USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 537 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: A 387 TYR OH : rot 31:sc= -4.24! USER MOD Set 1.2: A 404 CYS SG : rot -93:sc= -5.59 USER MOD Single : A 369 ASN : amide:sc= -0.85 X(o=-0.85,f=-0.86) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN : amide:sc= -3.28! C(o=-3.3!,f=-5!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 88:sc= 0.781 USER MOD Single : A 380 TYR OH : rot -152:sc= 1.47 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -0.991 K(o=-0.99,f=-0.0089) USER MOD Single : A 389 THR OG1 : rot 180:sc= 0 USER MOD Single : A 399 ASN : amide:sc= -0.438 X(o=-0.44,f=-0.058) USER MOD Single : A 400 SER OG : rot -100:sc= -1.2 USER MOD Single : A 410 THR OG1 : rot 33:sc= 0.0691 USER MOD Single : A 414 THR OG1 : rot 180:sc= -0.125 USER MOD Single : A 419 ASN : amide:sc= -4.72 K(o=-4.7,f=-21!) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -1.36 K(o=-1.4,f=-0.85) USER MOD Single : A 435 LYS NZ :NH3+ 163:sc= -0.0523 (180deg=-0.327) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl -108:sc= -0.231 (180deg=-2.32!) USER MOD Single : A 441 TYR OH : rot 30:sc= -1.68 USER MOD Single : A 443 LYS NZ :NH3+ -155:sc= -0.0621 (180deg=-0.324) USER MOD Single : A 444 GLN : amide:sc= -0.186 X(o=-0.19,f=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -3.189 -2.497 9.413 1.00 0.00 N ATOM 103 CA ASN A 369 -2.152 -1.637 9.973 1.00 0.00 C ATOM 104 C ASN A 369 -1.343 -0.932 8.887 1.00 0.00 C ATOM 105 O ASN A 369 -1.095 0.271 8.969 1.00 0.00 O ATOM 106 CB ASN A 369 -1.218 -2.453 10.869 1.00 0.00 C ATOM 107 CG ASN A 369 -0.464 -3.520 10.101 1.00 0.00 C ATOM 108 OD1 ASN A 369 0.704 -3.345 9.757 1.00 0.00 O ATOM 109 ND2 ASN A 369 -1.132 -4.636 9.829 1.00 0.00 N ATOM 0 HA ASN A 369 -2.651 -0.869 10.565 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -0.505 -1.784 11.350 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -1.799 -2.923 11.662 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -0.677 -5.391 9.315 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -2.100 -4.738 10.134 1.00 0.00 H new ATOM 116 N ALA A 370 -0.920 -1.686 7.882 1.00 0.00 N ATOM 117 CA ALA A 370 -0.122 -1.132 6.793 1.00 0.00 C ATOM 118 C ALA A 370 -0.860 -0.014 6.060 1.00 0.00 C ATOM 119 O ALA A 370 -0.262 1.001 5.700 1.00 0.00 O ATOM 120 CB ALA A 370 0.286 -2.230 5.822 1.00 0.00 C ATOM 0 H ALA A 370 -1.115 -2.683 7.797 1.00 0.00 H new ATOM 0 HA ALA A 370 0.776 -0.697 7.231 1.00 0.00 H new ATOM 0 HB1 ALA A 370 0.880 -1.800 5.016 1.00 0.00 H new ATOM 0 HB2 ALA A 370 0.876 -2.980 6.348 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.606 -2.697 5.405 1.00 0.00 H new ATOM 126 N LYS A 371 -2.155 -0.200 5.841 1.00 0.00 N ATOM 127 CA LYS A 371 -2.959 0.803 5.149 1.00 0.00 C ATOM 128 C LYS A 371 -3.114 2.053 6.005 1.00 0.00 C ATOM 129 O LYS A 371 -3.132 3.173 5.493 1.00 0.00 O ATOM 130 CB LYS A 371 -4.336 0.240 4.788 1.00 0.00 C ATOM 131 CG LYS A 371 -4.551 0.075 3.292 1.00 0.00 C ATOM 132 CD LYS A 371 -5.942 0.524 2.875 1.00 0.00 C ATOM 133 CE LYS A 371 -6.025 2.038 2.751 1.00 0.00 C ATOM 134 NZ LYS A 371 -7.430 2.525 2.816 1.00 0.00 N ATOM 0 H LYS A 371 -2.671 -1.031 6.130 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.441 1.072 4.229 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -4.463 -0.727 5.274 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.106 0.901 5.187 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -3.803 0.654 2.750 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -4.407 -0.970 3.016 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.203 0.065 1.922 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.672 0.177 3.606 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -5.444 2.500 3.549 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -5.576 2.350 1.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -7.443 3.561 2.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -7.979 2.105 2.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -7.851 2.250 3.726 1.00 0.00 H new ATOM 148 N ARG A 372 -3.219 1.856 7.314 1.00 0.00 N ATOM 149 CA ARG A 372 -3.364 2.969 8.242 1.00 0.00 C ATOM 150 C ARG A 372 -2.066 3.760 8.321 1.00 0.00 C ATOM 151 O ARG A 372 -2.077 4.978 8.498 1.00 0.00 O ATOM 152 CB ARG A 372 -3.755 2.463 9.632 1.00 0.00 C ATOM 153 CG ARG A 372 -5.152 1.866 9.691 1.00 0.00 C ATOM 154 CD ARG A 372 -5.535 1.470 11.108 1.00 0.00 C ATOM 155 NE ARG A 372 -4.449 0.778 11.800 1.00 0.00 N ATOM 156 CZ ARG A 372 -3.525 1.389 12.540 1.00 0.00 C ATOM 157 NH1 ARG A 372 -3.545 2.710 12.687 1.00 0.00 N ATOM 158 NH2 ARG A 372 -2.579 0.679 13.136 1.00 0.00 N ATOM 0 H ARG A 372 -3.206 0.937 7.756 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.155 3.622 7.875 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -3.034 1.711 9.952 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -3.691 3.288 10.341 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -5.873 2.588 9.308 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -5.202 0.991 9.043 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -5.812 2.362 11.670 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -6.414 0.826 11.079 1.00 0.00 H new ATOM 0 HE ARG A 372 -4.395 -0.237 11.711 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -4.271 3.263 12.232 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -2.834 3.171 13.255 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -2.558 -0.335 13.028 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -1.871 1.146 13.703 1.00 0.00 H new ATOM 170 N GLN A 373 -0.949 3.057 8.176 1.00 0.00 N ATOM 171 CA GLN A 373 0.358 3.691 8.218 1.00 0.00 C ATOM 172 C GLN A 373 0.550 4.585 7.000 1.00 0.00 C ATOM 173 O GLN A 373 0.933 5.747 7.126 1.00 0.00 O ATOM 174 CB GLN A 373 1.462 2.631 8.271 1.00 0.00 C ATOM 175 CG GLN A 373 2.261 2.658 9.563 1.00 0.00 C ATOM 176 CD GLN A 373 3.279 3.781 9.596 1.00 0.00 C ATOM 177 OE1 GLN A 373 3.052 4.822 10.212 1.00 0.00 O ATOM 178 NE2 GLN A 373 4.409 3.575 8.930 1.00 0.00 N ATOM 0 H GLN A 373 -0.925 2.048 8.028 1.00 0.00 H new ATOM 0 HA GLN A 373 0.417 4.304 9.117 1.00 0.00 H new ATOM 0 HB2 GLN A 373 1.015 1.644 8.149 1.00 0.00 H new ATOM 0 HB3 GLN A 373 2.139 2.780 7.430 1.00 0.00 H new ATOM 0 HG2 GLN A 373 1.578 2.767 10.406 1.00 0.00 H new ATOM 0 HG3 GLN A 373 2.773 1.704 9.689 1.00 0.00 H new ATOM 0 HE21 GLN A 373 4.555 2.696 8.433 1.00 0.00 H new ATOM 0 HE22 GLN A 373 5.131 4.295 8.915 1.00 0.00 H new ATOM 187 N LEU A 374 0.277 4.033 5.823 1.00 0.00 N ATOM 188 CA LEU A 374 0.415 4.779 4.581 1.00 0.00 C ATOM 189 C LEU A 374 -0.529 5.974 4.551 1.00 0.00 C ATOM 190 O LEU A 374 -0.168 7.053 4.086 1.00 0.00 O ATOM 191 CB LEU A 374 0.143 3.866 3.384 1.00 0.00 C ATOM 192 CG LEU A 374 1.233 3.862 2.311 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.566 3.444 2.910 1.00 0.00 C ATOM 194 CD2 LEU A 374 0.847 2.939 1.166 1.00 0.00 C ATOM 0 H LEU A 374 -0.041 3.071 5.704 1.00 0.00 H new ATOM 0 HA LEU A 374 1.438 5.151 4.522 1.00 0.00 H new ATOM 0 HB2 LEU A 374 0.008 2.847 3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.798 4.167 2.923 1.00 0.00 H new ATOM 0 HG LEU A 374 1.336 4.873 1.917 1.00 0.00 H new ATOM 0 HD11 LEU A 374 3.331 3.446 2.133 1.00 0.00 H new ATOM 0 HD12 LEU A 374 2.846 4.144 3.697 1.00 0.00 H new ATOM 0 HD13 LEU A 374 2.478 2.442 3.330 1.00 0.00 H new ATOM 0 HD21 LEU A 374 1.633 2.948 0.411 1.00 0.00 H new ATOM 0 HD22 LEU A 374 0.718 1.925 1.544 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -0.087 3.282 0.721 1.00 0.00 H new ATOM 206 N TYR A 375 -1.742 5.774 5.048 1.00 0.00 N ATOM 207 CA TYR A 375 -2.736 6.839 5.073 1.00 0.00 C ATOM 208 C TYR A 375 -2.410 7.866 6.151 1.00 0.00 C ATOM 209 O TYR A 375 -2.776 9.037 6.038 1.00 0.00 O ATOM 210 CB TYR A 375 -4.134 6.260 5.302 1.00 0.00 C ATOM 211 CG TYR A 375 -5.159 6.731 4.296 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.422 8.085 4.126 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.864 5.822 3.515 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.359 8.519 3.208 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.801 6.249 2.595 1.00 0.00 C ATOM 216 CZ TYR A 375 -7.045 7.598 2.444 1.00 0.00 C ATOM 217 OH TYR A 375 -7.979 8.027 1.529 1.00 0.00 O ATOM 0 H TYR A 375 -2.061 4.887 5.438 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.716 7.341 4.106 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.077 5.172 5.267 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.470 6.530 6.303 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.886 8.809 4.721 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.676 4.765 3.630 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -6.553 9.575 3.089 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.340 5.530 1.996 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.370 7.253 1.073 1.00 0.00 H new ATOM 227 N SER A 376 -1.722 7.422 7.195 1.00 0.00 N ATOM 228 CA SER A 376 -1.348 8.306 8.290 1.00 0.00 C ATOM 229 C SER A 376 0.019 8.945 8.046 1.00 0.00 C ATOM 230 O SER A 376 0.426 9.847 8.779 1.00 0.00 O ATOM 231 CB SER A 376 -1.334 7.533 9.610 1.00 0.00 C ATOM 232 OG SER A 376 -2.645 7.169 10.003 1.00 0.00 O ATOM 0 H SER A 376 -1.412 6.457 7.306 1.00 0.00 H new ATOM 0 HA SER A 376 -2.090 9.103 8.346 1.00 0.00 H new ATOM 0 HB2 SER A 376 -0.721 6.638 9.504 1.00 0.00 H new ATOM 0 HB3 SER A 376 -0.875 8.143 10.387 1.00 0.00 H new ATOM 0 HG SER A 376 -2.880 6.308 9.599 1.00 0.00 H new ATOM 238 N LEU A 377 0.730 8.474 7.023 1.00 0.00 N ATOM 239 CA LEU A 377 2.050 9.008 6.712 1.00 0.00 C ATOM 240 C LEU A 377 2.083 9.700 5.350 1.00 0.00 C ATOM 241 O LEU A 377 2.927 10.566 5.117 1.00 0.00 O ATOM 242 CB LEU A 377 3.101 7.896 6.752 1.00 0.00 C ATOM 243 CG LEU A 377 3.861 7.776 8.075 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.906 7.434 9.208 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.960 6.731 7.966 1.00 0.00 C ATOM 0 H LEU A 377 0.415 7.729 6.401 1.00 0.00 H new ATOM 0 HA LEU A 377 2.280 9.754 7.472 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.611 6.945 6.544 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.820 8.066 5.951 1.00 0.00 H new ATOM 0 HG LEU A 377 4.324 8.738 8.295 1.00 0.00 H new ATOM 0 HD11 LEU A 377 3.463 7.352 10.141 1.00 0.00 H new ATOM 0 HD12 LEU A 377 2.156 8.219 9.301 1.00 0.00 H new ATOM 0 HD13 LEU A 377 2.414 6.485 8.995 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.490 6.660 8.916 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.520 5.764 7.722 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.660 7.019 7.181 1.00 0.00 H new ATOM 257 N ILE A 378 1.181 9.323 4.444 1.00 0.00 N ATOM 258 CA ILE A 378 1.163 9.936 3.119 1.00 0.00 C ATOM 259 C ILE A 378 -0.253 10.214 2.617 1.00 0.00 C ATOM 260 O ILE A 378 -0.475 11.180 1.887 1.00 0.00 O ATOM 261 CB ILE A 378 1.922 9.072 2.088 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.197 7.748 1.834 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.342 8.812 2.566 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.553 7.114 0.509 1.00 0.00 C ATOM 0 H ILE A 378 0.467 8.611 4.599 1.00 0.00 H new ATOM 0 HA ILE A 378 1.671 10.894 3.225 1.00 0.00 H new ATOM 0 HB ILE A 378 1.958 9.621 1.147 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.436 7.051 2.638 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.121 7.919 1.869 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.867 8.202 1.831 1.00 0.00 H new ATOM 0 HG22 ILE A 378 3.864 9.761 2.690 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.314 8.286 3.520 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.004 6.179 0.394 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.289 7.793 -0.302 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.624 6.912 0.478 1.00 0.00 H new ATOM 276 N GLY A 379 -1.208 9.376 3.005 1.00 0.00 N ATOM 277 CA GLY A 379 -2.579 9.573 2.570 1.00 0.00 C ATOM 278 C GLY A 379 -3.237 10.761 3.246 1.00 0.00 C ATOM 279 O GLY A 379 -3.688 10.663 4.386 1.00 0.00 O ATOM 0 H GLY A 379 -1.059 8.568 3.610 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.597 9.718 1.490 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.157 8.673 2.781 1.00 0.00 H new ATOM 283 N TYR A 380 -3.296 11.888 2.540 1.00 0.00 N ATOM 284 CA TYR A 380 -3.908 13.096 3.082 1.00 0.00 C ATOM 285 C TYR A 380 -5.303 13.308 2.502 1.00 0.00 C ATOM 286 O TYR A 380 -6.242 13.640 3.227 1.00 0.00 O ATOM 287 CB TYR A 380 -3.036 14.330 2.815 1.00 0.00 C ATOM 288 CG TYR A 380 -2.164 14.227 1.582 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.706 14.370 0.310 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.799 13.990 1.691 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.911 14.281 -0.817 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.000 13.898 0.570 1.00 0.00 C ATOM 293 CZ TYR A 380 -0.559 14.045 -0.682 1.00 0.00 C ATOM 294 OH TYR A 380 0.235 13.954 -1.803 1.00 0.00 O ATOM 0 H TYR A 380 -2.928 11.989 1.594 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.994 12.962 4.160 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.683 15.202 2.715 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.399 14.503 3.682 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.765 14.553 0.201 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -0.356 13.876 2.669 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -2.346 14.396 -1.799 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.059 13.712 0.673 1.00 0.00 H new ATOM 0 HH TYR A 380 1.002 13.374 -1.614 1.00 0.00 H new ATOM 304 N ALA A 381 -5.435 13.117 1.193 1.00 0.00 N ATOM 305 CA ALA A 381 -6.720 13.288 0.521 1.00 0.00 C ATOM 306 C ALA A 381 -6.598 13.045 -0.979 1.00 0.00 C ATOM 307 O ALA A 381 -7.107 12.054 -1.501 1.00 0.00 O ATOM 308 CB ALA A 381 -7.277 14.681 0.786 1.00 0.00 C ATOM 0 H ALA A 381 -4.669 12.844 0.577 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.410 12.548 0.927 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -8.235 14.792 0.278 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -7.416 14.819 1.858 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -6.579 15.429 0.411 1.00 0.00 H new ATOM 314 N SER A 382 -5.918 13.958 -1.668 1.00 0.00 N ATOM 315 CA SER A 382 -5.729 13.845 -3.112 1.00 0.00 C ATOM 316 C SER A 382 -5.154 12.482 -3.486 1.00 0.00 C ATOM 317 O SER A 382 -5.421 11.960 -4.568 1.00 0.00 O ATOM 318 CB SER A 382 -4.805 14.954 -3.614 1.00 0.00 C ATOM 319 OG SER A 382 -4.927 15.127 -5.015 1.00 0.00 O ATOM 0 H SER A 382 -5.489 14.784 -1.250 1.00 0.00 H new ATOM 0 HA SER A 382 -6.705 13.948 -3.587 1.00 0.00 H new ATOM 0 HB2 SER A 382 -5.045 15.889 -3.107 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.772 14.712 -3.363 1.00 0.00 H new ATOM 0 HG SER A 382 -4.326 15.843 -5.310 1.00 0.00 H new ATOM 325 N LEU A 383 -4.364 11.912 -2.583 1.00 0.00 N ATOM 326 CA LEU A 383 -3.753 10.610 -2.818 1.00 0.00 C ATOM 327 C LEU A 383 -4.659 9.487 -2.324 1.00 0.00 C ATOM 328 O LEU A 383 -4.456 8.944 -1.239 1.00 0.00 O ATOM 329 CB LEU A 383 -2.394 10.529 -2.120 1.00 0.00 C ATOM 330 CG LEU A 383 -1.404 9.545 -2.745 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.719 10.169 -3.951 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.376 9.099 -1.716 1.00 0.00 C ATOM 0 H LEU A 383 -4.132 12.331 -1.682 1.00 0.00 H new ATOM 0 HA LEU A 383 -3.610 10.491 -3.892 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.944 11.522 -2.118 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.553 10.249 -1.079 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.956 8.668 -3.082 1.00 0.00 H new ATOM 0 HD11 LEU A 383 -0.018 9.454 -4.382 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -1.468 10.438 -4.696 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -0.179 11.063 -3.640 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.321 8.399 -2.177 1.00 0.00 H new ATOM 0 HD22 LEU A 383 0.172 9.967 -1.349 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.883 8.611 -0.883 1.00 0.00 H new ATOM 344 N ARG A 384 -5.660 9.147 -3.129 1.00 0.00 N ATOM 345 CA ARG A 384 -6.600 8.090 -2.776 1.00 0.00 C ATOM 346 C ARG A 384 -5.894 6.740 -2.692 1.00 0.00 C ATOM 347 O ARG A 384 -5.943 5.943 -3.629 1.00 0.00 O ATOM 348 CB ARG A 384 -7.734 8.024 -3.801 1.00 0.00 C ATOM 349 CG ARG A 384 -9.089 7.706 -3.190 1.00 0.00 C ATOM 350 CD ARG A 384 -10.140 7.461 -4.262 1.00 0.00 C ATOM 351 NE ARG A 384 -10.481 6.046 -4.380 1.00 0.00 N ATOM 352 CZ ARG A 384 -11.198 5.538 -5.380 1.00 0.00 C ATOM 353 NH1 ARG A 384 -11.648 6.323 -6.350 1.00 0.00 N ATOM 354 NH2 ARG A 384 -11.464 4.239 -5.411 1.00 0.00 N ATOM 0 H ARG A 384 -5.841 9.588 -4.031 1.00 0.00 H new ATOM 0 HA ARG A 384 -7.019 8.322 -1.797 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -7.796 8.978 -4.324 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -7.494 7.266 -4.547 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -9.005 6.825 -2.554 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -9.404 8.531 -2.552 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -11.038 8.032 -4.026 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -9.772 7.827 -5.221 1.00 0.00 H new ATOM 0 HE ARG A 384 -10.151 5.410 -3.654 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -11.445 7.322 -6.333 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -12.197 5.927 -7.113 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -11.119 3.630 -4.669 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -12.013 3.849 -6.177 1.00 0.00 H new ATOM 366 N LEU A 385 -5.239 6.491 -1.563 1.00 0.00 N ATOM 367 CA LEU A 385 -4.523 5.237 -1.353 1.00 0.00 C ATOM 368 C LEU A 385 -5.447 4.040 -1.565 1.00 0.00 C ATOM 369 O LEU A 385 -6.389 3.828 -0.801 1.00 0.00 O ATOM 370 CB LEU A 385 -3.925 5.195 0.058 1.00 0.00 C ATOM 371 CG LEU A 385 -3.295 3.858 0.455 1.00 0.00 C ATOM 372 CD1 LEU A 385 -2.003 3.629 -0.312 1.00 0.00 C ATOM 373 CD2 LEU A 385 -3.044 3.814 1.955 1.00 0.00 C ATOM 0 H LEU A 385 -5.189 7.141 -0.779 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.715 5.182 -2.083 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -3.167 5.974 0.138 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.709 5.437 0.776 1.00 0.00 H new ATOM 0 HG LEU A 385 -3.990 3.058 0.199 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.569 2.674 -0.017 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -2.212 3.618 -1.382 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.300 4.431 -0.088 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -2.596 2.857 2.221 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.367 4.622 2.235 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -3.989 3.932 2.486 1.00 0.00 H new ATOM 385 N HIS A 386 -5.169 3.259 -2.605 1.00 0.00 N ATOM 386 CA HIS A 386 -5.973 2.086 -2.915 1.00 0.00 C ATOM 387 C HIS A 386 -5.086 0.898 -3.271 1.00 0.00 C ATOM 388 O HIS A 386 -3.976 1.069 -3.777 1.00 0.00 O ATOM 389 CB HIS A 386 -6.932 2.386 -4.068 1.00 0.00 C ATOM 390 CG HIS A 386 -8.038 1.385 -4.202 1.00 0.00 C ATOM 391 ND1 HIS A 386 -9.276 1.550 -3.617 1.00 0.00 N ATOM 392 CD2 HIS A 386 -8.088 0.200 -4.856 1.00 0.00 C ATOM 393 CE1 HIS A 386 -10.039 0.510 -3.905 1.00 0.00 C ATOM 394 NE2 HIS A 386 -9.342 -0.322 -4.655 1.00 0.00 N ATOM 0 H HIS A 386 -4.392 3.419 -3.246 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.554 1.831 -2.028 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.364 3.376 -3.922 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -6.368 2.419 -5.000 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -7.291 -0.250 -5.429 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -11.059 0.366 -3.581 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -9.680 -1.210 -5.026 1.00 0.00 H new ATOM 403 N TYR A 387 -5.579 -0.307 -3.000 1.00 0.00 N ATOM 404 CA TYR A 387 -4.828 -1.521 -3.287 1.00 0.00 C ATOM 405 C TYR A 387 -5.556 -2.394 -4.300 1.00 0.00 C ATOM 406 O TYR A 387 -6.708 -2.776 -4.095 1.00 0.00 O ATOM 407 CB TYR A 387 -4.575 -2.303 -2.001 1.00 0.00 C ATOM 408 CG TYR A 387 -3.480 -1.703 -1.156 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.670 -0.496 -0.498 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.252 -2.337 -1.026 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.667 0.066 0.265 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.244 -1.784 -0.262 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.456 -0.581 0.381 1.00 0.00 C ATOM 414 OH TYR A 387 -0.454 -0.022 1.139 1.00 0.00 O ATOM 0 H TYR A 387 -6.496 -0.467 -2.582 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.871 -1.230 -3.720 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.496 -2.343 -1.419 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.312 -3.330 -2.252 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.619 0.012 -0.585 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.083 -3.277 -1.530 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.830 1.007 0.768 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.294 -2.290 -0.168 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.848 0.492 1.875 1.00 0.00 H new ATOM 424 N VAL A 388 -4.874 -2.701 -5.397 1.00 0.00 N ATOM 425 CA VAL A 388 -5.446 -3.523 -6.450 1.00 0.00 C ATOM 426 C VAL A 388 -4.554 -4.723 -6.758 1.00 0.00 C ATOM 427 O VAL A 388 -3.358 -4.572 -7.010 1.00 0.00 O ATOM 428 CB VAL A 388 -5.649 -2.699 -7.735 1.00 0.00 C ATOM 429 CG1 VAL A 388 -6.227 -3.559 -8.853 1.00 0.00 C ATOM 430 CG2 VAL A 388 -6.543 -1.498 -7.460 1.00 0.00 C ATOM 0 H VAL A 388 -3.920 -2.390 -5.578 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.412 -3.882 -6.094 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.675 -2.337 -8.064 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -6.360 -2.951 -9.748 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.544 -4.380 -9.070 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -7.191 -3.961 -8.541 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -6.677 -0.926 -8.378 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -7.514 -1.841 -7.102 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -6.080 -0.865 -6.703 1.00 0.00 H new ATOM 440 N THR A 389 -5.145 -5.914 -6.744 1.00 0.00 N ATOM 441 CA THR A 389 -4.404 -7.137 -7.030 1.00 0.00 C ATOM 442 C THR A 389 -4.147 -7.269 -8.527 1.00 0.00 C ATOM 443 O THR A 389 -4.912 -6.756 -9.344 1.00 0.00 O ATOM 444 CB THR A 389 -5.173 -8.358 -6.522 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.260 -8.657 -7.378 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.724 -8.179 -5.124 1.00 0.00 C ATOM 0 H THR A 389 -6.134 -6.058 -6.538 1.00 0.00 H new ATOM 0 HA THR A 389 -3.445 -7.085 -6.514 1.00 0.00 H new ATOM 0 HB THR A 389 -4.447 -9.171 -6.507 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.738 -9.442 -7.037 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.258 -9.081 -4.825 1.00 0.00 H new ATOM 0 HG22 THR A 389 -4.903 -7.996 -4.430 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.408 -7.331 -5.108 1.00 0.00 H new ATOM 594 N ASN A 399 1.374 -16.689 -6.695 1.00 0.00 N ATOM 595 CA ASN A 399 0.904 -16.191 -5.406 1.00 0.00 C ATOM 596 C ASN A 399 -0.041 -15.009 -5.598 1.00 0.00 C ATOM 597 O ASN A 399 -0.493 -14.737 -6.710 1.00 0.00 O ATOM 598 CB ASN A 399 2.086 -15.773 -4.527 1.00 0.00 C ATOM 599 CG ASN A 399 3.193 -16.807 -4.511 1.00 0.00 C ATOM 600 OD1 ASN A 399 3.329 -17.574 -3.558 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.993 -16.830 -5.569 1.00 0.00 N ATOM 0 HA ASN A 399 0.363 -16.997 -4.910 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.485 -14.825 -4.887 1.00 0.00 H new ATOM 0 HB3 ASN A 399 1.736 -15.605 -3.509 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.758 -17.503 -5.615 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.843 -16.175 -6.336 1.00 0.00 H new ATOM 608 N SER A 400 -0.329 -14.305 -4.509 1.00 0.00 N ATOM 609 CA SER A 400 -1.210 -13.148 -4.562 1.00 0.00 C ATOM 610 C SER A 400 -0.392 -11.869 -4.657 1.00 0.00 C ATOM 611 O SER A 400 0.063 -11.336 -3.645 1.00 0.00 O ATOM 612 CB SER A 400 -2.111 -13.103 -3.326 1.00 0.00 C ATOM 613 OG SER A 400 -2.637 -14.386 -3.028 1.00 0.00 O ATOM 0 H SER A 400 0.035 -14.516 -3.580 1.00 0.00 H new ATOM 0 HA SER A 400 -1.839 -13.233 -5.448 1.00 0.00 H new ATOM 0 HB2 SER A 400 -1.544 -12.732 -2.472 1.00 0.00 H new ATOM 0 HB3 SER A 400 -2.929 -12.402 -3.494 1.00 0.00 H new ATOM 0 HG SER A 400 -3.556 -14.448 -3.362 1.00 0.00 H new ATOM 619 N ILE A 401 -0.199 -11.384 -5.878 1.00 0.00 N ATOM 620 CA ILE A 401 0.573 -10.173 -6.096 1.00 0.00 C ATOM 621 C ILE A 401 -0.335 -8.947 -6.114 1.00 0.00 C ATOM 622 O ILE A 401 -1.295 -8.884 -6.883 1.00 0.00 O ATOM 623 CB ILE A 401 1.392 -10.259 -7.407 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.639 -9.381 -7.314 1.00 0.00 C ATOM 625 CG2 ILE A 401 0.552 -9.870 -8.616 1.00 0.00 C ATOM 626 CD1 ILE A 401 2.333 -7.920 -7.062 1.00 0.00 C ATOM 0 H ILE A 401 -0.566 -11.811 -6.728 1.00 0.00 H new ATOM 0 HA ILE A 401 1.273 -10.073 -5.266 1.00 0.00 H new ATOM 0 HB ILE A 401 1.702 -11.296 -7.540 1.00 0.00 H new ATOM 0 HG12 ILE A 401 3.277 -9.754 -6.512 1.00 0.00 H new ATOM 0 HG13 ILE A 401 3.206 -9.470 -8.240 1.00 0.00 H new ATOM 0 HG21 ILE A 401 1.159 -9.942 -9.519 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -0.301 -10.543 -8.698 1.00 0.00 H new ATOM 0 HG23 ILE A 401 0.197 -8.846 -8.498 1.00 0.00 H new ATOM 0 HD11 ILE A 401 3.265 -7.357 -7.008 1.00 0.00 H new ATOM 0 HD12 ILE A 401 1.721 -7.531 -7.876 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.793 -7.819 -6.121 1.00 0.00 H new ATOM 638 N VAL A 402 -0.031 -7.980 -5.258 1.00 0.00 N ATOM 639 CA VAL A 402 -0.823 -6.765 -5.174 1.00 0.00 C ATOM 640 C VAL A 402 0.065 -5.530 -5.171 1.00 0.00 C ATOM 641 O VAL A 402 1.246 -5.598 -4.829 1.00 0.00 O ATOM 642 CB VAL A 402 -1.706 -6.753 -3.913 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.637 -5.550 -3.921 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.498 -8.048 -3.805 1.00 0.00 C ATOM 0 H VAL A 402 0.759 -8.016 -4.613 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.464 -6.746 -6.055 1.00 0.00 H new ATOM 0 HB VAL A 402 -1.058 -6.674 -3.040 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -3.252 -5.560 -3.021 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -2.047 -4.634 -3.947 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.279 -5.593 -4.801 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -3.117 -8.022 -2.908 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.135 -8.159 -4.682 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.810 -8.891 -3.747 1.00 0.00 H new ATOM 654 N GLU A 403 -0.516 -4.404 -5.555 1.00 0.00 N ATOM 655 CA GLU A 403 0.209 -3.145 -5.601 1.00 0.00 C ATOM 656 C GLU A 403 -0.666 -2.008 -5.092 1.00 0.00 C ATOM 657 O GLU A 403 -1.878 -2.000 -5.310 1.00 0.00 O ATOM 658 CB GLU A 403 0.675 -2.850 -7.028 1.00 0.00 C ATOM 659 CG GLU A 403 1.397 -4.015 -7.686 1.00 0.00 C ATOM 660 CD GLU A 403 1.479 -3.874 -9.192 1.00 0.00 C ATOM 661 OE1 GLU A 403 0.649 -3.138 -9.766 1.00 0.00 O ATOM 662 OE2 GLU A 403 2.376 -4.498 -9.799 1.00 0.00 O ATOM 0 H GLU A 403 -1.493 -4.337 -5.841 1.00 0.00 H new ATOM 0 HA GLU A 403 1.084 -3.229 -4.956 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.189 -2.580 -7.635 1.00 0.00 H new ATOM 0 HB3 GLU A 403 1.337 -1.985 -7.013 1.00 0.00 H new ATOM 0 HG2 GLU A 403 2.404 -4.091 -7.277 1.00 0.00 H new ATOM 0 HG3 GLU A 403 0.882 -4.943 -7.439 1.00 0.00 H new ATOM 669 N CYS A 404 -0.048 -1.049 -4.417 1.00 0.00 N ATOM 670 CA CYS A 404 -0.774 0.093 -3.885 1.00 0.00 C ATOM 671 C CYS A 404 -0.737 1.246 -4.879 1.00 0.00 C ATOM 672 O CYS A 404 0.324 1.804 -5.155 1.00 0.00 O ATOM 673 CB CYS A 404 -0.194 0.545 -2.535 1.00 0.00 C ATOM 674 SG CYS A 404 1.163 -0.460 -1.884 1.00 0.00 S ATOM 0 H CYS A 404 0.954 -1.040 -4.225 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.808 -0.212 -3.724 1.00 0.00 H new ATOM 0 HB2 CYS A 404 0.156 1.572 -2.637 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -0.999 0.554 -1.800 1.00 0.00 H new ATOM 0 HG CYS A 404 0.685 -1.375 -1.093 1.00 0.00 H new ATOM 680 N ARG A 405 -1.900 1.599 -5.417 1.00 0.00 N ATOM 681 CA ARG A 405 -1.994 2.683 -6.381 1.00 0.00 C ATOM 682 C ARG A 405 -2.635 3.909 -5.754 1.00 0.00 C ATOM 683 O ARG A 405 -3.590 3.800 -4.985 1.00 0.00 O ATOM 684 CB ARG A 405 -2.799 2.242 -7.605 1.00 0.00 C ATOM 685 CG ARG A 405 -2.204 1.045 -8.326 1.00 0.00 C ATOM 686 CD ARG A 405 -3.286 0.160 -8.925 1.00 0.00 C ATOM 687 NE ARG A 405 -2.749 -0.765 -9.921 1.00 0.00 N ATOM 688 CZ ARG A 405 -2.362 -0.398 -11.140 1.00 0.00 C ATOM 689 NH1 ARG A 405 -2.450 0.871 -11.518 1.00 0.00 N ATOM 690 NH2 ARG A 405 -1.883 -1.302 -11.984 1.00 0.00 N ATOM 0 H ARG A 405 -2.789 1.148 -5.200 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.983 2.942 -6.697 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.815 1.999 -7.293 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.870 3.077 -8.302 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -1.536 1.390 -9.116 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -1.601 0.463 -7.630 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -3.773 -0.406 -8.130 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -4.051 0.785 -9.386 1.00 0.00 H new ATOM 0 HE ARG A 405 -2.666 -1.749 -9.667 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -2.816 1.571 -10.873 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -2.152 1.146 -12.454 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -1.811 -2.279 -11.699 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -1.586 -1.021 -12.918 1.00 0.00 H new ATOM 702 N VAL A 406 -2.104 5.078 -6.085 1.00 0.00 N ATOM 703 CA VAL A 406 -2.627 6.326 -5.549 1.00 0.00 C ATOM 704 C VAL A 406 -3.705 6.905 -6.458 1.00 0.00 C ATOM 705 O VAL A 406 -3.834 6.509 -7.616 1.00 0.00 O ATOM 706 CB VAL A 406 -1.510 7.370 -5.360 1.00 0.00 C ATOM 707 CG1 VAL A 406 -0.524 6.911 -4.297 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.799 7.637 -6.677 1.00 0.00 C ATOM 0 H VAL A 406 -1.314 5.188 -6.720 1.00 0.00 H new ATOM 0 HA VAL A 406 -3.063 6.095 -4.577 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.963 8.302 -5.024 1.00 0.00 H new ATOM 0 HG11 VAL A 406 0.258 7.661 -4.178 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -1.046 6.777 -3.350 1.00 0.00 H new ATOM 0 HG13 VAL A 406 -0.076 5.965 -4.601 1.00 0.00 H new ATOM 0 HG21 VAL A 406 -0.014 8.377 -6.523 1.00 0.00 H new ATOM 0 HG22 VAL A 406 -0.358 6.711 -7.047 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -1.515 8.015 -7.407 1.00 0.00 H new ATOM 744 N THR A 410 -0.624 6.089 -9.776 1.00 0.00 N ATOM 745 CA THR A 410 0.748 5.605 -9.686 1.00 0.00 C ATOM 746 C THR A 410 0.910 4.648 -8.509 1.00 0.00 C ATOM 747 O THR A 410 0.343 4.863 -7.437 1.00 0.00 O ATOM 748 CB THR A 410 1.715 6.781 -9.540 1.00 0.00 C ATOM 749 OG1 THR A 410 1.609 7.657 -10.648 1.00 0.00 O ATOM 750 CG2 THR A 410 3.164 6.358 -9.428 1.00 0.00 C ATOM 0 HA THR A 410 0.979 5.065 -10.604 1.00 0.00 H new ATOM 0 HB THR A 410 1.426 7.277 -8.613 1.00 0.00 H new ATOM 0 HG1 THR A 410 0.685 7.661 -10.974 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.794 7.242 -9.327 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.290 5.720 -8.553 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.452 5.807 -10.323 1.00 0.00 H new ATOM 758 N VAL A 411 1.691 3.591 -8.715 1.00 0.00 N ATOM 759 CA VAL A 411 1.929 2.603 -7.671 1.00 0.00 C ATOM 760 C VAL A 411 3.082 3.024 -6.769 1.00 0.00 C ATOM 761 O VAL A 411 4.209 3.211 -7.228 1.00 0.00 O ATOM 762 CB VAL A 411 2.235 1.215 -8.269 1.00 0.00 C ATOM 763 CG1 VAL A 411 2.404 0.181 -7.166 1.00 0.00 C ATOM 764 CG2 VAL A 411 1.139 0.797 -9.236 1.00 0.00 C ATOM 0 H VAL A 411 2.169 3.398 -9.595 1.00 0.00 H new ATOM 0 HA VAL A 411 1.015 2.540 -7.080 1.00 0.00 H new ATOM 0 HB VAL A 411 3.172 1.278 -8.822 1.00 0.00 H new ATOM 0 HG11 VAL A 411 2.619 -0.791 -7.609 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.228 0.474 -6.516 1.00 0.00 H new ATOM 0 HG13 VAL A 411 1.486 0.118 -6.582 1.00 0.00 H new ATOM 0 HG21 VAL A 411 1.372 -0.185 -9.648 1.00 0.00 H new ATOM 0 HG22 VAL A 411 0.186 0.752 -8.709 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.072 1.524 -10.046 1.00 0.00 H new ATOM 774 N LEU A 412 2.788 3.169 -5.484 1.00 0.00 N ATOM 775 CA LEU A 412 3.793 3.565 -4.510 1.00 0.00 C ATOM 776 C LEU A 412 4.390 2.345 -3.815 1.00 0.00 C ATOM 777 O LEU A 412 5.499 2.403 -3.284 1.00 0.00 O ATOM 778 CB LEU A 412 3.181 4.510 -3.474 1.00 0.00 C ATOM 779 CG LEU A 412 4.005 5.764 -3.176 1.00 0.00 C ATOM 780 CD1 LEU A 412 3.640 6.883 -4.139 1.00 0.00 C ATOM 781 CD2 LEU A 412 3.796 6.207 -1.736 1.00 0.00 C ATOM 0 H LEU A 412 1.859 3.018 -5.092 1.00 0.00 H new ATOM 0 HA LEU A 412 4.592 4.084 -5.039 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.194 4.816 -3.822 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.035 3.960 -2.544 1.00 0.00 H new ATOM 0 HG LEU A 412 5.060 5.525 -3.313 1.00 0.00 H new ATOM 0 HD11 LEU A 412 4.236 7.767 -3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 412 3.840 6.563 -5.161 1.00 0.00 H new ATOM 0 HD13 LEU A 412 2.582 7.122 -4.035 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.389 7.100 -1.540 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.741 6.429 -1.573 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.107 5.410 -1.061 1.00 0.00 H new ATOM 793 N GLY A 413 3.647 1.240 -3.816 1.00 0.00 N ATOM 794 CA GLY A 413 4.129 0.030 -3.173 1.00 0.00 C ATOM 795 C GLY A 413 3.689 -1.237 -3.886 1.00 0.00 C ATOM 796 O GLY A 413 2.527 -1.378 -4.260 1.00 0.00 O ATOM 0 H GLY A 413 2.726 1.162 -4.248 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.218 0.057 -3.130 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.770 0.004 -2.144 1.00 0.00 H new ATOM 800 N THR A 414 4.628 -2.160 -4.074 1.00 0.00 N ATOM 801 CA THR A 414 4.345 -3.422 -4.740 1.00 0.00 C ATOM 802 C THR A 414 4.883 -4.591 -3.917 1.00 0.00 C ATOM 803 O THR A 414 6.025 -4.561 -3.458 1.00 0.00 O ATOM 804 CB THR A 414 4.979 -3.416 -6.131 1.00 0.00 C ATOM 805 OG1 THR A 414 4.302 -2.510 -6.984 1.00 0.00 O ATOM 806 CG2 THR A 414 4.981 -4.770 -6.808 1.00 0.00 C ATOM 0 H THR A 414 5.596 -2.054 -3.771 1.00 0.00 H new ATOM 0 HA THR A 414 3.266 -3.541 -4.837 1.00 0.00 H new ATOM 0 HB THR A 414 6.014 -3.115 -5.969 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.722 -2.518 -7.869 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.447 -4.685 -7.790 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.542 -5.480 -6.200 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.955 -5.121 -6.922 1.00 0.00 H new ATOM 814 N GLY A 415 4.058 -5.619 -3.729 1.00 0.00 N ATOM 815 CA GLY A 415 4.488 -6.771 -2.956 1.00 0.00 C ATOM 816 C GLY A 415 3.609 -7.989 -3.163 1.00 0.00 C ATOM 817 O GLY A 415 2.415 -7.865 -3.440 1.00 0.00 O ATOM 0 H GLY A 415 3.108 -5.674 -4.095 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.514 -7.021 -3.227 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.493 -6.510 -1.898 1.00 0.00 H new ATOM 821 N VAL A 416 4.205 -9.170 -3.027 1.00 0.00 N ATOM 822 CA VAL A 416 3.486 -10.424 -3.192 1.00 0.00 C ATOM 823 C VAL A 416 3.025 -10.967 -1.843 1.00 0.00 C ATOM 824 O VAL A 416 3.518 -10.550 -0.796 1.00 0.00 O ATOM 825 CB VAL A 416 4.376 -11.474 -3.881 1.00 0.00 C ATOM 826 CG1 VAL A 416 3.593 -12.746 -4.168 1.00 0.00 C ATOM 827 CG2 VAL A 416 4.981 -10.912 -5.158 1.00 0.00 C ATOM 0 H VAL A 416 5.193 -9.282 -2.801 1.00 0.00 H new ATOM 0 HA VAL A 416 2.614 -10.225 -3.815 1.00 0.00 H new ATOM 0 HB VAL A 416 5.190 -11.726 -3.201 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.244 -13.472 -4.655 1.00 0.00 H new ATOM 0 HG12 VAL A 416 3.220 -13.163 -3.232 1.00 0.00 H new ATOM 0 HG13 VAL A 416 2.752 -12.516 -4.823 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.606 -11.671 -5.629 1.00 0.00 H new ATOM 0 HG22 VAL A 416 4.183 -10.623 -5.842 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.588 -10.039 -4.919 1.00 0.00 H new ATOM 837 N GLY A 417 2.078 -11.898 -1.875 1.00 0.00 N ATOM 838 CA GLY A 417 1.572 -12.478 -0.646 1.00 0.00 C ATOM 839 C GLY A 417 0.723 -13.711 -0.890 1.00 0.00 C ATOM 840 O GLY A 417 0.285 -13.958 -2.014 1.00 0.00 O ATOM 0 H GLY A 417 1.653 -12.260 -2.728 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.410 -12.740 -0.000 1.00 0.00 H new ATOM 0 HA3 GLY A 417 0.980 -11.733 -0.114 1.00 0.00 H new ATOM 844 N ARG A 418 0.487 -14.483 0.165 1.00 0.00 N ATOM 845 CA ARG A 418 -0.319 -15.693 0.059 1.00 0.00 C ATOM 846 C ARG A 418 -1.758 -15.351 -0.315 1.00 0.00 C ATOM 847 O ARG A 418 -2.436 -16.125 -0.990 1.00 0.00 O ATOM 848 CB ARG A 418 -0.292 -16.468 1.379 1.00 0.00 C ATOM 849 CG ARG A 418 1.079 -17.020 1.733 1.00 0.00 C ATOM 850 CD ARG A 418 1.156 -17.429 3.197 1.00 0.00 C ATOM 851 NE ARG A 418 1.185 -18.880 3.359 1.00 0.00 N ATOM 852 CZ ARG A 418 1.089 -19.497 4.534 1.00 0.00 C ATOM 853 NH1 ARG A 418 0.960 -18.793 5.653 1.00 0.00 N ATOM 854 NH2 ARG A 418 1.125 -20.821 4.593 1.00 0.00 N ATOM 0 H ARG A 418 0.842 -14.293 1.102 1.00 0.00 H new ATOM 0 HA ARG A 418 0.106 -16.317 -0.727 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -0.629 -15.813 2.182 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -1.002 -17.293 1.321 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.300 -17.881 1.102 1.00 0.00 H new ATOM 0 HG3 ARG A 418 1.840 -16.268 1.524 1.00 0.00 H new ATOM 0 HD2 ARG A 418 2.049 -16.996 3.648 1.00 0.00 H new ATOM 0 HD3 ARG A 418 0.299 -17.021 3.733 1.00 0.00 H new ATOM 0 HE ARG A 418 1.285 -19.454 2.522 1.00 0.00 H new ATOM 0 HH11 ARG A 418 0.934 -17.774 5.614 1.00 0.00 H new ATOM 0 HH12 ARG A 418 0.887 -19.271 6.551 1.00 0.00 H new ATOM 0 HH21 ARG A 418 1.226 -21.367 3.737 1.00 0.00 H new ATOM 0 HH22 ARG A 418 1.051 -21.294 5.494 1.00 0.00 H new ATOM 866 N ASN A 419 -2.214 -14.183 0.127 1.00 0.00 N ATOM 867 CA ASN A 419 -3.571 -13.732 -0.163 1.00 0.00 C ATOM 868 C ASN A 419 -3.658 -12.211 -0.108 1.00 0.00 C ATOM 869 O ASN A 419 -2.707 -11.539 0.290 1.00 0.00 O ATOM 870 CB ASN A 419 -4.559 -14.349 0.828 1.00 0.00 C ATOM 871 CG ASN A 419 -4.162 -14.105 2.271 1.00 0.00 C ATOM 872 OD1 ASN A 419 -3.959 -12.963 2.685 1.00 0.00 O ATOM 873 ND2 ASN A 419 -4.047 -15.178 3.044 1.00 0.00 N ATOM 0 H ASN A 419 -1.664 -13.532 0.687 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.830 -14.057 -1.171 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -5.552 -13.934 0.652 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -4.626 -15.422 0.649 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -3.781 -15.075 4.023 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -4.225 -16.106 2.659 1.00 0.00 H new ATOM 880 N ILE A 420 -4.805 -11.672 -0.514 1.00 0.00 N ATOM 881 CA ILE A 420 -5.017 -10.227 -0.514 1.00 0.00 C ATOM 882 C ILE A 420 -4.577 -9.594 0.805 1.00 0.00 C ATOM 883 O ILE A 420 -4.179 -8.429 0.844 1.00 0.00 O ATOM 884 CB ILE A 420 -6.496 -9.868 -0.782 1.00 0.00 C ATOM 885 CG1 ILE A 420 -7.382 -10.292 0.388 1.00 0.00 C ATOM 886 CG2 ILE A 420 -6.974 -10.504 -2.082 1.00 0.00 C ATOM 887 CD1 ILE A 420 -7.476 -11.783 0.549 1.00 0.00 C ATOM 0 H ILE A 420 -5.602 -12.214 -0.847 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.404 -9.826 -1.321 1.00 0.00 H new ATOM 0 HB ILE A 420 -6.570 -8.785 -0.883 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -6.991 -9.858 1.308 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -8.383 -9.885 0.244 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -8.018 -10.240 -2.254 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.366 -10.140 -2.910 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -6.881 -11.588 -2.013 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -8.119 -12.018 1.397 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -7.895 -12.221 -0.357 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -6.481 -12.193 0.724 1.00 0.00 H new ATOM 899 N LYS A 421 -4.652 -10.368 1.884 1.00 0.00 N ATOM 900 CA LYS A 421 -4.263 -9.881 3.203 1.00 0.00 C ATOM 901 C LYS A 421 -2.751 -9.706 3.296 1.00 0.00 C ATOM 902 O LYS A 421 -2.258 -8.625 3.622 1.00 0.00 O ATOM 903 CB LYS A 421 -4.749 -10.845 4.287 1.00 0.00 C ATOM 904 CG LYS A 421 -5.598 -10.177 5.357 1.00 0.00 C ATOM 905 CD LYS A 421 -5.322 -10.762 6.734 1.00 0.00 C ATOM 906 CE LYS A 421 -6.118 -12.037 6.969 1.00 0.00 C ATOM 907 NZ LYS A 421 -5.268 -13.130 7.515 1.00 0.00 N ATOM 0 H LYS A 421 -4.978 -11.334 1.871 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.730 -8.908 3.357 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -5.328 -11.642 3.820 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -3.885 -11.313 4.759 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -5.395 -9.106 5.368 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -6.654 -10.299 5.114 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -4.257 -10.973 6.834 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -5.575 -10.028 7.499 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -6.935 -11.832 7.661 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -6.568 -12.362 6.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -5.848 -13.981 7.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -4.503 -13.343 6.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -4.858 -12.831 8.423 1.00 0.00 H new ATOM 921 N ILE A 422 -2.024 -10.775 3.006 1.00 0.00 N ATOM 922 CA ILE A 422 -0.568 -10.748 3.053 1.00 0.00 C ATOM 923 C ILE A 422 -0.005 -9.821 1.983 1.00 0.00 C ATOM 924 O ILE A 422 0.788 -8.925 2.273 1.00 0.00 O ATOM 925 CB ILE A 422 0.028 -12.162 2.875 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.245 -13.011 4.118 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.525 -12.093 2.600 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.650 -13.567 4.176 1.00 0.00 C ATOM 0 H ILE A 422 -2.419 -11.675 2.735 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.286 -10.371 4.036 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.453 -12.629 2.015 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.465 -13.838 4.146 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -0.066 -12.406 5.007 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.920 -13.102 2.479 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.702 -11.522 1.688 1.00 0.00 H new ATOM 0 HG23 ILE A 422 2.026 -11.605 3.436 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.770 -14.158 5.084 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -2.366 -12.746 4.180 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -1.827 -14.199 3.306 1.00 0.00 H new ATOM 940 N ALA A 423 -0.418 -10.048 0.743 1.00 0.00 N ATOM 941 CA ALA A 423 0.044 -9.241 -0.378 1.00 0.00 C ATOM 942 C ALA A 423 -0.136 -7.754 -0.097 1.00 0.00 C ATOM 943 O ALA A 423 0.747 -6.945 -0.384 1.00 0.00 O ATOM 944 CB ALA A 423 -0.689 -9.633 -1.651 1.00 0.00 C ATOM 0 H ALA A 423 -1.074 -10.786 0.488 1.00 0.00 H new ATOM 0 HA ALA A 423 1.109 -9.431 -0.513 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.332 -9.021 -2.479 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.502 -10.684 -1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.759 -9.475 -1.518 1.00 0.00 H new ATOM 950 N GLY A 424 -1.281 -7.405 0.475 1.00 0.00 N ATOM 951 CA GLY A 424 -1.555 -6.019 0.798 1.00 0.00 C ATOM 952 C GLY A 424 -0.540 -5.454 1.771 1.00 0.00 C ATOM 953 O GLY A 424 -0.020 -4.357 1.571 1.00 0.00 O ATOM 0 H GLY A 424 -2.025 -8.058 0.721 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.551 -5.426 -0.116 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.554 -5.937 1.227 1.00 0.00 H new ATOM 957 N ILE A 425 -0.251 -6.214 2.823 1.00 0.00 N ATOM 958 CA ILE A 425 0.715 -5.792 3.825 1.00 0.00 C ATOM 959 C ILE A 425 2.102 -5.659 3.207 1.00 0.00 C ATOM 960 O ILE A 425 2.886 -4.792 3.593 1.00 0.00 O ATOM 961 CB ILE A 425 0.772 -6.789 5.000 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.602 -6.908 5.661 1.00 0.00 C ATOM 963 CG2 ILE A 425 1.819 -6.362 6.019 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.736 -8.114 6.566 1.00 0.00 C ATOM 0 H ILE A 425 -0.673 -7.125 3.001 1.00 0.00 H new ATOM 0 HA ILE A 425 0.392 -4.822 4.204 1.00 0.00 H new ATOM 0 HB ILE A 425 1.057 -7.766 4.609 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -0.797 -6.006 6.241 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.366 -6.959 4.885 1.00 0.00 H new ATOM 0 HG21 ILE A 425 1.842 -7.079 6.839 1.00 0.00 H new ATOM 0 HG22 ILE A 425 2.798 -6.325 5.541 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.568 -5.375 6.407 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.736 -8.134 7.000 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.574 -9.023 5.987 1.00 0.00 H new ATOM 0 HD13 ILE A 425 0.005 -8.055 7.363 1.00 0.00 H new ATOM 976 N ARG A 426 2.393 -6.521 2.238 1.00 0.00 N ATOM 977 CA ARG A 426 3.681 -6.497 1.559 1.00 0.00 C ATOM 978 C ARG A 426 3.787 -5.273 0.659 1.00 0.00 C ATOM 979 O ARG A 426 4.806 -4.583 0.648 1.00 0.00 O ATOM 980 CB ARG A 426 3.878 -7.775 0.739 1.00 0.00 C ATOM 981 CG ARG A 426 4.776 -8.799 1.416 1.00 0.00 C ATOM 982 CD ARG A 426 4.052 -9.517 2.544 1.00 0.00 C ATOM 983 NE ARG A 426 4.691 -10.786 2.884 1.00 0.00 N ATOM 984 CZ ARG A 426 4.491 -11.432 4.030 1.00 0.00 C ATOM 985 NH1 ARG A 426 3.670 -10.935 4.946 1.00 0.00 N ATOM 986 NH2 ARG A 426 5.112 -12.581 4.259 1.00 0.00 N ATOM 0 H ARG A 426 1.754 -7.244 1.906 1.00 0.00 H new ATOM 0 HA ARG A 426 4.466 -6.443 2.314 1.00 0.00 H new ATOM 0 HB2 ARG A 426 2.905 -8.227 0.547 1.00 0.00 H new ATOM 0 HB3 ARG A 426 4.305 -7.514 -0.229 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.118 -9.527 0.680 1.00 0.00 H new ATOM 0 HG3 ARG A 426 5.663 -8.303 1.810 1.00 0.00 H new ATOM 0 HD2 ARG A 426 4.028 -8.876 3.425 1.00 0.00 H new ATOM 0 HD3 ARG A 426 3.017 -9.699 2.253 1.00 0.00 H new ATOM 0 HE ARG A 426 5.327 -11.201 2.203 1.00 0.00 H new ATOM 0 HH11 ARG A 426 3.188 -10.053 4.774 1.00 0.00 H new ATOM 0 HH12 ARG A 426 3.521 -11.435 5.822 1.00 0.00 H new ATOM 0 HH21 ARG A 426 5.742 -12.969 3.557 1.00 0.00 H new ATOM 0 HH22 ARG A 426 4.959 -13.077 5.137 1.00 0.00 H new ATOM 998 N ALA A 427 2.721 -5.003 -0.087 1.00 0.00 N ATOM 999 CA ALA A 427 2.690 -3.852 -0.981 1.00 0.00 C ATOM 1000 C ALA A 427 2.781 -2.559 -0.184 1.00 0.00 C ATOM 1001 O ALA A 427 3.496 -1.630 -0.560 1.00 0.00 O ATOM 1002 CB ALA A 427 1.427 -3.870 -1.833 1.00 0.00 C ATOM 0 H ALA A 427 1.869 -5.564 -0.090 1.00 0.00 H new ATOM 0 HA ALA A 427 3.551 -3.908 -1.647 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.422 -3.003 -2.494 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.404 -4.782 -2.430 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.551 -3.838 -1.185 1.00 0.00 H new ATOM 1008 N ALA A 428 2.055 -2.512 0.927 1.00 0.00 N ATOM 1009 CA ALA A 428 2.053 -1.341 1.791 1.00 0.00 C ATOM 1010 C ALA A 428 3.423 -1.133 2.415 1.00 0.00 C ATOM 1011 O ALA A 428 3.935 -0.013 2.459 1.00 0.00 O ATOM 1012 CB ALA A 428 0.996 -1.488 2.875 1.00 0.00 C ATOM 0 H ALA A 428 1.459 -3.274 1.250 1.00 0.00 H new ATOM 0 HA ALA A 428 1.815 -0.467 1.185 1.00 0.00 H new ATOM 0 HB1 ALA A 428 1.005 -0.605 3.514 1.00 0.00 H new ATOM 0 HB2 ALA A 428 0.014 -1.592 2.414 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.210 -2.373 3.475 1.00 0.00 H new ATOM 1018 N GLU A 429 4.016 -2.220 2.889 1.00 0.00 N ATOM 1019 CA GLU A 429 5.333 -2.159 3.502 1.00 0.00 C ATOM 1020 C GLU A 429 6.364 -1.682 2.488 1.00 0.00 C ATOM 1021 O GLU A 429 7.281 -0.932 2.821 1.00 0.00 O ATOM 1022 CB GLU A 429 5.728 -3.526 4.058 1.00 0.00 C ATOM 1023 CG GLU A 429 5.267 -3.748 5.488 1.00 0.00 C ATOM 1024 CD GLU A 429 5.643 -5.118 6.017 1.00 0.00 C ATOM 1025 OE1 GLU A 429 6.821 -5.510 5.868 1.00 0.00 O ATOM 1026 OE2 GLU A 429 4.761 -5.801 6.579 1.00 0.00 O ATOM 0 H GLU A 429 3.605 -3.153 2.860 1.00 0.00 H new ATOM 0 HA GLU A 429 5.299 -1.448 4.327 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.306 -4.305 3.422 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.812 -3.630 4.013 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.704 -2.983 6.129 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.185 -3.627 5.540 1.00 0.00 H new ATOM 1033 N ASN A 430 6.193 -2.112 1.241 1.00 0.00 N ATOM 1034 CA ASN A 430 7.094 -1.715 0.169 1.00 0.00 C ATOM 1035 C ASN A 430 7.003 -0.212 -0.052 1.00 0.00 C ATOM 1036 O ASN A 430 7.998 0.449 -0.349 1.00 0.00 O ATOM 1037 CB ASN A 430 6.749 -2.463 -1.123 1.00 0.00 C ATOM 1038 CG ASN A 430 7.835 -3.436 -1.536 1.00 0.00 C ATOM 1039 OD1 ASN A 430 8.283 -4.259 -0.738 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.265 -3.346 -2.790 1.00 0.00 N ATOM 0 H ASN A 430 5.439 -2.735 0.950 1.00 0.00 H new ATOM 0 HA ASN A 430 8.115 -1.971 0.453 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.813 -3.004 -0.987 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.587 -1.742 -1.924 1.00 0.00 H new ATOM 0 HD21 ASN A 430 8.995 -3.975 -3.125 1.00 0.00 H new ATOM 0 HD22 ASN A 430 7.865 -2.648 -3.417 1.00 0.00 H new ATOM 1047 N ALA A 431 5.795 0.321 0.105 1.00 0.00 N ATOM 1048 CA ALA A 431 5.555 1.746 -0.062 1.00 0.00 C ATOM 1049 C ALA A 431 6.116 2.533 1.119 1.00 0.00 C ATOM 1050 O ALA A 431 6.504 3.692 0.976 1.00 0.00 O ATOM 1051 CB ALA A 431 4.064 2.013 -0.217 1.00 0.00 C ATOM 0 H ALA A 431 4.964 -0.218 0.349 1.00 0.00 H new ATOM 0 HA ALA A 431 6.068 2.077 -0.965 1.00 0.00 H new ATOM 0 HB1 ALA A 431 3.897 3.083 -0.341 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.689 1.483 -1.092 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.538 1.664 0.672 1.00 0.00 H new ATOM 1057 N LEU A 432 6.160 1.892 2.285 1.00 0.00 N ATOM 1058 CA LEU A 432 6.676 2.531 3.489 1.00 0.00 C ATOM 1059 C LEU A 432 8.203 2.485 3.524 1.00 0.00 C ATOM 1060 O LEU A 432 8.841 3.288 4.205 1.00 0.00 O ATOM 1061 CB LEU A 432 6.105 1.851 4.736 1.00 0.00 C ATOM 1062 CG LEU A 432 4.578 1.796 4.803 1.00 0.00 C ATOM 1063 CD1 LEU A 432 4.116 0.535 5.519 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.030 3.036 5.496 1.00 0.00 C ATOM 0 H LEU A 432 5.844 0.931 2.420 1.00 0.00 H new ATOM 0 HA LEU A 432 6.364 3.575 3.476 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.492 0.833 4.785 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.473 2.375 5.618 1.00 0.00 H new ATOM 0 HG LEU A 432 4.191 1.771 3.784 1.00 0.00 H new ATOM 0 HD11 LEU A 432 3.027 0.516 5.556 1.00 0.00 H new ATOM 0 HD12 LEU A 432 4.477 -0.342 4.981 1.00 0.00 H new ATOM 0 HD13 LEU A 432 4.513 0.527 6.534 1.00 0.00 H new ATOM 0 HD21 LEU A 432 2.942 2.980 5.535 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.427 3.092 6.510 1.00 0.00 H new ATOM 0 HD23 LEU A 432 4.328 3.925 4.940 1.00 0.00 H new ATOM 1076 N ARG A 433 8.784 1.542 2.785 1.00 0.00 N ATOM 1077 CA ARG A 433 10.234 1.395 2.735 1.00 0.00 C ATOM 1078 C ARG A 433 10.891 2.648 2.165 1.00 0.00 C ATOM 1079 O ARG A 433 11.842 3.178 2.738 1.00 0.00 O ATOM 1080 CB ARG A 433 10.617 0.177 1.894 1.00 0.00 C ATOM 1081 CG ARG A 433 10.306 -1.150 2.568 1.00 0.00 C ATOM 1082 CD ARG A 433 11.561 -1.984 2.771 1.00 0.00 C ATOM 1083 NE ARG A 433 11.923 -2.726 1.566 1.00 0.00 N ATOM 1084 CZ ARG A 433 12.856 -3.677 1.535 1.00 0.00 C ATOM 1085 NH1 ARG A 433 13.518 -4.002 2.638 1.00 0.00 N ATOM 1086 NH2 ARG A 433 13.124 -4.303 0.397 1.00 0.00 N ATOM 0 H ARG A 433 8.272 0.870 2.214 1.00 0.00 H new ATOM 0 HA ARG A 433 10.593 1.251 3.754 1.00 0.00 H new ATOM 0 HB2 ARG A 433 10.090 0.223 0.941 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.683 0.221 1.671 1.00 0.00 H new ATOM 0 HG2 ARG A 433 9.831 -0.966 3.532 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.592 -1.708 1.962 1.00 0.00 H new ATOM 0 HD2 ARG A 433 12.387 -1.333 3.058 1.00 0.00 H new ATOM 0 HD3 ARG A 433 11.404 -2.682 3.594 1.00 0.00 H new ATOM 0 HE ARG A 433 11.434 -2.504 0.699 1.00 0.00 H new ATOM 0 HH11 ARG A 433 13.314 -3.523 3.515 1.00 0.00 H new ATOM 0 HH12 ARG A 433 14.231 -4.731 2.609 1.00 0.00 H new ATOM 0 HH21 ARG A 433 12.616 -4.056 -0.453 1.00 0.00 H new ATOM 0 HH22 ARG A 433 13.838 -5.031 0.371 1.00 0.00 H new ATOM 1098 N ASP A 434 10.377 3.107 1.032 1.00 0.00 N ATOM 1099 CA ASP A 434 10.901 4.292 0.368 1.00 0.00 C ATOM 1100 C ASP A 434 10.869 5.508 1.292 1.00 0.00 C ATOM 1101 O ASP A 434 9.942 6.313 1.246 1.00 0.00 O ATOM 1102 CB ASP A 434 10.090 4.568 -0.898 1.00 0.00 C ATOM 1103 CG ASP A 434 8.593 4.537 -0.649 1.00 0.00 C ATOM 1104 OD1 ASP A 434 8.065 5.506 -0.064 1.00 0.00 O ATOM 1105 OD2 ASP A 434 7.949 3.541 -1.040 1.00 0.00 O ATOM 0 H ASP A 434 9.590 2.672 0.550 1.00 0.00 H new ATOM 0 HA ASP A 434 11.942 4.106 0.102 1.00 0.00 H new ATOM 0 HB2 ASP A 434 10.368 5.543 -1.298 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.344 3.828 -1.657 1.00 0.00 H new ATOM 1110 N LYS A 435 11.891 5.631 2.133 1.00 0.00 N ATOM 1111 CA LYS A 435 11.986 6.743 3.074 1.00 0.00 C ATOM 1112 C LYS A 435 11.933 8.085 2.351 1.00 0.00 C ATOM 1113 O LYS A 435 11.378 9.056 2.866 1.00 0.00 O ATOM 1114 CB LYS A 435 13.278 6.641 3.885 1.00 0.00 C ATOM 1115 CG LYS A 435 13.145 5.788 5.136 1.00 0.00 C ATOM 1116 CD LYS A 435 14.324 5.987 6.075 1.00 0.00 C ATOM 1117 CE LYS A 435 14.351 4.931 7.167 1.00 0.00 C ATOM 1118 NZ LYS A 435 14.649 3.578 6.624 1.00 0.00 N ATOM 0 H LYS A 435 12.668 4.972 2.182 1.00 0.00 H new ATOM 0 HA LYS A 435 11.132 6.684 3.748 1.00 0.00 H new ATOM 0 HB2 LYS A 435 14.062 6.224 3.253 1.00 0.00 H new ATOM 0 HB3 LYS A 435 13.598 7.643 4.171 1.00 0.00 H new ATOM 0 HG2 LYS A 435 12.220 6.041 5.654 1.00 0.00 H new ATOM 0 HG3 LYS A 435 13.076 4.737 4.855 1.00 0.00 H new ATOM 0 HD2 LYS A 435 15.253 5.948 5.507 1.00 0.00 H new ATOM 0 HD3 LYS A 435 14.268 6.977 6.527 1.00 0.00 H new ATOM 0 HE2 LYS A 435 15.102 5.197 7.911 1.00 0.00 H new ATOM 0 HE3 LYS A 435 13.389 4.913 7.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 14.941 2.949 7.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 13.798 3.192 6.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 15.416 3.646 5.925 1.00 0.00 H new ATOM 1132 N LYS A 436 12.511 8.133 1.157 1.00 0.00 N ATOM 1133 CA LYS A 436 12.524 9.359 0.367 1.00 0.00 C ATOM 1134 C LYS A 436 11.114 9.732 -0.063 1.00 0.00 C ATOM 1135 O LYS A 436 10.623 10.818 0.246 1.00 0.00 O ATOM 1136 CB LYS A 436 13.417 9.196 -0.864 1.00 0.00 C ATOM 1137 CG LYS A 436 14.896 9.082 -0.534 1.00 0.00 C ATOM 1138 CD LYS A 436 15.229 7.723 0.060 1.00 0.00 C ATOM 1139 CE LYS A 436 16.646 7.295 -0.289 1.00 0.00 C ATOM 1140 NZ LYS A 436 17.094 6.135 0.531 1.00 0.00 N ATOM 0 H LYS A 436 12.976 7.340 0.715 1.00 0.00 H new ATOM 0 HA LYS A 436 12.926 10.159 0.989 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.106 8.307 -1.412 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.266 10.048 -1.527 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.485 9.240 -1.437 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.175 9.866 0.170 1.00 0.00 H new ATOM 0 HD2 LYS A 436 15.115 7.760 1.143 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.522 6.980 -0.309 1.00 0.00 H new ATOM 0 HE2 LYS A 436 16.696 7.033 -1.346 1.00 0.00 H new ATOM 0 HE3 LYS A 436 17.326 8.133 -0.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 18.064 5.874 0.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 17.071 6.392 1.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 16.460 5.327 0.365 1.00 0.00 H new ATOM 1154 N MET A 437 10.469 8.819 -0.773 1.00 0.00 N ATOM 1155 CA MET A 437 9.110 9.039 -1.246 1.00 0.00 C ATOM 1156 C MET A 437 8.158 9.223 -0.068 1.00 0.00 C ATOM 1157 O MET A 437 7.128 9.886 -0.190 1.00 0.00 O ATOM 1158 CB MET A 437 8.655 7.867 -2.119 1.00 0.00 C ATOM 1159 CG MET A 437 7.197 7.946 -2.542 1.00 0.00 C ATOM 1160 SD MET A 437 6.983 7.874 -4.332 1.00 0.00 S ATOM 1161 CE MET A 437 6.449 9.548 -4.677 1.00 0.00 C ATOM 0 H MET A 437 10.866 7.917 -1.035 1.00 0.00 H new ATOM 0 HA MET A 437 9.096 9.948 -1.847 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.280 7.826 -3.011 1.00 0.00 H new ATOM 0 HB3 MET A 437 8.816 6.937 -1.574 1.00 0.00 H new ATOM 0 HG2 MET A 437 6.645 7.127 -2.082 1.00 0.00 H new ATOM 0 HG3 MET A 437 6.764 8.873 -2.166 1.00 0.00 H new ATOM 0 HE1 MET A 437 5.390 9.546 -4.934 1.00 0.00 H new ATOM 0 HE2 MET A 437 6.608 10.169 -3.796 1.00 0.00 H new ATOM 0 HE3 MET A 437 7.024 9.949 -5.512 1.00 0.00 H new ATOM 1171 N LEU A 438 8.511 8.639 1.073 1.00 0.00 N ATOM 1172 CA LEU A 438 7.686 8.751 2.270 1.00 0.00 C ATOM 1173 C LEU A 438 7.893 10.108 2.934 1.00 0.00 C ATOM 1174 O LEU A 438 6.982 10.650 3.559 1.00 0.00 O ATOM 1175 CB LEU A 438 8.016 7.631 3.259 1.00 0.00 C ATOM 1176 CG LEU A 438 6.826 7.116 4.071 1.00 0.00 C ATOM 1177 CD1 LEU A 438 6.188 8.250 4.859 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.804 6.457 3.157 1.00 0.00 C ATOM 0 H LEU A 438 9.359 8.086 1.193 1.00 0.00 H new ATOM 0 HA LEU A 438 6.641 8.659 1.973 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.450 6.796 2.708 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.780 7.989 3.949 1.00 0.00 H new ATOM 0 HG LEU A 438 7.187 6.369 4.778 1.00 0.00 H new ATOM 0 HD11 LEU A 438 5.343 7.866 5.431 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.923 8.678 5.541 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.840 9.020 4.171 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.964 6.096 3.751 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.447 7.183 2.427 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.268 5.618 2.637 1.00 0.00 H new ATOM 1190 N ASP A 439 9.096 10.655 2.785 1.00 0.00 N ATOM 1191 CA ASP A 439 9.421 11.953 3.363 1.00 0.00 C ATOM 1192 C ASP A 439 8.672 13.063 2.637 1.00 0.00 C ATOM 1193 O ASP A 439 8.179 14.005 3.258 1.00 0.00 O ATOM 1194 CB ASP A 439 10.928 12.206 3.293 1.00 0.00 C ATOM 1195 CG ASP A 439 11.427 13.052 4.447 1.00 0.00 C ATOM 1196 OD1 ASP A 439 11.403 14.296 4.324 1.00 0.00 O ATOM 1197 OD2 ASP A 439 11.839 12.474 5.473 1.00 0.00 O ATOM 0 H ASP A 439 9.861 10.219 2.269 1.00 0.00 H new ATOM 0 HA ASP A 439 9.113 11.949 4.409 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.454 11.251 3.292 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.167 12.702 2.352 1.00 0.00 H new ATOM 1202 N PHE A 440 8.584 12.940 1.317 1.00 0.00 N ATOM 1203 CA PHE A 440 7.887 13.929 0.502 1.00 0.00 C ATOM 1204 C PHE A 440 6.419 14.016 0.902 1.00 0.00 C ATOM 1205 O PHE A 440 5.850 15.105 0.986 1.00 0.00 O ATOM 1206 CB PHE A 440 8.000 13.568 -0.977 1.00 0.00 C ATOM 1207 CG PHE A 440 7.749 14.727 -1.901 1.00 0.00 C ATOM 1208 CD1 PHE A 440 8.381 15.943 -1.695 1.00 0.00 C ATOM 1209 CD2 PHE A 440 6.881 14.600 -2.973 1.00 0.00 C ATOM 1210 CE1 PHE A 440 8.152 17.010 -2.542 1.00 0.00 C ATOM 1211 CE2 PHE A 440 6.649 15.664 -3.824 1.00 0.00 C ATOM 1212 CZ PHE A 440 7.285 16.870 -3.608 1.00 0.00 C ATOM 0 H PHE A 440 8.986 12.166 0.789 1.00 0.00 H new ATOM 0 HA PHE A 440 8.353 14.900 0.669 1.00 0.00 H new ATOM 0 HB2 PHE A 440 8.996 13.170 -1.170 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.289 12.773 -1.204 1.00 0.00 H new ATOM 0 HD1 PHE A 440 9.060 16.058 -0.863 1.00 0.00 H new ATOM 0 HD2 PHE A 440 6.380 13.659 -3.146 1.00 0.00 H new ATOM 0 HE1 PHE A 440 8.650 17.953 -2.371 1.00 0.00 H new ATOM 0 HE2 PHE A 440 5.971 15.552 -4.657 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.105 17.703 -4.272 1.00 0.00 H new ATOM 1222 N TYR A 441 5.815 12.861 1.156 1.00 0.00 N ATOM 1223 CA TYR A 441 4.418 12.800 1.558 1.00 0.00 C ATOM 1224 C TYR A 441 4.290 13.082 3.042 1.00 0.00 C ATOM 1225 O TYR A 441 3.422 13.841 3.468 1.00 0.00 O ATOM 1226 CB TYR A 441 3.830 11.428 1.235 1.00 0.00 C ATOM 1227 CG TYR A 441 3.338 11.295 -0.188 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.206 10.941 -1.214 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.006 11.519 -0.504 1.00 0.00 C ATOM 1230 CE1 TYR A 441 3.759 10.816 -2.515 1.00 0.00 C ATOM 1231 CE2 TYR A 441 1.549 11.395 -1.803 1.00 0.00 C ATOM 1232 CZ TYR A 441 2.430 11.043 -2.805 1.00 0.00 C ATOM 1233 OH TYR A 441 1.979 10.917 -4.099 1.00 0.00 O ATOM 0 H TYR A 441 6.274 11.952 1.090 1.00 0.00 H new ATOM 0 HA TYR A 441 3.864 13.557 1.003 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.587 10.666 1.421 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.003 11.228 1.916 1.00 0.00 H new ATOM 0 HD1 TYR A 441 5.247 10.761 -0.990 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.314 11.795 0.278 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.447 10.542 -3.301 1.00 0.00 H new ATOM 0 HE2 TYR A 441 0.509 11.573 -2.032 1.00 0.00 H new ATOM 0 HH TYR A 441 2.518 10.248 -4.570 1.00 0.00 H new ATOM 1243 N ALA A 442 5.170 12.479 3.827 1.00 0.00 N ATOM 1244 CA ALA A 442 5.161 12.683 5.266 1.00 0.00 C ATOM 1245 C ALA A 442 5.271 14.167 5.596 1.00 0.00 C ATOM 1246 O ALA A 442 4.768 14.625 6.622 1.00 0.00 O ATOM 1247 CB ALA A 442 6.288 11.900 5.923 1.00 0.00 C ATOM 0 H ALA A 442 5.897 11.847 3.492 1.00 0.00 H new ATOM 0 HA ALA A 442 4.214 12.315 5.661 1.00 0.00 H new ATOM 0 HB1 ALA A 442 6.266 12.065 7.000 1.00 0.00 H new ATOM 0 HB2 ALA A 442 6.162 10.837 5.716 1.00 0.00 H new ATOM 0 HB3 ALA A 442 7.245 12.236 5.524 1.00 0.00 H new ATOM 1253 N LYS A 443 5.917 14.918 4.707 1.00 0.00 N ATOM 1254 CA LYS A 443 6.073 16.356 4.896 1.00 0.00 C ATOM 1255 C LYS A 443 4.819 17.099 4.435 1.00 0.00 C ATOM 1256 O LYS A 443 4.701 18.310 4.620 1.00 0.00 O ATOM 1257 CB LYS A 443 7.297 16.865 4.132 1.00 0.00 C ATOM 1258 CG LYS A 443 8.533 17.031 5.004 1.00 0.00 C ATOM 1259 CD LYS A 443 8.877 15.743 5.738 1.00 0.00 C ATOM 1260 CE LYS A 443 8.738 15.903 7.244 1.00 0.00 C ATOM 1261 NZ LYS A 443 9.667 16.934 7.782 1.00 0.00 N ATOM 0 H LYS A 443 6.339 14.555 3.852 1.00 0.00 H new ATOM 0 HA LYS A 443 6.218 16.547 5.959 1.00 0.00 H new ATOM 0 HB2 LYS A 443 7.524 16.171 3.322 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.055 17.823 3.672 1.00 0.00 H new ATOM 0 HG2 LYS A 443 9.377 17.335 4.385 1.00 0.00 H new ATOM 0 HG3 LYS A 443 8.364 17.829 5.727 1.00 0.00 H new ATOM 0 HD2 LYS A 443 8.222 14.942 5.395 1.00 0.00 H new ATOM 0 HD3 LYS A 443 9.898 15.447 5.496 1.00 0.00 H new ATOM 0 HE2 LYS A 443 7.711 16.178 7.486 1.00 0.00 H new ATOM 0 HE3 LYS A 443 8.936 14.948 7.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 9.862 16.736 8.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 10.557 16.913 7.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 9.231 17.874 7.693 1.00 0.00 H new ATOM 1275 N GLN A 444 3.881 16.362 3.843 1.00 0.00 N ATOM 1276 CA GLN A 444 2.635 16.940 3.367 1.00 0.00 C ATOM 1277 C GLN A 444 1.467 16.425 4.197 1.00 0.00 C ATOM 1278 O GLN A 444 0.653 17.203 4.694 1.00 0.00 O ATOM 1279 CB GLN A 444 2.419 16.608 1.889 1.00 0.00 C ATOM 1280 CG GLN A 444 3.614 16.938 1.010 1.00 0.00 C ATOM 1281 CD GLN A 444 3.491 18.295 0.346 1.00 0.00 C ATOM 1282 OE1 GLN A 444 3.366 18.394 -0.875 1.00 0.00 O ATOM 1283 NE2 GLN A 444 3.528 19.353 1.149 1.00 0.00 N ATOM 0 H GLN A 444 3.965 15.358 3.683 1.00 0.00 H new ATOM 0 HA GLN A 444 2.693 18.023 3.473 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.190 15.547 1.793 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.549 17.155 1.526 1.00 0.00 H new ATOM 0 HG2 GLN A 444 4.522 16.913 1.613 1.00 0.00 H new ATOM 0 HG3 GLN A 444 3.720 16.170 0.243 1.00 0.00 H new ATOM 0 HE21 GLN A 444 3.633 19.226 2.156 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.451 20.292 0.759 1.00 0.00 H new ATOM 1292 N ARG A 445 1.398 15.107 4.349 1.00 0.00 N ATOM 1293 CA ARG A 445 0.335 14.488 5.133 1.00 0.00 C ATOM 1294 C ARG A 445 0.469 14.869 6.601 1.00 0.00 C ATOM 1295 O ARG A 445 -0.508 15.235 7.255 1.00 0.00 O ATOM 1296 CB ARG A 445 0.370 12.967 4.983 1.00 0.00 C ATOM 1297 CG ARG A 445 -0.995 12.308 5.118 1.00 0.00 C ATOM 1298 CD ARG A 445 -1.412 12.171 6.574 1.00 0.00 C ATOM 1299 NE ARG A 445 -2.837 12.434 6.760 1.00 0.00 N ATOM 1300 CZ ARG A 445 -3.536 12.026 7.816 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -2.945 11.340 8.788 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -4.829 12.305 7.904 1.00 0.00 N ATOM 0 H ARG A 445 2.062 14.449 3.942 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.621 14.853 4.759 1.00 0.00 H new ATOM 0 HB2 ARG A 445 0.790 12.716 4.009 1.00 0.00 H new ATOM 0 HB3 ARG A 445 1.040 12.552 5.736 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -1.738 12.897 4.581 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -0.971 11.323 4.652 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -1.180 11.166 6.925 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -0.832 12.864 7.184 1.00 0.00 H new ATOM 0 HE ARG A 445 -3.325 12.962 6.037 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -1.950 11.123 8.727 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -3.486 11.030 9.595 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -5.289 12.833 7.162 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -5.364 11.992 8.714 1.00 0.00 H new ATOM 1314 N ALA A 446 1.691 14.784 7.112 1.00 0.00 N ATOM 1315 CA ALA A 446 1.968 15.123 8.501 1.00 0.00 C ATOM 1316 C ALA A 446 1.949 16.632 8.705 1.00 0.00 C ATOM 1317 O ALA A 446 1.625 17.120 9.787 1.00 0.00 O ATOM 1318 CB ALA A 446 3.311 14.547 8.927 1.00 0.00 C ATOM 0 H ALA A 446 2.509 14.482 6.582 1.00 0.00 H new ATOM 0 HA ALA A 446 1.186 14.686 9.122 1.00 0.00 H new ATOM 0 HB1 ALA A 446 3.505 14.808 9.967 1.00 0.00 H new ATOM 0 HB2 ALA A 446 3.291 13.462 8.823 1.00 0.00 H new ATOM 0 HB3 ALA A 446 4.100 14.958 8.296 1.00 0.00 H new