIS B 386 6.929 5.918 -7.152 1.00 0.00 H new ATOM 0 HB2 HIS B 386 9.509 7.131 -7.511 1.00 0.00 H new ATOM 0 HB3 HIS B 386 9.765 5.398 -7.571 1.00 0.00 H new ATOM 0 HD2 HIS B 386 7.099 4.522 -9.291 1.00 0.00 H new ATOM 0 HE1 HIS B 386 8.514 7.318 -12.148 1.00 0.00 H new ATOM 0 HE2 HIS B 386 6.970 5.334 -11.766 1.00 0.00 H new ATOM 1403 N TYR B 387 7.053 4.055 -5.448 1.00 0.00 N ATOM 1404 CA TYR B 387 7.140 2.758 -4.787 1.00 0.00 C ATOM 1405 C TYR B 387 7.006 1.647 -5.819 1.00 0.00 C ATOM 1406 O TYR B 387 5.958 1.504 -6.449 1.00 0.00 O ATOM 1407 CB TYR B 387 6.046 2.610 -3.739 1.00 0.00 C ATOM 1408 CG TYR B 387 6.328 3.380 -2.482 1.00 0.00 C ATOM 1409 CD1 TYR B 387 5.971 4.711 -2.380 1.00 0.00 C ATOM 1410 CD2 TYR B 387 6.957 2.778 -1.402 1.00 0.00 C ATOM 1411 CE1 TYR B 387 6.229 5.429 -1.237 1.00 0.00 C ATOM 1412 CE2 TYR B 387 7.222 3.488 -0.250 1.00 0.00 C ATOM 1413 CZ TYR B 387 6.856 4.816 -0.170 1.00 0.00 C ATOM 1414 OH TYR B 387 7.118 5.531 0.976 1.00 0.00 O ATOM 0 H TYR B 387 6.113 4.448 -5.488 1.00 0.00 H new ATOM 0 HA TYR B 387 8.109 2.688 -4.292 1.00 0.00 H new ATOM 0 HB2 TYR B 387 5.099 2.948 -4.160 1.00 0.00 H new ATOM 0 HB3 TYR B 387 5.927 1.555 -3.493 1.00 0.00 H new ATOM 0 HD1 TYR B 387 5.481 5.195 -3.212 1.00 0.00 H new ATOM 0 HD2 TYR B 387 7.243 1.738 -1.464 1.00 0.00 H new ATOM 0 HE1 TYR B 387 5.943 6.468 -1.173 1.00 0.00 H new ATOM 0 HE2 TYR B 387 7.713 3.008 0.584 1.00 0.00 H new ATOM 0 HH TYR B 387 7.955 5.214 1.375 1.00 0.00 H new ATOM 1424 N VAL B 388 8.064 0.868 -6.005 1.00 0.00 N ATOM 1425 CA VAL B 388 8.025 -0.212 -6.985 1.00 0.00 C ATOM 1426 C VAL B 388 8.354 -1.562 -6.369 1.00 0.00 C ATOM 1427 O VAL B 388 9.471 -1.791 -5.905 1.00 0.00 O ATOM 1428 CB VAL B 388 8.989 0.039 -8.158 1.00 0.00 C ATOM 1429 CG1 VAL B 388 8.204 0.211 -9.447 1.00 0.00 C ATOM 1430 CG2 VAL B 388 9.872 1.249 -7.888 1.00 0.00 C ATOM 0 H VAL B 388 8.946 0.960 -5.500 1.00 0.00 H new ATOM 0 HA VAL B 388 7.000 -0.230 -7.356 1.00 0.00 H new ATOM 0 HB VAL B 388 9.643 -0.827 -8.264 1.00 0.00 H new ATOM 0 HG11 VAL B 388 8.894 0.388 -10.272 1.00 0.00 H new ATOM 0 HG12 VAL B 388 7.626 -0.692 -9.644 1.00 0.00 H new ATOM 0 HG13 VAL B 388 7.528 1.060 -9.351 1.00 0.00 H new ATOM 0 HG21 VAL B 388 10.544 1.405 -8.732 1.00 0.00 H new ATOM 0 HG22 VAL B 388 9.248 2.132 -7.754 1.00 0.00 H new ATOM 0 HG23 VAL B 388 10.458 1.078 -6.985 1.00 0.00 H new ATOM 1440 N THR B 389 7.374 -2.458 -6.378 1.00 0.00 N ATOM 1441 CA THR B 389 7.561 -3.795 -5.828 1.00 0.00 C ATOM 1442 C THR B 389 8.491 -4.611 -6.713 1.00 0.00 C ATOM 1443 O THR B 389 8.298 -4.694 -7.926 1.00 0.00 O ATOM 1444 CB THR B 389 6.221 -4.545 -5.682 1.00 0.00 C ATOM 1445 OG1 THR B 389 5.478 -4.071 -4.552 1.00 0.00 O ATOM 1446 CG2 THR B 389 6.447 -6.046 -5.515 1.00 0.00 C ATOM 0 H THR B 389 6.444 -2.284 -6.759 1.00 0.00 H new ATOM 0 HA THR B 389 8.002 -3.674 -4.839 1.00 0.00 H new ATOM 0 HB THR B 389 5.655 -4.357 -6.594 1.00 0.00 H new ATOM 0 HG1 THR B 389 4.633 -4.563 -4.486 1.00 0.00 H new ATOM 0 HG21 THR B 389 5.486 -6.550 -5.414 1.00 0.00 H new ATOM 0 HG22 THR B 389 6.970 -6.435 -6.389 1.00 0.00 H new ATOM 0 HG23 THR B 389 7.046 -6.227 -4.623 1.00 0.00 H new ATOM 1454 N VAL B 390 9.505 -5.201 -6.100 1.00 0.00 N ATOM 1455 CA VAL B 390 10.471 -5.997 -6.834 1.00 0.00 C ATOM 1456 C VAL B 390 10.733 -7.337 -6.148 1.00 0.00 C ATOM 1457 O VAL B 390 10.468 -7.502 -4.957 1.00 0.00 O ATOM 1458 CB VAL B 390 11.796 -5.230 -6.989 1.00 0.00 C ATOM 1459 CG1 VAL B 390 11.605 -4.027 -7.899 1.00 0.00 C ATOM 1460 CG2 VAL B 390 12.319 -4.790 -5.631 1.00 0.00 C ATOM 0 H VAL B 390 9.679 -5.143 -5.097 1.00 0.00 H new ATOM 0 HA VAL B 390 10.048 -6.193 -7.819 1.00 0.00 H new ATOM 0 HB VAL B 390 12.531 -5.896 -7.441 1.00 0.00 H new ATOM 0 HG11 VAL B 390 12.550 -3.493 -8.000 1.00 0.00 H new ATOM 0 HG12 VAL B 390 11.271 -4.363 -8.881 1.00 0.00 H new ATOM 0 HG13 VAL B 390 10.857 -3.361 -7.470 1.00 0.00 H new ATOM 0 HG21 VAL B 390 13.257 -4.249 -5.760 1.00 0.00 H new ATOM 0 HG22 VAL B 390 11.587 -4.139 -5.153 1.00 0.00 H new ATOM 0 HG23 VAL B 390 12.489 -5.666 -5.005 1.00 0.00 H new ATOM 1470 N LYS B 391 11.256 -8.282 -6.926 1.00 0.00 N ATOM 1471 CA LYS B 391 11.577 -9.621 -6.439 1.00 0.00 C ATOM 1472 C LYS B 391 10.420 -10.595 -6.655 1.00 0.00 C ATOM 1473 O LYS B 391 10.179 -11.465 -5.820 1.00 0.00 O ATOM 1474 CB LYS B 391 11.958 -9.576 -4.961 1.00 0.00 C ATOM 1475 CG LYS B 391 12.629 -10.846 -4.445 1.00 0.00 C ATOM 1476 CD LYS B 391 13.176 -11.713 -5.574 1.00 0.00 C ATOM 1477 CE LYS B 391 14.440 -11.120 -6.175 1.00 0.00 C ATOM 1478 NZ LYS B 391 14.518 -11.351 -7.643 1.00 0.00 N ATOM 0 H LYS B 391 11.469 -8.140 -7.913 1.00 0.00 H new ATOM 0 HA LYS B 391 12.428 -9.982 -7.016 1.00 0.00 H new ATOM 0 HB2 LYS B 391 12.629 -8.733 -4.796 1.00 0.00 H new ATOM 0 HB3 LYS B 391 11.060 -9.389 -4.372 1.00 0.00 H new ATOM 0 HG2 LYS B 391 13.442 -10.576 -3.771 1.00 0.00 H new ATOM 0 HG3 LYS B 391 11.910 -11.423 -3.863 1.00 0.00 H new ATOM 0 HD2 LYS B 391 13.387 -12.713 -5.195 1.00 0.00 H new ATOM 0 HD3 LYS B 391 12.419 -11.820 -6.351 1.00 0.00 H new ATOM 0 HE2 LYS B 391 14.470 -10.049 -5.974 1.00 0.00 H new ATOM 0 HE3 LYS B 391 15.313 -11.559 -5.692 1.00 0.00 H new ATOM 0 HZ1 LYS B 391 15.500 -11.569 -7.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 391 13.904 -12.150 -7.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 391 14.205 -10.496 -8.146 1.00 0.00 H new ATOM 1492 N LYS B 392 9.726 -10.431 -7.788 1.00 0.00 N ATOM 1493 CA LYS B 392 8.585 -11.277 -8.173 1.00 0.00 C ATOM 1494 C LYS B 392 8.265 -12.347 -7.129 1.00 0.00 C ATOM 1495 O LYS B 392 9.088 -13.218 -6.846 1.00 0.00 O ATOM 1496 CB LYS B 392 8.867 -11.945 -9.517 1.00 0.00 C ATOM 1497 CG LYS B 392 8.206 -11.248 -10.694 1.00 0.00 C ATOM 1498 CD LYS B 392 6.717 -11.058 -10.460 1.00 0.00 C ATOM 1499 CE LYS B 392 6.319 -9.595 -10.564 1.00 0.00 C ATOM 1500 NZ LYS B 392 4.900 -9.432 -10.983 1.00 0.00 N ATOM 0 H LYS B 392 9.940 -9.703 -8.469 1.00 0.00 H new ATOM 0 HA LYS B 392 7.715 -10.625 -8.248 1.00 0.00 H new ATOM 0 HB2 LYS B 392 9.944 -11.973 -9.680 1.00 0.00 H new ATOM 0 HB3 LYS B 392 8.524 -12.979 -9.478 1.00 0.00 H new ATOM 0 HG2 LYS B 392 8.677 -10.279 -10.856 1.00 0.00 H new ATOM 0 HG3 LYS B 392 8.362 -11.834 -11.600 1.00 0.00 H new ATOM 0 HD2 LYS B 392 6.156 -11.642 -11.190 1.00 0.00 H new ATOM 0 HD3 LYS B 392 6.451 -11.439 -9.474 1.00 0.00 H new ATOM 0 HE2 LYS B 392 6.471 -9.109 -9.600 1.00 0.00 H new ATOM 0 HE3 LYS B 392 6.969 -9.092 -11.281 1.00 0.00 H new ATOM 0 HZ1 LYS B 392 4.669 -8.420 -11.042 1.00 0.00 H new ATOM 0 HZ2 LYS B 392 4.760 -9.873 -11.914 1.00 0.00 H new ATOM 0 HZ3 LYS B 392 4.278 -9.889 -10.286 1.00 0.00 H new ATOM 1514 N PRO B 393 7.059 -12.292 -6.544 1.00 0.00 N ATOM 1515 CA PRO B 393 6.630 -13.253 -5.523 1.00 0.00 C ATOM 1516 C PRO B 393 6.609 -14.693 -6.023 1.00 0.00 C ATOM 1517 O PRO B 393 6.639 -14.955 -7.226 1.00 0.00 O ATOM 1518 CB PRO B 393 5.208 -12.815 -5.169 1.00 0.00 C ATOM 1519 CG PRO B 393 5.087 -11.412 -5.660 1.00 0.00 C ATOM 1520 CD PRO B 393 6.024 -11.287 -6.828 1.00 0.00 C ATOM 0 HA PRO B 393 7.322 -13.250 -4.681 1.00 0.00 H new ATOM 0 HB2 PRO B 393 4.469 -13.461 -5.643 1.00 0.00 H new ATOM 0 HB3 PRO B 393 5.037 -12.870 -4.094 1.00 0.00 H new ATOM 0 HG2 PRO B 393 4.062 -11.193 -5.960 1.00 0.00 H new ATOM 0 HG3 PRO B 393 5.348 -10.702 -4.875 1.00 0.00 H new ATOM 0 HD2 PRO B 393 5.518 -11.487 -7.772 1.00 0.00 H new ATOM 0 HD3 PRO B 393 6.446 -10.285 -6.899 1.00 0.00 H new ATOM 1528 N THR B 394 6.560 -15.614 -5.072 1.00 0.00 N ATOM 1529 CA THR B 394 6.535 -17.043 -5.376 1.00 0.00 C ATOM 1530 C THR B 394 5.495 -17.765 -4.528 1.00 0.00 C ATOM 1531 O THR B 394 4.913 -17.174 -3.619 1.00 0.00 O ATOM 1532 CB THR B 394 7.914 -17.687 -5.139 1.00 0.00 C ATOM 1533 OG1 THR B 394 8.186 -17.835 -3.739 1.00 0.00 O ATOM 1534 CG2 THR B 394 9.018 -16.843 -5.759 1.00 0.00 C ATOM 0 H THR B 394 6.537 -15.398 -4.075 1.00 0.00 H new ATOM 0 HA THR B 394 6.271 -17.142 -6.429 1.00 0.00 H new ATOM 0 HB THR B 394 7.891 -18.670 -5.608 1.00 0.00 H new ATOM 0 HG1 THR B 394 9.152 -17.778 -3.586 1.00 0.00 H new ATOM 0 HG21 THR B 394 9.983 -17.317 -5.579 1.00 0.00 H new ATOM 0 HG22 THR B 394 8.851 -16.757 -6.833 1.00 0.00 H new ATOM 0 HG23 THR B 394 9.012 -15.850 -5.310 1.00 0.00 H new ATOM 1542 N ALA B 395 5.261 -19.046 -4.816 1.00 0.00 N ATOM 1543 CA ALA B 395 4.292 -19.829 -4.061 1.00 0.00 C ATOM 1544 C ALA B 395 4.994 -20.663 -2.997 1.00 0.00 C ATOM 1545 O ALA B 395 4.427 -21.612 -2.454 1.00 0.00 O ATOM 1546 CB ALA B 395 3.480 -20.726 -4.980 1.00 0.00 C ATOM 0 H ALA B 395 5.729 -19.558 -5.564 1.00 0.00 H new ATOM 0 HA ALA B 395 3.609 -19.136 -3.571 1.00 0.00 H new ATOM 0 HB1 ALA B 395 2.765 -21.299 -4.390 1.00 0.00 H new ATOM 0 HB2 ALA B 395 2.944 -20.114 -5.706 1.00 0.00 H new ATOM 0 HB3 ALA B 395 4.148 -21.409 -5.504 1.00 0.00 H new ATOM 1552 N VAL B 396 6.222 -20.272 -2.685 1.00 0.00 N ATOM 1553 CA VAL B 396 7.017 -20.942 -1.662 1.00 0.00 C ATOM 1554 C VAL B 396 7.491 -19.929 -0.624 1.00 0.00 C ATOM 1555 O VAL B 396 8.175 -20.267 0.340 1.00 0.00 O ATOM 1556 CB VAL B 396 8.235 -21.663 -2.267 1.00 0.00 C ATOM 1557 CG1 VAL B 396 7.806 -22.581 -3.403 1.00 0.00 C ATOM 1558 CG2 VAL B 396 9.266 -20.654 -2.750 1.00 0.00 C ATOM 0 H VAL B 396 6.694 -19.485 -3.131 1.00 0.00 H new ATOM 0 HA VAL B 396 6.381 -21.690 -1.189 1.00 0.00 H new ATOM 0 HB VAL B 396 8.693 -22.275 -1.490 1.00 0.00 H new ATOM 0 HG11 VAL B 396 8.682 -23.081 -3.817 1.00 0.00 H new ATOM 0 HG12 VAL B 396 7.107 -23.327 -3.024 1.00 0.00 H new ATOM 0 HG13 VAL B 396 7.321 -21.993 -4.183 1.00 0.00 H new ATOM 0 HG21 VAL B 396 10.120 -21.181 -3.175 1.00 0.00 H new ATOM 0 HG22 VAL B 396 8.820 -20.014 -3.511 1.00 0.00 H new ATOM 0 HG23 VAL B 396 9.598 -20.043 -1.911 1.00 0.00 H new ATOM 1568 N ASP B 397 7.115 -18.681 -0.859 1.00 0.00 N ATOM 1569 CA ASP B 397 7.469 -17.561 -0.001 1.00 0.00 C ATOM 1570 C ASP B 397 7.068 -16.266 -0.701 1.00 0.00 C ATOM 1571 O ASP B 397 7.889 -15.371 -0.907 1.00 0.00 O ATOM 1572 CB ASP B 397 8.970 -17.560 0.297 1.00 0.00 C ATOM 1573 CG ASP B 397 9.300 -18.254 1.605 1.00 0.00 C ATOM 1574 OD1 ASP B 397 8.357 -18.586 2.355 1.00 0.00 O ATOM 1575 OD2 ASP B 397 10.500 -18.466 1.879 1.00 0.00 O ATOM 0 H ASP B 397 6.547 -18.414 -1.663 1.00 0.00 H new ATOM 0 HA ASP B 397 6.941 -17.649 0.949 1.00 0.00 H new ATOM 0 HB2 ASP B 397 9.500 -18.054 -0.517 1.00 0.00 H new ATOM 0 HB3 ASP B 397 9.330 -16.532 0.333 1.00 0.00 H new ATOM 1580 N PRO B 398 5.787 -16.176 -1.094 1.00 0.00 N ATOM 1581 CA PRO B 398 5.228 -15.031 -1.795 1.00 0.00 C ATOM 1582 C PRO B 398 5.912 -13.716 -1.452 1.00 0.00 C ATOM 1583 O PRO B 398 5.987 -12.815 -2.284 1.00 0.00 O ATOM 1584 CB PRO B 398 3.783 -15.025 -1.309 1.00 0.00 C ATOM 1585 CG PRO B 398 3.461 -16.451 -0.974 1.00 0.00 C ATOM 1586 CD PRO B 398 4.767 -17.212 -0.893 1.00 0.00 C ATOM 0 HA PRO B 398 5.348 -15.116 -2.875 1.00 0.00 H new ATOM 0 HB2 PRO B 398 3.666 -14.382 -0.437 1.00 0.00 H new ATOM 0 HB3 PRO B 398 3.113 -14.643 -2.079 1.00 0.00 H new ATOM 0 HG2 PRO B 398 2.925 -16.509 -0.027 1.00 0.00 H new ATOM 0 HG3 PRO B 398 2.812 -16.885 -1.735 1.00 0.00 H new ATOM 0 HD2 PRO B 398 4.883 -17.706 0.071 1.00 0.00 H new ATOM 0 HD3 PRO B 398 4.827 -17.987 -1.657 1.00 0.00 H new ATOM 1594 N ASN B 399 6.379 -13.608 -0.217 1.00 0.00 N ATOM 1595 CA ASN B 399 7.034 -12.397 0.265 1.00 0.00 C ATOM 1596 C ASN B 399 7.656 -11.596 -0.874 1.00 0.00 C ATOM 1597 O ASN B 399 8.190 -12.158 -1.830 1.00 0.00 O ATOM 1598 CB ASN B 399 8.094 -12.740 1.315 1.00 0.00 C ATOM 1599 CG ASN B 399 9.367 -13.288 0.706 1.00 0.00 C ATOM 1600 OD1 ASN B 399 9.839 -12.809 -0.325 1.00 0.00 O ATOM 1601 ND2 ASN B 399 9.939 -14.293 1.350 1.00 0.00 N ATOM 0 H ASN B 399 6.316 -14.352 0.478 1.00 0.00 H new ATOM 0 HA ASN B 399 6.267 -11.774 0.726 1.00 0.00 H new ATOM 0 HB2 ASN B 399 8.329 -11.846 1.893 1.00 0.00 H new ATOM 0 HB3 ASN B 399 7.685 -13.472 2.012 1.00 0.00 H new ATOM 0 HD21 ASN B 399 10.804 -14.700 0.995 1.00 0.00 H new ATOM 0 HD22 ASN B 399 9.515 -14.661 2.202 1.00 0.00 H new ATOM 1608 N SER B 400 7.563 -10.278 -0.765 1.00 0.00 N ATOM 1609 CA SER B 400 8.097 -9.384 -1.786 1.00 0.00 C ATOM 1610 C SER B 400 8.751 -8.150 -1.168 1.00 0.00 C ATOM 1611 O SER B 400 8.471 -7.785 -0.026 1.00 0.00 O ATOM 1612 CB SER B 400 6.985 -8.960 -2.748 1.00 0.00 C ATOM 1613 OG SER B 400 7.206 -7.648 -3.235 1.00 0.00 O ATOM 0 H SER B 400 7.122 -9.802 0.022 1.00 0.00 H new ATOM 0 HA SER B 400 8.864 -9.929 -2.336 1.00 0.00 H new ATOM 0 HB2 SER B 400 6.937 -9.658 -3.584 1.00 0.00 H new ATOM 0 HB3 SER B 400 6.022 -9.005 -2.239 1.00 0.00 H new ATOM 0 HG SER B 400 6.647 -7.016 -2.737 1.00 0.00 H new ATOM 1619 N ILE B 401 9.638 -7.527 -1.939 1.00 0.00 N ATOM 1620 CA ILE B 401 10.357 -6.344 -1.491 1.00 0.00 C ATOM 1621 C ILE B 401 9.899 -5.095 -2.248 1.00 0.00 C ATOM 1622 O ILE B 401 9.570 -5.156 -3.432 1.00 0.00 O ATOM 1623 CB ILE B 401 11.873 -6.544 -1.668 1.00 0.00 C ATOM 1624 CG1 ILE B 401 12.643 -5.240 -1.453 1.00 0.00 C ATOM 1625 CG2 ILE B 401 12.161 -7.116 -3.041 1.00 0.00 C ATOM 1626 CD1 ILE B 401 13.594 -5.290 -0.279 1.00 0.00 C ATOM 0 H ILE B 401 9.876 -7.827 -2.884 1.00 0.00 H new ATOM 0 HA ILE B 401 10.136 -6.198 -0.434 1.00 0.00 H new ATOM 0 HB ILE B 401 12.213 -7.249 -0.909 1.00 0.00 H new ATOM 0 HG12 ILE B 401 13.206 -5.006 -2.357 1.00 0.00 H new ATOM 0 HG13 ILE B 401 11.932 -4.428 -1.301 1.00 0.00 H new ATOM 0 HG21 ILE B 401 13.236 -7.255 -3.159 1.00 0.00 H new ATOM 0 HG22 ILE B 401 11.657 -8.077 -3.148 1.00 0.00 H new ATOM 0 HG23 ILE B 401 11.798 -6.429 -3.805 1.00 0.00 H new ATOM 0 HD11 ILE B 401 14.107 -4.333 -0.185 1.00 0.00 H new ATOM 0 HD12 ILE B 401 13.034 -5.493 0.634 1.00 0.00 H new ATOM 0 HD13 ILE B 401 14.328 -6.080 -0.439 1.00 0.00 H new ATOM 1638 N VAL B 402 9.869 -3.972 -1.543 1.00 0.00 N ATOM 1639 CA VAL B 402 9.441 -2.700 -2.109 1.00 0.00 C ATOM 1640 C VAL B 402 10.622 -1.752 -2.261 1.00 0.00 C ATOM 1641 O VAL B 402 11.539 -1.752 -1.433 1.00 0.00 O ATOM 1642 CB VAL B 402 8.373 -2.030 -1.216 1.00 0.00 C ATOM 1643 CG1 VAL B 402 7.347 -1.283 -2.051 1.00 0.00 C ATOM 1644 CG2 VAL B 402 7.690 -3.068 -0.337 1.00 0.00 C ATOM 0 H VAL B 402 10.141 -3.917 -0.561 1.00 0.00 H new ATOM 0 HA VAL B 402 9.013 -2.907 -3.090 1.00 0.00 H new ATOM 0 HB VAL B 402 8.876 -1.305 -0.577 1.00 0.00 H new ATOM 0 HG11 VAL B 402 6.609 -0.822 -1.394 1.00 0.00 H new ATOM 0 HG12 VAL B 402 7.846 -0.510 -2.635 1.00 0.00 H new ATOM 0 HG13 VAL B 402 6.848 -1.980 -2.724 1.00 0.00 H new ATOM 0 HG21 VAL B 402 6.940 -2.580 0.286 1.00 0.00 H new ATOM 0 HG22 VAL B 402 7.208 -3.817 -0.966 1.00 0.00 H new ATOM 0 HG23 VAL B 402 8.432 -3.551 0.299 1.00 0.00 H new ATOM 1654 N GLU B 403 10.583 -0.930 -3.305 1.00 0.00 N ATOM 1655 CA GLU B 403 11.635 0.042 -3.562 1.00 0.00 C ATOM 1656 C GLU B 403 11.105 1.450 -3.357 1.00 0.00 C ATOM 1657 O GLU B 403 10.507 2.042 -4.260 1.00 0.00 O ATOM 1658 CB GLU B 403 12.179 -0.121 -4.985 1.00 0.00 C ATOM 1659 CG GLU B 403 13.648 0.246 -5.119 1.00 0.00 C ATOM 1660 CD GLU B 403 14.068 0.442 -6.562 1.00 0.00 C ATOM 1661 OE1 GLU B 403 14.015 -0.538 -7.334 1.00 0.00 O ATOM 1662 OE2 GLU B 403 14.446 1.577 -6.921 1.00 0.00 O ATOM 0 H GLU B 403 9.827 -0.920 -3.990 1.00 0.00 H new ATOM 0 HA GLU B 403 12.450 -0.132 -2.860 1.00 0.00 H new ATOM 0 HB2 GLU B 403 12.041 -1.155 -5.302 1.00 0.00 H new ATOM 0 HB3 GLU B 403 11.594 0.501 -5.662 1.00 0.00 H new ATOM 0 HG2 GLU B 403 13.843 1.161 -4.560 1.00 0.00 H new ATOM 0 HG3 GLU B 403 14.258 -0.538 -4.670 1.00 0.00 H new ATOM 1669 N CYS B 404 11.341 1.978 -2.161 1.00 0.00 N ATOM 1670 CA CYS B 404 10.911 3.321 -1.821 1.00 0.00 C ATOM 1671 C CYS B 404 11.839 4.316 -2.487 1.00 0.00 C ATOM 1672 O CYS B 404 12.832 4.747 -1.895 1.00 0.00 O ATOM 1673 CB CYS B 404 10.919 3.521 -0.303 1.00 0.00 C ATOM 1674 SG CYS B 404 9.827 4.841 0.275 1.00 0.00 S ATOM 0 H CYS B 404 11.830 1.490 -1.411 1.00 0.00 H new ATOM 0 HA CYS B 404 9.892 3.475 -2.175 1.00 0.00 H new ATOM 0 HB2 CYS B 404 10.627 2.587 0.177 1.00 0.00 H new ATOM 0 HB3 CYS B 404 11.937 3.740 0.018 1.00 0.00 H new ATOM 0 HG CYS B 404 8.596 4.547 -0.021 1.00 0.00 H new ATOM 1680 N ARG B 405 11.516 4.667 -3.728 1.00 0.00 N ATOM 1681 CA ARG B 405 12.327 5.599 -4.490 1.00 0.00 C ATOM 1682 C ARG B 405 11.462 6.658 -5.160 1.00 0.00 C ATOM 1683 O ARG B 405 10.290 6.422 -5.440 1.00 0.00 O ATOM 1684 CB ARG B 405 13.152 4.845 -5.533 1.00 0.00 C ATOM 1685 CG ARG B 405 12.363 4.467 -6.776 1.00 0.00 C ATOM 1686 CD ARG B 405 12.904 5.167 -8.013 1.00 0.00 C ATOM 1687 NE ARG B 405 11.897 5.274 -9.065 1.00 0.00 N ATOM 1688 CZ ARG B 405 11.760 4.398 -10.060 1.00 0.00 C ATOM 1689 NH1 ARG B 405 12.568 3.349 -10.150 1.00 0.00 N ATOM 1690 NH2 ARG B 405 10.811 4.573 -10.968 1.00 0.00 N ATOM 0 H ARG B 405 10.696 4.317 -4.224 1.00 0.00 H new ATOM 0 HA ARG B 405 13.003 6.106 -3.802 1.00 0.00 H new ATOM 0 HB2 ARG B 405 14.002 5.461 -5.826 1.00 0.00 H new ATOM 0 HB3 ARG B 405 13.555 3.940 -5.080 1.00 0.00 H new ATOM 0 HG2 ARG B 405 12.404 3.387 -6.920 1.00 0.00 H new ATOM 0 HG3 ARG B 405 11.314 4.730 -6.637 1.00 0.00 H new ATOM 0 HD2 ARG B 405 13.253 6.164 -7.742 1.00 0.00 H new ATOM 0 HD3 ARG B 405 13.767 4.619 -8.391 1.00 0.00 H new ATOM 0 HE ARG B 405 11.258 6.069 -9.037 1.00 0.00 H new ATOM 0 HH11 ARG B 405 13.301 3.208 -9.454 1.00 0.00 H new ATOM 0 HH12 ARG B 405 12.456 2.683 -10.915 1.00 0.00 H new ATOM 0 HH21 ARG B 405 10.187 5.377 -10.905 1.00 0.00 H new ATOM 0 HH22 ARG B 405 10.705 3.904 -11.730 1.00 0.00 H new ATOM 1704 N VAL B 406 12.043 7.829 -5.396 1.00 0.00 N ATOM 1705 CA VAL B 406 11.318 8.928 -6.013 1.00 0.00 C ATOM 1706 C VAL B 406 12.223 9.769 -6.909 1.00 0.00 C ATOM 1707 O VAL B 406 13.433 9.868 -6.675 1.00 0.00 O ATOM 1708 CB VAL B 406 10.677 9.834 -4.934 1.00 0.00 C ATOM 1709 CG1 VAL B 406 10.294 9.015 -3.718 1.00 0.00 C ATOM 1710 CG2 VAL B 406 11.609 10.959 -4.514 1.00 0.00 C ATOM 0 H VAL B 406 13.015 8.039 -5.168 1.00 0.00 H new ATOM 0 HA VAL B 406 10.535 8.488 -6.631 1.00 0.00 H new ATOM 0 HB VAL B 406 9.784 10.279 -5.374 1.00 0.00 H new ATOM 0 HG11 VAL B 406 9.845 9.666 -2.968 1.00 0.00 H new ATOM 0 HG12 VAL B 406 9.577 8.246 -4.008 1.00 0.00 H new ATOM 0 HG13 VAL B 406 11.184 8.543 -3.302 1.00 0.00 H new ATOM 0 HG21 VAL B 406 11.121 11.572 -3.756 1.00 0.00 H new ATOM 0 HG22 VAL B 406 12.527 10.537 -4.105 1.00 0.00 H new ATOM 0 HG23 VAL B 406 11.848 11.576 -5.380 1.00 0.00 H new ATOM 1720 N GLY B 407 11.621 10.373 -7.930 1.00 0.00 N ATOM 1721 CA GLY B 407 12.367 11.207 -8.846 1.00 0.00 C ATOM 1722 C GLY B 407 13.344 10.419 -9.691 1.00 0.00 C ATOM 1723 O GLY B 407 12.950 9.750 -10.645 1.00 0.00 O ATOM 0 H GLY B 407 10.625 10.297 -8.137 1.00 0.00 H new ATOM 0 HA2 GLY B 407 11.672 11.734 -9.499 1.00 0.00 H new ATOM 0 HA3 GLY B 407 12.910 11.964 -8.281 1.00 0.00 H new ATOM 1727 N ASP B 408 14.623 10.504 -9.348 1.00 0.00 N ATOM 1728 CA ASP B 408 15.652 9.796 -10.101 1.00 0.00 C ATOM 1729 C ASP B 408 16.843 9.393 -9.228 1.00 0.00 C ATOM 1730 O ASP B 408 17.819 8.839 -9.731 1.00 0.00 O ATOM 1731 CB ASP B 408 16.136 10.664 -11.265 1.00 0.00 C ATOM 1732 CG ASP B 408 16.477 9.846 -12.495 1.00 0.00 C ATOM 1733 OD1 ASP B 408 16.411 8.600 -12.418 1.00 0.00 O ATOM 1734 OD2 ASP B 408 16.808 10.450 -13.537 1.00 0.00 O ATOM 0 H ASP B 408 14.971 11.051 -8.561 1.00 0.00 H new ATOM 0 HA ASP B 408 15.200 8.879 -10.480 1.00 0.00 H new ATOM 0 HB2 ASP B 408 15.364 11.391 -11.518 1.00 0.00 H new ATOM 0 HB3 ASP B 408 17.015 11.228 -10.953 1.00 0.00 H new ATOM 1739 N GLY B 409 16.775 9.673 -7.928 1.00 0.00 N ATOM 1740 CA GLY B 409 17.877 9.320 -7.054 1.00 0.00 C ATOM 1741 C GLY B 409 17.521 9.400 -5.583 1.00 0.00 C ATOM 1742 O GLY B 409 18.406 9.534 -4.737 1.00 0.00 O ATOM 0 H GLY B 409 15.987 10.132 -7.471 1.00 0.00 H new ATOM 0 HA2 GLY B 409 18.207 8.308 -7.287 1.00 0.00 H new ATOM 0 HA3 GLY B 409 18.718 9.984 -7.254 1.00 0.00 H new ATOM 1746 N THR B 410 16.235 9.311 -5.266 1.00 0.00 N ATOM 1747 CA THR B 410 15.803 9.368 -3.876 1.00 0.00 C ATOM 1748 C THR B 410 15.151 8.058 -3.455 1.00 0.00 C ATOM 1749 O THR B 410 13.972 7.846 -3.693 1.00 0.00 O ATOM 1750 CB THR B 410 14.815 10.522 -3.640 1.00 0.00 C ATOM 1751 OG1 THR B 410 14.879 11.490 -4.695 1.00 0.00 O ATOM 1752 CG2 THR B 410 15.107 11.222 -2.323 1.00 0.00 C ATOM 0 H THR B 410 15.481 9.200 -5.944 1.00 0.00 H new ATOM 0 HA THR B 410 16.694 9.539 -3.273 1.00 0.00 H new ATOM 0 HB THR B 410 13.817 10.085 -3.614 1.00 0.00 H new ATOM 0 HG1 THR B 410 14.434 11.134 -5.493 1.00 0.00 H new ATOM 0 HG21 THR B 410 14.395 12.035 -2.177 1.00 0.00 H new ATOM 0 HG22 THR B 410 15.016 10.509 -1.504 1.00 0.00 H new ATOM 0 HG23 THR B 410 16.120 11.625 -2.342 1.00 0.00 H new ATOM 1760 N VAL B 411 15.923 7.195 -2.804 1.00 0.00 N ATOM 1761 CA VAL B 411 15.414 5.910 -2.330 1.00 0.00 C ATOM 1762 C VAL B 411 15.234 5.927 -0.823 1.00 0.00 C ATOM 1763 O VAL B 411 15.930 5.205 -0.110 1.00 0.00 O ATOM 1764 CB VAL B 411 16.355 4.750 -2.705 1.00 0.00 C ATOM 1765 CG1 VAL B 411 15.944 3.471 -1.987 1.00 0.00 C ATOM 1766 CG2 VAL B 411 16.359 4.541 -4.208 1.00 0.00 C ATOM 0 H VAL B 411 16.907 7.361 -2.591 1.00 0.00 H new ATOM 0 HA VAL B 411 14.451 5.753 -2.817 1.00 0.00 H new ATOM 0 HB VAL B 411 17.365 5.008 -2.388 1.00 0.00 H new ATOM 0 HG11 VAL B 411 16.621 2.664 -2.266 1.00 0.00 H new ATOM 0 HG12 VAL B 411 15.990 3.628 -0.909 1.00 0.00 H new ATOM 0 HG13 VAL B 411 14.926 3.205 -2.272 1.00 0.00 H new ATOM 0 HG21 VAL B 411 17.028 3.718 -4.459 1.00 0.00 H new ATOM 0 HG22 VAL B 411 15.350 4.304 -4.545 1.00 0.00 H new ATOM 0 HG23 VAL B 411 16.702 5.451 -4.701 1.00 0.00 H new ATOM 1776 N LEU B 412 14.316 6.766 -0.336 1.00 0.00 N ATOM 1777 CA LEU B 412 14.060 6.878 1.094 1.00 0.00 C ATOM 1778 C LEU B 412 14.318 5.556 1.796 1.00 0.00 C ATOM 1779 O LEU B 412 14.794 5.530 2.931 1.00 0.00 O ATOM 1780 CB LEU B 412 12.615 7.321 1.354 1.00 0.00 C ATOM 1781 CG LEU B 412 12.092 8.460 0.469 1.00 0.00 C ATOM 1782 CD1 LEU B 412 13.221 9.386 0.035 1.00 0.00 C ATOM 1783 CD2 LEU B 412 11.358 7.900 -0.742 1.00 0.00 C ATOM 0 H LEU B 412 13.739 7.376 -0.915 1.00 0.00 H new ATOM 0 HA LEU B 412 14.741 7.630 1.493 1.00 0.00 H new ATOM 0 HB2 LEU B 412 11.962 6.458 1.225 1.00 0.00 H new ATOM 0 HB3 LEU B 412 12.532 7.630 2.396 1.00 0.00 H new ATOM 0 HG LEU B 412 11.389 9.048 1.059 1.00 0.00 H new ATOM 0 HD11 LEU B 412 12.818 10.182 -0.591 1.00 0.00 H new ATOM 0 HD12 LEU B 412 13.694 9.820 0.916 1.00 0.00 H new ATOM 0 HD13 LEU B 412 13.960 8.819 -0.531 1.00 0.00 H new ATOM 0 HD21 LEU B 412 10.994 8.722 -1.359 1.00 0.00 H new ATOM 0 HD22 LEU B 412 12.039 7.282 -1.327 1.00 0.00 H new ATOM 0 HD23 LEU B 412 10.515 7.295 -0.409 1.00 0.00 H new ATOM 1795 N GLY B 413 14.008 4.457 1.116 1.00 0.00 N ATOM 1796 CA GLY B 413 14.230 3.159 1.712 1.00 0.00 C ATOM 1797 C GLY B 413 13.534 2.034 0.982 1.00 0.00 C ATOM 1798 O GLY B 413 13.235 2.135 -0.208 1.00 0.00 O ATOM 0 H GLY B 413 13.613 4.444 0.176 1.00 0.00 H new ATOM 0 HA2 GLY B 413 15.301 2.958 1.737 1.00 0.00 H new ATOM 0 HA3 GLY B 413 13.885 3.179 2.746 1.00 0.00 H new ATOM 1802 N THR B 414 13.308 0.947 1.703 1.00 0.00 N ATOM 1803 CA THR B 414 12.673 -0.231 1.132 1.00 0.00 C ATOM 1804 C THR B 414 11.956 -1.056 2.191 1.00 0.00 C ATOM 1805 O THR B 414 12.045 -0.767 3.383 1.00 0.00 O ATOM 1806 CB THR B 414 13.711 -1.119 0.425 1.00 0.00 C ATOM 1807 OG1 THR B 414 13.186 -2.425 0.151 1.00 0.00 O ATOM 1808 CG2 THR B 414 14.964 -1.265 1.278 1.00 0.00 C ATOM 0 H THR B 414 13.556 0.856 2.688 1.00 0.00 H new ATOM 0 HA THR B 414 11.938 0.125 0.410 1.00 0.00 H new ATOM 0 HB THR B 414 13.959 -0.631 -0.517 1.00 0.00 H new ATOM 0 HG1 THR B 414 12.682 -2.405 -0.689 1.00 0.00 H new ATOM 0 HG21 THR B 414 15.685 -1.897 0.760 1.00 0.00 H new ATOM 0 HG22 THR B 414 15.402 -0.282 1.453 1.00 0.00 H new ATOM 0 HG23 THR B 414 14.703 -1.721 2.233 1.00 0.00 H new ATOM 1816 N GLY B 415 11.241 -2.088 1.747 1.00 0.00 N ATOM 1817 CA GLY B 415 10.520 -2.935 2.680 1.00 0.00 C ATOM 1818 C GLY B 415 10.214 -4.311 2.121 1.00 0.00 C ATOM 1819 O GLY B 415 9.840 -4.448 0.966 1.00 0.00 O ATOM 0 H GLY B 415 11.149 -2.350 0.766 1.00 0.00 H new ATOM 0 HA2 GLY B 415 11.107 -3.042 3.592 1.00 0.00 H new ATOM 0 HA3 GLY B 415 9.586 -2.446 2.958 1.00 0.00 H new ATOM 1823 N VAL B 416 10.349 -5.331 2.956 1.00 0.00 N ATOM 1824 CA VAL B 416 10.067 -6.702 2.547 1.00 0.00 C ATOM 1825 C VAL B 416 9.067 -7.332 3.512 1.00 0.00 C ATOM 1826 O VAL B 416 9.033 -6.979 4.691 1.00 0.00 O ATOM 1827 CB VAL B 416 11.348 -7.555 2.527 1.00 0.00 C ATOM 1828 CG1 VAL B 416 11.011 -9.035 2.417 1.00 0.00 C ATOM 1829 CG2 VAL B 416 12.256 -7.118 1.388 1.00 0.00 C ATOM 0 H VAL B 416 10.653 -5.236 3.925 1.00 0.00 H new ATOM 0 HA VAL B 416 9.652 -6.672 1.539 1.00 0.00 H new ATOM 0 HB VAL B 416 11.879 -7.403 3.467 1.00 0.00 H new ATOM 0 HG11 VAL B 416 11.932 -9.618 2.405 1.00 0.00 H new ATOM 0 HG12 VAL B 416 10.404 -9.334 3.271 1.00 0.00 H new ATOM 0 HG13 VAL B 416 10.456 -9.214 1.496 1.00 0.00 H new ATOM 0 HG21 VAL B 416 13.158 -7.730 1.386 1.00 0.00 H new ATOM 0 HG22 VAL B 416 11.733 -7.239 0.439 1.00 0.00 H new ATOM 0 HG23 VAL B 416 12.528 -6.071 1.521 1.00 0.00 H new ATOM 1839 N GLY B 417 8.255 -8.258 3.020 1.00 0.00 N ATOM 1840 CA GLY B 417 7.276 -8.901 3.880 1.00 0.00 C ATOM 1841 C GLY B 417 6.735 -10.184 3.283 1.00 0.00 C ATOM 1842 O GLY B 417 6.865 -10.407 2.085 1.00 0.00 O ATOM 0 H GLY B 417 8.254 -8.575 2.050 1.00 0.00 H new ATOM 0 HA2 GLY B 417 7.732 -9.117 4.846 1.00 0.00 H new ATOM 0 HA3 GLY B 417 6.451 -8.213 4.064 1.00 0.00 H new ATOM 1846 N ARG B 418 6.129 -11.025 4.120 1.00 0.00 N ATOM 1847 CA ARG B 418 5.570 -12.301 3.659 1.00 0.00 C ATOM 1848 C ARG B 418 4.241 -12.105 2.931 1.00 0.00 C ATOM 1849 O ARG B 418 4.003 -12.718 1.892 1.00 0.00 O ATOM 1850 CB ARG B 418 5.381 -13.281 4.827 1.00 0.00 C ATOM 1851 CG ARG B 418 5.375 -12.629 6.202 1.00 0.00 C ATOM 1852 CD ARG B 418 4.849 -13.576 7.269 1.00 0.00 C ATOM 1853 NE ARG B 418 4.891 -12.981 8.604 1.00 0.00 N ATOM 1854 CZ ARG B 418 4.634 -13.657 9.718 1.00 0.00 C ATOM 1855 NH1 ARG B 418 4.317 -14.943 9.655 1.00 0.00 N ATOM 1856 NH2 ARG B 418 4.692 -13.051 10.896 1.00 0.00 N ATOM 0 H ARG B 418 6.011 -10.849 5.118 1.00 0.00 H new ATOM 0 HA ARG B 418 6.289 -12.724 2.957 1.00 0.00 H new ATOM 0 HB2 ARG B 418 4.441 -13.816 4.688 1.00 0.00 H new ATOM 0 HB3 ARG B 418 6.178 -14.024 4.794 1.00 0.00 H new ATOM 0 HG2 ARG B 418 6.386 -12.315 6.460 1.00 0.00 H new ATOM 0 HG3 ARG B 418 4.758 -11.730 6.176 1.00 0.00 H new ATOM 0 HD2 ARG B 418 3.823 -13.856 7.030 1.00 0.00 H new ATOM 0 HD3 ARG B 418 5.440 -14.492 7.263 1.00 0.00 H new ATOM 0 HE ARG B 418 5.131 -11.993 8.684 1.00 0.00 H new ATOM 0 HH11 ARG B 418 4.271 -15.413 8.751 1.00 0.00 H new ATOM 0 HH12 ARG B 418 4.120 -15.462 10.511 1.00 0.00 H new ATOM 0 HH21 ARG B 418 4.935 -12.062 10.949 1.00 0.00 H new ATOM 0 HH22 ARG B 418 4.494 -13.574 11.749 1.00 0.00 H new ATOM 1870 N ASN B 419 3.388 -11.234 3.463 1.00 0.00 N ATOM 1871 CA ASN B 419 2.100 -10.956 2.836 1.00 0.00 C ATOM 1872 C ASN B 419 2.169 -9.638 2.077 1.00 0.00 C ATOM 1873 O ASN B 419 1.158 -8.969 1.876 1.00 0.00 O ATOM 1874 CB ASN B 419 0.983 -10.907 3.877 1.00 0.00 C ATOM 1875 CG ASN B 419 1.502 -10.606 5.269 1.00 0.00 C ATOM 1876 OD1 ASN B 419 2.222 -11.407 5.864 1.00 0.00 O ATOM 1877 ND2 ASN B 419 1.135 -9.444 5.796 1.00 0.00 N ATOM 0 H ASN B 419 3.564 -10.712 4.321 1.00 0.00 H new ATOM 0 HA ASN B 419 1.876 -11.762 2.138 1.00 0.00 H new ATOM 0 HB2 ASN B 419 0.257 -10.146 3.591 1.00 0.00 H new ATOM 0 HB3 ASN B 419 0.457 -11.862 3.887 1.00 0.00 H new ATOM 0 HD21 ASN B 419 1.451 -9.185 6.730 1.00 0.00 H new ATOM 0 HD22 ASN B 419 0.537 -8.810 5.266 1.00 0.00 H new ATOM 1884 N ILE B 420 3.379 -9.312 1.637 1.00 0.00 N ATOM 1885 CA ILE B 420 3.670 -8.103 0.855 1.00 0.00 C ATOM 1886 C ILE B 420 3.234 -6.794 1.527 1.00 0.00 C ATOM 1887 O ILE B 420 3.994 -5.830 1.527 1.00 0.00 O ATOM 1888 CB ILE B 420 3.082 -8.200 -0.560 1.00 0.00 C ATOM 1889 CG1 ILE B 420 1.699 -7.552 -0.665 1.00 0.00 C ATOM 1890 CG2 ILE B 420 3.006 -9.659 -0.973 1.00 0.00 C ATOM 1891 CD1 ILE B 420 1.741 -6.087 -1.032 1.00 0.00 C ATOM 0 H ILE B 420 4.203 -9.886 1.814 1.00 0.00 H new ATOM 0 HA ILE B 420 4.757 -8.061 0.794 1.00 0.00 H new ATOM 0 HB ILE B 420 3.742 -7.651 -1.232 1.00 0.00 H new ATOM 0 HG12 ILE B 420 1.112 -8.088 -1.411 1.00 0.00 H new ATOM 0 HG13 ILE B 420 1.182 -7.664 0.288 1.00 0.00 H new ATOM 0 HG21 ILE B 420 2.589 -9.732 -1.977 1.00 0.00 H new ATOM 0 HG22 ILE B 420 4.006 -10.092 -0.963 1.00 0.00 H new ATOM 0 HG23 ILE B 420 2.368 -10.202 -0.275 1.00 0.00 H new ATOM 0 HD11 ILE B 420 0.725 -5.697 -1.088 1.00 0.00 H new ATOM 0 HD12 ILE B 420 2.300 -5.538 -0.274 1.00 0.00 H new ATOM 0 HD13 ILE B 420 2.229 -5.968 -1.999 1.00 0.00 H new ATOM 1903 N LYS B 421 2.029 -6.744 2.090 1.00 0.00 N ATOM 1904 CA LYS B 421 1.571 -5.534 2.747 1.00 0.00 C ATOM 1905 C LYS B 421 2.720 -4.990 3.585 1.00 0.00 C ATOM 1906 O LYS B 421 3.180 -3.869 3.378 1.00 0.00 O ATOM 1907 CB LYS B 421 0.338 -5.816 3.604 1.00 0.00 C ATOM 1908 CG LYS B 421 0.113 -4.801 4.705 1.00 0.00 C ATOM 1909 CD LYS B 421 0.965 -5.123 5.912 1.00 0.00 C ATOM 1910 CE LYS B 421 0.389 -4.516 7.182 1.00 0.00 C ATOM 1911 NZ LYS B 421 0.595 -5.397 8.365 1.00 0.00 N ATOM 0 H LYS B 421 1.364 -7.518 2.102 1.00 0.00 H new ATOM 0 HA LYS B 421 1.275 -4.791 2.007 1.00 0.00 H new ATOM 0 HB2 LYS B 421 -0.542 -5.841 2.961 1.00 0.00 H new ATOM 0 HB3 LYS B 421 0.436 -6.806 4.050 1.00 0.00 H new ATOM 0 HG2 LYS B 421 0.353 -3.802 4.340 1.00 0.00 H new ATOM 0 HG3 LYS B 421 -0.939 -4.792 4.989 1.00 0.00 H new ATOM 0 HD2 LYS B 421 1.041 -6.204 6.027 1.00 0.00 H new ATOM 0 HD3 LYS B 421 1.976 -4.748 5.755 1.00 0.00 H new ATOM 0 HE2 LYS B 421 0.856 -3.548 7.365 1.00 0.00 H new ATOM 0 HE3 LYS B 421 -0.677 -4.335 7.046 1.00 0.00 H new ATOM 0 HZ1 LYS B 421 0.188 -4.946 9.209 1.00 0.00 H new ATOM 0 HZ2 LYS B 421 0.128 -6.312 8.202 1.00 0.00 H new ATOM 0 HZ3 LYS B 421 1.613 -5.549 8.511 1.00 0.00 H new ATOM 1925 N ILE B 422 3.195 -5.811 4.523 1.00 0.00 N ATOM 1926 CA ILE B 422 4.319 -5.420 5.378 1.00 0.00 C ATOM 1927 C ILE B 422 5.415 -4.803 4.530 1.00 0.00 C ATOM 1928 O ILE B 422 6.169 -3.954 4.991 1.00 0.00 O ATOM 1929 CB ILE B 422 4.933 -6.603 6.162 1.00 0.00 C ATOM 1930 CG1 ILE B 422 4.104 -7.878 6.000 1.00 0.00 C ATOM 1931 CG2 ILE B 422 5.078 -6.242 7.631 1.00 0.00 C ATOM 1932 CD1 ILE B 422 4.205 -8.481 4.617 1.00 0.00 C ATOM 0 H ILE B 422 2.824 -6.742 4.710 1.00 0.00 H new ATOM 0 HA ILE B 422 3.918 -4.709 6.101 1.00 0.00 H new ATOM 0 HB ILE B 422 5.922 -6.801 5.748 1.00 0.00 H new ATOM 0 HG12 ILE B 422 4.432 -8.613 6.735 1.00 0.00 H new ATOM 0 HG13 ILE B 422 3.059 -7.655 6.217 1.00 0.00 H new ATOM 0 HG21 ILE B 422 5.511 -7.084 8.171 1.00 0.00 H new ATOM 0 HG22 ILE B 422 5.729 -5.373 7.730 1.00 0.00 H new ATOM 0 HG23 ILE B 422 4.098 -6.010 8.047 1.00 0.00 H new ATOM 0 HD11 ILE B 422 3.594 -9.382 4.568 1.00 0.00 H new ATOM 0 HD12 ILE B 422 3.850 -7.761 3.879 1.00 0.00 H new ATOM 0 HD13 ILE B 422 5.244 -8.735 4.406 1.00 0.00 H new ATOM 1944 N ALA B 423 5.449 -5.195 3.265 1.00 0.00 N ATOM 1945 CA ALA B 423 6.404 -4.644 2.326 1.00 0.00 C ATOM 1946 C ALA B 423 5.918 -3.269 1.904 1.00 0.00 C ATOM 1947 O ALA B 423 6.667 -2.291 1.918 1.00 0.00 O ATOM 1948 CB ALA B 423 6.574 -5.552 1.118 1.00 0.00 C ATOM 0 H ALA B 423 4.822 -5.895 2.868 1.00 0.00 H new ATOM 0 HA ALA B 423 7.381 -4.563 2.803 1.00 0.00 H new ATOM 0 HB1 ALA B 423 7.297 -5.112 0.431 1.00 0.00 H new ATOM 0 HB2 ALA B 423 6.931 -6.529 1.444 1.00 0.00 H new ATOM 0 HB3 ALA B 423 5.616 -5.667 0.612 1.00 0.00 H new ATOM 1954 N GLY B 424 4.639 -3.207 1.553 1.00 0.00 N ATOM 1955 CA GLY B 424 4.035 -1.955 1.154 1.00 0.00 C ATOM 1956 C GLY B 424 4.041 -0.972 2.296 1.00 0.00 C ATOM 1957 O GLY B 424 4.578 0.130 2.180 1.00 0.00 O ATOM 0 H GLY B 424 4.008 -4.008 1.539 1.00 0.00 H new ATOM 0 HA2 GLY B 424 4.578 -1.538 0.306 1.00 0.00 H new ATOM 0 HA3 GLY B 424 3.011 -2.129 0.823 1.00 0.00 H new ATOM 1961 N ILE B 425 3.463 -1.383 3.420 1.00 0.00 N ATOM 1962 CA ILE B 425 3.431 -0.539 4.599 1.00 0.00 C ATOM 1963 C ILE B 425 4.852 -0.177 5.015 1.00 0.00 C ATOM 1964 O ILE B 425 5.272 0.972 4.878 1.00 0.00 O ATOM 1965 CB ILE B 425 2.706 -1.237 5.774 1.00 0.00 C ATOM 1966 CG1 ILE B 425 1.193 -1.120 5.600 1.00 0.00 C ATOM 1967 CG2 ILE B 425 3.133 -0.645 7.113 1.00 0.00 C ATOM 1968 CD1 ILE B 425 0.740 -1.245 4.162 1.00 0.00 C ATOM 0 H ILE B 425 3.014 -2.291 3.535 1.00 0.00 H new ATOM 0 HA ILE B 425 2.878 0.367 4.349 1.00 0.00 H new ATOM 0 HB ILE B 425 2.984 -2.291 5.769 1.00 0.00 H new ATOM 0 HG12 ILE B 425 0.706 -1.893 6.195 1.00 0.00 H new ATOM 0 HG13 ILE B 425 0.863 -0.159 5.994 1.00 0.00 H new ATOM 0 HG21 ILE B 425 2.607 -1.155 7.920 1.00 0.00 H new ATOM 0 HG22 ILE B 425 4.208 -0.774 7.241 1.00 0.00 H new ATOM 0 HG23 ILE B 425 2.889 0.417 7.135 1.00 0.00 H new ATOM 0 HD11 ILE B 425 -0.345 -1.152 4.113 1.00 0.00 H new ATOM 0 HD12 ILE B 425 1.199 -0.456 3.566 1.00 0.00 H new ATOM 0 HD13 ILE B 425 1.039 -2.217 3.769 1.00 0.00 H new ATOM 1980 N ARG B 426 5.579 -1.155 5.549 1.00 0.00 N ATOM 1981 CA ARG B 426 6.941 -0.906 6.005 1.00 0.00 C ATOM 1982 C ARG B 426 7.708 -0.070 4.983 1.00 0.00 C ATOM 1983 O ARG B 426 8.612 0.683 5.343 1.00 0.00 O ATOM 1984 CB ARG B 426 7.667 -2.214 6.359 1.00 0.00 C ATOM 1985 CG ARG B 426 8.609 -2.755 5.294 1.00 0.00 C ATOM 1986 CD ARG B 426 9.964 -3.069 5.899 1.00 0.00 C ATOM 1987 NE ARG B 426 10.236 -4.503 5.926 1.00 0.00 N ATOM 1988 CZ ARG B 426 11.257 -5.045 6.584 1.00 0.00 C ATOM 1989 NH1 ARG B 426 12.088 -4.274 7.272 1.00 0.00 N ATOM 1990 NH2 ARG B 426 11.445 -6.356 6.558 1.00 0.00 N ATOM 0 H ARG B 426 5.253 -2.113 5.675 1.00 0.00 H new ATOM 0 HA ARG B 426 6.892 -0.325 6.926 1.00 0.00 H new ATOM 0 HB2 ARG B 426 8.236 -2.056 7.275 1.00 0.00 H new ATOM 0 HB3 ARG B 426 6.919 -2.976 6.577 1.00 0.00 H new ATOM 0 HG2 ARG B 426 8.185 -3.655 4.847 1.00 0.00 H new ATOM 0 HG3 ARG B 426 8.721 -2.024 4.493 1.00 0.00 H new ATOM 0 HD2 ARG B 426 10.742 -2.564 5.326 1.00 0.00 H new ATOM 0 HD3 ARG B 426 10.008 -2.673 6.914 1.00 0.00 H new ATOM 0 HE ARG B 426 9.609 -5.123 5.413 1.00 0.00 H new ATOM 0 HH11 ARG B 426 11.944 -3.264 7.297 1.00 0.00 H new ATOM 0 HH12 ARG B 426 12.871 -4.690 7.776 1.00 0.00 H new ATOM 0 HH21 ARG B 426 10.806 -6.953 6.032 1.00 0.00 H new ATOM 0 HH22 ARG B 426 12.229 -6.769 7.063 1.00 0.00 H new ATOM 2004 N ALA B 427 7.306 -0.154 3.712 1.00 0.00 N ATOM 2005 CA ALA B 427 7.934 0.660 2.682 1.00 0.00 C ATOM 2006 C ALA B 427 7.694 2.119 3.040 1.00 0.00 C ATOM 2007 O ALA B 427 8.624 2.913 3.188 1.00 0.00 O ATOM 2008 CB ALA B 427 7.376 0.340 1.303 1.00 0.00 C ATOM 0 H ALA B 427 6.562 -0.768 3.381 1.00 0.00 H new ATOM 0 HA ALA B 427 9.002 0.448 2.641 1.00 0.00 H new ATOM 0 HB1 ALA B 427 7.867 0.966 0.558 1.00 0.00 H new ATOM 0 HB2 ALA B 427 7.557 -0.710 1.072 1.00 0.00 H new ATOM 0 HB3 ALA B 427 6.304 0.534 1.290 1.00 0.00 H new ATOM 2014 N ALA B 428 6.426 2.453 3.228 1.00 0.00 N ATOM 2015 CA ALA B 428 6.067 3.797 3.627 1.00 0.00 C ATOM 2016 C ALA B 428 6.867 4.146 4.873 1.00 0.00 C ATOM 2017 O ALA B 428 7.509 5.194 4.947 1.00 0.00 O ATOM 2018 CB ALA B 428 4.575 3.916 3.892 1.00 0.00 C ATOM 0 H ALA B 428 5.638 1.816 3.111 1.00 0.00 H new ATOM 0 HA ALA B 428 6.300 4.494 2.822 1.00 0.00 H new ATOM 0 HB1 ALA B 428 4.339 4.938 4.190 1.00 0.00 H new ATOM 0 HB2 ALA B 428 4.023 3.665 2.986 1.00 0.00 H new ATOM 0 HB3 ALA B 428 4.292 3.231 4.691 1.00 0.00 H new ATOM 2024 N GLU B 429 6.835 3.237 5.849 1.00 0.00 N ATOM 2025 CA GLU B 429 7.569 3.419 7.093 1.00 0.00 C ATOM 2026 C GLU B 429 9.042 3.695 6.805 1.00 0.00 C ATOM 2027 O GLU B 429 9.747 4.285 7.623 1.00 0.00 O ATOM 2028 CB GLU B 429 7.426 2.184 7.985 1.00 0.00 C ATOM 2029 CG GLU B 429 6.035 2.024 8.576 1.00 0.00 C ATOM 2030 CD GLU B 429 5.980 0.973 9.668 1.00 0.00 C ATOM 2031 OE1 GLU B 429 6.460 -0.156 9.430 1.00 0.00 O ATOM 2032 OE2 GLU B 429 5.457 1.279 10.760 1.00 0.00 O ATOM 0 H GLU B 429 6.306 2.367 5.797 1.00 0.00 H new ATOM 0 HA GLU B 429 7.149 4.277 7.619 1.00 0.00 H new ATOM 0 HB2 GLU B 429 7.670 1.295 7.404 1.00 0.00 H new ATOM 0 HB3 GLU B 429 8.152 2.244 8.796 1.00 0.00 H new ATOM 0 HG2 GLU B 429 5.705 2.980 8.981 1.00 0.00 H new ATOM 0 HG3 GLU B 429 5.337 1.755 7.783 1.00 0.00 H new ATOM 2039 N ASN B 430 9.498 3.291 5.623 1.00 0.00 N ATOM 2040 CA ASN B 430 10.877 3.534 5.228 1.00 0.00 C ATOM 2041 C ASN B 430 11.030 5.002 4.841 1.00 0.00 C ATOM 2042 O ASN B 430 12.052 5.629 5.120 1.00 0.00 O ATOM 2043 CB ASN B 430 11.290 2.617 4.074 1.00 0.00 C ATOM 2044 CG ASN B 430 12.227 1.522 4.533 1.00 0.00 C ATOM 2045 OD1 ASN B 430 13.395 1.481 4.144 1.00 0.00 O ATOM 2046 ND2 ASN B 430 11.714 0.628 5.369 1.00 0.00 N ATOM 0 H ASN B 430 8.936 2.798 4.929 1.00 0.00 H new ATOM 0 HA ASN B 430 11.536 3.311 6.067 1.00 0.00 H new ATOM 0 HB2 ASN B 430 10.401 2.171 3.628 1.00 0.00 H new ATOM 0 HB3 ASN B 430 11.775 3.207 3.296 1.00 0.00 H new ATOM 0 HD21 ASN B 430 12.294 -0.135 5.718 1.00 0.00 H new ATOM 0 HD22 ASN B 430 10.740 0.704 5.663 1.00 0.00 H new ATOM 2053 N ALA B 431 9.994 5.546 4.195 1.00 0.00 N ATOM 2054 CA ALA B 431 10.002 6.940 3.765 1.00 0.00 C ATOM 2055 C ALA B 431 9.950 7.891 4.962 1.00 0.00 C ATOM 2056 O ALA B 431 10.733 8.837 5.046 1.00 0.00 O ATOM 2057 CB ALA B 431 8.844 7.222 2.819 1.00 0.00 C ATOM 0 H ALA B 431 9.141 5.039 3.960 1.00 0.00 H new ATOM 0 HA ALA B 431 10.937 7.114 3.233 1.00 0.00 H new ATOM 0 HB1 ALA B 431 8.871 8.268 2.512 1.00 0.00 H new ATOM 0 HB2 ALA B 431 8.929 6.583 1.940 1.00 0.00 H new ATOM 0 HB3 ALA B 431 7.901 7.017 3.327 1.00 0.00 H new ATOM 2063 N LEU B 432 9.023 7.636 5.884 1.00 0.00 N ATOM 2064 CA LEU B 432 8.874 8.474 7.073 1.00 0.00 C ATOM 2065 C LEU B 432 9.958 8.173 8.104 1.00 0.00 C ATOM 2066 O LEU B 432 9.988 8.760 9.185 1.00 0.00 O ATOM 2067 CB LEU B 432 7.490 8.266 7.695 1.00 0.00 C ATOM 2068 CG LEU B 432 7.423 7.304 8.889 1.00 0.00 C ATOM 2069 CD1 LEU B 432 5.992 6.879 9.131 1.00 0.00 C ATOM 2070 CD2 LEU B 432 8.289 6.076 8.666 1.00 0.00 C ATOM 0 H LEU B 432 8.365 6.858 5.831 1.00 0.00 H new ATOM 0 HA LEU B 432 8.979 9.514 6.765 1.00 0.00 H new ATOM 0 HB2 LEU B 432 7.108 9.236 8.014 1.00 0.00 H new ATOM 0 HB3 LEU B 432 6.818 7.898 6.920 1.00 0.00 H new ATOM 0 HG LEU B 432 7.803 7.833 9.763 1.00 0.00 H new ATOM 0 HD11 LEU B 432 5.954 6.196 9.980 1.00 0.00 H new ATOM 0 HD12 LEU B 432 5.383 7.757 9.344 1.00 0.00 H new ATOM 0 HD13 LEU B 432 5.607 6.376 8.244 1.00 0.00 H new ATOM 0 HD21 LEU B 432 8.217 5.418 9.532 1.00 0.00 H new ATOM 0 HD22 LEU B 432 7.947 5.546 7.777 1.00 0.00 H new ATOM 0 HD23 LEU B 432 9.326 6.382 8.529 1.00 0.00 H new ATOM 2082 N ARG B 433 10.843 7.253 7.754 1.00 0.00 N ATOM 2083 CA ARG B 433 11.934 6.859 8.635 1.00 0.00 C ATOM 2084 C ARG B 433 12.983 7.962 8.728 1.00 0.00 C ATOM 2085 O ARG B 433 13.855 7.931 9.596 1.00 0.00 O ATOM 2086 CB ARG B 433 12.582 5.573 8.116 1.00 0.00 C ATOM 2087 CG ARG B 433 12.957 4.590 9.212 1.00 0.00 C ATOM 2088 CD ARG B 433 13.981 3.579 8.720 1.00 0.00 C ATOM 2089 NE ARG B 433 14.945 3.225 9.757 1.00 0.00 N ATOM 2090 CZ ARG B 433 15.987 3.982 10.080 1.00 0.00 C ATOM 2091 NH1 ARG B 433 16.184 5.138 9.460 1.00 0.00 N ATOM 2092 NH2 ARG B 433 16.829 3.590 11.025 1.00 0.00 N ATOM 0 H ARG B 433 10.827 6.762 6.860 1.00 0.00 H new ATOM 0 HA ARG B 433 11.526 6.686 9.631 1.00 0.00 H new ATOM 0 HB2 ARG B 433 11.896 5.086 7.423 1.00 0.00 H new ATOM 0 HB3 ARG B 433 13.477 5.831 7.550 1.00 0.00 H new ATOM 0 HG2 ARG B 433 13.360 5.132 10.068 1.00 0.00 H new ATOM 0 HG3 ARG B 433 12.064 4.068 9.557 1.00 0.00 H new ATOM 0 HD2 ARG B 433 13.468 2.679 8.381 1.00 0.00 H new ATOM 0 HD3 ARG B 433 14.509 3.988 7.859 1.00 0.00 H new ATOM 0 HE ARG B 433 14.811 2.348 10.261 1.00 0.00 H new ATOM 0 HH11 ARG B 433 15.535 5.445 8.735 1.00 0.00 H new ATOM 0 HH12 ARG B 433 16.984 5.720 9.708 1.00 0.00 H new ATOM 0 HH21 ARG B 433 16.678 2.704 11.507 1.00 0.00 H new ATOM 0 HH22 ARG B 433 17.628 4.174 11.270 1.00 0.00 H new ATOM 2106 N ASP B 434 12.907 8.924 7.814 1.00 0.00 N ATOM 2107 CA ASP B 434 13.869 10.018 7.786 1.00 0.00 C ATOM 2108 C ASP B 434 13.193 11.374 7.942 1.00 0.00 C ATOM 2109 O ASP B 434 12.873 12.035 6.954 1.00 0.00 O ATOM 2110 CB ASP B 434 14.660 9.983 6.478 1.00 0.00 C ATOM 2111 CG ASP B 434 15.306 8.635 6.230 1.00 0.00 C ATOM 2112 OD1 ASP B 434 14.622 7.737 5.696 1.00 0.00 O ATOM 2113 OD2 ASP B 434 16.498 8.477 6.571 1.00 0.00 O ATOM 0 H ASP B 434 12.193 8.968 7.087 1.00 0.00 H new ATOM 0 HA ASP B 434 14.544 9.884 8.631 1.00 0.00 H new ATOM 0 HB2 ASP B 434 13.995 10.223 5.648 1.00 0.00 H new ATOM 0 HB3 ASP B 434 15.431 10.753 6.502 1.00 0.00 H new ATOM 2118 N LYS B 435 12.989 11.793 9.187 1.00 0.00 N ATOM 2119 CA LYS B 435 12.365 13.081 9.459 1.00 0.00 C ATOM 2120 C LYS B 435 13.092 14.188 8.705 1.00 0.00 C ATOM 2121 O LYS B 435 12.478 14.970 7.982 1.00 0.00 O ATOM 2122 CB LYS B 435 12.382 13.374 10.964 1.00 0.00 C ATOM 2123 CG LYS B 435 13.623 14.124 11.428 1.00 0.00 C ATOM 2124 CD LYS B 435 13.524 14.533 12.885 1.00 0.00 C ATOM 2125 CE LYS B 435 13.722 13.345 13.812 1.00 0.00 C ATOM 2126 NZ LYS B 435 15.014 12.650 13.555 1.00 0.00 N ATOM 0 H LYS B 435 13.246 11.262 10.019 1.00 0.00 H new ATOM 0 HA LYS B 435 11.330 13.043 9.120 1.00 0.00 H new ATOM 0 HB2 LYS B 435 11.498 13.958 11.221 1.00 0.00 H new ATOM 0 HB3 LYS B 435 12.312 12.433 11.509 1.00 0.00 H new ATOM 0 HG2 LYS B 435 14.502 13.495 11.286 1.00 0.00 H new ATOM 0 HG3 LYS B 435 13.763 15.011 10.810 1.00 0.00 H new ATOM 0 HD2 LYS B 435 14.274 15.294 13.102 1.00 0.00 H new ATOM 0 HD3 LYS B 435 12.549 14.983 13.072 1.00 0.00 H new ATOM 0 HE2 LYS B 435 13.691 13.683 14.848 1.00 0.00 H new ATOM 0 HE3 LYS B 435 12.899 12.642 13.682 1.00 0.00 H new ATOM 0 HZ1 LYS B 435 15.275 12.084 14.387 1.00 0.00 H new ATOM 0 HZ2 LYS B 435 14.914 12.026 12.729 1.00 0.00 H new ATOM 0 HZ3 LYS B 435 15.756 13.354 13.369 1.00 0.00 H new ATOM 2140 N LYS B 436 14.407 14.243 8.884 1.00 0.00 N ATOM 2141 CA LYS B 436 15.229 15.248 8.228 1.00 0.00 C ATOM 2142 C LYS B 436 14.939 15.283 6.732 1.00 0.00 C ATOM 2143 O LYS B 436 14.930 16.348 6.115 1.00 0.00 O ATOM 2144 CB LYS B 436 16.708 14.963 8.483 1.00 0.00 C ATOM 2145 CG LYS B 436 17.079 14.988 9.957 1.00 0.00 C ATOM 2146 CD LYS B 436 18.064 13.883 10.305 1.00 0.00 C ATOM 2147 CE LYS B 436 19.330 13.985 9.470 1.00 0.00 C ATOM 2148 NZ LYS B 436 20.414 14.708 10.190 1.00 0.00 N ATOM 0 H LYS B 436 14.927 13.600 9.481 1.00 0.00 H new ATOM 0 HA LYS B 436 14.986 16.226 8.644 1.00 0.00 H new ATOM 0 HB2 LYS B 436 16.960 13.987 8.069 1.00 0.00 H new ATOM 0 HB3 LYS B 436 17.310 15.700 7.951 1.00 0.00 H new ATOM 0 HG2 LYS B 436 17.514 15.956 10.207 1.00 0.00 H new ATOM 0 HG3 LYS B 436 16.179 14.877 10.561 1.00 0.00 H new ATOM 0 HD2 LYS B 436 18.319 13.941 11.363 1.00 0.00 H new ATOM 0 HD3 LYS B 436 17.596 12.912 10.142 1.00 0.00 H new ATOM 0 HE2 LYS B 436 19.673 12.984 9.208 1.00 0.00 H new ATOM 0 HE3 LYS B 436 19.108 14.501 8.536 1.00 0.00 H new ATOM 0 HZ1 LYS B 436 21.260 14.756 9.587 1.00 0.00 H new ATOM 0 HZ2 LYS B 436 20.096 15.672 10.418 1.00 0.00 H new ATOM 0 HZ3 LYS B 436 20.644 14.202 11.069 1.00 0.00 H new ATOM 2162 N MET B 437 14.685 14.112 6.159 1.00 0.00 N ATOM 2163 CA MET B 437 14.372 14.012 4.741 1.00 0.00 C ATOM 2164 C MET B 437 12.910 14.376 4.510 1.00 0.00 C ATOM 2165 O MET B 437 12.580 15.138 3.601 1.00 0.00 O ATOM 2166 CB MET B 437 14.653 12.597 4.231 1.00 0.00 C ATOM 2167 CG MET B 437 14.074 12.322 2.854 1.00 0.00 C ATOM 2168 SD MET B 437 13.223 10.734 2.763 1.00 0.00 S ATOM 2169 CE MET B 437 11.574 11.202 3.283 1.00 0.00 C ATOM 0 H MET B 437 14.690 13.221 6.655 1.00 0.00 H new ATOM 0 HA MET B 437 15.004 14.708 4.189 1.00 0.00 H new ATOM 0 HB2 MET B 437 15.731 12.438 4.201 1.00 0.00 H new ATOM 0 HB3 MET B 437 14.244 11.876 4.939 1.00 0.00 H new ATOM 0 HG2 MET B 437 13.378 13.119 2.591 1.00 0.00 H new ATOM 0 HG3 MET B 437 14.876 12.343 2.116 1.00 0.00 H new ATOM 0 HE1 MET B 437 10.847 10.517 2.847 1.00 0.00 H new ATOM 0 HE2 MET B 437 11.509 11.156 4.370 1.00 0.00 H new ATOM 0 HE3 MET B 437 11.362 12.218 2.949 1.00 0.00 H new ATOM 2179 N LEU B 438 12.040 13.842 5.360 1.00 0.00 N ATOM 2180 CA LEU B 438 10.613 14.125 5.276 1.00 0.00 C ATOM 2181 C LEU B 438 10.392 15.631 5.270 1.00 0.00 C ATOM 2182 O LEU B 438 9.908 16.211 4.294 1.00 0.00 O ATOM 2183 CB LEU B 438 9.883 13.510 6.470 1.00 0.00 C ATOM 2184 CG LEU B 438 9.858 11.979 6.518 1.00 0.00 C ATOM 2185 CD1 LEU B 438 9.357 11.507 7.874 1.00 0.00 C ATOM 2186 CD2 LEU B 438 8.980 11.429 5.404 1.00 0.00 C ATOM 0 H LEU B 438 12.299 13.209 6.117 1.00 0.00 H new ATOM 0 HA LEU B 438 10.220 13.692 4.356 1.00 0.00 H new ATOM 0 HB2 LEU B 438 10.349 13.876 7.385 1.00 0.00 H new ATOM 0 HB3 LEU B 438 8.855 13.872 6.469 1.00 0.00 H new ATOM 0 HG LEU B 438 10.872 11.606 6.372 1.00 0.00 H new ATOM 0 HD11 LEU B 438 9.343 10.417 7.898 1.00 0.00 H new ATOM 0 HD12 LEU B 438 10.019 11.878 8.656 1.00 0.00 H new ATOM 0 HD13 LEU B 438 8.349 11.886 8.042 1.00 0.00 H new ATOM 0 HD21 LEU B 438 8.972 10.340 5.451 1.00 0.00 H new ATOM 0 HD22 LEU B 438 7.964 11.805 5.523 1.00 0.00 H new ATOM 0 HD23 LEU B 438 9.374 11.748 4.439 1.00 0.00 H new ATOM 2198 N ASP B 439 10.785 16.260 6.369 1.00 0.00 N ATOM 2199 CA ASP B 439 10.670 17.699 6.501 1.00 0.00 C ATOM 2200 C ASP B 439 11.394 18.362 5.338 1.00 0.00 C ATOM 2201 O ASP B 439 10.879 19.291 4.717 1.00 0.00 O ATOM 2202 CB ASP B 439 11.256 18.165 7.835 1.00 0.00 C ATOM 2203 CG ASP B 439 10.785 19.554 8.220 1.00 0.00 C ATOM 2204 OD1 ASP B 439 11.457 20.535 7.838 1.00 0.00 O ATOM 2205 OD2 ASP B 439 9.746 19.659 8.904 1.00 0.00 O ATOM 0 H ASP B 439 11.187 15.792 7.182 1.00 0.00 H new ATOM 0 HA ASP B 439 9.618 17.982 6.482 1.00 0.00 H new ATOM 0 HB2 ASP B 439 10.976 17.460 8.618 1.00 0.00 H new ATOM 0 HB3 ASP B 439 12.344 18.158 7.773 1.00 0.00 H new ATOM 2210 N PHE B 440 12.592 17.859 5.039 1.00 0.00 N ATOM 2211 CA PHE B 440 13.380 18.390 3.939 1.00 0.00 C ATOM 2212 C PHE B 440 12.456 18.658 2.761 1.00 0.00 C ATOM 2213 O PHE B 440 12.550 19.689 2.091 1.00 0.00 O ATOM 2214 CB PHE B 440 14.493 17.402 3.557 1.00 0.00 C ATOM 2215 CG PHE B 440 14.783 17.336 2.081 1.00 0.00 C ATOM 2216 CD1 PHE B 440 14.008 16.546 1.247 1.00 0.00 C ATOM 2217 CD2 PHE B 440 15.825 18.065 1.531 1.00 0.00 C ATOM 2218 CE1 PHE B 440 14.267 16.484 -0.109 1.00 0.00 C ATOM 2219 CE2 PHE B 440 16.089 18.006 0.175 1.00 0.00 C ATOM 2220 CZ PHE B 440 15.309 17.215 -0.646 1.00 0.00 C ATOM 0 H PHE B 440 13.032 17.089 5.543 1.00 0.00 H new ATOM 0 HA PHE B 440 13.857 19.323 4.238 1.00 0.00 H new ATOM 0 HB2 PHE B 440 15.406 17.681 4.083 1.00 0.00 H new ATOM 0 HB3 PHE B 440 14.215 16.407 3.906 1.00 0.00 H new ATOM 0 HD1 PHE B 440 13.192 15.972 1.661 1.00 0.00 H new ATOM 0 HD2 PHE B 440 16.437 18.686 2.168 1.00 0.00 H new ATOM 0 HE1 PHE B 440 13.655 15.865 -0.748 1.00 0.00 H new ATOM 0 HE2 PHE B 440 16.905 18.578 -0.242 1.00 0.00 H new ATOM 0 HZ PHE B 440 15.513 17.168 -1.705 1.00 0.00 H new ATOM 2230 N TYR B 441 11.549 17.719 2.529 1.00 0.00 N ATOM 2231 CA TYR B 441 10.589 17.839 1.450 1.00 0.00 C ATOM 2232 C TYR B 441 9.607 18.957 1.730 1.00 0.00 C ATOM 2233 O TYR B 441 9.348 19.788 0.862 1.00 0.00 O ATOM 2234 CB TYR B 441 9.859 16.519 1.245 1.00 0.00 C ATOM 2235 CG TYR B 441 10.702 15.521 0.506 1.00 0.00 C ATOM 2236 CD1 TYR B 441 10.941 15.670 -0.849 1.00 0.00 C ATOM 2237 CD2 TYR B 441 11.281 14.448 1.165 1.00 0.00 C ATOM 2238 CE1 TYR B 441 11.730 14.775 -1.534 1.00 0.00 C ATOM 2239 CE2 TYR B 441 12.076 13.547 0.490 1.00 0.00 C ATOM 2240 CZ TYR B 441 12.299 13.713 -0.861 1.00 0.00 C ATOM 2241 OH TYR B 441 13.091 12.816 -1.541 1.00 0.00 O ATOM 0 H TYR B 441 11.461 16.864 3.078 1.00 0.00 H new ATOM 0 HA TYR B 441 11.126 18.083 0.533 1.00 0.00 H new ATOM 0 HB2 TYR B 441 9.575 16.107 2.213 1.00 0.00 H new ATOM 0 HB3 TYR B 441 8.937 16.696 0.691 1.00 0.00 H new ATOM 0 HD1 TYR B 441 10.501 16.503 -1.377 1.00 0.00 H new ATOM 0 HD2 TYR B 441 11.107 14.316 2.223 1.00 0.00 H new ATOM 0 HE1 TYR B 441 11.903 14.903 -2.592 1.00 0.00 H new ATOM 0 HE2 TYR B 441 12.522 12.716 1.016 1.00 0.00 H new ATOM 0 HH TYR B 441 12.623 12.512 -2.346 1.00 0.00 H new ATOM 2251 N ALA B 442 9.074 19.004 2.947 1.00 0.00 N ATOM 2252 CA ALA B 442 8.144 20.066 3.299 1.00 0.00 C ATOM 2253 C ALA B 442 8.666 21.390 2.757 1.00 0.00 C ATOM 2254 O ALA B 442 8.022 22.031 1.926 1.00 0.00 O ATOM 2255 CB ALA B 442 7.945 20.145 4.805 1.00 0.00 C ATOM 0 H ALA B 442 9.266 18.333 3.691 1.00 0.00 H new ATOM 0 HA ALA B 442 7.174 19.848 2.852 1.00 0.00 H new ATOM 0 HB1 ALA B 442 7.245 20.948 5.038 1.00 0.00 H new ATOM 0 HB2 ALA B 442 7.546 19.198 5.169 1.00 0.00 H new ATOM 0 HB3 ALA B 442 8.901 20.346 5.288 1.00 0.00 H new ATOM 2261 N LYS B 443 9.851 21.782 3.220 1.00 0.00 N ATOM 2262 CA LYS B 443 10.475 23.016 2.766 1.00 0.00 C ATOM 2263 C LYS B 443 10.490 23.058 1.243 1.00 0.00 C ATOM 2264 O LYS B 443 10.171 24.081 0.637 1.00 0.00 O ATOM 2265 CB LYS B 443 11.902 23.127 3.308 1.00 0.00 C ATOM 2266 CG LYS B 443 12.714 24.236 2.659 1.00 0.00 C ATOM 2267 CD LYS B 443 13.389 23.760 1.383 1.00 0.00 C ATOM 2268 CE LYS B 443 14.829 24.243 1.300 1.00 0.00 C ATOM 2269 NZ LYS B 443 15.230 24.560 -0.099 1.00 0.00 N ATOM 0 H LYS B 443 10.395 21.262 3.908 1.00 0.00 H new ATOM 0 HA LYS B 443 9.896 23.859 3.142 1.00 0.00 H new ATOM 0 HB2 LYS B 443 11.861 23.300 4.383 1.00 0.00 H new ATOM 0 HB3 LYS B 443 12.414 22.177 3.157 1.00 0.00 H new ATOM 0 HG2 LYS B 443 12.063 25.081 2.434 1.00 0.00 H new ATOM 0 HG3 LYS B 443 13.469 24.593 3.360 1.00 0.00 H new ATOM 0 HD2 LYS B 443 13.367 22.671 1.343 1.00 0.00 H new ATOM 0 HD3 LYS B 443 12.832 24.122 0.519 1.00 0.00 H new ATOM 0 HE2 LYS B 443 14.951 25.130 1.922 1.00 0.00 H new ATOM 0 HE3 LYS B 443 15.492 23.478 1.703 1.00 0.00 H new ATOM 0 HZ1 LYS B 443 16.218 24.885 -0.112 1.00 0.00 H new ATOM 0 HZ2 LYS B 443 15.139 23.708 -0.688 1.00 0.00 H new ATOM 0 HZ3 LYS B 443 14.614 25.309 -0.476 1.00 0.00 H new ATOM 2283 N GLN B 444 10.852 21.932 0.630 1.00 0.00 N ATOM 2284 CA GLN B 444 10.891 21.840 -0.821 1.00 0.00 C ATOM 2285 C GLN B 444 9.539 22.230 -1.406 1.00 0.00 C ATOM 2286 O GLN B 444 9.449 23.125 -2.246 1.00 0.00 O ATOM 2287 CB GLN B 444 11.258 20.417 -1.259 1.00 0.00 C ATOM 2288 CG GLN B 444 12.732 20.242 -1.580 1.00 0.00 C ATOM 2289 CD GLN B 444 12.954 19.600 -2.934 1.00 0.00 C ATOM 2290 OE1 GLN B 444 13.945 19.876 -3.610 1.00 0.00 O ATOM 2291 NE2 GLN B 444 12.030 18.736 -3.335 1.00 0.00 N ATOM 0 H GLN B 444 11.121 21.077 1.116 1.00 0.00 H new ATOM 0 HA GLN B 444 11.652 22.527 -1.191 1.00 0.00 H new ATOM 0 HB2 GLN B 444 10.981 19.720 -0.468 1.00 0.00 H new ATOM 0 HB3 GLN B 444 10.669 20.153 -2.137 1.00 0.00 H new ATOM 0 HG2 GLN B 444 13.224 21.214 -1.556 1.00 0.00 H new ATOM 0 HG3 GLN B 444 13.199 19.629 -0.809 1.00 0.00 H new ATOM 0 HE21 GLN B 444 11.225 18.538 -2.741 1.00 0.00 H new ATOM 0 HE22 GLN B 444 12.125 18.270 -4.237 1.00 0.00 H new ATOM 2300 N ARG B 445 8.494 21.548 -0.949 1.00 0.00 N ATOM 2301 CA ARG B 445 7.134 21.800 -1.411 1.00 0.00 C ATOM 2302 C ARG B 445 6.784 23.283 -1.341 1.00 0.00 C ATOM 2303 O ARG B 445 6.153 23.823 -2.247 1.00 0.00 O ATOM 2304 CB ARG B 445 6.137 20.996 -0.575 1.00 0.00 C ATOM 2305 CG ARG B 445 5.492 19.849 -1.333 1.00 0.00 C ATOM 2306 CD ARG B 445 4.372 20.340 -2.236 1.00 0.00 C ATOM 2307 NE ARG B 445 3.060 20.193 -1.614 1.00 0.00 N ATOM 2308 CZ ARG B 445 1.921 20.190 -2.298 1.00 0.00 C ATOM 2309 NH1 ARG B 445 1.937 20.326 -3.616 1.00 0.00 N ATOM 2310 NH2 ARG B 445 0.764 20.052 -1.664 1.00 0.00 N ATOM 0 H ARG B 445 8.565 20.808 -0.251 1.00 0.00 H new ATOM 0 HA ARG B 445 7.075 21.486 -2.453 1.00 0.00 H new ATOM 0 HB2 ARG B 445 6.648 20.599 0.302 1.00 0.00 H new ATOM 0 HB3 ARG B 445 5.357 21.665 -0.213 1.00 0.00 H new ATOM 0 HG2 ARG B 445 6.246 19.337 -1.931 1.00 0.00 H new ATOM 0 HG3 ARG B 445 5.097 19.120 -0.625 1.00 0.00 H new ATOM 0 HD2 ARG B 445 4.540 21.388 -2.484 1.00 0.00 H new ATOM 0 HD3 ARG B 445 4.393 19.784 -3.173 1.00 0.00 H new ATOM 0 HE ARG B 445 3.015 20.087 -0.601 1.00 0.00 H new ATOM 0 HH11 ARG B 445 2.825 20.433 -4.107 1.00 0.00 H new ATOM 0 HH12 ARG B 445 1.062 20.323 -4.140 1.00 0.00 H new ATOM 0 HH21 ARG B 445 0.748 19.948 -0.649 1.00 0.00 H new ATOM 0 HH22 ARG B 445 -0.109 20.050 -2.191 1.00 0.00 H new ATOM 2324 N ALA B 446 7.188 23.941 -0.264 1.00 0.00 N ATOM 2325 CA ALA B 446 6.905 25.360 -0.102 1.00 0.00 C ATOM 2326 C ALA B 446 7.645 26.170 -1.160 1.00 0.00 C ATOM 2327 O ALA B 446 7.079 27.067 -1.785 1.00 0.00 O ATOM 2328 CB ALA B 446 7.285 25.836 1.292 1.00 0.00 C ATOM 0 H ALA B 446 7.709 23.519 0.505 1.00 0.00 H new ATOM 0 HA ALA B 446 5.833 25.510 -0.230 1.00 0.00 H new ATOM 0 HB1 ALA B 446 7.063 26.899 1.386 1.00 0.00 H new ATOM 0 HB2 ALA B 446 6.714 25.279 2.035 1.00 0.00 H new ATOM 0 HB3 ALA B 446 8.350 25.672 1.455 1.00 0.00 H new ATOM 2334 N ALA B 447 8.921 25.849 -1.339 1.00 0.00 N ATOM 2335 CA ALA B 447 9.764 26.542 -2.303 1.00 0.00 C ATOM 2336 C ALA B 447 9.433 26.138 -3.738 1.00 0.00 C ATOM 2337 O ALA B 447 8.791 26.894 -4.466 1.00 0.00 O ATOM 2338 CB ALA B 447 11.235 26.281 -2.017 1.00 0.00 C ATOM 0 H ALA B 447 9.396 25.107 -0.824 1.00 0.00 H new ATOM 0 HA ALA B 447 9.564 27.608 -2.198 1.00 0.00 H new ATOM 0 HB1 ALA B 447 11.847 26.808 -2.749 1.00 0.00 H new ATOM 0 HB2 ALA B 447 11.480 26.636 -1.016 1.00 0.00 H new ATOM 0 HB3 ALA B 447 11.434 25.211 -2.081 1.00 0.00 H new