USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=17 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 50:sc= -3.43! USER MOD Set 1.2: A 404 CYS SG : rot 95:sc= -1.16 USER MOD Single : A 369 ASN :FLIP amide:sc=-0.00375 F(o=-0.77,f=-0.0037) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN :FLIP amide:sc= -1.67! C(o=-2.7!,f=-1.7!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 380 TYR OH : rot -151:sc= 1.11 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HE2:sc= -1.02 K(o=-1,f=-7.8!) USER MOD Single : A 389 THR OG1 : rot 180:sc= 0 USER MOD Single : A 399 ASN : amide:sc= -0.16 X(o=-0.16,f=0) USER MOD Single : A 400 SER OG : rot 65:sc= -0.135 USER MOD Single : A 410 THR OG1 : rot 29:sc= 0.105 USER MOD Single : A 414 THR OG1 : rot -38:sc= -3.74! USER MOD Single : A 419 ASN : amide:sc= -3.89 X(o=-3.9,f=-4.1!) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -0.0175 X(o=-0.017,f=-0.071) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 149:sc= -0.25 (180deg=-1.01) USER MOD Single : A 437 MET CE :methyl 147:sc= -0.453 (180deg=-1.8!) USER MOD Single : A 441 TYR OH : rot 30:sc= -0.309 USER MOD Single : A 443 LYS NZ :NH3+ -134:sc= -0.903 (180deg=-2.27!) USER MOD Single : A 444 GLN : amide:sc= -0.272 X(o=-0.27,f=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -4.131 -2.376 8.231 1.00 0.00 N ATOM 103 CA ASN A 369 -3.051 -1.990 9.132 1.00 0.00 C ATOM 104 C ASN A 369 -1.946 -1.267 8.373 1.00 0.00 C ATOM 105 O ASN A 369 -1.804 -0.050 8.473 1.00 0.00 O ATOM 106 CB ASN A 369 -2.487 -3.221 9.846 1.00 0.00 C ATOM 107 CG ASN A 369 -1.380 -2.868 10.820 1.00 0.00 C ATOM 108 OD1 ASN A 369 -0.150 -2.817 10.323 1.00 0.00 O flip ATOM 109 ND2 ASN A 369 -1.625 -2.645 12.006 1.00 0.00 N flip ATOM 0 HA ASN A 369 -3.457 -1.307 9.878 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -3.290 -3.727 10.381 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.105 -3.924 9.106 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -2.585 -2.695 12.347 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -0.868 -2.410 12.648 1.00 0.00 H new ATOM 116 N ALA A 370 -1.172 -2.019 7.606 1.00 0.00 N ATOM 117 CA ALA A 370 -0.088 -1.437 6.823 1.00 0.00 C ATOM 118 C ALA A 370 -0.623 -0.381 5.860 1.00 0.00 C ATOM 119 O ALA A 370 0.115 0.497 5.414 1.00 0.00 O ATOM 120 CB ALA A 370 0.659 -2.523 6.066 1.00 0.00 C ATOM 0 H ALA A 370 -1.272 -3.029 7.508 1.00 0.00 H new ATOM 0 HA ALA A 370 0.608 -0.950 7.507 1.00 0.00 H new ATOM 0 HB1 ALA A 370 1.465 -2.074 5.486 1.00 0.00 H new ATOM 0 HB2 ALA A 370 1.077 -3.239 6.774 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.028 -3.037 5.394 1.00 0.00 H new ATOM 126 N LYS A 371 -1.915 -0.469 5.550 1.00 0.00 N ATOM 127 CA LYS A 371 -2.549 0.483 4.649 1.00 0.00 C ATOM 128 C LYS A 371 -2.868 1.780 5.378 1.00 0.00 C ATOM 129 O LYS A 371 -2.700 2.870 4.830 1.00 0.00 O ATOM 130 CB LYS A 371 -3.827 -0.113 4.054 1.00 0.00 C ATOM 131 CG LYS A 371 -4.538 0.816 3.085 1.00 0.00 C ATOM 132 CD LYS A 371 -6.048 0.659 3.169 1.00 0.00 C ATOM 133 CE LYS A 371 -6.660 1.664 4.131 1.00 0.00 C ATOM 134 NZ LYS A 371 -7.996 2.131 3.669 1.00 0.00 N ATOM 0 H LYS A 371 -2.540 -1.190 5.910 1.00 0.00 H new ATOM 0 HA LYS A 371 -1.853 0.701 3.839 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -3.579 -1.041 3.539 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.509 -0.370 4.864 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -4.266 1.849 3.303 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -4.205 0.607 2.068 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.484 0.790 2.179 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.292 -0.352 3.494 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -6.755 1.211 5.118 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -5.993 2.519 4.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -8.380 2.815 4.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -7.902 2.586 2.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -8.641 1.318 3.593 1.00 0.00 H new ATOM 148 N ARG A 372 -3.318 1.661 6.623 1.00 0.00 N ATOM 149 CA ARG A 372 -3.644 2.833 7.424 1.00 0.00 C ATOM 150 C ARG A 372 -2.383 3.642 7.700 1.00 0.00 C ATOM 151 O ARG A 372 -2.429 4.865 7.832 1.00 0.00 O ATOM 152 CB ARG A 372 -4.319 2.426 8.738 1.00 0.00 C ATOM 153 CG ARG A 372 -3.401 1.702 9.713 1.00 0.00 C ATOM 154 CD ARG A 372 -3.615 2.184 11.140 1.00 0.00 C ATOM 155 NE ARG A 372 -3.074 1.244 12.119 1.00 0.00 N ATOM 156 CZ ARG A 372 -2.759 1.576 13.370 1.00 0.00 C ATOM 157 NH1 ARG A 372 -2.934 2.819 13.800 1.00 0.00 N ATOM 158 NH2 ARG A 372 -2.270 0.659 14.194 1.00 0.00 N ATOM 0 H ARG A 372 -3.464 0.769 7.096 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.345 3.452 6.863 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -4.713 3.319 9.223 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -5.170 1.784 8.512 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -3.584 0.629 9.659 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -2.362 1.863 9.425 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -3.140 3.157 11.270 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -4.681 2.323 11.320 1.00 0.00 H new ATOM 0 HE ARG A 372 -2.929 0.277 11.828 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -3.312 3.528 13.171 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -2.691 3.066 14.759 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -2.136 -0.299 13.869 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -2.028 0.911 15.152 1.00 0.00 H new ATOM 170 N GLN A 373 -1.256 2.943 7.773 1.00 0.00 N ATOM 171 CA GLN A 373 0.027 3.581 8.018 1.00 0.00 C ATOM 172 C GLN A 373 0.364 4.543 6.886 1.00 0.00 C ATOM 173 O GLN A 373 0.644 5.719 7.119 1.00 0.00 O ATOM 174 CB GLN A 373 1.126 2.521 8.155 1.00 0.00 C ATOM 175 CG GLN A 373 1.648 2.366 9.573 1.00 0.00 C ATOM 176 CD GLN A 373 3.142 2.607 9.675 1.00 0.00 C ATOM 177 OE1 GLN A 373 3.576 3.799 9.283 1.00 0.00 O flip ATOM 178 NE2 GLN A 373 3.896 1.732 10.102 1.00 0.00 N flip ATOM 0 H GLN A 373 -1.208 1.930 7.665 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.036 4.145 8.948 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.738 1.562 7.813 1.00 0.00 H new ATOM 0 HB3 GLN A 373 1.955 2.783 7.498 1.00 0.00 H new ATOM 0 HG2 GLN A 373 1.126 3.065 10.227 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.420 1.362 9.932 1.00 0.00 H new ATOM 0 HE21 GLN A 373 3.518 0.830 10.392 1.00 0.00 H new ATOM 0 HE22 GLN A 373 4.898 1.909 10.166 1.00 0.00 H new ATOM 187 N LEU A 374 0.326 4.036 5.656 1.00 0.00 N ATOM 188 CA LEU A 374 0.622 4.851 4.485 1.00 0.00 C ATOM 189 C LEU A 374 -0.328 6.039 4.397 1.00 0.00 C ATOM 190 O LEU A 374 0.097 7.172 4.180 1.00 0.00 O ATOM 191 CB LEU A 374 0.524 4.005 3.213 1.00 0.00 C ATOM 192 CG LEU A 374 1.858 3.480 2.680 1.00 0.00 C ATOM 193 CD1 LEU A 374 1.673 2.121 2.024 1.00 0.00 C ATOM 194 CD2 LEU A 374 2.465 4.471 1.698 1.00 0.00 C ATOM 0 H LEU A 374 0.093 3.065 5.447 1.00 0.00 H new ATOM 0 HA LEU A 374 1.639 5.231 4.582 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -0.131 3.156 3.409 1.00 0.00 H new ATOM 0 HB3 LEU A 374 0.048 4.601 2.434 1.00 0.00 H new ATOM 0 HG LEU A 374 2.544 3.364 3.519 1.00 0.00 H new ATOM 0 HD11 LEU A 374 2.633 1.763 1.651 1.00 0.00 H new ATOM 0 HD12 LEU A 374 1.282 1.414 2.756 1.00 0.00 H new ATOM 0 HD13 LEU A 374 0.971 2.210 1.195 1.00 0.00 H new ATOM 0 HD21 LEU A 374 3.414 4.082 1.328 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.782 4.618 0.861 1.00 0.00 H new ATOM 0 HD23 LEU A 374 2.634 5.424 2.200 1.00 0.00 H new ATOM 206 N TYR A 375 -1.614 5.771 4.573 1.00 0.00 N ATOM 207 CA TYR A 375 -2.624 6.820 4.514 1.00 0.00 C ATOM 208 C TYR A 375 -2.400 7.846 5.620 1.00 0.00 C ATOM 209 O TYR A 375 -2.724 9.023 5.462 1.00 0.00 O ATOM 210 CB TYR A 375 -4.027 6.216 4.631 1.00 0.00 C ATOM 211 CG TYR A 375 -4.932 6.561 3.468 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.078 7.875 3.044 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.638 5.571 2.797 1.00 0.00 C ATOM 214 CE1 TYR A 375 -5.904 8.194 1.983 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.466 5.882 1.735 1.00 0.00 C ATOM 216 CZ TYR A 375 -6.595 7.195 1.332 1.00 0.00 C ATOM 217 OH TYR A 375 -7.419 7.508 0.275 1.00 0.00 O ATOM 0 H TYR A 375 -1.983 4.838 4.758 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.537 7.324 3.552 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -3.942 5.132 4.706 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.488 6.564 5.555 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.537 8.660 3.551 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.538 4.542 3.110 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -6.008 9.221 1.666 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.009 5.101 1.223 1.00 0.00 H new ATOM 0 HH TYR A 375 -7.830 6.689 -0.073 1.00 0.00 H new ATOM 227 N SER A 376 -1.841 7.394 6.737 1.00 0.00 N ATOM 228 CA SER A 376 -1.571 8.275 7.864 1.00 0.00 C ATOM 229 C SER A 376 -0.158 8.851 7.790 1.00 0.00 C ATOM 230 O SER A 376 0.233 9.661 8.630 1.00 0.00 O ATOM 231 CB SER A 376 -1.757 7.522 9.182 1.00 0.00 C ATOM 232 OG SER A 376 -2.186 8.395 10.212 1.00 0.00 O ATOM 0 H SER A 376 -1.567 6.423 6.885 1.00 0.00 H new ATOM 0 HA SER A 376 -2.280 9.102 7.819 1.00 0.00 H new ATOM 0 HB2 SER A 376 -2.488 6.725 9.049 1.00 0.00 H new ATOM 0 HB3 SER A 376 -0.818 7.049 9.470 1.00 0.00 H new ATOM 0 HG SER A 376 -2.299 7.889 11.044 1.00 0.00 H new ATOM 238 N LEU A 377 0.611 8.428 6.786 1.00 0.00 N ATOM 239 CA LEU A 377 1.977 8.906 6.622 1.00 0.00 C ATOM 240 C LEU A 377 2.167 9.649 5.300 1.00 0.00 C ATOM 241 O LEU A 377 3.159 10.357 5.124 1.00 0.00 O ATOM 242 CB LEU A 377 2.964 7.738 6.706 1.00 0.00 C ATOM 243 CG LEU A 377 3.720 7.625 8.030 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.784 7.179 9.143 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.890 6.661 7.896 1.00 0.00 C ATOM 0 H LEU A 377 0.309 7.758 6.079 1.00 0.00 H new ATOM 0 HA LEU A 377 2.173 9.608 7.432 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.420 6.809 6.535 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.689 7.836 5.898 1.00 0.00 H new ATOM 0 HG LEU A 377 4.113 8.609 8.287 1.00 0.00 H new ATOM 0 HD11 LEU A 377 3.340 7.104 10.078 1.00 0.00 H new ATOM 0 HD12 LEU A 377 1.980 7.907 9.256 1.00 0.00 H new ATOM 0 HD13 LEU A 377 2.360 6.206 8.894 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.416 6.593 8.848 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.519 5.675 7.616 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.574 7.023 7.128 1.00 0.00 H new ATOM 257 N ILE A 378 1.231 9.486 4.366 1.00 0.00 N ATOM 258 CA ILE A 378 1.345 10.155 3.072 1.00 0.00 C ATOM 259 C ILE A 378 -0.015 10.531 2.483 1.00 0.00 C ATOM 260 O ILE A 378 -0.138 11.551 1.805 1.00 0.00 O ATOM 261 CB ILE A 378 2.118 9.285 2.060 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.390 7.966 1.806 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.528 9.021 2.564 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.795 7.305 0.507 1.00 0.00 C ATOM 0 H ILE A 378 0.399 8.907 4.478 1.00 0.00 H new ATOM 0 HA ILE A 378 1.898 11.076 3.257 1.00 0.00 H new ATOM 0 HB ILE A 378 2.176 9.828 1.117 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.589 7.283 2.632 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.315 8.147 1.795 1.00 0.00 H new ATOM 0 HG21 ILE A 378 4.064 8.406 1.841 1.00 0.00 H new ATOM 0 HG22 ILE A 378 4.052 9.968 2.693 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.481 8.499 3.520 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.243 6.373 0.385 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.570 7.971 -0.326 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.864 7.094 0.524 1.00 0.00 H new ATOM 276 N GLY A 379 -1.027 9.706 2.728 1.00 0.00 N ATOM 277 CA GLY A 379 -2.349 9.985 2.196 1.00 0.00 C ATOM 278 C GLY A 379 -2.974 11.236 2.786 1.00 0.00 C ATOM 279 O GLY A 379 -3.411 11.234 3.937 1.00 0.00 O ATOM 0 H GLY A 379 -0.957 8.853 3.283 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.283 10.094 1.113 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.000 9.133 2.391 1.00 0.00 H new ATOM 283 N TYR A 380 -3.021 12.310 1.996 1.00 0.00 N ATOM 284 CA TYR A 380 -3.605 13.566 2.457 1.00 0.00 C ATOM 285 C TYR A 380 -4.920 13.867 1.740 1.00 0.00 C ATOM 286 O TYR A 380 -5.819 14.486 2.311 1.00 0.00 O ATOM 287 CB TYR A 380 -2.630 14.734 2.268 1.00 0.00 C ATOM 288 CG TYR A 380 -1.720 14.609 1.063 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.236 14.563 -0.227 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.343 14.547 1.219 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.402 14.455 -1.324 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.497 14.441 0.129 1.00 0.00 C ATOM 293 CZ TYR A 380 -0.037 14.395 -1.142 1.00 0.00 C ATOM 294 OH TYR A 380 0.796 14.290 -2.231 1.00 0.00 O ATOM 0 H TYR A 380 -2.664 12.334 1.041 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.810 13.451 3.521 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.203 15.657 2.180 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.015 14.825 3.163 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.305 14.612 -0.374 1.00 0.00 H new ATOM 0 HD2 TYR A 380 0.080 14.582 2.212 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.818 14.418 -2.320 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.567 14.394 0.270 1.00 0.00 H new ATOM 0 HH TYR A 380 1.614 13.816 -1.973 1.00 0.00 H new ATOM 304 N ALA A 381 -5.028 13.430 0.490 1.00 0.00 N ATOM 305 CA ALA A 381 -6.234 13.658 -0.300 1.00 0.00 C ATOM 306 C ALA A 381 -6.087 13.067 -1.698 1.00 0.00 C ATOM 307 O ALA A 381 -6.563 11.963 -1.968 1.00 0.00 O ATOM 308 CB ALA A 381 -6.544 15.146 -0.382 1.00 0.00 C ATOM 0 H ALA A 381 -4.295 12.916 0.001 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.065 13.157 0.196 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -7.446 15.298 -0.975 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -6.699 15.541 0.622 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -5.709 15.666 -0.852 1.00 0.00 H new ATOM 314 N SER A 382 -5.417 13.800 -2.584 1.00 0.00 N ATOM 315 CA SER A 382 -5.202 13.336 -3.950 1.00 0.00 C ATOM 316 C SER A 382 -4.509 11.977 -3.949 1.00 0.00 C ATOM 317 O SER A 382 -4.659 11.188 -4.883 1.00 0.00 O ATOM 318 CB SER A 382 -4.363 14.350 -4.731 1.00 0.00 C ATOM 319 OG SER A 382 -4.479 14.143 -6.128 1.00 0.00 O ATOM 0 H SER A 382 -5.015 14.715 -2.380 1.00 0.00 H new ATOM 0 HA SER A 382 -6.173 13.234 -4.435 1.00 0.00 H new ATOM 0 HB2 SER A 382 -4.685 15.361 -4.482 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.318 14.267 -4.434 1.00 0.00 H new ATOM 0 HG SER A 382 -3.935 14.805 -6.603 1.00 0.00 H new ATOM 325 N LEU A 383 -3.757 11.710 -2.886 1.00 0.00 N ATOM 326 CA LEU A 383 -3.043 10.449 -2.742 1.00 0.00 C ATOM 327 C LEU A 383 -4.020 9.318 -2.425 1.00 0.00 C ATOM 328 O LEU A 383 -3.977 8.726 -1.347 1.00 0.00 O ATOM 329 CB LEU A 383 -1.990 10.574 -1.632 1.00 0.00 C ATOM 330 CG LEU A 383 -0.585 10.054 -1.962 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.483 8.565 -1.674 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.210 10.350 -3.409 1.00 0.00 C ATOM 0 H LEU A 383 -3.627 12.356 -2.107 1.00 0.00 H new ATOM 0 HA LEU A 383 -2.542 10.215 -3.681 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.909 11.625 -1.355 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.354 10.040 -0.754 1.00 0.00 H new ATOM 0 HG LEU A 383 0.124 10.579 -1.321 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.521 8.216 -1.915 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.687 8.384 -0.619 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -1.210 8.026 -2.282 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.791 9.969 -3.611 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -0.924 9.866 -4.076 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.229 11.427 -3.577 1.00 0.00 H new ATOM 344 N ARG A 384 -4.909 9.033 -3.372 1.00 0.00 N ATOM 345 CA ARG A 384 -5.907 7.984 -3.199 1.00 0.00 C ATOM 346 C ARG A 384 -5.248 6.621 -3.026 1.00 0.00 C ATOM 347 O ARG A 384 -5.164 5.835 -3.971 1.00 0.00 O ATOM 348 CB ARG A 384 -6.855 7.955 -4.400 1.00 0.00 C ATOM 349 CG ARG A 384 -8.255 7.468 -4.058 1.00 0.00 C ATOM 350 CD ARG A 384 -9.305 8.114 -4.948 1.00 0.00 C ATOM 351 NE ARG A 384 -10.378 8.729 -4.170 1.00 0.00 N ATOM 352 CZ ARG A 384 -11.571 9.041 -4.670 1.00 0.00 C ATOM 353 NH1 ARG A 384 -11.850 8.796 -5.944 1.00 0.00 N ATOM 354 NH2 ARG A 384 -12.490 9.599 -3.893 1.00 0.00 N ATOM 0 H ARG A 384 -4.958 9.516 -4.269 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.476 8.206 -2.296 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.921 8.957 -4.824 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -6.433 7.310 -5.170 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.301 6.385 -4.168 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -8.474 7.692 -3.014 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -8.833 8.870 -5.576 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -9.726 7.363 -5.616 1.00 0.00 H new ATOM 0 HE ARG A 384 -10.202 8.931 -3.186 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -11.148 8.366 -6.546 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -12.766 9.038 -6.321 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -12.282 9.789 -2.913 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -13.405 9.838 -4.276 1.00 0.00 H new ATOM 366 N LEU A 385 -4.786 6.342 -1.812 1.00 0.00 N ATOM 367 CA LEU A 385 -4.139 5.070 -1.516 1.00 0.00 C ATOM 368 C LEU A 385 -5.127 3.919 -1.660 1.00 0.00 C ATOM 369 O LEU A 385 -5.908 3.639 -0.750 1.00 0.00 O ATOM 370 CB LEU A 385 -3.555 5.084 -0.102 1.00 0.00 C ATOM 371 CG LEU A 385 -2.702 3.865 0.257 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.222 4.211 0.200 1.00 0.00 C ATOM 373 CD2 LEU A 385 -3.075 3.340 1.635 1.00 0.00 C ATOM 0 H LEU A 385 -4.848 6.979 -1.018 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.329 4.926 -2.231 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -2.947 5.981 0.015 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.375 5.159 0.613 1.00 0.00 H new ATOM 0 HG LEU A 385 -2.899 3.081 -0.475 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -0.632 3.331 0.458 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -0.963 4.538 -0.807 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.008 5.012 0.908 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -2.458 2.473 1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.909 4.119 2.379 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -4.126 3.051 1.642 1.00 0.00 H new ATOM 385 N HIS A 386 -5.085 3.252 -2.808 1.00 0.00 N ATOM 386 CA HIS A 386 -5.974 2.130 -3.076 1.00 0.00 C ATOM 387 C HIS A 386 -5.184 0.930 -3.581 1.00 0.00 C ATOM 388 O HIS A 386 -4.367 1.051 -4.495 1.00 0.00 O ATOM 389 CB HIS A 386 -7.041 2.525 -4.100 1.00 0.00 C ATOM 390 CG HIS A 386 -6.480 2.915 -5.432 1.00 0.00 C ATOM 391 ND1 HIS A 386 -6.114 4.208 -5.745 1.00 0.00 N ATOM 392 CD2 HIS A 386 -6.223 2.174 -6.536 1.00 0.00 C ATOM 393 CE1 HIS A 386 -5.657 4.244 -6.985 1.00 0.00 C ATOM 394 NE2 HIS A 386 -5.711 3.025 -7.486 1.00 0.00 N ATOM 0 H HIS A 386 -4.442 3.471 -3.569 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.467 1.855 -2.144 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.729 1.690 -4.235 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -7.623 3.357 -3.703 1.00 0.00 H new ATOM 0 HD1 HIS A 386 -6.185 5.010 -5.118 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -6.389 1.113 -6.649 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -5.300 5.123 -7.501 1.00 0.00 H new ATOM 403 N TYR A 387 -5.425 -0.228 -2.977 1.00 0.00 N ATOM 404 CA TYR A 387 -4.728 -1.446 -3.361 1.00 0.00 C ATOM 405 C TYR A 387 -5.501 -2.215 -4.421 1.00 0.00 C ATOM 406 O TYR A 387 -6.676 -2.535 -4.245 1.00 0.00 O ATOM 407 CB TYR A 387 -4.485 -2.325 -2.136 1.00 0.00 C ATOM 408 CG TYR A 387 -3.356 -1.819 -1.273 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.365 -0.518 -0.790 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.277 -2.631 -0.953 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.332 -0.040 -0.012 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.238 -2.161 -0.175 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.270 -0.863 0.294 1.00 0.00 C ATOM 414 OH TYR A 387 -0.237 -0.388 1.067 1.00 0.00 O ATOM 0 H TYR A 387 -6.098 -0.347 -2.220 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.767 -1.163 -3.789 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.398 -2.374 -1.542 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.261 -3.341 -2.461 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.195 0.131 -1.028 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.250 -3.647 -1.318 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.355 0.975 0.356 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.405 -2.805 0.065 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.599 0.035 1.873 1.00 0.00 H new ATOM 424 N VAL A 388 -4.827 -2.505 -5.526 1.00 0.00 N ATOM 425 CA VAL A 388 -5.434 -3.234 -6.626 1.00 0.00 C ATOM 426 C VAL A 388 -4.852 -4.638 -6.739 1.00 0.00 C ATOM 427 O VAL A 388 -3.702 -4.814 -7.141 1.00 0.00 O ATOM 428 CB VAL A 388 -5.237 -2.495 -7.962 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.962 -3.216 -9.089 1.00 0.00 C ATOM 430 CG2 VAL A 388 -5.712 -1.054 -7.851 1.00 0.00 C ATOM 0 H VAL A 388 -3.854 -2.244 -5.682 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.501 -3.304 -6.414 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.172 -2.487 -8.195 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -5.809 -2.676 -10.024 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.569 -4.228 -9.186 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -7.028 -3.261 -8.866 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -5.565 -0.548 -8.805 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -6.771 -1.039 -7.592 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.141 -0.541 -7.076 1.00 0.00 H new ATOM 440 N THR A 389 -5.654 -5.633 -6.380 1.00 0.00 N ATOM 441 CA THR A 389 -5.221 -7.023 -6.438 1.00 0.00 C ATOM 442 C THR A 389 -5.352 -7.572 -7.855 1.00 0.00 C ATOM 443 O THR A 389 -6.375 -7.382 -8.512 1.00 0.00 O ATOM 444 CB THR A 389 -6.040 -7.873 -5.468 1.00 0.00 C ATOM 445 OG1 THR A 389 -7.369 -8.029 -5.934 1.00 0.00 O ATOM 446 CG2 THR A 389 -6.109 -7.290 -4.073 1.00 0.00 C ATOM 0 H THR A 389 -6.609 -5.503 -6.045 1.00 0.00 H new ATOM 0 HA THR A 389 -4.171 -7.066 -6.148 1.00 0.00 H new ATOM 0 HB THR A 389 -5.524 -8.832 -5.419 1.00 0.00 H new ATOM 0 HG1 THR A 389 -7.876 -8.578 -5.300 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.705 -7.943 -3.435 1.00 0.00 H new ATOM 0 HG22 THR A 389 -5.102 -7.204 -3.664 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.570 -6.303 -4.114 1.00 0.00 H new ATOM 594 N ASN A 399 1.023 -16.858 -6.994 1.00 0.00 N ATOM 595 CA ASN A 399 0.615 -16.493 -5.642 1.00 0.00 C ATOM 596 C ASN A 399 -0.352 -15.313 -5.667 1.00 0.00 C ATOM 597 O ASN A 399 -1.007 -15.059 -6.679 1.00 0.00 O ATOM 598 CB ASN A 399 1.842 -16.150 -4.788 1.00 0.00 C ATOM 599 CG ASN A 399 3.111 -16.818 -5.280 1.00 0.00 C ATOM 600 OD1 ASN A 399 3.510 -17.869 -4.779 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.752 -16.206 -6.268 1.00 0.00 N ATOM 0 HA ASN A 399 0.104 -17.348 -5.199 1.00 0.00 H new ATOM 0 HB2 ASN A 399 1.985 -15.069 -4.784 1.00 0.00 H new ATOM 0 HB3 ASN A 399 1.656 -16.451 -3.757 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.612 -16.606 -6.642 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.384 -15.336 -6.653 1.00 0.00 H new ATOM 608 N SER A 400 -0.441 -14.592 -4.551 1.00 0.00 N ATOM 609 CA SER A 400 -1.328 -13.444 -4.459 1.00 0.00 C ATOM 610 C SER A 400 -0.544 -12.143 -4.607 1.00 0.00 C ATOM 611 O SER A 400 0.153 -11.722 -3.684 1.00 0.00 O ATOM 612 CB SER A 400 -2.084 -13.461 -3.130 1.00 0.00 C ATOM 613 OG SER A 400 -1.973 -14.720 -2.491 1.00 0.00 O ATOM 0 H SER A 400 0.091 -14.785 -3.702 1.00 0.00 H new ATOM 0 HA SER A 400 -2.051 -13.503 -5.273 1.00 0.00 H new ATOM 0 HB2 SER A 400 -1.691 -12.683 -2.476 1.00 0.00 H new ATOM 0 HB3 SER A 400 -3.135 -13.230 -3.304 1.00 0.00 H new ATOM 0 HG SER A 400 -1.038 -14.880 -2.243 1.00 0.00 H new ATOM 619 N ILE A 401 -0.651 -11.513 -5.777 1.00 0.00 N ATOM 620 CA ILE A 401 0.060 -10.272 -6.038 1.00 0.00 C ATOM 621 C ILE A 401 -0.866 -9.060 -5.942 1.00 0.00 C ATOM 622 O ILE A 401 -1.917 -9.014 -6.581 1.00 0.00 O ATOM 623 CB ILE A 401 0.738 -10.306 -7.429 1.00 0.00 C ATOM 624 CG1 ILE A 401 1.967 -9.396 -7.447 1.00 0.00 C ATOM 625 CG2 ILE A 401 -0.239 -9.911 -8.531 1.00 0.00 C ATOM 626 CD1 ILE A 401 1.661 -7.955 -7.099 1.00 0.00 C ATOM 0 H ILE A 401 -1.223 -11.844 -6.554 1.00 0.00 H new ATOM 0 HA ILE A 401 0.828 -10.176 -5.271 1.00 0.00 H new ATOM 0 HB ILE A 401 1.060 -11.330 -7.621 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.704 -9.782 -6.743 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.421 -9.433 -8.437 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.268 -9.945 -9.496 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -1.079 -10.605 -8.538 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -0.604 -8.900 -8.348 1.00 0.00 H new ATOM 0 HD11 ILE A 401 2.580 -7.370 -7.132 1.00 0.00 H new ATOM 0 HD12 ILE A 401 0.947 -7.551 -7.817 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.235 -7.905 -6.097 1.00 0.00 H new ATOM 638 N VAL A 402 -0.459 -8.076 -5.147 1.00 0.00 N ATOM 639 CA VAL A 402 -1.235 -6.858 -4.973 1.00 0.00 C ATOM 640 C VAL A 402 -0.353 -5.631 -5.162 1.00 0.00 C ATOM 641 O VAL A 402 0.861 -5.693 -4.968 1.00 0.00 O ATOM 642 CB VAL A 402 -1.902 -6.800 -3.585 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.767 -5.553 -3.455 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.725 -8.055 -3.338 1.00 0.00 C ATOM 0 H VAL A 402 0.409 -8.101 -4.611 1.00 0.00 H new ATOM 0 HA VAL A 402 -2.019 -6.865 -5.730 1.00 0.00 H new ATOM 0 HB VAL A 402 -1.119 -6.749 -2.829 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -3.229 -5.532 -2.468 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -2.148 -4.665 -3.585 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.545 -5.568 -4.219 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -3.189 -7.998 -2.353 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.500 -8.138 -4.100 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -2.077 -8.930 -3.383 1.00 0.00 H new ATOM 654 N GLU A 403 -0.964 -4.518 -5.548 1.00 0.00 N ATOM 655 CA GLU A 403 -0.223 -3.285 -5.770 1.00 0.00 C ATOM 656 C GLU A 403 -0.961 -2.081 -5.198 1.00 0.00 C ATOM 657 O GLU A 403 -2.175 -1.950 -5.353 1.00 0.00 O ATOM 658 CB GLU A 403 0.028 -3.078 -7.265 1.00 0.00 C ATOM 659 CG GLU A 403 0.880 -4.166 -7.896 1.00 0.00 C ATOM 660 CD GLU A 403 0.369 -4.589 -9.260 1.00 0.00 C ATOM 661 OE1 GLU A 403 -0.380 -3.808 -9.881 1.00 0.00 O ATOM 662 OE2 GLU A 403 0.719 -5.703 -9.705 1.00 0.00 O ATOM 0 H GLU A 403 -1.968 -4.445 -5.713 1.00 0.00 H new ATOM 0 HA GLU A 403 0.732 -3.375 -5.253 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.930 -3.033 -7.783 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.516 -2.115 -7.413 1.00 0.00 H new ATOM 0 HG2 GLU A 403 1.906 -3.810 -7.991 1.00 0.00 H new ATOM 0 HG3 GLU A 403 0.903 -5.033 -7.236 1.00 0.00 H new ATOM 669 N CYS A 404 -0.213 -1.200 -4.541 1.00 0.00 N ATOM 670 CA CYS A 404 -0.784 0.002 -3.950 1.00 0.00 C ATOM 671 C CYS A 404 -0.664 1.176 -4.914 1.00 0.00 C ATOM 672 O CYS A 404 0.425 1.709 -5.123 1.00 0.00 O ATOM 673 CB CYS A 404 -0.077 0.331 -2.633 1.00 0.00 C ATOM 674 SG CYS A 404 -0.625 1.872 -1.859 1.00 0.00 S ATOM 0 H CYS A 404 0.793 -1.298 -4.405 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.840 -0.179 -3.748 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.236 -0.490 -1.934 1.00 0.00 H new ATOM 0 HB3 CYS A 404 0.996 0.391 -2.815 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.540 1.611 -0.973 1.00 0.00 H new ATOM 680 N ARG A 405 -1.787 1.579 -5.497 1.00 0.00 N ATOM 681 CA ARG A 405 -1.802 2.690 -6.434 1.00 0.00 C ATOM 682 C ARG A 405 -2.398 3.929 -5.786 1.00 0.00 C ATOM 683 O ARG A 405 -3.372 3.844 -5.039 1.00 0.00 O ATOM 684 CB ARG A 405 -2.596 2.323 -7.688 1.00 0.00 C ATOM 685 CG ARG A 405 -1.978 1.193 -8.493 1.00 0.00 C ATOM 686 CD ARG A 405 -2.568 1.118 -9.891 1.00 0.00 C ATOM 687 NE ARG A 405 -2.028 -0.006 -10.654 1.00 0.00 N ATOM 688 CZ ARG A 405 -2.107 -0.108 -11.979 1.00 0.00 C ATOM 689 NH1 ARG A 405 -2.699 0.844 -12.691 1.00 0.00 N ATOM 690 NH2 ARG A 405 -1.590 -1.162 -12.594 1.00 0.00 N ATOM 0 H ARG A 405 -2.699 1.151 -5.335 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.773 2.906 -6.720 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.607 2.039 -7.397 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.683 3.205 -8.323 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -0.900 1.339 -8.559 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -2.140 0.246 -7.977 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -3.652 1.022 -9.822 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -2.363 2.048 -10.421 1.00 0.00 H new ATOM 0 HE ARG A 405 -1.564 -0.756 -10.141 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -3.096 1.659 -12.223 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -2.757 0.761 -13.706 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -1.132 -1.895 -12.052 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -1.650 -1.241 -13.609 1.00 0.00 H new ATOM 702 N VAL A 406 -1.809 5.080 -6.075 1.00 0.00 N ATOM 703 CA VAL A 406 -2.285 6.334 -5.517 1.00 0.00 C ATOM 704 C VAL A 406 -2.618 7.338 -6.615 1.00 0.00 C ATOM 705 O VAL A 406 -2.128 7.231 -7.739 1.00 0.00 O ATOM 706 CB VAL A 406 -1.249 6.957 -4.563 1.00 0.00 C ATOM 707 CG1 VAL A 406 -1.038 6.066 -3.348 1.00 0.00 C ATOM 708 CG2 VAL A 406 0.066 7.205 -5.288 1.00 0.00 C ATOM 0 H VAL A 406 -1.002 5.170 -6.692 1.00 0.00 H new ATOM 0 HA VAL A 406 -3.190 6.103 -4.956 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.632 7.917 -4.218 1.00 0.00 H new ATOM 0 HG11 VAL A 406 -0.303 6.522 -2.685 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -1.982 5.947 -2.816 1.00 0.00 H new ATOM 0 HG13 VAL A 406 -0.678 5.089 -3.671 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.785 7.645 -4.597 1.00 0.00 H new ATOM 0 HG22 VAL A 406 0.457 6.260 -5.665 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -0.101 7.887 -6.121 1.00 0.00 H new ATOM 744 N THR A 410 -0.425 5.757 -9.839 1.00 0.00 N ATOM 745 CA THR A 410 0.973 5.682 -9.442 1.00 0.00 C ATOM 746 C THR A 410 1.166 4.673 -8.315 1.00 0.00 C ATOM 747 O THR A 410 0.724 4.893 -7.188 1.00 0.00 O ATOM 748 CB THR A 410 1.476 7.058 -9.002 1.00 0.00 C ATOM 749 OG1 THR A 410 1.297 8.010 -10.035 1.00 0.00 O ATOM 750 CG2 THR A 410 2.939 7.066 -8.618 1.00 0.00 C ATOM 0 HA THR A 410 1.551 5.351 -10.305 1.00 0.00 H new ATOM 0 HB THR A 410 0.886 7.314 -8.122 1.00 0.00 H new ATOM 0 HG1 THR A 410 0.529 7.753 -10.587 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.230 8.072 -8.316 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.101 6.377 -7.789 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.541 6.755 -9.472 1.00 0.00 H new ATOM 758 N VAL A 411 1.830 3.565 -8.629 1.00 0.00 N ATOM 759 CA VAL A 411 2.082 2.521 -7.643 1.00 0.00 C ATOM 760 C VAL A 411 3.213 2.919 -6.701 1.00 0.00 C ATOM 761 O VAL A 411 4.341 3.158 -7.133 1.00 0.00 O ATOM 762 CB VAL A 411 2.431 1.182 -8.321 1.00 0.00 C ATOM 763 CG1 VAL A 411 3.706 1.308 -9.142 1.00 0.00 C ATOM 764 CG2 VAL A 411 2.562 0.075 -7.286 1.00 0.00 C ATOM 0 H VAL A 411 2.203 3.367 -9.558 1.00 0.00 H new ATOM 0 HA VAL A 411 1.164 2.396 -7.068 1.00 0.00 H new ATOM 0 HB VAL A 411 1.618 0.921 -8.998 1.00 0.00 H new ATOM 0 HG11 VAL A 411 3.933 0.351 -9.611 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.569 2.067 -9.913 1.00 0.00 H new ATOM 0 HG13 VAL A 411 4.531 1.597 -8.491 1.00 0.00 H new ATOM 0 HG21 VAL A 411 2.809 -0.862 -7.785 1.00 0.00 H new ATOM 0 HG22 VAL A 411 3.352 0.329 -6.580 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.619 -0.036 -6.751 1.00 0.00 H new ATOM 774 N LEU A 412 2.900 2.991 -5.413 1.00 0.00 N ATOM 775 CA LEU A 412 3.883 3.362 -4.405 1.00 0.00 C ATOM 776 C LEU A 412 4.332 2.148 -3.598 1.00 0.00 C ATOM 777 O LEU A 412 5.393 2.167 -2.973 1.00 0.00 O ATOM 778 CB LEU A 412 3.302 4.422 -3.467 1.00 0.00 C ATOM 779 CG LEU A 412 4.332 5.359 -2.832 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.472 6.631 -3.655 1.00 0.00 C ATOM 781 CD2 LEU A 412 3.940 5.688 -1.400 1.00 0.00 C ATOM 0 H LEU A 412 1.970 2.797 -5.042 1.00 0.00 H new ATOM 0 HA LEU A 412 4.753 3.771 -4.919 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.582 5.022 -4.023 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.752 3.919 -2.672 1.00 0.00 H new ATOM 0 HG LEU A 412 5.297 4.853 -2.816 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.208 7.286 -3.190 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.798 6.378 -4.664 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.510 7.142 -3.702 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.683 6.355 -0.963 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.965 6.176 -1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 412 3.890 4.769 -0.816 1.00 0.00 H new ATOM 793 N GLY A 413 3.518 1.095 -3.605 1.00 0.00 N ATOM 794 CA GLY A 413 3.860 -0.103 -2.857 1.00 0.00 C ATOM 795 C GLY A 413 3.308 -1.371 -3.481 1.00 0.00 C ATOM 796 O GLY A 413 2.100 -1.601 -3.471 1.00 0.00 O ATOM 0 H GLY A 413 2.634 1.050 -4.111 1.00 0.00 H new ATOM 0 HA2 GLY A 413 4.945 -0.183 -2.786 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.480 -0.010 -1.840 1.00 0.00 H new ATOM 800 N THR A 414 4.200 -2.198 -4.018 1.00 0.00 N ATOM 801 CA THR A 414 3.806 -3.452 -4.642 1.00 0.00 C ATOM 802 C THR A 414 4.461 -4.634 -3.931 1.00 0.00 C ATOM 803 O THR A 414 5.629 -4.567 -3.546 1.00 0.00 O ATOM 804 CB THR A 414 4.196 -3.443 -6.122 1.00 0.00 C ATOM 805 OG1 THR A 414 3.455 -2.466 -6.828 1.00 0.00 O ATOM 806 CG2 THR A 414 3.979 -4.773 -6.815 1.00 0.00 C ATOM 0 H THR A 414 5.204 -2.019 -4.032 1.00 0.00 H new ATOM 0 HA THR A 414 2.724 -3.558 -4.560 1.00 0.00 H new ATOM 0 HB THR A 414 5.263 -3.220 -6.134 1.00 0.00 H new ATOM 0 HG1 THR A 414 2.537 -2.441 -6.486 1.00 0.00 H new ATOM 0 HG21 THR A 414 4.277 -4.691 -7.860 1.00 0.00 H new ATOM 0 HG22 THR A 414 4.579 -5.540 -6.326 1.00 0.00 H new ATOM 0 HG23 THR A 414 2.925 -5.045 -6.758 1.00 0.00 H new ATOM 814 N GLY A 415 3.706 -5.715 -3.757 1.00 0.00 N ATOM 815 CA GLY A 415 4.243 -6.888 -3.091 1.00 0.00 C ATOM 816 C GLY A 415 3.330 -8.092 -3.197 1.00 0.00 C ATOM 817 O GLY A 415 2.106 -7.960 -3.151 1.00 0.00 O ATOM 0 H GLY A 415 2.737 -5.800 -4.064 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.213 -7.134 -3.524 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.412 -6.657 -2.039 1.00 0.00 H new ATOM 821 N VAL A 416 3.927 -9.271 -3.337 1.00 0.00 N ATOM 822 CA VAL A 416 3.166 -10.508 -3.447 1.00 0.00 C ATOM 823 C VAL A 416 2.846 -11.076 -2.074 1.00 0.00 C ATOM 824 O VAL A 416 3.233 -10.520 -1.046 1.00 0.00 O ATOM 825 CB VAL A 416 3.930 -11.564 -4.277 1.00 0.00 C ATOM 826 CG1 VAL A 416 5.025 -12.232 -3.453 1.00 0.00 C ATOM 827 CG2 VAL A 416 2.980 -12.600 -4.857 1.00 0.00 C ATOM 0 H VAL A 416 4.939 -9.395 -3.377 1.00 0.00 H new ATOM 0 HA VAL A 416 2.234 -10.268 -3.958 1.00 0.00 H new ATOM 0 HB VAL A 416 4.408 -11.044 -5.107 1.00 0.00 H new ATOM 0 HG11 VAL A 416 5.543 -12.969 -4.066 1.00 0.00 H new ATOM 0 HG12 VAL A 416 5.736 -11.479 -3.113 1.00 0.00 H new ATOM 0 HG13 VAL A 416 4.580 -12.726 -2.589 1.00 0.00 H new ATOM 0 HG21 VAL A 416 3.547 -13.330 -5.436 1.00 0.00 H new ATOM 0 HG22 VAL A 416 2.456 -13.107 -4.047 1.00 0.00 H new ATOM 0 HG23 VAL A 416 2.255 -12.107 -5.505 1.00 0.00 H new ATOM 837 N GLY A 417 2.135 -12.188 -2.075 1.00 0.00 N ATOM 838 CA GLY A 417 1.761 -12.834 -0.832 1.00 0.00 C ATOM 839 C GLY A 417 0.988 -14.117 -1.055 1.00 0.00 C ATOM 840 O GLY A 417 0.445 -14.342 -2.136 1.00 0.00 O ATOM 0 H GLY A 417 1.807 -12.660 -2.917 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.660 -13.051 -0.254 1.00 0.00 H new ATOM 0 HA3 GLY A 417 1.157 -12.149 -0.237 1.00 0.00 H new ATOM 844 N ARG A 418 0.937 -14.961 -0.031 1.00 0.00 N ATOM 845 CA ARG A 418 0.223 -16.229 -0.119 1.00 0.00 C ATOM 846 C ARG A 418 -1.286 -16.011 -0.063 1.00 0.00 C ATOM 847 O ARG A 418 -2.061 -16.848 -0.527 1.00 0.00 O ATOM 848 CB ARG A 418 0.657 -17.164 1.011 1.00 0.00 C ATOM 849 CG ARG A 418 2.167 -17.273 1.166 1.00 0.00 C ATOM 850 CD ARG A 418 2.626 -16.827 2.547 1.00 0.00 C ATOM 851 NE ARG A 418 3.018 -17.957 3.386 1.00 0.00 N ATOM 852 CZ ARG A 418 3.152 -17.887 4.708 1.00 0.00 C ATOM 853 NH1 ARG A 418 2.923 -16.746 5.347 1.00 0.00 N ATOM 854 NH2 ARG A 418 3.515 -18.962 5.395 1.00 0.00 N ATOM 0 H ARG A 418 1.382 -14.790 0.871 1.00 0.00 H new ATOM 0 HA ARG A 418 0.470 -16.689 -1.076 1.00 0.00 H new ATOM 0 HB2 ARG A 418 0.229 -16.810 1.949 1.00 0.00 H new ATOM 0 HB3 ARG A 418 0.246 -18.157 0.828 1.00 0.00 H new ATOM 0 HG2 ARG A 418 2.477 -18.304 0.995 1.00 0.00 H new ATOM 0 HG3 ARG A 418 2.656 -16.663 0.406 1.00 0.00 H new ATOM 0 HD2 ARG A 418 3.468 -16.142 2.445 1.00 0.00 H new ATOM 0 HD3 ARG A 418 1.823 -16.275 3.035 1.00 0.00 H new ATOM 0 HE ARG A 418 3.200 -18.852 2.932 1.00 0.00 H new ATOM 0 HH11 ARG A 418 2.642 -15.916 4.824 1.00 0.00 H new ATOM 0 HH12 ARG A 418 3.028 -16.699 6.361 1.00 0.00 H new ATOM 0 HH21 ARG A 418 3.691 -19.842 4.910 1.00 0.00 H new ATOM 0 HH22 ARG A 418 3.618 -18.909 6.408 1.00 0.00 H new ATOM 866 N ASN A 419 -1.701 -14.884 0.509 1.00 0.00 N ATOM 867 CA ASN A 419 -3.119 -14.563 0.624 1.00 0.00 C ATOM 868 C ASN A 419 -3.344 -13.054 0.553 1.00 0.00 C ATOM 869 O ASN A 419 -2.409 -12.270 0.717 1.00 0.00 O ATOM 870 CB ASN A 419 -3.676 -15.120 1.936 1.00 0.00 C ATOM 871 CG ASN A 419 -5.158 -14.853 2.099 1.00 0.00 C ATOM 872 OD1 ASN A 419 -5.972 -15.285 1.283 1.00 0.00 O ATOM 873 ND2 ASN A 419 -5.516 -14.135 3.156 1.00 0.00 N ATOM 0 H ASN A 419 -1.076 -14.179 0.899 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.645 -15.024 -0.212 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -3.498 -16.195 1.975 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -3.136 -14.677 2.773 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -6.500 -13.921 3.318 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -4.807 -13.797 3.807 1.00 0.00 H new ATOM 880 N ILE A 420 -4.588 -12.655 0.303 1.00 0.00 N ATOM 881 CA ILE A 420 -4.940 -11.240 0.203 1.00 0.00 C ATOM 882 C ILE A 420 -4.400 -10.443 1.387 1.00 0.00 C ATOM 883 O ILE A 420 -3.736 -9.423 1.211 1.00 0.00 O ATOM 884 CB ILE A 420 -6.467 -11.043 0.120 1.00 0.00 C ATOM 885 CG1 ILE A 420 -7.052 -11.887 -1.013 1.00 0.00 C ATOM 886 CG2 ILE A 420 -6.805 -9.572 -0.081 1.00 0.00 C ATOM 887 CD1 ILE A 420 -7.626 -13.207 -0.549 1.00 0.00 C ATOM 0 H ILE A 420 -5.372 -13.293 0.165 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.481 -10.871 -0.714 1.00 0.00 H new ATOM 0 HB ILE A 420 -6.910 -11.372 1.060 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -7.834 -11.316 -1.514 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -6.274 -12.078 -1.752 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -7.887 -9.452 -0.137 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.419 -8.992 0.757 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -6.352 -9.218 -1.007 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -8.023 -13.752 -1.405 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -6.843 -13.798 -0.074 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.427 -13.024 0.167 1.00 0.00 H new ATOM 899 N LYS A 421 -4.696 -10.916 2.589 1.00 0.00 N ATOM 900 CA LYS A 421 -4.249 -10.251 3.809 1.00 0.00 C ATOM 901 C LYS A 421 -2.730 -10.106 3.830 1.00 0.00 C ATOM 902 O LYS A 421 -2.198 -9.083 4.266 1.00 0.00 O ATOM 903 CB LYS A 421 -4.711 -11.035 5.037 1.00 0.00 C ATOM 904 CG LYS A 421 -6.175 -11.437 4.985 1.00 0.00 C ATOM 905 CD LYS A 421 -6.682 -11.879 6.349 1.00 0.00 C ATOM 906 CE LYS A 421 -8.146 -12.285 6.295 1.00 0.00 C ATOM 907 NZ LYS A 421 -8.310 -13.762 6.199 1.00 0.00 N ATOM 0 H LYS A 421 -5.246 -11.760 2.748 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.690 -9.255 3.830 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.100 -11.932 5.136 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.540 -10.432 5.929 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.771 -10.597 4.629 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -6.305 -12.247 4.267 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.084 -12.717 6.706 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -6.555 -11.068 7.066 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -8.657 -11.920 7.186 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -8.623 -11.810 5.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -9.322 -13.997 6.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.845 -14.108 5.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -7.878 -14.214 7.030 1.00 0.00 H new ATOM 921 N ILE A 422 -2.039 -11.137 3.361 1.00 0.00 N ATOM 922 CA ILE A 422 -0.582 -11.135 3.330 1.00 0.00 C ATOM 923 C ILE A 422 -0.054 -10.225 2.225 1.00 0.00 C ATOM 924 O ILE A 422 0.730 -9.312 2.481 1.00 0.00 O ATOM 925 CB ILE A 422 -0.027 -12.566 3.141 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.188 -13.373 4.434 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.437 -12.533 2.721 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.609 -13.424 4.951 1.00 0.00 C ATOM 0 H ILE A 422 -2.466 -11.988 2.996 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.239 -10.751 4.290 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.598 -13.049 2.348 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.162 -14.391 4.262 1.00 0.00 H new ATOM 0 HG13 ILE A 422 0.453 -12.941 5.203 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.802 -13.552 2.595 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.533 -11.994 1.779 1.00 0.00 H new ATOM 0 HG23 ILE A 422 2.024 -12.029 3.489 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.642 -14.013 5.868 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -1.958 -12.412 5.157 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -2.253 -13.884 4.201 1.00 0.00 H new ATOM 940 N ALA A 423 -0.484 -10.483 0.997 1.00 0.00 N ATOM 941 CA ALA A 423 -0.050 -9.687 -0.147 1.00 0.00 C ATOM 942 C ALA A 423 -0.269 -8.200 0.105 1.00 0.00 C ATOM 943 O ALA A 423 0.533 -7.363 -0.309 1.00 0.00 O ATOM 944 CB ALA A 423 -0.778 -10.124 -1.409 1.00 0.00 C ATOM 0 H ALA A 423 -1.132 -11.236 0.766 1.00 0.00 H new ATOM 0 HA ALA A 423 1.018 -9.853 -0.286 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.441 -9.519 -2.251 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.564 -11.174 -1.608 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.852 -9.992 -1.274 1.00 0.00 H new ATOM 950 N GLY A 424 -1.358 -7.878 0.794 1.00 0.00 N ATOM 951 CA GLY A 424 -1.659 -6.494 1.098 1.00 0.00 C ATOM 952 C GLY A 424 -0.658 -5.894 2.064 1.00 0.00 C ATOM 953 O GLY A 424 -0.118 -4.814 1.821 1.00 0.00 O ATOM 0 H GLY A 424 -2.037 -8.552 1.147 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.665 -5.913 0.176 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.660 -6.426 1.524 1.00 0.00 H new ATOM 957 N ILE A 425 -0.403 -6.601 3.160 1.00 0.00 N ATOM 958 CA ILE A 425 0.548 -6.136 4.162 1.00 0.00 C ATOM 959 C ILE A 425 1.962 -6.099 3.587 1.00 0.00 C ATOM 960 O ILE A 425 2.793 -5.297 4.011 1.00 0.00 O ATOM 961 CB ILE A 425 0.528 -7.035 5.417 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.858 -7.011 6.061 1.00 0.00 C ATOM 963 CG2 ILE A 425 1.588 -6.590 6.415 1.00 0.00 C ATOM 964 CD1 ILE A 425 -1.206 -8.289 6.795 1.00 0.00 C ATOM 0 H ILE A 425 -0.841 -7.496 3.376 1.00 0.00 H new ATOM 0 HA ILE A 425 0.249 -5.128 4.450 1.00 0.00 H new ATOM 0 HB ILE A 425 0.755 -8.057 5.114 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -0.911 -6.175 6.758 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.606 -6.830 5.289 1.00 0.00 H new ATOM 0 HG21 ILE A 425 1.557 -7.237 7.292 1.00 0.00 H new ATOM 0 HG22 ILE A 425 2.573 -6.654 5.952 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.395 -5.561 6.716 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -2.203 -8.201 7.227 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -1.185 -9.126 6.097 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -0.480 -8.461 7.590 1.00 0.00 H new ATOM 976 N ARG A 426 2.227 -6.971 2.619 1.00 0.00 N ATOM 977 CA ARG A 426 3.539 -7.033 1.988 1.00 0.00 C ATOM 978 C ARG A 426 3.756 -5.832 1.076 1.00 0.00 C ATOM 979 O ARG A 426 4.801 -5.181 1.127 1.00 0.00 O ATOM 980 CB ARG A 426 3.688 -8.334 1.194 1.00 0.00 C ATOM 981 CG ARG A 426 4.756 -9.263 1.747 1.00 0.00 C ATOM 982 CD ARG A 426 5.348 -10.143 0.658 1.00 0.00 C ATOM 983 NE ARG A 426 6.782 -10.358 0.846 1.00 0.00 N ATOM 984 CZ ARG A 426 7.295 -11.176 1.762 1.00 0.00 C ATOM 985 NH1 ARG A 426 6.496 -11.859 2.572 1.00 0.00 N ATOM 986 NH2 ARG A 426 8.610 -11.313 1.865 1.00 0.00 N ATOM 0 H ARG A 426 1.551 -7.643 2.256 1.00 0.00 H new ATOM 0 HA ARG A 426 4.296 -7.012 2.772 1.00 0.00 H new ATOM 0 HB2 ARG A 426 2.732 -8.857 1.186 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.928 -8.093 0.159 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.547 -8.674 2.210 1.00 0.00 H new ATOM 0 HG3 ARG A 426 4.326 -9.889 2.528 1.00 0.00 H new ATOM 0 HD2 ARG A 426 4.835 -11.105 0.651 1.00 0.00 H new ATOM 0 HD3 ARG A 426 5.175 -9.682 -0.314 1.00 0.00 H new ATOM 0 HE ARG A 426 7.427 -9.851 0.240 1.00 0.00 H new ATOM 0 HH11 ARG A 426 5.484 -11.758 2.494 1.00 0.00 H new ATOM 0 HH12 ARG A 426 6.894 -12.485 3.272 1.00 0.00 H new ATOM 0 HH21 ARG A 426 9.227 -10.792 1.243 1.00 0.00 H new ATOM 0 HH22 ARG A 426 9.004 -11.940 2.567 1.00 0.00 H new ATOM 998 N ALA A 427 2.762 -5.539 0.249 1.00 0.00 N ATOM 999 CA ALA A 427 2.840 -4.411 -0.669 1.00 0.00 C ATOM 1000 C ALA A 427 2.936 -3.101 0.099 1.00 0.00 C ATOM 1001 O ALA A 427 3.743 -2.232 -0.230 1.00 0.00 O ATOM 1002 CB ALA A 427 1.634 -4.397 -1.596 1.00 0.00 C ATOM 0 H ALA A 427 1.891 -6.067 0.195 1.00 0.00 H new ATOM 0 HA ALA A 427 3.740 -4.521 -1.273 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.707 -3.548 -2.276 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.607 -5.322 -2.172 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.722 -4.311 -1.005 1.00 0.00 H new ATOM 1008 N ALA A 428 2.113 -2.974 1.132 1.00 0.00 N ATOM 1009 CA ALA A 428 2.108 -1.778 1.962 1.00 0.00 C ATOM 1010 C ALA A 428 3.462 -1.590 2.628 1.00 0.00 C ATOM 1011 O ALA A 428 3.950 -0.468 2.768 1.00 0.00 O ATOM 1012 CB ALA A 428 1.008 -1.865 3.007 1.00 0.00 C ATOM 0 H ALA A 428 1.440 -3.686 1.415 1.00 0.00 H new ATOM 0 HA ALA A 428 1.913 -0.914 1.327 1.00 0.00 H new ATOM 0 HB1 ALA A 428 1.017 -0.964 3.620 1.00 0.00 H new ATOM 0 HB2 ALA A 428 0.042 -1.958 2.511 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.176 -2.736 3.640 1.00 0.00 H new ATOM 1018 N GLU A 429 4.071 -2.701 3.029 1.00 0.00 N ATOM 1019 CA GLU A 429 5.377 -2.664 3.670 1.00 0.00 C ATOM 1020 C GLU A 429 6.428 -2.159 2.692 1.00 0.00 C ATOM 1021 O GLU A 429 7.341 -1.424 3.066 1.00 0.00 O ATOM 1022 CB GLU A 429 5.759 -4.053 4.186 1.00 0.00 C ATOM 1023 CG GLU A 429 5.359 -4.289 5.633 1.00 0.00 C ATOM 1024 CD GLU A 429 5.811 -5.642 6.149 1.00 0.00 C ATOM 1025 OE1 GLU A 429 7.025 -5.928 6.080 1.00 0.00 O ATOM 1026 OE2 GLU A 429 4.951 -6.415 6.622 1.00 0.00 O ATOM 0 H GLU A 429 3.680 -3.637 2.921 1.00 0.00 H new ATOM 0 HA GLU A 429 5.328 -1.981 4.518 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.287 -4.809 3.558 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.836 -4.185 4.088 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.787 -3.505 6.257 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.275 -4.213 5.724 1.00 0.00 H new ATOM 1033 N ASN A 430 6.279 -2.548 1.430 1.00 0.00 N ATOM 1034 CA ASN A 430 7.202 -2.124 0.387 1.00 0.00 C ATOM 1035 C ASN A 430 7.107 -0.616 0.188 1.00 0.00 C ATOM 1036 O ASN A 430 8.094 0.043 -0.141 1.00 0.00 O ATOM 1037 CB ASN A 430 6.895 -2.853 -0.924 1.00 0.00 C ATOM 1038 CG ASN A 430 7.855 -3.996 -1.189 1.00 0.00 C ATOM 1039 OD1 ASN A 430 8.211 -4.747 -0.280 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.281 -4.133 -2.439 1.00 0.00 N ATOM 0 H ASN A 430 5.527 -3.156 1.106 1.00 0.00 H new ATOM 0 HA ASN A 430 8.217 -2.376 0.693 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.876 -3.238 -0.892 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.942 -2.144 -1.750 1.00 0.00 H new ATOM 0 HD21 ASN A 430 8.929 -4.884 -2.678 1.00 0.00 H new ATOM 0 HD22 ASN A 430 7.960 -3.488 -3.161 1.00 0.00 H new ATOM 1047 N ALA A 431 5.909 -0.078 0.400 1.00 0.00 N ATOM 1048 CA ALA A 431 5.675 1.351 0.256 1.00 0.00 C ATOM 1049 C ALA A 431 6.220 2.114 1.459 1.00 0.00 C ATOM 1050 O ALA A 431 6.626 3.270 1.341 1.00 0.00 O ATOM 1051 CB ALA A 431 4.188 1.625 0.082 1.00 0.00 C ATOM 0 H ALA A 431 5.085 -0.614 0.673 1.00 0.00 H new ATOM 0 HA ALA A 431 6.202 1.698 -0.633 1.00 0.00 H new ATOM 0 HB1 ALA A 431 4.026 2.698 -0.025 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.825 1.113 -0.809 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.646 1.261 0.955 1.00 0.00 H new ATOM 1057 N LEU A 432 6.229 1.457 2.616 1.00 0.00 N ATOM 1058 CA LEU A 432 6.728 2.071 3.841 1.00 0.00 C ATOM 1059 C LEU A 432 8.253 2.107 3.849 1.00 0.00 C ATOM 1060 O LEU A 432 8.860 2.988 4.458 1.00 0.00 O ATOM 1061 CB LEU A 432 6.217 1.307 5.065 1.00 0.00 C ATOM 1062 CG LEU A 432 4.945 1.874 5.698 1.00 0.00 C ATOM 1063 CD1 LEU A 432 3.746 1.622 4.799 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.719 1.267 7.075 1.00 0.00 C ATOM 0 H LEU A 432 5.896 0.500 2.730 1.00 0.00 H new ATOM 0 HA LEU A 432 6.358 3.096 3.881 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.031 0.272 4.777 1.00 0.00 H new ATOM 0 HB3 LEU A 432 7.004 1.291 5.819 1.00 0.00 H new ATOM 0 HG LEU A 432 5.067 2.951 5.814 1.00 0.00 H new ATOM 0 HD11 LEU A 432 2.850 2.032 5.265 1.00 0.00 H new ATOM 0 HD12 LEU A 432 3.907 2.104 3.835 1.00 0.00 H new ATOM 0 HD13 LEU A 432 3.620 0.549 4.652 1.00 0.00 H new ATOM 0 HD21 LEU A 432 3.810 1.682 7.511 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.617 0.186 6.984 1.00 0.00 H new ATOM 0 HD23 LEU A 432 5.568 1.498 7.718 1.00 0.00 H new ATOM 1076 N ARG A 433 8.867 1.142 3.170 1.00 0.00 N ATOM 1077 CA ARG A 433 10.321 1.061 3.100 1.00 0.00 C ATOM 1078 C ARG A 433 10.912 2.332 2.499 1.00 0.00 C ATOM 1079 O ARG A 433 11.968 2.799 2.924 1.00 0.00 O ATOM 1080 CB ARG A 433 10.747 -0.154 2.274 1.00 0.00 C ATOM 1081 CG ARG A 433 10.923 -1.418 3.099 1.00 0.00 C ATOM 1082 CD ARG A 433 11.587 -2.523 2.292 1.00 0.00 C ATOM 1083 NE ARG A 433 13.008 -2.262 2.074 1.00 0.00 N ATOM 1084 CZ ARG A 433 13.832 -3.109 1.462 1.00 0.00 C ATOM 1085 NH1 ARG A 433 13.381 -4.272 1.007 1.00 0.00 N ATOM 1086 NH2 ARG A 433 15.110 -2.794 1.304 1.00 0.00 N ATOM 0 H ARG A 433 8.379 0.405 2.661 1.00 0.00 H new ATOM 0 HA ARG A 433 10.701 0.952 4.116 1.00 0.00 H new ATOM 0 HB2 ARG A 433 10.002 -0.336 1.500 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.685 0.072 1.767 1.00 0.00 H new ATOM 0 HG2 ARG A 433 11.525 -1.197 3.980 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.951 -1.760 3.455 1.00 0.00 H new ATOM 0 HD2 ARG A 433 11.468 -3.473 2.812 1.00 0.00 H new ATOM 0 HD3 ARG A 433 11.084 -2.621 1.330 1.00 0.00 H new ATOM 0 HE ARG A 433 13.391 -1.379 2.411 1.00 0.00 H new ATOM 0 HH11 ARG A 433 12.399 -4.520 1.126 1.00 0.00 H new ATOM 0 HH12 ARG A 433 14.017 -4.918 0.539 1.00 0.00 H new ATOM 0 HH21 ARG A 433 15.462 -1.902 1.652 1.00 0.00 H new ATOM 0 HH22 ARG A 433 15.741 -3.444 0.835 1.00 0.00 H new ATOM 1098 N ASP A 434 10.224 2.885 1.506 1.00 0.00 N ATOM 1099 CA ASP A 434 10.680 4.104 0.846 1.00 0.00 C ATOM 1100 C ASP A 434 10.640 5.288 1.808 1.00 0.00 C ATOM 1101 O ASP A 434 9.740 6.125 1.742 1.00 0.00 O ATOM 1102 CB ASP A 434 9.821 4.394 -0.386 1.00 0.00 C ATOM 1103 CG ASP A 434 10.651 4.835 -1.576 1.00 0.00 C ATOM 1104 OD1 ASP A 434 10.917 6.049 -1.698 1.00 0.00 O ATOM 1105 OD2 ASP A 434 11.034 3.965 -2.388 1.00 0.00 O ATOM 0 H ASP A 434 9.349 2.509 1.140 1.00 0.00 H new ATOM 0 HA ASP A 434 11.712 3.955 0.528 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.256 3.500 -0.651 1.00 0.00 H new ATOM 0 HB3 ASP A 434 9.095 5.170 -0.145 1.00 0.00 H new ATOM 1110 N LYS A 435 11.620 5.348 2.703 1.00 0.00 N ATOM 1111 CA LYS A 435 11.699 6.426 3.683 1.00 0.00 C ATOM 1112 C LYS A 435 11.781 7.784 2.998 1.00 0.00 C ATOM 1113 O LYS A 435 11.178 8.756 3.450 1.00 0.00 O ATOM 1114 CB LYS A 435 12.911 6.226 4.596 1.00 0.00 C ATOM 1115 CG LYS A 435 12.642 6.578 6.050 1.00 0.00 C ATOM 1116 CD LYS A 435 13.828 7.288 6.684 1.00 0.00 C ATOM 1117 CE LYS A 435 14.118 6.755 8.078 1.00 0.00 C ATOM 1118 NZ LYS A 435 14.396 7.854 9.046 1.00 0.00 N ATOM 0 H LYS A 435 12.372 4.662 2.770 1.00 0.00 H new ATOM 0 HA LYS A 435 10.791 6.401 4.285 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.233 5.186 4.536 1.00 0.00 H new ATOM 0 HB3 LYS A 435 13.736 6.837 4.230 1.00 0.00 H new ATOM 0 HG2 LYS A 435 11.760 7.215 6.113 1.00 0.00 H new ATOM 0 HG3 LYS A 435 12.420 5.669 6.610 1.00 0.00 H new ATOM 0 HD2 LYS A 435 14.709 7.160 6.054 1.00 0.00 H new ATOM 0 HD3 LYS A 435 13.627 8.358 6.737 1.00 0.00 H new ATOM 0 HE2 LYS A 435 13.267 6.170 8.427 1.00 0.00 H new ATOM 0 HE3 LYS A 435 14.974 6.081 8.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 14.589 7.449 9.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 15.223 8.397 8.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 13.570 8.483 9.103 1.00 0.00 H new ATOM 1132 N LYS A 436 12.528 7.841 1.902 1.00 0.00 N ATOM 1133 CA LYS A 436 12.687 9.079 1.150 1.00 0.00 C ATOM 1134 C LYS A 436 11.342 9.562 0.628 1.00 0.00 C ATOM 1135 O LYS A 436 10.910 10.676 0.923 1.00 0.00 O ATOM 1136 CB LYS A 436 13.653 8.871 -0.016 1.00 0.00 C ATOM 1137 CG LYS A 436 15.010 8.335 0.408 1.00 0.00 C ATOM 1138 CD LYS A 436 15.074 6.820 0.279 1.00 0.00 C ATOM 1139 CE LYS A 436 16.021 6.392 -0.832 1.00 0.00 C ATOM 1140 NZ LYS A 436 17.381 6.971 -0.656 1.00 0.00 N ATOM 0 H LYS A 436 13.033 7.044 1.514 1.00 0.00 H new ATOM 0 HA LYS A 436 13.096 9.836 1.819 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.205 8.179 -0.729 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.792 9.819 -0.536 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.789 8.787 -0.206 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.210 8.623 1.440 1.00 0.00 H new ATOM 0 HD2 LYS A 436 15.402 6.387 1.224 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.077 6.429 0.078 1.00 0.00 H new ATOM 0 HE2 LYS A 436 16.089 5.304 -0.852 1.00 0.00 H new ATOM 0 HE3 LYS A 436 15.616 6.704 -1.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 18.090 6.317 -1.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 17.438 7.881 -1.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 17.566 7.121 0.356 1.00 0.00 H new ATOM 1154 N MET A 437 10.684 8.708 -0.142 1.00 0.00 N ATOM 1155 CA MET A 437 9.381 9.033 -0.704 1.00 0.00 C ATOM 1156 C MET A 437 8.371 9.294 0.407 1.00 0.00 C ATOM 1157 O MET A 437 7.465 10.113 0.258 1.00 0.00 O ATOM 1158 CB MET A 437 8.891 7.895 -1.602 1.00 0.00 C ATOM 1159 CG MET A 437 7.537 8.163 -2.239 1.00 0.00 C ATOM 1160 SD MET A 437 7.672 8.954 -3.854 1.00 0.00 S ATOM 1161 CE MET A 437 8.725 7.790 -4.716 1.00 0.00 C ATOM 0 H MET A 437 11.032 7.782 -0.392 1.00 0.00 H new ATOM 0 HA MET A 437 9.481 9.937 -1.304 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.625 7.722 -2.389 1.00 0.00 H new ATOM 0 HB3 MET A 437 8.832 6.979 -1.014 1.00 0.00 H new ATOM 0 HG2 MET A 437 6.997 7.222 -2.344 1.00 0.00 H new ATOM 0 HG3 MET A 437 6.948 8.797 -1.577 1.00 0.00 H new ATOM 0 HE1 MET A 437 8.454 7.767 -5.772 1.00 0.00 H new ATOM 0 HE2 MET A 437 9.766 8.097 -4.615 1.00 0.00 H new ATOM 0 HE3 MET A 437 8.596 6.796 -4.287 1.00 0.00 H new ATOM 1171 N LEU A 438 8.540 8.593 1.525 1.00 0.00 N ATOM 1172 CA LEU A 438 7.646 8.752 2.665 1.00 0.00 C ATOM 1173 C LEU A 438 7.889 10.091 3.353 1.00 0.00 C ATOM 1174 O LEU A 438 6.955 10.729 3.839 1.00 0.00 O ATOM 1175 CB LEU A 438 7.844 7.607 3.662 1.00 0.00 C ATOM 1176 CG LEU A 438 6.631 7.294 4.538 1.00 0.00 C ATOM 1177 CD1 LEU A 438 6.147 8.548 5.250 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.513 6.688 3.702 1.00 0.00 C ATOM 0 H LEU A 438 9.286 7.912 1.664 1.00 0.00 H new ATOM 0 HA LEU A 438 6.619 8.728 2.301 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.116 6.708 3.110 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.687 7.851 4.309 1.00 0.00 H new ATOM 0 HG LEU A 438 6.930 6.566 5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 438 5.283 8.305 5.869 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.946 8.940 5.880 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.865 9.299 4.512 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.657 6.471 4.341 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.216 7.393 2.925 1.00 0.00 H new ATOM 0 HD23 LEU A 438 5.864 5.765 3.240 1.00 0.00 H new ATOM 1190 N ASP A 439 9.147 10.512 3.385 1.00 0.00 N ATOM 1191 CA ASP A 439 9.515 11.777 4.008 1.00 0.00 C ATOM 1192 C ASP A 439 8.926 12.951 3.232 1.00 0.00 C ATOM 1193 O ASP A 439 8.482 13.937 3.820 1.00 0.00 O ATOM 1194 CB ASP A 439 11.037 11.912 4.085 1.00 0.00 C ATOM 1195 CG ASP A 439 11.473 12.980 5.069 1.00 0.00 C ATOM 1196 OD1 ASP A 439 11.123 14.159 4.859 1.00 0.00 O ATOM 1197 OD2 ASP A 439 12.166 12.636 6.050 1.00 0.00 O ATOM 0 H ASP A 439 9.931 9.995 2.986 1.00 0.00 H new ATOM 0 HA ASP A 439 9.108 11.789 5.019 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.470 10.955 4.376 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.428 12.151 3.096 1.00 0.00 H new ATOM 1202 N PHE A 440 8.927 12.834 1.910 1.00 0.00 N ATOM 1203 CA PHE A 440 8.391 13.883 1.050 1.00 0.00 C ATOM 1204 C PHE A 440 6.890 14.049 1.265 1.00 0.00 C ATOM 1205 O PHE A 440 6.375 15.166 1.282 1.00 0.00 O ATOM 1206 CB PHE A 440 8.674 13.561 -0.417 1.00 0.00 C ATOM 1207 CG PHE A 440 9.107 14.753 -1.222 1.00 0.00 C ATOM 1208 CD1 PHE A 440 10.305 15.393 -0.945 1.00 0.00 C ATOM 1209 CD2 PHE A 440 8.318 15.233 -2.254 1.00 0.00 C ATOM 1210 CE1 PHE A 440 10.708 16.490 -1.684 1.00 0.00 C ATOM 1211 CE2 PHE A 440 8.715 16.330 -2.996 1.00 0.00 C ATOM 1212 CZ PHE A 440 9.911 16.959 -2.711 1.00 0.00 C ATOM 0 H PHE A 440 9.293 12.024 1.410 1.00 0.00 H new ATOM 0 HA PHE A 440 8.883 14.820 1.312 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.449 12.797 -0.469 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.777 13.136 -0.867 1.00 0.00 H new ATOM 0 HD1 PHE A 440 10.931 15.031 -0.143 1.00 0.00 H new ATOM 0 HD2 PHE A 440 7.382 14.745 -2.482 1.00 0.00 H new ATOM 0 HE1 PHE A 440 11.644 16.979 -1.459 1.00 0.00 H new ATOM 0 HE2 PHE A 440 8.090 16.695 -3.798 1.00 0.00 H new ATOM 0 HZ PHE A 440 10.223 17.816 -3.290 1.00 0.00 H new ATOM 1222 N TYR A 441 6.195 12.928 1.435 1.00 0.00 N ATOM 1223 CA TYR A 441 4.756 12.948 1.657 1.00 0.00 C ATOM 1224 C TYR A 441 4.454 13.249 3.113 1.00 0.00 C ATOM 1225 O TYR A 441 3.566 14.038 3.423 1.00 0.00 O ATOM 1226 CB TYR A 441 4.137 11.610 1.261 1.00 0.00 C ATOM 1227 CG TYR A 441 3.752 11.523 -0.197 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.656 11.069 -1.148 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.484 11.895 -0.622 1.00 0.00 C ATOM 1230 CE1 TYR A 441 4.308 10.986 -2.482 1.00 0.00 C ATOM 1231 CE2 TYR A 441 2.126 11.816 -1.954 1.00 0.00 C ATOM 1232 CZ TYR A 441 3.042 11.361 -2.881 1.00 0.00 C ATOM 1233 OH TYR A 441 2.691 11.283 -4.209 1.00 0.00 O ATOM 0 H TYR A 441 6.607 11.995 1.423 1.00 0.00 H new ATOM 0 HA TYR A 441 4.321 13.732 1.036 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.844 10.812 1.489 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.251 11.435 1.872 1.00 0.00 H new ATOM 0 HD1 TYR A 441 5.648 10.776 -0.839 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.765 12.252 0.101 1.00 0.00 H new ATOM 0 HE1 TYR A 441 5.023 10.629 -3.209 1.00 0.00 H new ATOM 0 HE2 TYR A 441 1.135 12.109 -2.268 1.00 0.00 H new ATOM 0 HH TYR A 441 3.189 10.556 -4.637 1.00 0.00 H new ATOM 1243 N ALA A 442 5.209 12.624 4.005 1.00 0.00 N ATOM 1244 CA ALA A 442 5.024 12.840 5.432 1.00 0.00 C ATOM 1245 C ALA A 442 5.183 14.319 5.768 1.00 0.00 C ATOM 1246 O ALA A 442 4.544 14.830 6.688 1.00 0.00 O ATOM 1247 CB ALA A 442 6.004 11.997 6.233 1.00 0.00 C ATOM 0 H ALA A 442 5.952 11.967 3.767 1.00 0.00 H new ATOM 0 HA ALA A 442 4.014 12.532 5.702 1.00 0.00 H new ATOM 0 HB1 ALA A 442 5.850 12.173 7.298 1.00 0.00 H new ATOM 0 HB2 ALA A 442 5.842 10.942 6.012 1.00 0.00 H new ATOM 0 HB3 ALA A 442 7.024 12.271 5.964 1.00 0.00 H new ATOM 1253 N LYS A 443 6.021 15.006 4.996 1.00 0.00 N ATOM 1254 CA LYS A 443 6.244 16.434 5.191 1.00 0.00 C ATOM 1255 C LYS A 443 5.176 17.242 4.458 1.00 0.00 C ATOM 1256 O LYS A 443 5.179 18.473 4.497 1.00 0.00 O ATOM 1257 CB LYS A 443 7.636 16.830 4.694 1.00 0.00 C ATOM 1258 CG LYS A 443 8.749 16.513 5.681 1.00 0.00 C ATOM 1259 CD LYS A 443 8.489 17.152 7.037 1.00 0.00 C ATOM 1260 CE LYS A 443 7.925 16.147 8.031 1.00 0.00 C ATOM 1261 NZ LYS A 443 6.629 16.599 8.608 1.00 0.00 N ATOM 0 H LYS A 443 6.556 14.596 4.230 1.00 0.00 H new ATOM 0 HA LYS A 443 6.179 16.651 6.257 1.00 0.00 H new ATOM 0 HB2 LYS A 443 7.837 16.315 3.755 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.646 17.899 4.480 1.00 0.00 H new ATOM 0 HG2 LYS A 443 8.837 15.433 5.797 1.00 0.00 H new ATOM 0 HG3 LYS A 443 9.700 16.870 5.286 1.00 0.00 H new ATOM 0 HD2 LYS A 443 9.417 17.569 7.427 1.00 0.00 H new ATOM 0 HD3 LYS A 443 7.791 17.981 6.921 1.00 0.00 H new ATOM 0 HE2 LYS A 443 7.786 15.186 7.535 1.00 0.00 H new ATOM 0 HE3 LYS A 443 8.644 15.990 8.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 6.640 16.459 9.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 6.488 17.608 8.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 5.852 16.047 8.192 1.00 0.00 H new ATOM 1275 N GLN A 444 4.258 16.539 3.796 1.00 0.00 N ATOM 1276 CA GLN A 444 3.179 17.176 3.062 1.00 0.00 C ATOM 1277 C GLN A 444 1.839 16.853 3.708 1.00 0.00 C ATOM 1278 O GLN A 444 1.043 17.747 3.987 1.00 0.00 O ATOM 1279 CB GLN A 444 3.182 16.721 1.602 1.00 0.00 C ATOM 1280 CG GLN A 444 4.388 17.209 0.816 1.00 0.00 C ATOM 1281 CD GLN A 444 4.114 18.502 0.073 1.00 0.00 C ATOM 1282 OE1 GLN A 444 3.984 18.515 -1.151 1.00 0.00 O ATOM 1283 NE2 GLN A 444 4.026 19.601 0.813 1.00 0.00 N ATOM 0 H GLN A 444 4.245 15.520 3.757 1.00 0.00 H new ATOM 0 HA GLN A 444 3.333 18.255 3.090 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.154 15.632 1.569 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.274 17.078 1.117 1.00 0.00 H new ATOM 0 HG2 GLN A 444 5.226 17.356 1.497 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.688 16.441 0.103 1.00 0.00 H new ATOM 0 HE21 GLN A 444 4.140 19.545 1.825 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.844 20.501 0.369 1.00 0.00 H new ATOM 1292 N ARG A 445 1.598 15.568 3.947 1.00 0.00 N ATOM 1293 CA ARG A 445 0.350 15.137 4.570 1.00 0.00 C ATOM 1294 C ARG A 445 0.263 15.631 6.008 1.00 0.00 C ATOM 1295 O ARG A 445 -0.803 16.039 6.472 1.00 0.00 O ATOM 1296 CB ARG A 445 0.225 13.612 4.531 1.00 0.00 C ATOM 1297 CG ARG A 445 1.247 12.890 5.394 1.00 0.00 C ATOM 1298 CD ARG A 445 0.672 12.526 6.754 1.00 0.00 C ATOM 1299 NE ARG A 445 -0.579 11.776 6.635 1.00 0.00 N ATOM 1300 CZ ARG A 445 -1.783 12.281 6.902 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -1.919 13.539 7.303 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -2.861 11.519 6.765 1.00 0.00 N ATOM 0 H ARG A 445 2.244 14.812 3.721 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.474 15.571 4.004 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -0.776 13.330 4.858 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.331 13.274 3.500 1.00 0.00 H new ATOM 0 HG2 ARG A 445 1.580 11.986 4.885 1.00 0.00 H new ATOM 0 HG3 ARG A 445 2.125 13.523 5.527 1.00 0.00 H new ATOM 0 HD2 ARG A 445 1.399 11.933 7.309 1.00 0.00 H new ATOM 0 HD3 ARG A 445 0.497 13.435 7.329 1.00 0.00 H new ATOM 0 HE ARG A 445 -0.526 10.805 6.328 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -1.096 14.132 7.410 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -2.847 13.913 7.504 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -2.766 10.551 6.457 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -3.785 11.901 6.968 1.00 0.00 H new ATOM 1314 N ALA A 446 1.390 15.601 6.707 1.00 0.00 N ATOM 1315 CA ALA A 446 1.444 16.053 8.091 1.00 0.00 C ATOM 1316 C ALA A 446 1.597 17.568 8.158 1.00 0.00 C ATOM 1317 O ALA A 446 1.218 18.199 9.144 1.00 0.00 O ATOM 1318 CB ALA A 446 2.587 15.370 8.827 1.00 0.00 C ATOM 0 H ALA A 446 2.280 15.268 6.338 1.00 0.00 H new ATOM 0 HA ALA A 446 0.506 15.783 8.577 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.614 15.718 9.860 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.436 14.291 8.812 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.531 15.611 8.338 1.00 0.00 H new