USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=13 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 Single : A 369 ASN : amide:sc= -0.863 X(o=-0.86,f=-0.75) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN : amide:sc= -14.5! C(o=-15!,f=-20!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot -37:sc= 0.115 USER MOD Single : A 380 TYR OH : rot -152:sc= 1.27 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -0.373 X(o=-0.37,f=-0.0022) USER MOD Single : A 387 TYR OH : rot -79:sc= -4.13! USER MOD Single : A 389 THR OG1 : rot -1:sc= 0.716 USER MOD Single : A 399 ASN : amide:sc= -0.332 X(o=-0.33,f=-0.008) USER MOD Single : A 400 SER OG : rot 180:sc= 0 USER MOD Single : A 404 CYS SG : rot 104:sc= 0.873 USER MOD Single : A 410 THR OG1 : rot 33:sc= 0.0986 USER MOD Single : A 414 THR OG1 : rot 180:sc= -1.6 USER MOD Single : A 419 ASN :FLIP amide:sc= -0.634 F(o=-1.5,f=-0.63) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -0.925 X(o=-0.92,f=-0.92) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl -162:sc=-0.00945 (180deg=-0.486) USER MOD Single : A 441 TYR OH : rot 180:sc= -2.36! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.306 X(o=-0.31,f=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -3.686 -1.841 9.580 1.00 0.00 N ATOM 103 CA ASN A 369 -2.571 -1.084 10.135 1.00 0.00 C ATOM 104 C ASN A 369 -1.699 -0.489 9.035 1.00 0.00 C ATOM 105 O ASN A 369 -1.356 0.693 9.072 1.00 0.00 O ATOM 106 CB ASN A 369 -1.726 -1.973 11.049 1.00 0.00 C ATOM 107 CG ASN A 369 -1.195 -3.201 10.337 1.00 0.00 C ATOM 108 OD1 ASN A 369 -0.037 -3.238 9.919 1.00 0.00 O ATOM 109 ND2 ASN A 369 -2.041 -4.215 10.194 1.00 0.00 N ATOM 0 HA ASN A 369 -2.987 -0.263 10.719 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -0.890 -1.394 11.441 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.326 -2.284 11.904 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -1.740 -5.068 9.722 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -2.992 -4.141 10.556 1.00 0.00 H new ATOM 116 N ALA A 370 -1.341 -1.313 8.061 1.00 0.00 N ATOM 117 CA ALA A 370 -0.505 -0.866 6.954 1.00 0.00 C ATOM 118 C ALA A 370 -1.232 0.159 6.091 1.00 0.00 C ATOM 119 O ALA A 370 -0.622 1.098 5.581 1.00 0.00 O ATOM 120 CB ALA A 370 -0.060 -2.056 6.113 1.00 0.00 C ATOM 0 H ALA A 370 -1.616 -2.294 8.014 1.00 0.00 H new ATOM 0 HA ALA A 370 0.378 -0.382 7.371 1.00 0.00 H new ATOM 0 HB1 ALA A 370 0.564 -1.707 5.290 1.00 0.00 H new ATOM 0 HB2 ALA A 370 0.511 -2.747 6.733 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.936 -2.567 5.713 1.00 0.00 H new ATOM 126 N LYS A 371 -2.539 -0.020 5.938 1.00 0.00 N ATOM 127 CA LYS A 371 -3.344 0.899 5.141 1.00 0.00 C ATOM 128 C LYS A 371 -3.612 2.182 5.914 1.00 0.00 C ATOM 129 O LYS A 371 -3.610 3.274 5.346 1.00 0.00 O ATOM 130 CB LYS A 371 -4.669 0.248 4.738 1.00 0.00 C ATOM 131 CG LYS A 371 -5.235 0.779 3.432 1.00 0.00 C ATOM 132 CD LYS A 371 -6.165 -0.230 2.777 1.00 0.00 C ATOM 133 CE LYS A 371 -7.313 0.458 2.055 1.00 0.00 C ATOM 134 NZ LYS A 371 -8.383 -0.502 1.670 1.00 0.00 N ATOM 0 H LYS A 371 -3.063 -0.790 6.354 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.784 1.141 4.238 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -4.523 -0.829 4.650 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.399 0.407 5.532 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -5.776 1.706 3.619 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -4.418 1.018 2.751 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -5.602 -0.840 2.070 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.563 -0.905 3.535 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -7.734 1.232 2.697 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -6.934 0.956 1.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -9.146 0.007 1.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -7.988 -1.226 1.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -8.763 -0.959 2.524 1.00 0.00 H new ATOM 148 N ARG A 372 -3.830 2.043 7.215 1.00 0.00 N ATOM 149 CA ARG A 372 -4.085 3.194 8.069 1.00 0.00 C ATOM 150 C ARG A 372 -2.790 3.950 8.320 1.00 0.00 C ATOM 151 O ARG A 372 -2.787 5.174 8.458 1.00 0.00 O ATOM 152 CB ARG A 372 -4.704 2.751 9.397 1.00 0.00 C ATOM 153 CG ARG A 372 -6.167 2.352 9.282 1.00 0.00 C ATOM 154 CD ARG A 372 -6.882 2.462 10.618 1.00 0.00 C ATOM 155 NE ARG A 372 -6.385 1.487 11.587 1.00 0.00 N ATOM 156 CZ ARG A 372 -7.062 1.104 12.668 1.00 0.00 C ATOM 157 NH1 ARG A 372 -8.261 1.611 12.924 1.00 0.00 N ATOM 158 NH2 ARG A 372 -6.536 0.212 13.496 1.00 0.00 N ATOM 0 H ARG A 372 -3.835 1.146 7.701 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.790 3.854 7.564 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -4.136 1.908 9.790 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -4.613 3.562 10.120 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -6.662 2.990 8.550 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -6.238 1.329 8.914 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -6.752 3.468 11.017 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -7.952 2.313 10.470 1.00 0.00 H new ATOM 0 HE ARG A 372 -5.466 1.076 11.426 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -8.670 2.299 12.291 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -8.774 1.313 13.754 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -5.614 -0.180 13.305 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -7.053 -0.082 14.324 1.00 0.00 H new ATOM 170 N GLN A 373 -1.687 3.211 8.360 1.00 0.00 N ATOM 171 CA GLN A 373 -0.379 3.806 8.573 1.00 0.00 C ATOM 172 C GLN A 373 0.002 4.672 7.380 1.00 0.00 C ATOM 173 O GLN A 373 0.523 5.776 7.540 1.00 0.00 O ATOM 174 CB GLN A 373 0.672 2.715 8.794 1.00 0.00 C ATOM 175 CG GLN A 373 2.038 3.255 9.187 1.00 0.00 C ATOM 176 CD GLN A 373 2.909 3.569 7.986 1.00 0.00 C ATOM 177 OE1 GLN A 373 2.444 3.561 6.847 1.00 0.00 O ATOM 178 NE2 GLN A 373 4.183 3.847 8.238 1.00 0.00 N ATOM 0 H GLN A 373 -1.676 2.197 8.247 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.420 4.433 9.463 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.321 2.037 9.572 1.00 0.00 H new ATOM 0 HB3 GLN A 373 0.772 2.128 7.881 1.00 0.00 H new ATOM 0 HG2 GLN A 373 1.910 4.158 9.784 1.00 0.00 H new ATOM 0 HG3 GLN A 373 2.545 2.525 9.818 1.00 0.00 H new ATOM 0 HE21 GLN A 373 4.526 3.842 9.199 1.00 0.00 H new ATOM 0 HE22 GLN A 373 4.819 4.065 7.471 1.00 0.00 H new ATOM 187 N LEU A 374 -0.276 4.168 6.180 1.00 0.00 N ATOM 188 CA LEU A 374 0.029 4.901 4.960 1.00 0.00 C ATOM 189 C LEU A 374 -0.802 6.176 4.884 1.00 0.00 C ATOM 190 O LEU A 374 -0.271 7.266 4.676 1.00 0.00 O ATOM 191 CB LEU A 374 -0.236 4.029 3.729 1.00 0.00 C ATOM 192 CG LEU A 374 1.012 3.518 3.001 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.035 4.632 2.825 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.622 2.341 3.751 1.00 0.00 C ATOM 0 H LEU A 374 -0.711 3.258 6.029 1.00 0.00 H new ATOM 0 HA LEU A 374 1.085 5.170 4.978 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -0.834 3.170 4.035 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.838 4.601 3.023 1.00 0.00 H new ATOM 0 HG LEU A 374 0.712 3.178 2.010 1.00 0.00 H new ATOM 0 HD11 LEU A 374 2.911 4.243 2.306 1.00 0.00 H new ATOM 0 HD12 LEU A 374 1.596 5.440 2.240 1.00 0.00 H new ATOM 0 HD13 LEU A 374 2.332 5.011 3.803 1.00 0.00 H new ATOM 0 HD21 LEU A 374 2.507 1.991 3.220 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.903 2.656 4.756 1.00 0.00 H new ATOM 0 HD23 LEU A 374 0.893 1.533 3.814 1.00 0.00 H new ATOM 206 N TYR A 375 -2.108 6.027 5.057 1.00 0.00 N ATOM 207 CA TYR A 375 -3.018 7.163 5.012 1.00 0.00 C ATOM 208 C TYR A 375 -2.663 8.183 6.089 1.00 0.00 C ATOM 209 O TYR A 375 -2.939 9.374 5.945 1.00 0.00 O ATOM 210 CB TYR A 375 -4.464 6.696 5.190 1.00 0.00 C ATOM 211 CG TYR A 375 -5.463 7.485 4.373 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.716 7.160 3.046 1.00 0.00 C ATOM 213 CD2 TYR A 375 -6.153 8.555 4.930 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.628 7.880 2.298 1.00 0.00 C ATOM 215 CE2 TYR A 375 -7.067 9.278 4.188 1.00 0.00 C ATOM 216 CZ TYR A 375 -7.301 8.936 2.872 1.00 0.00 C ATOM 217 OH TYR A 375 -8.210 9.655 2.131 1.00 0.00 O ATOM 0 H TYR A 375 -2.561 5.130 5.230 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.918 7.639 4.037 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.533 5.644 4.914 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.733 6.768 6.244 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -5.192 6.332 2.592 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.972 8.826 5.960 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -6.812 7.616 1.267 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.596 10.107 4.636 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.596 10.364 2.686 1.00 0.00 H new ATOM 227 N SER A 376 -2.051 7.707 7.168 1.00 0.00 N ATOM 228 CA SER A 376 -1.658 8.578 8.267 1.00 0.00 C ATOM 229 C SER A 376 -0.235 9.101 8.080 1.00 0.00 C ATOM 230 O SER A 376 0.203 9.993 8.806 1.00 0.00 O ATOM 231 CB SER A 376 -1.766 7.831 9.598 1.00 0.00 C ATOM 232 OG SER A 376 -1.665 8.724 10.694 1.00 0.00 O ATOM 0 H SER A 376 -1.817 6.724 7.304 1.00 0.00 H new ATOM 0 HA SER A 376 -2.336 9.431 8.275 1.00 0.00 H new ATOM 0 HB2 SER A 376 -2.717 7.300 9.644 1.00 0.00 H new ATOM 0 HB3 SER A 376 -0.978 7.081 9.662 1.00 0.00 H new ATOM 0 HG SER A 376 -1.009 9.422 10.488 1.00 0.00 H new ATOM 238 N LEU A 377 0.489 8.541 7.112 1.00 0.00 N ATOM 239 CA LEU A 377 1.861 8.962 6.856 1.00 0.00 C ATOM 240 C LEU A 377 1.999 9.669 5.509 1.00 0.00 C ATOM 241 O LEU A 377 3.002 10.338 5.262 1.00 0.00 O ATOM 242 CB LEU A 377 2.809 7.762 6.915 1.00 0.00 C ATOM 243 CG LEU A 377 3.575 7.613 8.229 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.640 7.165 9.343 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.727 6.632 8.068 1.00 0.00 C ATOM 0 H LEU A 377 0.150 7.801 6.498 1.00 0.00 H new ATOM 0 HA LEU A 377 2.131 9.674 7.636 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.233 6.853 6.742 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.527 7.844 6.099 1.00 0.00 H new ATOM 0 HG LEU A 377 3.989 8.585 8.499 1.00 0.00 H new ATOM 0 HD11 LEU A 377 3.202 7.064 10.271 1.00 0.00 H new ATOM 0 HD12 LEU A 377 1.851 7.905 9.475 1.00 0.00 H new ATOM 0 HD13 LEU A 377 2.196 6.204 9.081 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.261 6.539 9.014 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.337 5.658 7.774 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.410 6.996 7.300 1.00 0.00 H new ATOM 257 N ILE A 378 1.004 9.525 4.635 1.00 0.00 N ATOM 258 CA ILE A 378 1.065 10.167 3.326 1.00 0.00 C ATOM 259 C ILE A 378 -0.323 10.538 2.803 1.00 0.00 C ATOM 260 O ILE A 378 -0.516 11.623 2.254 1.00 0.00 O ATOM 261 CB ILE A 378 1.789 9.276 2.293 1.00 0.00 C ATOM 262 CG1 ILE A 378 0.915 8.094 1.868 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.107 8.775 2.866 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.554 7.231 0.804 1.00 0.00 C ATOM 0 H ILE A 378 0.160 8.979 4.806 1.00 0.00 H new ATOM 0 HA ILE A 378 1.636 11.086 3.461 1.00 0.00 H new ATOM 0 HB ILE A 378 1.989 9.881 1.408 1.00 0.00 H new ATOM 0 HG12 ILE A 378 0.697 7.480 2.742 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -0.038 8.471 1.497 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.609 8.148 2.129 1.00 0.00 H new ATOM 0 HG22 ILE A 378 3.743 9.625 3.113 1.00 0.00 H new ATOM 0 HG23 ILE A 378 2.914 8.193 3.767 1.00 0.00 H new ATOM 0 HD11 ILE A 378 0.882 6.412 0.548 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.748 7.832 -0.084 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.494 6.826 1.180 1.00 0.00 H new ATOM 276 N GLY A 379 -1.281 9.635 2.968 1.00 0.00 N ATOM 277 CA GLY A 379 -2.629 9.896 2.496 1.00 0.00 C ATOM 278 C GLY A 379 -3.246 11.125 3.136 1.00 0.00 C ATOM 279 O GLY A 379 -3.763 11.058 4.250 1.00 0.00 O ATOM 0 H GLY A 379 -1.151 8.729 3.418 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.612 10.025 1.414 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.257 9.029 2.704 1.00 0.00 H new ATOM 283 N TYR A 380 -3.196 12.250 2.427 1.00 0.00 N ATOM 284 CA TYR A 380 -3.761 13.494 2.936 1.00 0.00 C ATOM 285 C TYR A 380 -5.095 13.801 2.264 1.00 0.00 C ATOM 286 O TYR A 380 -6.003 14.351 2.888 1.00 0.00 O ATOM 287 CB TYR A 380 -2.791 14.666 2.737 1.00 0.00 C ATOM 288 CG TYR A 380 -1.916 14.559 1.505 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.464 14.612 0.229 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.539 14.412 1.619 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.665 14.519 -0.896 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.266 14.321 0.502 1.00 0.00 C ATOM 293 CZ TYR A 380 -0.300 14.374 -0.753 1.00 0.00 C ATOM 294 OH TYR A 380 0.498 14.283 -1.870 1.00 0.00 O ATOM 0 H TYR A 380 -2.772 12.325 1.502 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.929 13.364 4.005 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.366 15.590 2.679 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.151 14.744 3.616 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.532 14.728 0.114 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -0.090 14.368 2.600 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -2.107 14.560 -1.881 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.335 14.209 0.611 1.00 0.00 H new ATOM 0 HH TYR A 380 1.301 13.763 -1.657 1.00 0.00 H new ATOM 304 N ALA A 381 -5.209 13.443 0.988 1.00 0.00 N ATOM 305 CA ALA A 381 -6.433 13.680 0.227 1.00 0.00 C ATOM 306 C ALA A 381 -6.229 13.365 -1.250 1.00 0.00 C ATOM 307 O ALA A 381 -6.795 12.405 -1.775 1.00 0.00 O ATOM 308 CB ALA A 381 -6.899 15.119 0.398 1.00 0.00 C ATOM 0 H ALA A 381 -4.467 12.987 0.458 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.203 13.013 0.615 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -7.812 15.276 -0.176 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -7.095 15.315 1.452 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -6.124 15.797 0.041 1.00 0.00 H new ATOM 314 N SER A 382 -5.417 14.179 -1.916 1.00 0.00 N ATOM 315 CA SER A 382 -5.136 13.989 -3.335 1.00 0.00 C ATOM 316 C SER A 382 -4.550 12.604 -3.592 1.00 0.00 C ATOM 317 O SER A 382 -4.770 12.014 -4.650 1.00 0.00 O ATOM 318 CB SER A 382 -4.172 15.066 -3.834 1.00 0.00 C ATOM 319 OG SER A 382 -4.532 15.513 -5.130 1.00 0.00 O ATOM 0 H SER A 382 -4.941 14.977 -1.496 1.00 0.00 H new ATOM 0 HA SER A 382 -6.076 14.073 -3.881 1.00 0.00 H new ATOM 0 HB2 SER A 382 -4.173 15.908 -3.142 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.157 14.670 -3.852 1.00 0.00 H new ATOM 0 HG SER A 382 -3.901 16.202 -5.425 1.00 0.00 H new ATOM 325 N LEU A 383 -3.805 12.092 -2.618 1.00 0.00 N ATOM 326 CA LEU A 383 -3.188 10.776 -2.740 1.00 0.00 C ATOM 327 C LEU A 383 -4.192 9.675 -2.413 1.00 0.00 C ATOM 328 O LEU A 383 -4.205 9.143 -1.302 1.00 0.00 O ATOM 329 CB LEU A 383 -1.977 10.668 -1.813 1.00 0.00 C ATOM 330 CG LEU A 383 -0.938 9.623 -2.228 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.222 10.058 -3.496 1.00 0.00 C ATOM 332 CD2 LEU A 383 0.058 9.388 -1.103 1.00 0.00 C ATOM 0 H LEU A 383 -3.614 12.568 -1.736 1.00 0.00 H new ATOM 0 HA LEU A 383 -2.858 10.651 -3.771 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.490 11.642 -1.760 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.327 10.432 -0.808 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.454 8.684 -2.431 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.513 9.303 -3.776 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.947 10.175 -4.301 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.283 11.008 -3.321 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.790 8.642 -1.415 1.00 0.00 H new ATOM 0 HD22 LEU A 383 0.569 10.322 -0.868 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.470 9.031 -0.219 1.00 0.00 H new ATOM 344 N ARG A 384 -5.029 9.338 -3.387 1.00 0.00 N ATOM 345 CA ARG A 384 -6.036 8.300 -3.204 1.00 0.00 C ATOM 346 C ARG A 384 -5.382 6.933 -3.023 1.00 0.00 C ATOM 347 O ARG A 384 -5.324 6.134 -3.957 1.00 0.00 O ATOM 348 CB ARG A 384 -6.988 8.270 -4.401 1.00 0.00 C ATOM 349 CG ARG A 384 -8.221 9.141 -4.218 1.00 0.00 C ATOM 350 CD ARG A 384 -8.620 9.824 -5.517 1.00 0.00 C ATOM 351 NE ARG A 384 -10.069 9.860 -5.696 1.00 0.00 N ATOM 352 CZ ARG A 384 -10.882 10.652 -5.000 1.00 0.00 C ATOM 353 NH1 ARG A 384 -10.392 11.475 -4.081 1.00 0.00 N ATOM 354 NH2 ARG A 384 -12.189 10.622 -5.224 1.00 0.00 N ATOM 0 H ARG A 384 -5.030 9.769 -4.312 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.603 8.532 -2.303 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.450 8.598 -5.291 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -7.303 7.242 -4.579 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -9.049 8.530 -3.858 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -8.025 9.894 -3.455 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -8.229 10.841 -5.526 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -8.164 9.299 -6.357 1.00 0.00 H new ATOM 0 HE ARG A 384 -10.482 9.242 -6.395 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -9.388 11.503 -3.905 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -11.020 12.079 -3.551 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -12.571 9.992 -5.929 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -12.812 11.229 -4.691 1.00 0.00 H new ATOM 366 N LEU A 385 -4.892 6.672 -1.814 1.00 0.00 N ATOM 367 CA LEU A 385 -4.244 5.400 -1.511 1.00 0.00 C ATOM 368 C LEU A 385 -5.196 4.234 -1.764 1.00 0.00 C ATOM 369 O LEU A 385 -6.123 3.997 -0.990 1.00 0.00 O ATOM 370 CB LEU A 385 -3.763 5.381 -0.056 1.00 0.00 C ATOM 371 CG LEU A 385 -3.234 4.031 0.438 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.755 4.128 0.779 1.00 0.00 C ATOM 373 CD2 LEU A 385 -4.030 3.553 1.644 1.00 0.00 C ATOM 0 H LEU A 385 -4.931 7.323 -1.030 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.382 5.291 -2.169 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -2.976 6.126 0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.588 5.687 0.587 1.00 0.00 H new ATOM 0 HG LEU A 385 -3.354 3.302 -0.364 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.398 3.159 1.128 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.195 4.423 -0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.610 4.872 1.563 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.639 2.593 1.980 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -3.943 4.282 2.449 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -5.078 3.441 1.367 1.00 0.00 H new ATOM 385 N HIS A 386 -4.961 3.508 -2.853 1.00 0.00 N ATOM 386 CA HIS A 386 -5.796 2.369 -3.208 1.00 0.00 C ATOM 387 C HIS A 386 -4.942 1.155 -3.556 1.00 0.00 C ATOM 388 O HIS A 386 -3.825 1.294 -4.054 1.00 0.00 O ATOM 389 CB HIS A 386 -6.706 2.721 -4.385 1.00 0.00 C ATOM 390 CG HIS A 386 -7.839 1.761 -4.572 1.00 0.00 C ATOM 391 ND1 HIS A 386 -9.090 1.955 -4.025 1.00 0.00 N ATOM 392 CD2 HIS A 386 -7.906 0.591 -5.252 1.00 0.00 C ATOM 393 CE1 HIS A 386 -9.876 0.947 -4.359 1.00 0.00 C ATOM 394 NE2 HIS A 386 -9.182 0.107 -5.103 1.00 0.00 N ATOM 0 H HIS A 386 -4.198 3.690 -3.505 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.413 2.121 -2.344 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.110 3.722 -4.235 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -6.111 2.751 -5.298 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -7.105 0.126 -5.808 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -10.911 0.830 -4.072 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -9.536 -0.762 -5.503 1.00 0.00 H new ATOM 403 N TYR A 387 -5.471 -0.033 -3.288 1.00 0.00 N ATOM 404 CA TYR A 387 -4.755 -1.268 -3.571 1.00 0.00 C ATOM 405 C TYR A 387 -5.469 -2.087 -4.638 1.00 0.00 C ATOM 406 O TYR A 387 -6.640 -2.434 -4.492 1.00 0.00 O ATOM 407 CB TYR A 387 -4.592 -2.090 -2.294 1.00 0.00 C ATOM 408 CG TYR A 387 -3.494 -1.574 -1.395 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.608 -0.340 -0.771 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.340 -2.315 -1.182 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.602 0.143 0.042 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.330 -1.840 -0.371 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.465 -0.610 0.239 1.00 0.00 C ATOM 414 OH TYR A 387 -0.459 -0.132 1.047 1.00 0.00 O ATOM 0 H TYR A 387 -6.394 -0.166 -2.875 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.768 -1.005 -3.952 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.534 -2.089 -1.745 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.379 -3.125 -2.560 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.498 0.252 -0.924 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.231 -3.278 -1.658 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.706 1.106 0.521 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.438 -2.428 -0.214 1.00 0.00 H new ATOM 0 HH TYR A 387 0.074 0.524 0.552 1.00 0.00 H new ATOM 424 N VAL A 388 -4.750 -2.391 -5.713 1.00 0.00 N ATOM 425 CA VAL A 388 -5.302 -3.165 -6.811 1.00 0.00 C ATOM 426 C VAL A 388 -4.474 -4.421 -7.064 1.00 0.00 C ATOM 427 O VAL A 388 -3.258 -4.350 -7.240 1.00 0.00 O ATOM 428 CB VAL A 388 -5.357 -2.325 -8.101 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.936 -3.134 -9.255 1.00 0.00 C ATOM 430 CG2 VAL A 388 -6.160 -1.054 -7.876 1.00 0.00 C ATOM 0 H VAL A 388 -3.778 -2.110 -5.844 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.314 -3.456 -6.529 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.338 -2.044 -8.367 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -5.964 -2.518 -10.154 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.312 -4.010 -9.435 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -6.947 -3.454 -9.003 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -6.188 -0.473 -8.798 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -7.176 -1.313 -7.580 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.692 -0.463 -7.089 1.00 0.00 H new ATOM 440 N THR A 389 -5.141 -5.570 -7.086 1.00 0.00 N ATOM 441 CA THR A 389 -4.465 -6.841 -7.321 1.00 0.00 C ATOM 442 C THR A 389 -4.395 -7.145 -8.815 1.00 0.00 C ATOM 443 O THR A 389 -5.420 -7.216 -9.493 1.00 0.00 O ATOM 444 CB THR A 389 -5.186 -7.974 -6.590 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.343 -8.377 -7.304 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.619 -7.603 -5.187 1.00 0.00 C ATOM 0 H THR A 389 -6.148 -5.647 -6.944 1.00 0.00 H new ATOM 0 HA THR A 389 -3.449 -6.762 -6.933 1.00 0.00 H new ATOM 0 HB THR A 389 -4.459 -8.784 -6.526 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.438 -7.828 -8.110 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.124 -8.452 -4.726 1.00 0.00 H new ATOM 0 HG22 THR A 389 -4.744 -7.336 -4.595 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.301 -6.754 -5.229 1.00 0.00 H new ATOM 594 N ASN A 399 1.286 -16.409 -6.913 1.00 0.00 N ATOM 595 CA ASN A 399 0.765 -15.832 -5.678 1.00 0.00 C ATOM 596 C ASN A 399 -0.174 -14.666 -5.974 1.00 0.00 C ATOM 597 O ASN A 399 -0.521 -14.413 -7.127 1.00 0.00 O ATOM 598 CB ASN A 399 1.914 -15.357 -4.787 1.00 0.00 C ATOM 599 CG ASN A 399 2.962 -16.429 -4.569 1.00 0.00 C ATOM 600 OD1 ASN A 399 2.991 -17.083 -3.527 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.829 -16.615 -5.556 1.00 0.00 N ATOM 0 HA ASN A 399 0.203 -16.606 -5.156 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.382 -14.483 -5.239 1.00 0.00 H new ATOM 0 HB3 ASN A 399 1.515 -15.042 -3.823 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.557 -17.324 -5.468 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.767 -16.049 -6.402 1.00 0.00 H new ATOM 608 N SER A 400 -0.572 -13.954 -4.923 1.00 0.00 N ATOM 609 CA SER A 400 -1.461 -12.810 -5.068 1.00 0.00 C ATOM 610 C SER A 400 -0.658 -11.515 -5.096 1.00 0.00 C ATOM 611 O SER A 400 -0.307 -10.968 -4.051 1.00 0.00 O ATOM 612 CB SER A 400 -2.477 -12.775 -3.923 1.00 0.00 C ATOM 613 OG SER A 400 -3.790 -12.572 -4.413 1.00 0.00 O ATOM 0 H SER A 400 -0.292 -14.151 -3.962 1.00 0.00 H new ATOM 0 HA SER A 400 -2.000 -12.909 -6.010 1.00 0.00 H new ATOM 0 HB2 SER A 400 -2.434 -13.711 -3.366 1.00 0.00 H new ATOM 0 HB3 SER A 400 -2.218 -11.977 -3.227 1.00 0.00 H new ATOM 0 HG SER A 400 -4.420 -12.555 -3.663 1.00 0.00 H new ATOM 619 N ILE A 401 -0.359 -11.038 -6.299 1.00 0.00 N ATOM 620 CA ILE A 401 0.417 -9.815 -6.460 1.00 0.00 C ATOM 621 C ILE A 401 -0.479 -8.578 -6.412 1.00 0.00 C ATOM 622 O ILE A 401 -1.473 -8.488 -7.133 1.00 0.00 O ATOM 623 CB ILE A 401 1.226 -9.837 -7.780 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.544 -9.083 -7.603 1.00 0.00 C ATOM 625 CG2 ILE A 401 0.425 -9.252 -8.937 1.00 0.00 C ATOM 626 CD1 ILE A 401 2.365 -7.650 -7.152 1.00 0.00 C ATOM 0 H ILE A 401 -0.641 -11.478 -7.175 1.00 0.00 H new ATOM 0 HA ILE A 401 1.117 -9.763 -5.626 1.00 0.00 H new ATOM 0 HB ILE A 401 1.443 -10.877 -8.024 1.00 0.00 H new ATOM 0 HG12 ILE A 401 3.160 -9.610 -6.874 1.00 0.00 H new ATOM 0 HG13 ILE A 401 3.088 -9.093 -8.547 1.00 0.00 H new ATOM 0 HG21 ILE A 401 1.024 -9.284 -9.847 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -0.485 -9.835 -9.081 1.00 0.00 H new ATOM 0 HG23 ILE A 401 0.162 -8.219 -8.712 1.00 0.00 H new ATOM 0 HD11 ILE A 401 3.341 -7.177 -7.047 1.00 0.00 H new ATOM 0 HD12 ILE A 401 1.776 -7.107 -7.891 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.849 -7.632 -6.192 1.00 0.00 H new ATOM 638 N VAL A 402 -0.119 -7.628 -5.556 1.00 0.00 N ATOM 639 CA VAL A 402 -0.882 -6.397 -5.410 1.00 0.00 C ATOM 640 C VAL A 402 0.023 -5.176 -5.520 1.00 0.00 C ATOM 641 O VAL A 402 1.229 -5.260 -5.285 1.00 0.00 O ATOM 642 CB VAL A 402 -1.631 -6.354 -4.066 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.537 -5.133 -3.995 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.431 -7.631 -3.860 1.00 0.00 C ATOM 0 H VAL A 402 0.700 -7.689 -4.951 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.612 -6.378 -6.220 1.00 0.00 H new ATOM 0 HB VAL A 402 -0.896 -6.278 -3.265 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -3.057 -5.121 -3.037 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -1.937 -4.228 -4.093 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.267 -5.174 -4.804 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -2.954 -7.583 -2.905 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.157 -7.740 -4.666 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.756 -8.487 -3.861 1.00 0.00 H new ATOM 654 N GLU A 403 -0.567 -4.044 -5.883 1.00 0.00 N ATOM 655 CA GLU A 403 0.187 -2.805 -6.031 1.00 0.00 C ATOM 656 C GLU A 403 -0.643 -1.600 -5.599 1.00 0.00 C ATOM 657 O GLU A 403 -1.697 -1.321 -6.170 1.00 0.00 O ATOM 658 CB GLU A 403 0.637 -2.631 -7.482 1.00 0.00 C ATOM 659 CG GLU A 403 1.736 -3.594 -7.898 1.00 0.00 C ATOM 660 CD GLU A 403 2.103 -3.462 -9.362 1.00 0.00 C ATOM 661 OE1 GLU A 403 1.286 -3.863 -10.218 1.00 0.00 O ATOM 662 OE2 GLU A 403 3.207 -2.957 -9.654 1.00 0.00 O ATOM 0 H GLU A 403 -1.564 -3.958 -6.080 1.00 0.00 H new ATOM 0 HA GLU A 403 1.064 -2.866 -5.386 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.222 -2.768 -8.139 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.988 -1.609 -7.625 1.00 0.00 H new ATOM 0 HG2 GLU A 403 2.621 -3.415 -7.288 1.00 0.00 H new ATOM 0 HG3 GLU A 403 1.413 -4.616 -7.699 1.00 0.00 H new ATOM 669 N CYS A 404 -0.156 -0.887 -4.590 1.00 0.00 N ATOM 670 CA CYS A 404 -0.845 0.293 -4.083 1.00 0.00 C ATOM 671 C CYS A 404 -0.635 1.478 -5.018 1.00 0.00 C ATOM 672 O CYS A 404 0.475 1.993 -5.139 1.00 0.00 O ATOM 673 CB CYS A 404 -0.343 0.642 -2.683 1.00 0.00 C ATOM 674 SG CYS A 404 -1.126 2.103 -1.958 1.00 0.00 S ATOM 0 H CYS A 404 0.715 -1.106 -4.106 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.911 0.070 -4.032 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.512 -0.211 -2.026 1.00 0.00 H new ATOM 0 HB3 CYS A 404 0.734 0.804 -2.725 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.990 1.732 -1.060 1.00 0.00 H new ATOM 680 N ARG A 405 -1.708 1.908 -5.674 1.00 0.00 N ATOM 681 CA ARG A 405 -1.635 3.032 -6.595 1.00 0.00 C ATOM 682 C ARG A 405 -2.337 4.251 -6.013 1.00 0.00 C ATOM 683 O ARG A 405 -3.395 4.136 -5.395 1.00 0.00 O ATOM 684 CB ARG A 405 -2.259 2.663 -7.941 1.00 0.00 C ATOM 685 CG ARG A 405 -1.515 1.560 -8.676 1.00 0.00 C ATOM 686 CD ARG A 405 -2.327 1.019 -9.841 1.00 0.00 C ATOM 687 NE ARG A 405 -2.191 -0.429 -9.978 1.00 0.00 N ATOM 688 CZ ARG A 405 -2.485 -1.100 -11.089 1.00 0.00 C ATOM 689 NH1 ARG A 405 -2.931 -0.459 -12.162 1.00 0.00 N ATOM 690 NH2 ARG A 405 -2.334 -2.417 -11.128 1.00 0.00 N ATOM 0 H ARG A 405 -2.636 1.495 -5.584 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.584 3.276 -6.749 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.290 2.349 -7.780 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.291 3.551 -8.572 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -0.563 1.944 -9.042 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -1.287 0.750 -7.983 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -3.378 1.273 -9.699 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -2.004 1.502 -10.763 1.00 0.00 H new ATOM 0 HE ARG A 405 -1.851 -0.957 -9.174 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -3.050 0.554 -12.138 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -3.155 -0.979 -13.011 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -1.993 -2.916 -10.306 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -2.559 -2.931 -11.980 1.00 0.00 H new ATOM 702 N VAL A 406 -1.741 5.418 -6.216 1.00 0.00 N ATOM 703 CA VAL A 406 -2.309 6.660 -5.711 1.00 0.00 C ATOM 704 C VAL A 406 -2.597 7.640 -6.845 1.00 0.00 C ATOM 705 O VAL A 406 -2.020 7.539 -7.928 1.00 0.00 O ATOM 706 CB VAL A 406 -1.374 7.333 -4.688 1.00 0.00 C ATOM 707 CG1 VAL A 406 -1.173 6.433 -3.478 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.039 7.684 -5.329 1.00 0.00 C ATOM 0 H VAL A 406 -0.865 5.530 -6.726 1.00 0.00 H new ATOM 0 HA VAL A 406 -3.245 6.398 -5.218 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.841 8.259 -4.352 1.00 0.00 H new ATOM 0 HG11 VAL A 406 -0.510 6.924 -2.766 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -2.136 6.240 -3.004 1.00 0.00 H new ATOM 0 HG13 VAL A 406 -0.729 5.490 -3.796 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.606 8.158 -4.589 1.00 0.00 H new ATOM 0 HG22 VAL A 406 0.438 6.776 -5.697 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -0.204 8.370 -6.160 1.00 0.00 H new ATOM 744 N THR A 410 -0.079 6.118 -9.861 1.00 0.00 N ATOM 745 CA THR A 410 1.306 6.026 -9.414 1.00 0.00 C ATOM 746 C THR A 410 1.444 5.026 -8.272 1.00 0.00 C ATOM 747 O THR A 410 1.011 5.286 -7.150 1.00 0.00 O ATOM 748 CB THR A 410 1.813 7.398 -8.969 1.00 0.00 C ATOM 749 OG1 THR A 410 1.695 8.342 -10.019 1.00 0.00 O ATOM 750 CG2 THR A 410 3.260 7.387 -8.523 1.00 0.00 C ATOM 0 HA THR A 410 1.909 5.678 -10.253 1.00 0.00 H new ATOM 0 HB THR A 410 1.189 7.673 -8.118 1.00 0.00 H new ATOM 0 HG1 THR A 410 0.907 8.131 -10.562 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.555 8.392 -8.221 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.376 6.706 -7.680 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.892 7.056 -9.347 1.00 0.00 H new ATOM 758 N VAL A 411 2.050 3.879 -8.564 1.00 0.00 N ATOM 759 CA VAL A 411 2.243 2.842 -7.559 1.00 0.00 C ATOM 760 C VAL A 411 3.332 3.236 -6.567 1.00 0.00 C ATOM 761 O VAL A 411 4.486 3.444 -6.944 1.00 0.00 O ATOM 762 CB VAL A 411 2.610 1.491 -8.208 1.00 0.00 C ATOM 763 CG1 VAL A 411 3.923 1.597 -8.968 1.00 0.00 C ATOM 764 CG2 VAL A 411 2.681 0.394 -7.155 1.00 0.00 C ATOM 0 H VAL A 411 2.415 3.646 -9.487 1.00 0.00 H new ATOM 0 HA VAL A 411 1.297 2.733 -7.028 1.00 0.00 H new ATOM 0 HB VAL A 411 1.828 1.230 -8.921 1.00 0.00 H new ATOM 0 HG11 VAL A 411 4.162 0.633 -9.417 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.830 2.349 -9.751 1.00 0.00 H new ATOM 0 HG13 VAL A 411 4.719 1.885 -8.281 1.00 0.00 H new ATOM 0 HG21 VAL A 411 2.941 -0.551 -7.631 1.00 0.00 H new ATOM 0 HG22 VAL A 411 3.440 0.648 -6.415 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.713 0.298 -6.663 1.00 0.00 H new ATOM 774 N LEU A 412 2.955 3.338 -5.298 1.00 0.00 N ATOM 775 CA LEU A 412 3.893 3.710 -4.248 1.00 0.00 C ATOM 776 C LEU A 412 4.316 2.495 -3.429 1.00 0.00 C ATOM 777 O LEU A 412 5.352 2.516 -2.763 1.00 0.00 O ATOM 778 CB LEU A 412 3.269 4.761 -3.330 1.00 0.00 C ATOM 779 CG LEU A 412 4.263 5.715 -2.668 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.415 6.983 -3.494 1.00 0.00 C ATOM 781 CD2 LEU A 412 3.821 6.047 -1.250 1.00 0.00 C ATOM 0 H LEU A 412 2.004 3.168 -4.972 1.00 0.00 H new ATOM 0 HA LEU A 412 4.780 4.127 -4.725 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.555 5.348 -3.908 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.704 4.250 -2.550 1.00 0.00 H new ATOM 0 HG LEU A 412 5.233 5.221 -2.617 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.126 7.651 -3.008 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.779 6.728 -4.489 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.449 7.481 -3.578 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.541 6.727 -0.794 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.840 6.521 -1.276 1.00 0.00 H new ATOM 0 HD23 LEU A 412 3.765 5.131 -0.662 1.00 0.00 H new ATOM 793 N GLY A 413 3.510 1.438 -3.475 1.00 0.00 N ATOM 794 CA GLY A 413 3.827 0.237 -2.722 1.00 0.00 C ATOM 795 C GLY A 413 3.414 -1.036 -3.436 1.00 0.00 C ATOM 796 O GLY A 413 2.227 -1.284 -3.640 1.00 0.00 O ATOM 0 H GLY A 413 2.647 1.391 -4.017 1.00 0.00 H new ATOM 0 HA2 GLY A 413 4.900 0.208 -2.530 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.331 0.281 -1.753 1.00 0.00 H new ATOM 800 N THR A 414 4.399 -1.844 -3.814 1.00 0.00 N ATOM 801 CA THR A 414 4.140 -3.100 -4.504 1.00 0.00 C ATOM 802 C THR A 414 4.591 -4.285 -3.654 1.00 0.00 C ATOM 803 O THR A 414 5.709 -4.300 -3.139 1.00 0.00 O ATOM 804 CB THR A 414 4.861 -3.114 -5.853 1.00 0.00 C ATOM 805 OG1 THR A 414 4.346 -2.107 -6.705 1.00 0.00 O ATOM 806 CG2 THR A 414 4.750 -4.436 -6.585 1.00 0.00 C ATOM 0 H THR A 414 5.387 -1.649 -3.653 1.00 0.00 H new ATOM 0 HA THR A 414 3.067 -3.188 -4.673 1.00 0.00 H new ATOM 0 HB THR A 414 5.911 -2.938 -5.619 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.820 -2.130 -7.562 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.284 -4.373 -7.533 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.185 -5.227 -5.975 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.700 -4.660 -6.775 1.00 0.00 H new ATOM 814 N GLY A 415 3.717 -5.277 -3.509 1.00 0.00 N ATOM 815 CA GLY A 415 4.052 -6.445 -2.717 1.00 0.00 C ATOM 816 C GLY A 415 3.113 -7.611 -2.964 1.00 0.00 C ATOM 817 O GLY A 415 1.902 -7.428 -3.081 1.00 0.00 O ATOM 0 H GLY A 415 2.786 -5.292 -3.925 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.073 -6.752 -2.944 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.026 -6.181 -1.660 1.00 0.00 H new ATOM 821 N VAL A 416 3.677 -8.813 -3.044 1.00 0.00 N ATOM 822 CA VAL A 416 2.889 -10.015 -3.276 1.00 0.00 C ATOM 823 C VAL A 416 2.385 -10.606 -1.968 1.00 0.00 C ATOM 824 O VAL A 416 2.680 -10.102 -0.884 1.00 0.00 O ATOM 825 CB VAL A 416 3.709 -11.077 -4.038 1.00 0.00 C ATOM 826 CG1 VAL A 416 4.699 -11.779 -3.118 1.00 0.00 C ATOM 827 CG2 VAL A 416 2.801 -12.084 -4.728 1.00 0.00 C ATOM 0 H VAL A 416 4.679 -8.978 -2.951 1.00 0.00 H new ATOM 0 HA VAL A 416 2.032 -9.725 -3.883 1.00 0.00 H new ATOM 0 HB VAL A 416 4.280 -10.558 -4.808 1.00 0.00 H new ATOM 0 HG11 VAL A 416 5.260 -12.521 -3.686 1.00 0.00 H new ATOM 0 HG12 VAL A 416 5.388 -11.046 -2.698 1.00 0.00 H new ATOM 0 HG13 VAL A 416 4.158 -12.273 -2.311 1.00 0.00 H new ATOM 0 HG21 VAL A 416 3.408 -12.819 -5.256 1.00 0.00 H new ATOM 0 HG22 VAL A 416 2.186 -12.589 -3.983 1.00 0.00 H new ATOM 0 HG23 VAL A 416 2.158 -11.566 -5.439 1.00 0.00 H new ATOM 837 N GLY A 417 1.625 -11.679 -2.087 1.00 0.00 N ATOM 838 CA GLY A 417 1.079 -12.345 -0.920 1.00 0.00 C ATOM 839 C GLY A 417 0.233 -13.550 -1.283 1.00 0.00 C ATOM 840 O GLY A 417 -0.336 -13.611 -2.372 1.00 0.00 O ATOM 0 H GLY A 417 1.372 -12.107 -2.978 1.00 0.00 H new ATOM 0 HA2 GLY A 417 1.895 -12.660 -0.270 1.00 0.00 H new ATOM 0 HA3 GLY A 417 0.474 -11.638 -0.352 1.00 0.00 H new ATOM 844 N ARG A 418 0.152 -14.512 -0.369 1.00 0.00 N ATOM 845 CA ARG A 418 -0.631 -15.721 -0.599 1.00 0.00 C ATOM 846 C ARG A 418 -2.081 -15.380 -0.928 1.00 0.00 C ATOM 847 O ARG A 418 -2.749 -16.109 -1.662 1.00 0.00 O ATOM 848 CB ARG A 418 -0.575 -16.632 0.630 1.00 0.00 C ATOM 849 CG ARG A 418 0.579 -17.621 0.602 1.00 0.00 C ATOM 850 CD ARG A 418 1.219 -17.771 1.973 1.00 0.00 C ATOM 851 NE ARG A 418 1.955 -16.573 2.367 1.00 0.00 N ATOM 852 CZ ARG A 418 3.094 -16.181 1.800 1.00 0.00 C ATOM 853 NH1 ARG A 418 3.631 -16.890 0.816 1.00 0.00 N ATOM 854 NH2 ARG A 418 3.696 -15.077 2.219 1.00 0.00 N ATOM 0 H ARG A 418 0.619 -14.478 0.537 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.199 -16.245 -1.452 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -0.493 -16.016 1.525 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -1.513 -17.182 0.707 1.00 0.00 H new ATOM 0 HG2 ARG A 418 0.220 -18.591 0.259 1.00 0.00 H new ATOM 0 HG3 ARG A 418 1.328 -17.287 -0.116 1.00 0.00 H new ATOM 0 HD2 ARG A 418 0.447 -17.982 2.713 1.00 0.00 H new ATOM 0 HD3 ARG A 418 1.895 -18.626 1.966 1.00 0.00 H new ATOM 0 HE ARG A 418 1.574 -16.002 3.122 1.00 0.00 H new ATOM 0 HH11 ARG A 418 3.171 -17.740 0.490 1.00 0.00 H new ATOM 0 HH12 ARG A 418 4.504 -16.585 0.385 1.00 0.00 H new ATOM 0 HH21 ARG A 418 3.287 -14.529 2.975 1.00 0.00 H new ATOM 0 HH22 ARG A 418 4.569 -14.776 1.785 1.00 0.00 H new ATOM 866 N ASN A 419 -2.561 -14.267 -0.384 1.00 0.00 N ATOM 867 CA ASN A 419 -3.932 -13.829 -0.622 1.00 0.00 C ATOM 868 C ASN A 419 -4.013 -12.308 -0.677 1.00 0.00 C ATOM 869 O ASN A 419 -3.001 -11.617 -0.554 1.00 0.00 O ATOM 870 CB ASN A 419 -4.858 -14.361 0.474 1.00 0.00 C ATOM 871 CG ASN A 419 -4.665 -15.844 0.723 1.00 0.00 C ATOM 872 OD1 ASN A 419 -4.057 -16.180 1.855 1.00 0.00 O flip ATOM 873 ND2 ASN A 419 -5.060 -16.679 -0.091 1.00 0.00 N flip ATOM 0 H ASN A 419 -2.021 -13.652 0.225 1.00 0.00 H new ATOM 0 HA ASN A 419 -4.253 -14.228 -1.584 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -4.675 -13.813 1.398 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -5.894 -14.174 0.193 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -5.522 -16.376 -0.948 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -4.925 -17.673 0.092 1.00 0.00 H new ATOM 880 N ILE A 420 -5.223 -11.789 -0.862 1.00 0.00 N ATOM 881 CA ILE A 420 -5.432 -10.347 -0.932 1.00 0.00 C ATOM 882 C ILE A 420 -5.054 -9.678 0.386 1.00 0.00 C ATOM 883 O ILE A 420 -4.593 -8.537 0.404 1.00 0.00 O ATOM 884 CB ILE A 420 -6.895 -10.004 -1.272 1.00 0.00 C ATOM 885 CG1 ILE A 420 -7.332 -10.736 -2.542 1.00 0.00 C ATOM 886 CG2 ILE A 420 -7.063 -8.500 -1.439 1.00 0.00 C ATOM 887 CD1 ILE A 420 -8.054 -12.037 -2.270 1.00 0.00 C ATOM 0 H ILE A 420 -6.072 -12.344 -0.966 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.789 -9.970 -1.728 1.00 0.00 H new ATOM 0 HB ILE A 420 -7.529 -10.332 -0.448 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -7.983 -10.083 -3.123 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -6.454 -10.938 -3.156 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -8.102 -8.274 -1.679 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.787 -7.998 -0.512 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -6.420 -8.149 -2.246 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -8.335 -12.502 -3.215 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -7.398 -12.708 -1.716 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.951 -11.840 -1.683 1.00 0.00 H new ATOM 899 N LYS A 421 -5.249 -10.398 1.486 1.00 0.00 N ATOM 900 CA LYS A 421 -4.926 -9.874 2.808 1.00 0.00 C ATOM 901 C LYS A 421 -3.422 -9.696 2.965 1.00 0.00 C ATOM 902 O LYS A 421 -2.940 -8.599 3.245 1.00 0.00 O ATOM 903 CB LYS A 421 -5.457 -10.809 3.896 1.00 0.00 C ATOM 904 CG LYS A 421 -6.899 -11.239 3.677 1.00 0.00 C ATOM 905 CD LYS A 421 -6.982 -12.643 3.100 1.00 0.00 C ATOM 906 CE LYS A 421 -7.191 -13.682 4.191 1.00 0.00 C ATOM 907 NZ LYS A 421 -8.110 -14.768 3.755 1.00 0.00 N ATOM 0 H LYS A 421 -5.629 -11.345 1.488 1.00 0.00 H new ATOM 0 HA LYS A 421 -5.404 -8.900 2.913 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.825 -11.696 3.942 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -5.378 -10.311 4.862 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -7.438 -11.201 4.623 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -7.390 -10.538 3.002 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -7.802 -12.695 2.384 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -6.066 -12.867 2.553 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -6.229 -14.111 4.472 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -7.596 -13.198 5.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -8.226 -15.455 4.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -9.036 -14.362 3.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -7.711 -15.247 2.922 1.00 0.00 H new ATOM 921 N ILE A 422 -2.688 -10.784 2.779 1.00 0.00 N ATOM 922 CA ILE A 422 -1.235 -10.759 2.895 1.00 0.00 C ATOM 923 C ILE A 422 -0.624 -9.799 1.881 1.00 0.00 C ATOM 924 O ILE A 422 0.128 -8.893 2.240 1.00 0.00 O ATOM 925 CB ILE A 422 -0.632 -12.168 2.700 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.971 -13.060 3.896 1.00 0.00 C ATOM 927 CG2 ILE A 422 0.878 -12.094 2.504 1.00 0.00 C ATOM 928 CD1 ILE A 422 -2.392 -13.581 3.880 1.00 0.00 C ATOM 0 H ILE A 422 -3.076 -11.698 2.546 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.998 -10.413 3.901 1.00 0.00 H new ATOM 0 HB ILE A 422 -1.069 -12.603 1.801 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -0.283 -13.905 3.915 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -0.810 -12.497 4.816 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.277 -13.099 2.369 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.101 -11.493 1.622 1.00 0.00 H new ATOM 0 HG23 ILE A 422 1.337 -11.636 3.380 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -2.560 -14.205 4.757 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -3.087 -12.742 3.893 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -2.553 -14.172 2.978 1.00 0.00 H new ATOM 940 N ALA A 423 -0.949 -10.010 0.613 1.00 0.00 N ATOM 941 CA ALA A 423 -0.431 -9.170 -0.461 1.00 0.00 C ATOM 942 C ALA A 423 -0.657 -7.693 -0.158 1.00 0.00 C ATOM 943 O ALA A 423 0.175 -6.846 -0.488 1.00 0.00 O ATOM 944 CB ALA A 423 -1.078 -9.546 -1.786 1.00 0.00 C ATOM 0 H ALA A 423 -1.570 -10.757 0.301 1.00 0.00 H new ATOM 0 HA ALA A 423 0.643 -9.339 -0.535 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.681 -8.911 -2.578 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.860 -10.589 -2.014 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -2.157 -9.408 -1.716 1.00 0.00 H new ATOM 950 N GLY A 424 -1.783 -7.392 0.478 1.00 0.00 N ATOM 951 CA GLY A 424 -2.094 -6.018 0.821 1.00 0.00 C ATOM 952 C GLY A 424 -1.160 -5.470 1.881 1.00 0.00 C ATOM 953 O GLY A 424 -0.732 -4.318 1.805 1.00 0.00 O ATOM 0 H GLY A 424 -2.486 -8.075 0.762 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -2.030 -5.398 -0.073 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -3.122 -5.958 1.178 1.00 0.00 H new ATOM 957 N ILE A 425 -0.841 -6.298 2.871 1.00 0.00 N ATOM 958 CA ILE A 425 0.052 -5.892 3.946 1.00 0.00 C ATOM 959 C ILE A 425 1.485 -5.772 3.441 1.00 0.00 C ATOM 960 O ILE A 425 2.240 -4.905 3.882 1.00 0.00 O ATOM 961 CB ILE A 425 0.011 -6.895 5.118 1.00 0.00 C ATOM 962 CG1 ILE A 425 -1.414 -7.024 5.658 1.00 0.00 C ATOM 963 CG2 ILE A 425 0.966 -6.465 6.224 1.00 0.00 C ATOM 964 CD1 ILE A 425 -1.537 -7.995 6.814 1.00 0.00 C ATOM 0 H ILE A 425 -1.189 -7.254 2.949 1.00 0.00 H new ATOM 0 HA ILE A 425 -0.291 -4.920 4.301 1.00 0.00 H new ATOM 0 HB ILE A 425 0.331 -7.870 4.750 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -1.762 -6.043 5.980 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -2.072 -7.347 4.851 1.00 0.00 H new ATOM 0 HG21 ILE A 425 0.923 -7.184 7.042 1.00 0.00 H new ATOM 0 HG22 ILE A 425 1.982 -6.422 5.831 1.00 0.00 H new ATOM 0 HG23 ILE A 425 0.677 -5.480 6.592 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -2.574 -8.036 7.146 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -1.220 -8.987 6.492 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -0.905 -7.662 7.638 1.00 0.00 H new ATOM 976 N ARG A 426 1.852 -6.647 2.512 1.00 0.00 N ATOM 977 CA ARG A 426 3.193 -6.638 1.943 1.00 0.00 C ATOM 978 C ARG A 426 3.401 -5.408 1.069 1.00 0.00 C ATOM 979 O ARG A 426 4.457 -4.775 1.108 1.00 0.00 O ATOM 980 CB ARG A 426 3.435 -7.911 1.129 1.00 0.00 C ATOM 981 CG ARG A 426 4.197 -8.984 1.890 1.00 0.00 C ATOM 982 CD ARG A 426 3.270 -9.809 2.770 1.00 0.00 C ATOM 983 NE ARG A 426 3.791 -9.952 4.128 1.00 0.00 N ATOM 984 CZ ARG A 426 4.907 -10.612 4.428 1.00 0.00 C ATOM 985 NH1 ARG A 426 5.623 -11.189 3.472 1.00 0.00 N ATOM 986 NH2 ARG A 426 5.309 -10.691 5.689 1.00 0.00 N ATOM 0 H ARG A 426 1.239 -7.371 2.137 1.00 0.00 H new ATOM 0 HA ARG A 426 3.910 -6.603 2.763 1.00 0.00 H new ATOM 0 HB2 ARG A 426 2.475 -8.316 0.810 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.989 -7.655 0.226 1.00 0.00 H new ATOM 0 HG2 ARG A 426 4.708 -9.639 1.184 1.00 0.00 H new ATOM 0 HG3 ARG A 426 4.966 -8.518 2.506 1.00 0.00 H new ATOM 0 HD2 ARG A 426 2.288 -9.337 2.806 1.00 0.00 H new ATOM 0 HD3 ARG A 426 3.133 -10.796 2.328 1.00 0.00 H new ATOM 0 HE ARG A 426 3.269 -9.521 4.891 1.00 0.00 H new ATOM 0 HH11 ARG A 426 5.319 -11.128 2.500 1.00 0.00 H new ATOM 0 HH12 ARG A 426 6.477 -11.693 3.709 1.00 0.00 H new ATOM 0 HH21 ARG A 426 4.763 -10.246 6.427 1.00 0.00 H new ATOM 0 HH22 ARG A 426 6.164 -11.196 5.921 1.00 0.00 H new ATOM 998 N ALA A 427 2.385 -5.071 0.284 1.00 0.00 N ATOM 999 CA ALA A 427 2.454 -3.913 -0.596 1.00 0.00 C ATOM 1000 C ALA A 427 2.632 -2.634 0.211 1.00 0.00 C ATOM 1001 O ALA A 427 3.503 -1.815 -0.082 1.00 0.00 O ATOM 1002 CB ALA A 427 1.204 -3.827 -1.461 1.00 0.00 C ATOM 0 H ALA A 427 1.504 -5.583 0.239 1.00 0.00 H new ATOM 0 HA ALA A 427 3.320 -4.029 -1.248 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.272 -2.956 -2.113 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.119 -4.728 -2.068 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.325 -3.735 -0.823 1.00 0.00 H new ATOM 1008 N ALA A 428 1.806 -2.478 1.238 1.00 0.00 N ATOM 1009 CA ALA A 428 1.874 -1.308 2.104 1.00 0.00 C ATOM 1010 C ALA A 428 3.234 -1.224 2.779 1.00 0.00 C ATOM 1011 O ALA A 428 3.830 -0.151 2.875 1.00 0.00 O ATOM 1012 CB ALA A 428 0.767 -1.359 3.146 1.00 0.00 C ATOM 0 H ALA A 428 1.080 -3.148 1.492 1.00 0.00 H new ATOM 0 HA ALA A 428 1.737 -0.416 1.493 1.00 0.00 H new ATOM 0 HB1 ALA A 428 0.829 -0.479 3.786 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -0.202 -1.377 2.647 1.00 0.00 H new ATOM 0 HB3 ALA A 428 0.879 -2.258 3.752 1.00 0.00 H new ATOM 1018 N GLU A 429 3.724 -2.370 3.235 1.00 0.00 N ATOM 1019 CA GLU A 429 5.021 -2.436 3.892 1.00 0.00 C ATOM 1020 C GLU A 429 6.119 -2.008 2.929 1.00 0.00 C ATOM 1021 O GLU A 429 7.073 -1.333 3.316 1.00 0.00 O ATOM 1022 CB GLU A 429 5.287 -3.848 4.410 1.00 0.00 C ATOM 1023 CG GLU A 429 4.714 -4.099 5.793 1.00 0.00 C ATOM 1024 CD GLU A 429 4.873 -5.538 6.241 1.00 0.00 C ATOM 1025 OE1 GLU A 429 4.420 -6.442 5.506 1.00 0.00 O ATOM 1026 OE2 GLU A 429 5.451 -5.763 7.324 1.00 0.00 O ATOM 0 H GLU A 429 3.242 -3.266 3.161 1.00 0.00 H new ATOM 0 HA GLU A 429 5.016 -1.754 4.742 1.00 0.00 H new ATOM 0 HB2 GLU A 429 4.862 -4.569 3.712 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.363 -4.022 4.433 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.207 -3.443 6.510 1.00 0.00 H new ATOM 0 HG3 GLU A 429 3.656 -3.837 5.796 1.00 0.00 H new ATOM 1033 N ASN A 430 5.965 -2.386 1.665 1.00 0.00 N ATOM 1034 CA ASN A 430 6.931 -2.022 0.638 1.00 0.00 C ATOM 1035 C ASN A 430 6.981 -0.507 0.497 1.00 0.00 C ATOM 1036 O ASN A 430 8.036 0.072 0.236 1.00 0.00 O ATOM 1037 CB ASN A 430 6.561 -2.670 -0.700 1.00 0.00 C ATOM 1038 CG ASN A 430 7.589 -3.688 -1.151 1.00 0.00 C ATOM 1039 OD1 ASN A 430 7.717 -4.762 -0.562 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.328 -3.356 -2.204 1.00 0.00 N ATOM 0 H ASN A 430 5.180 -2.944 1.328 1.00 0.00 H new ATOM 0 HA ASN A 430 7.915 -2.386 0.932 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.589 -3.155 -0.610 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.462 -1.896 -1.461 1.00 0.00 H new ATOM 0 HD21 ASN A 430 9.035 -4.002 -2.555 1.00 0.00 H new ATOM 0 HD22 ASN A 430 8.188 -2.455 -2.662 1.00 0.00 H new ATOM 1047 N ALA A 431 5.829 0.128 0.687 1.00 0.00 N ATOM 1048 CA ALA A 431 5.730 1.577 0.601 1.00 0.00 C ATOM 1049 C ALA A 431 6.430 2.229 1.789 1.00 0.00 C ATOM 1050 O ALA A 431 6.961 3.334 1.681 1.00 0.00 O ATOM 1051 CB ALA A 431 4.269 2.002 0.542 1.00 0.00 C ATOM 0 H ALA A 431 4.949 -0.342 0.902 1.00 0.00 H new ATOM 0 HA ALA A 431 6.224 1.908 -0.312 1.00 0.00 H new ATOM 0 HB1 ALA A 431 4.208 3.088 0.478 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.797 1.560 -0.335 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.755 1.662 1.441 1.00 0.00 H new ATOM 1057 N LEU A 432 6.431 1.530 2.922 1.00 0.00 N ATOM 1058 CA LEU A 432 7.071 2.034 4.131 1.00 0.00 C ATOM 1059 C LEU A 432 8.588 2.041 3.977 1.00 0.00 C ATOM 1060 O LEU A 432 9.274 2.908 4.519 1.00 0.00 O ATOM 1061 CB LEU A 432 6.671 1.179 5.338 1.00 0.00 C ATOM 1062 CG LEU A 432 5.646 1.818 6.275 1.00 0.00 C ATOM 1063 CD1 LEU A 432 4.293 1.926 5.589 1.00 0.00 C ATOM 1064 CD2 LEU A 432 5.532 1.018 7.564 1.00 0.00 C ATOM 0 H LEU A 432 5.996 0.614 3.026 1.00 0.00 H new ATOM 0 HA LEU A 432 6.735 3.058 4.293 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.269 0.233 4.976 1.00 0.00 H new ATOM 0 HB3 LEU A 432 7.568 0.945 5.911 1.00 0.00 H new ATOM 0 HG LEU A 432 5.985 2.823 6.525 1.00 0.00 H new ATOM 0 HD11 LEU A 432 3.575 2.383 6.270 1.00 0.00 H new ATOM 0 HD12 LEU A 432 4.387 2.541 4.694 1.00 0.00 H new ATOM 0 HD13 LEU A 432 3.946 0.931 5.310 1.00 0.00 H new ATOM 0 HD21 LEU A 432 4.798 1.487 8.220 1.00 0.00 H new ATOM 0 HD22 LEU A 432 5.216 0.001 7.334 1.00 0.00 H new ATOM 0 HD23 LEU A 432 6.501 0.993 8.063 1.00 0.00 H new ATOM 1076 N ARG A 433 9.106 1.067 3.234 1.00 0.00 N ATOM 1077 CA ARG A 433 10.543 0.957 3.006 1.00 0.00 C ATOM 1078 C ARG A 433 11.099 2.235 2.387 1.00 0.00 C ATOM 1079 O ARG A 433 12.169 2.708 2.769 1.00 0.00 O ATOM 1080 CB ARG A 433 10.844 -0.240 2.100 1.00 0.00 C ATOM 1081 CG ARG A 433 11.437 -1.429 2.840 1.00 0.00 C ATOM 1082 CD ARG A 433 12.759 -1.867 2.230 1.00 0.00 C ATOM 1083 NE ARG A 433 12.566 -2.777 1.102 1.00 0.00 N ATOM 1084 CZ ARG A 433 13.495 -3.023 0.181 1.00 0.00 C ATOM 1085 NH1 ARG A 433 14.681 -2.430 0.249 1.00 0.00 N ATOM 1086 NH2 ARG A 433 13.238 -3.865 -0.811 1.00 0.00 N ATOM 0 H ARG A 433 8.551 0.342 2.779 1.00 0.00 H new ATOM 0 HA ARG A 433 11.028 0.806 3.970 1.00 0.00 H new ATOM 0 HB2 ARG A 433 9.924 -0.552 1.606 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.536 0.072 1.317 1.00 0.00 H new ATOM 0 HG2 ARG A 433 11.588 -1.168 3.887 1.00 0.00 H new ATOM 0 HG3 ARG A 433 10.732 -2.260 2.817 1.00 0.00 H new ATOM 0 HD2 ARG A 433 13.313 -0.989 1.897 1.00 0.00 H new ATOM 0 HD3 ARG A 433 13.365 -2.357 2.992 1.00 0.00 H new ATOM 0 HE ARG A 433 11.667 -3.251 1.016 1.00 0.00 H new ATOM 0 HH11 ARG A 433 14.884 -1.782 1.010 1.00 0.00 H new ATOM 0 HH12 ARG A 433 15.389 -2.623 -0.460 1.00 0.00 H new ATOM 0 HH21 ARG A 433 12.329 -4.324 -0.868 1.00 0.00 H new ATOM 0 HH22 ARG A 433 13.950 -4.054 -1.517 1.00 0.00 H new ATOM 1098 N ASP A 434 10.364 2.786 1.429 1.00 0.00 N ATOM 1099 CA ASP A 434 10.780 4.011 0.755 1.00 0.00 C ATOM 1100 C ASP A 434 10.746 5.197 1.713 1.00 0.00 C ATOM 1101 O ASP A 434 9.851 6.039 1.642 1.00 0.00 O ATOM 1102 CB ASP A 434 9.881 4.284 -0.451 1.00 0.00 C ATOM 1103 CG ASP A 434 10.064 3.259 -1.553 1.00 0.00 C ATOM 1104 OD1 ASP A 434 10.539 2.144 -1.254 1.00 0.00 O ATOM 1105 OD2 ASP A 434 9.732 3.573 -2.716 1.00 0.00 O ATOM 0 H ASP A 434 9.477 2.405 1.101 1.00 0.00 H new ATOM 0 HA ASP A 434 11.805 3.878 0.410 1.00 0.00 H new ATOM 0 HB2 ASP A 434 8.839 4.287 -0.131 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.096 5.278 -0.844 1.00 0.00 H new ATOM 1110 N LYS A 435 11.727 5.255 2.608 1.00 0.00 N ATOM 1111 CA LYS A 435 11.812 6.334 3.587 1.00 0.00 C ATOM 1112 C LYS A 435 11.836 7.697 2.901 1.00 0.00 C ATOM 1113 O LYS A 435 11.246 8.660 3.391 1.00 0.00 O ATOM 1114 CB LYS A 435 13.061 6.165 4.455 1.00 0.00 C ATOM 1115 CG LYS A 435 13.097 4.851 5.219 1.00 0.00 C ATOM 1116 CD LYS A 435 14.267 4.802 6.188 1.00 0.00 C ATOM 1117 CE LYS A 435 14.973 3.457 6.143 1.00 0.00 C ATOM 1118 NZ LYS A 435 16.377 3.548 6.629 1.00 0.00 N ATOM 0 H LYS A 435 12.476 4.566 2.676 1.00 0.00 H new ATOM 0 HA LYS A 435 10.926 6.284 4.220 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.945 6.232 3.821 1.00 0.00 H new ATOM 0 HB3 LYS A 435 13.114 6.990 5.165 1.00 0.00 H new ATOM 0 HG2 LYS A 435 12.164 4.722 5.767 1.00 0.00 H new ATOM 0 HG3 LYS A 435 13.171 4.022 4.515 1.00 0.00 H new ATOM 0 HD2 LYS A 435 14.975 5.594 5.945 1.00 0.00 H new ATOM 0 HD3 LYS A 435 13.910 4.993 7.200 1.00 0.00 H new ATOM 0 HE2 LYS A 435 14.424 2.739 6.752 1.00 0.00 H new ATOM 0 HE3 LYS A 435 14.967 3.078 5.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 16.822 2.609 6.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 16.908 4.214 6.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 16.383 3.885 7.613 1.00 0.00 H new ATOM 1132 N LYS A 436 12.520 7.769 1.766 1.00 0.00 N ATOM 1133 CA LYS A 436 12.618 9.012 1.013 1.00 0.00 C ATOM 1134 C LYS A 436 11.248 9.446 0.513 1.00 0.00 C ATOM 1135 O LYS A 436 10.787 10.549 0.802 1.00 0.00 O ATOM 1136 CB LYS A 436 13.572 8.842 -0.169 1.00 0.00 C ATOM 1137 CG LYS A 436 14.952 8.343 0.229 1.00 0.00 C ATOM 1138 CD LYS A 436 15.051 6.829 0.112 1.00 0.00 C ATOM 1139 CE LYS A 436 16.035 6.415 -0.971 1.00 0.00 C ATOM 1140 NZ LYS A 436 15.713 5.072 -1.529 1.00 0.00 N ATOM 0 H LYS A 436 13.015 6.981 1.347 1.00 0.00 H new ATOM 0 HA LYS A 436 13.008 9.783 1.677 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.134 8.143 -0.881 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.675 9.798 -0.683 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.706 8.808 -0.406 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.168 8.645 1.254 1.00 0.00 H new ATOM 0 HD2 LYS A 436 15.363 6.409 1.068 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.068 6.416 -0.112 1.00 0.00 H new ATOM 0 HE2 LYS A 436 16.025 7.153 -1.773 1.00 0.00 H new ATOM 0 HE3 LYS A 436 17.044 6.405 -0.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 16.406 4.826 -2.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 15.748 4.363 -0.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 14.760 5.088 -1.944 1.00 0.00 H new ATOM 1154 N MET A 437 10.602 8.561 -0.233 1.00 0.00 N ATOM 1155 CA MET A 437 9.277 8.839 -0.773 1.00 0.00 C ATOM 1156 C MET A 437 8.285 9.096 0.353 1.00 0.00 C ATOM 1157 O MET A 437 7.347 9.878 0.201 1.00 0.00 O ATOM 1158 CB MET A 437 8.801 7.670 -1.637 1.00 0.00 C ATOM 1159 CG MET A 437 7.418 7.875 -2.234 1.00 0.00 C ATOM 1160 SD MET A 437 7.476 8.410 -3.956 1.00 0.00 S ATOM 1161 CE MET A 437 7.607 10.185 -3.753 1.00 0.00 C ATOM 0 H MET A 437 10.974 7.643 -0.479 1.00 0.00 H new ATOM 0 HA MET A 437 9.338 9.733 -1.393 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.516 7.512 -2.445 1.00 0.00 H new ATOM 0 HB3 MET A 437 8.796 6.762 -1.034 1.00 0.00 H new ATOM 0 HG2 MET A 437 6.856 6.944 -2.166 1.00 0.00 H new ATOM 0 HG3 MET A 437 6.879 8.617 -1.645 1.00 0.00 H new ATOM 0 HE1 MET A 437 7.335 10.679 -4.686 1.00 0.00 H new ATOM 0 HE2 MET A 437 6.934 10.511 -2.960 1.00 0.00 H new ATOM 0 HE3 MET A 437 8.632 10.446 -3.489 1.00 0.00 H new ATOM 1171 N LEU A 438 8.504 8.439 1.488 1.00 0.00 N ATOM 1172 CA LEU A 438 7.633 8.609 2.641 1.00 0.00 C ATOM 1173 C LEU A 438 7.889 9.954 3.305 1.00 0.00 C ATOM 1174 O LEU A 438 6.960 10.626 3.755 1.00 0.00 O ATOM 1175 CB LEU A 438 7.849 7.476 3.648 1.00 0.00 C ATOM 1176 CG LEU A 438 6.573 6.924 4.283 1.00 0.00 C ATOM 1177 CD1 LEU A 438 5.822 8.027 5.018 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.687 6.284 3.225 1.00 0.00 C ATOM 0 H LEU A 438 9.275 7.787 1.632 1.00 0.00 H new ATOM 0 HA LEU A 438 6.599 8.578 2.298 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.370 6.660 3.148 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.505 7.835 4.441 1.00 0.00 H new ATOM 0 HG LEU A 438 6.850 6.158 5.007 1.00 0.00 H new ATOM 0 HD11 LEU A 438 4.916 7.616 5.464 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.457 8.440 5.802 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.554 8.816 4.315 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.783 5.896 3.694 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.417 7.030 2.477 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.226 5.467 2.745 1.00 0.00 H new ATOM 1190 N ASP A 439 9.157 10.346 3.351 1.00 0.00 N ATOM 1191 CA ASP A 439 9.543 11.615 3.950 1.00 0.00 C ATOM 1192 C ASP A 439 8.922 12.778 3.186 1.00 0.00 C ATOM 1193 O ASP A 439 8.560 13.797 3.773 1.00 0.00 O ATOM 1194 CB ASP A 439 11.066 11.754 3.968 1.00 0.00 C ATOM 1195 CG ASP A 439 11.676 11.269 5.269 1.00 0.00 C ATOM 1196 OD1 ASP A 439 11.097 10.352 5.889 1.00 0.00 O ATOM 1197 OD2 ASP A 439 12.731 11.806 5.666 1.00 0.00 O ATOM 0 H ASP A 439 9.935 9.801 2.980 1.00 0.00 H new ATOM 0 HA ASP A 439 9.175 11.635 4.976 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.489 11.188 3.138 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.335 12.799 3.811 1.00 0.00 H new ATOM 1202 N PHE A 440 8.803 12.619 1.872 1.00 0.00 N ATOM 1203 CA PHE A 440 8.224 13.657 1.026 1.00 0.00 C ATOM 1204 C PHE A 440 6.740 13.843 1.327 1.00 0.00 C ATOM 1205 O PHE A 440 6.236 14.966 1.342 1.00 0.00 O ATOM 1206 CB PHE A 440 8.413 13.303 -0.447 1.00 0.00 C ATOM 1207 CG PHE A 440 8.649 14.498 -1.327 1.00 0.00 C ATOM 1208 CD1 PHE A 440 7.584 15.254 -1.790 1.00 0.00 C ATOM 1209 CD2 PHE A 440 9.934 14.866 -1.690 1.00 0.00 C ATOM 1210 CE1 PHE A 440 7.797 16.354 -2.599 1.00 0.00 C ATOM 1211 CE2 PHE A 440 10.154 15.964 -2.499 1.00 0.00 C ATOM 1212 CZ PHE A 440 9.083 16.710 -2.954 1.00 0.00 C ATOM 0 H PHE A 440 9.099 11.782 1.370 1.00 0.00 H new ATOM 0 HA PHE A 440 8.739 14.593 1.240 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.257 12.620 -0.543 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.530 12.771 -0.800 1.00 0.00 H new ATOM 0 HD1 PHE A 440 6.576 14.980 -1.515 1.00 0.00 H new ATOM 0 HD2 PHE A 440 10.774 14.287 -1.336 1.00 0.00 H new ATOM 0 HE1 PHE A 440 6.958 16.935 -2.953 1.00 0.00 H new ATOM 0 HE2 PHE A 440 11.161 16.239 -2.775 1.00 0.00 H new ATOM 0 HZ PHE A 440 9.252 17.569 -3.586 1.00 0.00 H new ATOM 1222 N TYR A 441 6.046 12.736 1.568 1.00 0.00 N ATOM 1223 CA TYR A 441 4.623 12.778 1.871 1.00 0.00 C ATOM 1224 C TYR A 441 4.404 13.107 3.335 1.00 0.00 C ATOM 1225 O TYR A 441 3.530 13.899 3.677 1.00 0.00 O ATOM 1226 CB TYR A 441 3.964 11.445 1.527 1.00 0.00 C ATOM 1227 CG TYR A 441 3.520 11.347 0.086 1.00 0.00 C ATOM 1228 CD1 TYR A 441 2.270 11.806 -0.307 1.00 0.00 C ATOM 1229 CD2 TYR A 441 4.352 10.798 -0.882 1.00 0.00 C ATOM 1230 CE1 TYR A 441 1.860 11.719 -1.623 1.00 0.00 C ATOM 1231 CE2 TYR A 441 3.950 10.709 -2.201 1.00 0.00 C ATOM 1232 CZ TYR A 441 2.703 11.170 -2.567 1.00 0.00 C ATOM 1233 OH TYR A 441 2.298 11.083 -3.879 1.00 0.00 O ATOM 0 H TYR A 441 6.448 11.798 1.559 1.00 0.00 H new ATOM 0 HA TYR A 441 4.165 13.559 1.264 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.664 10.637 1.739 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.101 11.297 2.176 1.00 0.00 H new ATOM 0 HD1 TYR A 441 1.607 12.238 0.428 1.00 0.00 H new ATOM 0 HD2 TYR A 441 5.329 10.435 -0.599 1.00 0.00 H new ATOM 0 HE1 TYR A 441 0.884 12.079 -1.912 1.00 0.00 H new ATOM 0 HE2 TYR A 441 4.609 10.281 -2.942 1.00 0.00 H new ATOM 0 HH TYR A 441 3.009 10.673 -4.414 1.00 0.00 H new ATOM 1243 N ALA A 442 5.210 12.506 4.198 1.00 0.00 N ATOM 1244 CA ALA A 442 5.100 12.760 5.624 1.00 0.00 C ATOM 1245 C ALA A 442 5.264 14.249 5.910 1.00 0.00 C ATOM 1246 O ALA A 442 4.691 14.777 6.863 1.00 0.00 O ATOM 1247 CB ALA A 442 6.126 11.942 6.395 1.00 0.00 C ATOM 0 H ALA A 442 5.941 11.844 3.937 1.00 0.00 H new ATOM 0 HA ALA A 442 4.108 12.455 5.957 1.00 0.00 H new ATOM 0 HB1 ALA A 442 6.027 12.146 7.461 1.00 0.00 H new ATOM 0 HB2 ALA A 442 5.957 10.881 6.212 1.00 0.00 H new ATOM 0 HB3 ALA A 442 7.129 12.212 6.065 1.00 0.00 H new ATOM 1253 N LYS A 443 6.026 14.927 5.054 1.00 0.00 N ATOM 1254 CA LYS A 443 6.236 16.364 5.191 1.00 0.00 C ATOM 1255 C LYS A 443 5.162 17.128 4.418 1.00 0.00 C ATOM 1256 O LYS A 443 5.203 18.355 4.324 1.00 0.00 O ATOM 1257 CB LYS A 443 7.627 16.755 4.689 1.00 0.00 C ATOM 1258 CG LYS A 443 8.516 17.355 5.766 1.00 0.00 C ATOM 1259 CD LYS A 443 9.224 16.277 6.570 1.00 0.00 C ATOM 1260 CE LYS A 443 9.320 16.651 8.041 1.00 0.00 C ATOM 1261 NZ LYS A 443 9.729 15.492 8.881 1.00 0.00 N ATOM 0 H LYS A 443 6.507 14.504 4.260 1.00 0.00 H new ATOM 0 HA LYS A 443 6.165 16.625 6.247 1.00 0.00 H new ATOM 0 HB2 LYS A 443 8.116 15.873 4.276 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.522 17.472 3.875 1.00 0.00 H new ATOM 0 HG2 LYS A 443 9.255 18.011 5.305 1.00 0.00 H new ATOM 0 HG3 LYS A 443 7.914 17.972 6.434 1.00 0.00 H new ATOM 0 HD2 LYS A 443 8.687 15.334 6.468 1.00 0.00 H new ATOM 0 HD3 LYS A 443 10.225 16.120 6.167 1.00 0.00 H new ATOM 0 HE2 LYS A 443 10.039 17.461 8.164 1.00 0.00 H new ATOM 0 HE3 LYS A 443 8.356 17.026 8.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 9.783 15.787 9.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 9.029 14.729 8.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 10.661 15.150 8.570 1.00 0.00 H new ATOM 1275 N GLN A 444 4.199 16.387 3.873 1.00 0.00 N ATOM 1276 CA GLN A 444 3.107 16.973 3.116 1.00 0.00 C ATOM 1277 C GLN A 444 1.784 16.707 3.818 1.00 0.00 C ATOM 1278 O GLN A 444 0.986 17.619 4.024 1.00 0.00 O ATOM 1279 CB GLN A 444 3.074 16.405 1.696 1.00 0.00 C ATOM 1280 CG GLN A 444 4.260 16.826 0.845 1.00 0.00 C ATOM 1281 CD GLN A 444 3.976 18.070 0.026 1.00 0.00 C ATOM 1282 OE1 GLN A 444 3.806 18.001 -1.191 1.00 0.00 O ATOM 1283 NE2 GLN A 444 3.925 19.219 0.692 1.00 0.00 N ATOM 0 H GLN A 444 4.158 15.370 3.946 1.00 0.00 H new ATOM 0 HA GLN A 444 3.265 18.050 3.054 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.044 15.317 1.750 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.154 16.726 1.207 1.00 0.00 H new ATOM 0 HG2 GLN A 444 5.119 17.008 1.490 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.531 16.009 0.176 1.00 0.00 H new ATOM 0 HE21 GLN A 444 4.072 19.230 1.701 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.739 20.089 0.194 1.00 0.00 H new ATOM 1292 N ARG A 445 1.558 15.451 4.188 1.00 0.00 N ATOM 1293 CA ARG A 445 0.328 15.079 4.879 1.00 0.00 C ATOM 1294 C ARG A 445 0.291 15.684 6.278 1.00 0.00 C ATOM 1295 O ARG A 445 -0.770 16.065 6.772 1.00 0.00 O ATOM 1296 CB ARG A 445 0.188 13.554 4.960 1.00 0.00 C ATOM 1297 CG ARG A 445 1.244 12.886 5.828 1.00 0.00 C ATOM 1298 CD ARG A 445 0.635 12.224 7.058 1.00 0.00 C ATOM 1299 NE ARG A 445 -0.258 13.125 7.785 1.00 0.00 N ATOM 1300 CZ ARG A 445 -0.362 13.164 9.114 1.00 0.00 C ATOM 1301 NH1 ARG A 445 0.350 12.340 9.873 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -1.192 14.026 9.685 1.00 0.00 N ATOM 0 H ARG A 445 2.204 14.679 4.023 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.511 15.474 4.306 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -0.799 13.309 5.352 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.243 13.139 3.953 1.00 0.00 H new ATOM 0 HG2 ARG A 445 1.777 12.139 5.240 1.00 0.00 H new ATOM 0 HG3 ARG A 445 1.978 13.628 6.142 1.00 0.00 H new ATOM 0 HD2 ARG A 445 0.083 11.335 6.754 1.00 0.00 H new ATOM 0 HD3 ARG A 445 1.433 11.892 7.722 1.00 0.00 H new ATOM 0 HE ARG A 445 -0.838 13.764 7.241 1.00 0.00 H new ATOM 0 HH11 ARG A 445 0.984 11.668 9.441 1.00 0.00 H new ATOM 0 HH12 ARG A 445 0.263 12.378 10.889 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -1.749 14.657 9.108 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -1.274 14.058 10.701 1.00 0.00 H new ATOM 1314 N ALA A 446 1.456 15.779 6.906 1.00 0.00 N ATOM 1315 CA ALA A 446 1.558 16.348 8.243 1.00 0.00 C ATOM 1316 C ALA A 446 1.757 17.858 8.171 1.00 0.00 C ATOM 1317 O ALA A 446 1.501 18.576 9.136 1.00 0.00 O ATOM 1318 CB ALA A 446 2.701 15.699 9.009 1.00 0.00 C ATOM 0 H ALA A 446 2.344 15.469 6.510 1.00 0.00 H new ATOM 0 HA ALA A 446 0.626 16.149 8.773 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.764 16.135 10.006 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.521 14.627 9.092 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.638 15.869 8.478 1.00 0.00 H new