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= -0.0325 X(o=-0.032,f=-0.049) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN :FLIP amide:sc= -0.0225 F(o=-1.8!,f=-0.023) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot -37:sc= 0.184 USER MOD Single : A 380 TYR OH : rot -145:sc= 1 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -0.0391 X(o=-0.039,f=-0.039) USER MOD Single : A 387 TYR OH : rot 38:sc= -4.06! USER MOD Single : A 389 THR OG1 : rot 45:sc= 0.876 USER MOD Single : A 399 ASN : amide:sc= -0.9 K(o=-0.9,f=-2.2!) USER MOD Single : A 400 SER OG : rot -90:sc= -2.58 USER MOD Single : A 404 CYS SG : rot 109:sc= 0.279 USER MOD Single : A 410 THR OG1 : rot 26:sc= 0.0862 USER MOD Single : A 414 THR OG1 : rot -149:sc= 0.267 USER MOD Single : A 419 ASN : amide:sc= -6.87! C(o=-6.9!,f=-12!) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -0.482 X(o=-0.48,f=-0.48) 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 147:sc= -0.529 (180deg=-1.74!) USER MOD Single : A 441 TYR OH : rot 180:sc= 0 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.221 X(o=-0.22,f=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -2.981 -3.092 9.194 1.00 0.00 N ATOM 103 CA ASN A 369 -2.636 -1.777 9.725 1.00 0.00 C ATOM 104 C ASN A 369 -1.695 -1.029 8.784 1.00 0.00 C ATOM 105 O ASN A 369 -1.675 0.202 8.763 1.00 0.00 O ATOM 106 CB ASN A 369 -1.987 -1.921 11.104 1.00 0.00 C ATOM 107 CG ASN A 369 -0.648 -2.633 11.043 1.00 0.00 C ATOM 108 OD1 ASN A 369 0.402 -1.997 10.954 1.00 0.00 O ATOM 109 ND2 ASN A 369 -0.679 -3.960 11.091 1.00 0.00 N ATOM 0 HA ASN A 369 -3.556 -1.199 9.816 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -1.850 -0.933 11.543 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.658 -2.472 11.763 1.00 0.00 H new ATOM 0 HD21 ASN A 369 0.190 -4.492 11.054 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -1.572 -4.447 11.165 1.00 0.00 H new ATOM 116 N ALA A 370 -0.912 -1.779 8.014 1.00 0.00 N ATOM 117 CA ALA A 370 0.038 -1.186 7.075 1.00 0.00 C ATOM 118 C ALA A 370 -0.607 -0.077 6.252 1.00 0.00 C ATOM 119 O ALA A 370 -0.010 0.979 6.040 1.00 0.00 O ATOM 120 CB ALA A 370 0.612 -2.258 6.161 1.00 0.00 C ATOM 0 H ALA A 370 -0.916 -2.799 8.021 1.00 0.00 H new ATOM 0 HA ALA A 370 0.847 -0.741 7.654 1.00 0.00 H new ATOM 0 HB1 ALA A 370 1.318 -1.804 5.466 1.00 0.00 H new ATOM 0 HB2 ALA A 370 1.125 -3.010 6.760 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.196 -2.729 5.601 1.00 0.00 H new ATOM 126 N LYS A 371 -1.828 -0.320 5.796 1.00 0.00 N ATOM 127 CA LYS A 371 -2.551 0.663 4.999 1.00 0.00 C ATOM 128 C LYS A 371 -2.836 1.916 5.817 1.00 0.00 C ATOM 129 O LYS A 371 -2.789 3.033 5.300 1.00 0.00 O ATOM 130 CB LYS A 371 -3.861 0.070 4.477 1.00 0.00 C ATOM 131 CG LYS A 371 -4.680 1.039 3.640 1.00 0.00 C ATOM 132 CD LYS A 371 -6.137 0.615 3.563 1.00 0.00 C ATOM 133 CE LYS A 371 -7.061 1.817 3.449 1.00 0.00 C ATOM 134 NZ LYS A 371 -8.489 1.441 3.641 1.00 0.00 N ATOM 0 H LYS A 371 -2.338 -1.187 5.963 1.00 0.00 H new ATOM 0 HA LYS A 371 -1.925 0.937 4.150 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -3.637 -0.813 3.879 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.462 -0.263 5.324 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -4.613 2.039 4.069 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -4.263 1.095 2.635 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.282 -0.040 2.703 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.397 0.038 4.450 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -6.779 2.563 4.192 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -6.936 2.279 2.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -9.086 2.289 3.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.766 0.748 2.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -8.614 1.023 4.585 1.00 0.00 H new ATOM 148 N ARG A 372 -3.121 1.725 7.100 1.00 0.00 N ATOM 149 CA ARG A 372 -3.403 2.843 7.991 1.00 0.00 C ATOM 150 C ARG A 372 -2.150 3.681 8.193 1.00 0.00 C ATOM 151 O ARG A 372 -2.213 4.908 8.271 1.00 0.00 O ATOM 152 CB ARG A 372 -3.921 2.338 9.339 1.00 0.00 C ATOM 153 CG ARG A 372 -5.254 1.614 9.247 1.00 0.00 C ATOM 154 CD ARG A 372 -5.901 1.465 10.614 1.00 0.00 C ATOM 155 NE ARG A 372 -5.558 0.194 11.248 1.00 0.00 N ATOM 156 CZ ARG A 372 -5.670 -0.038 12.553 1.00 0.00 C ATOM 157 NH1 ARG A 372 -6.116 0.912 13.368 1.00 0.00 N ATOM 158 NH2 ARG A 372 -5.335 -1.222 13.048 1.00 0.00 N ATOM 0 H ARG A 372 -3.163 0.808 7.545 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.174 3.463 7.534 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -3.181 1.666 9.774 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -4.023 3.183 10.019 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -5.923 2.163 8.584 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -5.105 0.629 8.804 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -5.585 2.287 11.256 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -6.984 1.539 10.512 1.00 0.00 H new ATOM 0 HE ARG A 372 -5.212 -0.560 10.655 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -6.375 1.825 12.994 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -6.200 0.728 14.368 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -4.991 -1.955 12.428 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -5.421 -1.399 14.049 1.00 0.00 H new ATOM 170 N GLN A 373 -1.007 3.007 8.263 1.00 0.00 N ATOM 171 CA GLN A 373 0.268 3.686 8.439 1.00 0.00 C ATOM 172 C GLN A 373 0.547 4.588 7.246 1.00 0.00 C ATOM 173 O GLN A 373 0.856 5.770 7.403 1.00 0.00 O ATOM 174 CB GLN A 373 1.395 2.663 8.599 1.00 0.00 C ATOM 175 CG GLN A 373 1.966 2.606 10.005 1.00 0.00 C ATOM 176 CD GLN A 373 3.400 3.096 10.076 1.00 0.00 C ATOM 177 OE1 GLN A 373 3.585 4.406 9.952 1.00 0.00 O flip ATOM 178 NE2 GLN A 373 4.330 2.307 10.240 1.00 0.00 N flip ATOM 0 H GLN A 373 -0.939 1.991 8.200 1.00 0.00 H new ATOM 0 HA GLN A 373 0.219 4.297 9.341 1.00 0.00 H new ATOM 0 HB2 GLN A 373 1.020 1.676 8.327 1.00 0.00 H new ATOM 0 HB3 GLN A 373 2.196 2.904 7.900 1.00 0.00 H new ATOM 0 HG2 GLN A 373 1.347 3.210 10.669 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.919 1.580 10.370 1.00 0.00 H new ATOM 0 HE21 GLN A 373 4.142 1.309 10.330 1.00 0.00 H new ATOM 0 HE22 GLN A 373 5.289 2.651 10.285 1.00 0.00 H new ATOM 187 N LEU A 374 0.427 4.021 6.052 1.00 0.00 N ATOM 188 CA LEU A 374 0.660 4.767 4.826 1.00 0.00 C ATOM 189 C LEU A 374 -0.312 5.934 4.711 1.00 0.00 C ATOM 190 O LEU A 374 0.083 7.057 4.405 1.00 0.00 O ATOM 191 CB LEU A 374 0.521 3.843 3.612 1.00 0.00 C ATOM 192 CG LEU A 374 1.247 4.307 2.348 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.688 4.681 2.661 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.197 3.222 1.281 1.00 0.00 C ATOM 0 H LEU A 374 0.169 3.045 5.909 1.00 0.00 H new ATOM 0 HA LEU A 374 1.674 5.166 4.854 1.00 0.00 H new ATOM 0 HB2 LEU A 374 0.895 2.856 3.883 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.538 3.731 3.382 1.00 0.00 H new ATOM 0 HG LEU A 374 0.741 5.194 1.967 1.00 0.00 H new ATOM 0 HD11 LEU A 374 3.186 5.008 1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 374 2.704 5.489 3.392 1.00 0.00 H new ATOM 0 HD13 LEU A 374 3.209 3.814 3.067 1.00 0.00 H new ATOM 0 HD21 LEU A 374 1.718 3.566 0.387 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.679 2.320 1.657 1.00 0.00 H new ATOM 0 HD23 LEU A 374 0.158 3.002 1.034 1.00 0.00 H new ATOM 206 N TYR A 375 -1.584 5.661 4.962 1.00 0.00 N ATOM 207 CA TYR A 375 -2.611 6.692 4.885 1.00 0.00 C ATOM 208 C TYR A 375 -2.395 7.760 5.951 1.00 0.00 C ATOM 209 O TYR A 375 -2.767 8.919 5.766 1.00 0.00 O ATOM 210 CB TYR A 375 -4.002 6.071 5.036 1.00 0.00 C ATOM 211 CG TYR A 375 -4.992 6.542 3.995 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.165 7.895 3.733 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.756 5.632 3.275 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.070 8.329 2.783 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.663 6.057 2.323 1.00 0.00 C ATOM 216 CZ TYR A 375 -6.816 7.406 2.081 1.00 0.00 C ATOM 217 OH TYR A 375 -7.719 7.833 1.133 1.00 0.00 O ATOM 0 H TYR A 375 -1.930 4.737 5.220 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.539 7.167 3.906 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -3.915 4.986 4.977 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.390 6.306 6.027 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.582 8.620 4.281 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.639 4.575 3.462 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -6.192 9.385 2.592 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.249 5.337 1.771 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.161 7.057 0.730 1.00 0.00 H new ATOM 227 N SER A 376 -1.791 7.365 7.065 1.00 0.00 N ATOM 228 CA SER A 376 -1.525 8.292 8.157 1.00 0.00 C ATOM 229 C SER A 376 -0.157 8.956 8.000 1.00 0.00 C ATOM 230 O SER A 376 0.196 9.849 8.770 1.00 0.00 O ATOM 231 CB SER A 376 -1.598 7.563 9.499 1.00 0.00 C ATOM 232 OG SER A 376 -1.611 8.481 10.579 1.00 0.00 O ATOM 0 H SER A 376 -1.477 6.410 7.236 1.00 0.00 H new ATOM 0 HA SER A 376 -2.287 9.071 8.128 1.00 0.00 H new ATOM 0 HB2 SER A 376 -2.495 6.945 9.532 1.00 0.00 H new ATOM 0 HB3 SER A 376 -0.745 6.892 9.599 1.00 0.00 H new ATOM 0 HG SER A 376 -1.017 9.234 10.376 1.00 0.00 H new ATOM 238 N LEU A 377 0.617 8.513 7.010 1.00 0.00 N ATOM 239 CA LEU A 377 1.943 9.069 6.779 1.00 0.00 C ATOM 240 C LEU A 377 2.010 9.866 5.475 1.00 0.00 C ATOM 241 O LEU A 377 2.853 10.750 5.331 1.00 0.00 O ATOM 242 CB LEU A 377 2.991 7.954 6.761 1.00 0.00 C ATOM 243 CG LEU A 377 3.825 7.830 8.038 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.947 7.424 9.211 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.953 6.828 7.841 1.00 0.00 C ATOM 0 H LEU A 377 0.348 7.775 6.360 1.00 0.00 H new ATOM 0 HA LEU A 377 2.155 9.755 7.600 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.487 7.005 6.581 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.664 8.122 5.920 1.00 0.00 H new ATOM 0 HG LEU A 377 4.264 8.803 8.260 1.00 0.00 H new ATOM 0 HD11 LEU A 377 3.557 7.341 10.110 1.00 0.00 H new ATOM 0 HD12 LEU A 377 2.174 8.177 9.365 1.00 0.00 H new ATOM 0 HD13 LEU A 377 2.479 6.462 9.000 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.536 6.752 8.759 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.534 5.852 7.595 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.598 7.161 7.028 1.00 0.00 H new ATOM 257 N ILE A 378 1.131 9.554 4.523 1.00 0.00 N ATOM 258 CA ILE A 378 1.134 10.262 3.246 1.00 0.00 C ATOM 259 C ILE A 378 -0.279 10.577 2.759 1.00 0.00 C ATOM 260 O ILE A 378 -0.536 11.669 2.251 1.00 0.00 O ATOM 261 CB ILE A 378 1.889 9.465 2.161 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.132 8.190 1.785 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.289 9.123 2.641 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.824 7.374 0.717 1.00 0.00 C ATOM 0 H ILE A 378 0.420 8.828 4.610 1.00 0.00 H new ATOM 0 HA ILE A 378 1.653 11.204 3.420 1.00 0.00 H new ATOM 0 HB ILE A 378 1.961 10.090 1.271 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.005 7.575 2.676 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.134 8.458 1.438 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.812 8.561 1.867 1.00 0.00 H new ATOM 0 HG22 ILE A 378 3.835 10.042 2.854 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.226 8.520 3.547 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.233 6.484 0.499 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.927 7.972 -0.188 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.812 7.076 1.069 1.00 0.00 H new ATOM 276 N GLY A 379 -1.190 9.623 2.908 1.00 0.00 N ATOM 277 CA GLY A 379 -2.559 9.834 2.469 1.00 0.00 C ATOM 278 C GLY A 379 -3.197 11.053 3.110 1.00 0.00 C ATOM 279 O GLY A 379 -3.734 10.970 4.215 1.00 0.00 O ATOM 0 H GLY A 379 -1.008 8.709 3.323 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.575 9.948 1.385 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.153 8.951 2.706 1.00 0.00 H new ATOM 283 N TYR A 380 -3.138 12.188 2.417 1.00 0.00 N ATOM 284 CA TYR A 380 -3.719 13.424 2.936 1.00 0.00 C ATOM 285 C TYR A 380 -5.088 13.693 2.319 1.00 0.00 C ATOM 286 O TYR A 380 -6.001 14.169 2.995 1.00 0.00 O ATOM 287 CB TYR A 380 -2.792 14.623 2.690 1.00 0.00 C ATOM 288 CG TYR A 380 -1.897 14.483 1.477 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.425 14.504 0.192 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.524 14.334 1.621 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.608 14.380 -0.916 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.299 14.208 0.519 1.00 0.00 C ATOM 293 CZ TYR A 380 -0.248 14.231 -0.747 1.00 0.00 C ATOM 294 OH TYR A 380 0.568 14.108 -1.848 1.00 0.00 O ATOM 0 H TYR A 380 -2.697 12.278 1.502 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.841 13.294 4.011 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.401 15.520 2.576 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.168 14.771 3.571 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.490 14.619 0.057 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -0.093 14.316 2.611 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -2.033 14.400 -1.909 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.365 14.092 0.648 1.00 0.00 H new ATOM 0 HH TYR A 380 1.307 13.498 -1.641 1.00 0.00 H new ATOM 304 N ALA A 381 -5.230 13.389 1.032 1.00 0.00 N ATOM 305 CA ALA A 381 -6.492 13.602 0.331 1.00 0.00 C ATOM 306 C ALA A 381 -6.383 13.201 -1.136 1.00 0.00 C ATOM 307 O ALA A 381 -6.847 12.133 -1.534 1.00 0.00 O ATOM 308 CB ALA A 381 -6.928 15.056 0.450 1.00 0.00 C ATOM 0 H ALA A 381 -4.488 12.995 0.454 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.246 12.969 0.799 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -7.871 15.198 -0.078 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -7.059 15.312 1.501 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -6.166 15.701 0.012 1.00 0.00 H new ATOM 314 N SER A 382 -5.764 14.064 -1.939 1.00 0.00 N ATOM 315 CA SER A 382 -5.593 13.798 -3.364 1.00 0.00 C ATOM 316 C SER A 382 -4.985 12.417 -3.592 1.00 0.00 C ATOM 317 O SER A 382 -5.220 11.787 -4.623 1.00 0.00 O ATOM 318 CB SER A 382 -4.705 14.870 -4.000 1.00 0.00 C ATOM 319 OG SER A 382 -4.783 14.823 -5.414 1.00 0.00 O ATOM 0 H SER A 382 -5.373 14.953 -1.626 1.00 0.00 H new ATOM 0 HA SER A 382 -6.576 13.823 -3.833 1.00 0.00 H new ATOM 0 HB2 SER A 382 -5.010 15.855 -3.648 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.672 14.725 -3.685 1.00 0.00 H new ATOM 0 HG SER A 382 -4.208 15.518 -5.797 1.00 0.00 H new ATOM 325 N LEU A 383 -4.208 11.953 -2.620 1.00 0.00 N ATOM 326 CA LEU A 383 -3.568 10.647 -2.709 1.00 0.00 C ATOM 327 C LEU A 383 -4.542 9.541 -2.314 1.00 0.00 C ATOM 328 O LEU A 383 -4.511 9.045 -1.188 1.00 0.00 O ATOM 329 CB LEU A 383 -2.334 10.600 -1.807 1.00 0.00 C ATOM 330 CG LEU A 383 -1.285 9.557 -2.192 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.131 9.576 -1.202 1.00 0.00 C ATOM 332 CD2 LEU A 383 -1.907 8.170 -2.258 1.00 0.00 C ATOM 0 H LEU A 383 -4.006 12.463 -1.760 1.00 0.00 H new ATOM 0 HA LEU A 383 -3.261 10.487 -3.742 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.864 11.583 -1.811 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.658 10.405 -0.785 1.00 0.00 H new ATOM 0 HG LEU A 383 -0.899 9.806 -3.180 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.608 8.828 -1.490 1.00 0.00 H new ATOM 0 HD12 LEU A 383 0.333 10.563 -1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -0.505 9.351 -0.203 1.00 0.00 H new ATOM 0 HD21 LEU A 383 -1.144 7.442 -2.534 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -2.321 7.910 -1.284 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -2.702 8.163 -3.004 1.00 0.00 H new ATOM 344 N ARG A 384 -5.405 9.159 -3.248 1.00 0.00 N ATOM 345 CA ARG A 384 -6.385 8.110 -2.995 1.00 0.00 C ATOM 346 C ARG A 384 -5.698 6.759 -2.823 1.00 0.00 C ATOM 347 O ARG A 384 -5.725 5.918 -3.721 1.00 0.00 O ATOM 348 CB ARG A 384 -7.398 8.042 -4.139 1.00 0.00 C ATOM 349 CG ARG A 384 -8.304 9.259 -4.222 1.00 0.00 C ATOM 350 CD ARG A 384 -9.152 9.238 -5.483 1.00 0.00 C ATOM 351 NE ARG A 384 -9.900 7.991 -5.619 1.00 0.00 N ATOM 352 CZ ARG A 384 -11.002 7.707 -4.928 1.00 0.00 C ATOM 353 NH1 ARG A 384 -11.489 8.580 -4.055 1.00 0.00 N ATOM 354 NH2 ARG A 384 -11.620 6.548 -5.112 1.00 0.00 N ATOM 0 H ARG A 384 -5.446 9.559 -4.185 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.911 8.350 -2.071 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.862 7.933 -5.082 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -8.012 7.150 -4.017 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.953 9.291 -3.347 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -7.699 10.166 -4.204 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -9.847 10.078 -5.466 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -8.510 9.373 -6.354 1.00 0.00 H new ATOM 0 HE ARG A 384 -9.558 7.296 -6.283 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -11.019 9.474 -3.911 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -12.334 8.357 -3.528 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -11.251 5.874 -5.783 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -12.464 6.331 -4.583 1.00 0.00 H new ATOM 366 N LEU A 385 -5.080 6.559 -1.662 1.00 0.00 N ATOM 367 CA LEU A 385 -4.383 5.311 -1.370 1.00 0.00 C ATOM 368 C LEU A 385 -5.299 4.110 -1.583 1.00 0.00 C ATOM 369 O LEU A 385 -6.136 3.796 -0.737 1.00 0.00 O ATOM 370 CB LEU A 385 -3.855 5.323 0.067 1.00 0.00 C ATOM 371 CG LEU A 385 -3.259 3.997 0.554 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.995 4.246 1.365 1.00 0.00 C ATOM 373 CD2 LEU A 385 -4.280 3.222 1.377 1.00 0.00 C ATOM 0 H LEU A 385 -5.048 7.246 -0.908 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.541 5.224 -2.057 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -3.093 6.098 0.151 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.670 5.604 0.734 1.00 0.00 H new ATOM 0 HG LEU A 385 -2.995 3.398 -0.317 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.586 3.294 1.702 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.259 4.758 0.744 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -2.234 4.865 2.230 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.839 2.284 1.714 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -4.576 3.815 2.242 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -5.157 3.011 0.765 1.00 0.00 H new ATOM 385 N HIS A 386 -5.134 3.445 -2.721 1.00 0.00 N ATOM 386 CA HIS A 386 -5.944 2.280 -3.051 1.00 0.00 C ATOM 387 C HIS A 386 -5.060 1.100 -3.440 1.00 0.00 C ATOM 388 O HIS A 386 -3.973 1.282 -3.989 1.00 0.00 O ATOM 389 CB HIS A 386 -6.908 2.610 -4.193 1.00 0.00 C ATOM 390 CG HIS A 386 -7.898 1.522 -4.475 1.00 0.00 C ATOM 391 ND1 HIS A 386 -8.960 1.237 -3.643 1.00 0.00 N ATOM 392 CD2 HIS A 386 -7.983 0.648 -5.505 1.00 0.00 C ATOM 393 CE1 HIS A 386 -9.656 0.234 -4.149 1.00 0.00 C ATOM 394 NE2 HIS A 386 -9.085 -0.140 -5.279 1.00 0.00 N ATOM 0 H HIS A 386 -4.445 3.694 -3.431 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.521 2.005 -2.168 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.447 3.526 -3.949 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -6.333 2.809 -5.097 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -7.310 0.582 -6.347 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -10.541 -0.205 -3.713 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -9.410 -0.893 -5.886 1.00 0.00 H new ATOM 403 N TYR A 387 -5.529 -0.108 -3.148 1.00 0.00 N ATOM 404 CA TYR A 387 -4.777 -1.314 -3.464 1.00 0.00 C ATOM 405 C TYR A 387 -5.493 -2.150 -4.517 1.00 0.00 C ATOM 406 O TYR A 387 -6.658 -2.513 -4.352 1.00 0.00 O ATOM 407 CB TYR A 387 -4.548 -2.144 -2.201 1.00 0.00 C ATOM 408 CG TYR A 387 -3.436 -1.608 -1.332 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.553 -0.372 -0.711 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.267 -2.334 -1.137 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.537 0.127 0.081 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.247 -1.842 -0.348 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.386 -0.611 0.258 1.00 0.00 C ATOM 414 OH TYR A 387 -0.371 -0.115 1.044 1.00 0.00 O ATOM 0 H TYR A 387 -6.426 -0.277 -2.693 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.812 -1.010 -3.870 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.471 -2.175 -1.622 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.316 -3.170 -2.485 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.453 0.209 -0.849 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.155 -3.298 -1.610 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.644 1.090 0.559 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.345 -2.418 -0.206 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.753 0.352 1.816 1.00 0.00 H new ATOM 424 N VAL A 388 -4.786 -2.451 -5.601 1.00 0.00 N ATOM 425 CA VAL A 388 -5.344 -3.243 -6.685 1.00 0.00 C ATOM 426 C VAL A 388 -4.640 -4.591 -6.795 1.00 0.00 C ATOM 427 O VAL A 388 -3.490 -4.668 -7.227 1.00 0.00 O ATOM 428 CB VAL A 388 -5.230 -2.501 -8.029 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.881 -3.304 -9.146 1.00 0.00 C ATOM 430 CG2 VAL A 388 -5.851 -1.116 -7.928 1.00 0.00 C ATOM 0 H VAL A 388 -3.821 -2.156 -5.750 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.397 -3.406 -6.456 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.173 -2.386 -8.268 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -5.789 -2.761 -10.086 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.386 -4.271 -9.235 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -6.936 -3.457 -8.917 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -5.761 -0.606 -8.887 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -6.904 -1.208 -7.663 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.333 -0.540 -7.161 1.00 0.00 H new ATOM 440 N THR A 389 -5.335 -5.652 -6.399 1.00 0.00 N ATOM 441 CA THR A 389 -4.774 -6.996 -6.454 1.00 0.00 C ATOM 442 C THR A 389 -4.822 -7.550 -7.874 1.00 0.00 C ATOM 443 O THR A 389 -5.883 -7.938 -8.365 1.00 0.00 O ATOM 444 CB THR A 389 -5.530 -7.926 -5.503 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.783 -8.293 -6.052 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.785 -7.315 -4.144 1.00 0.00 C ATOM 0 H THR A 389 -6.287 -5.607 -6.037 1.00 0.00 H new ATOM 0 HA THR A 389 -3.731 -6.940 -6.143 1.00 0.00 H new ATOM 0 HB THR A 389 -4.885 -8.795 -5.376 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.668 -8.539 -6.994 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.325 -8.028 -3.520 1.00 0.00 H new ATOM 0 HG22 THR A 389 -4.834 -7.067 -3.672 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.380 -6.409 -4.258 1.00 0.00 H new ATOM 594 N ASN A 399 0.809 -16.223 -7.216 1.00 0.00 N ATOM 595 CA ASN A 399 0.835 -15.587 -5.904 1.00 0.00 C ATOM 596 C ASN A 399 -0.158 -14.433 -5.838 1.00 0.00 C ATOM 597 O ASN A 399 -0.744 -14.047 -6.849 1.00 0.00 O ATOM 598 CB ASN A 399 2.245 -15.083 -5.587 1.00 0.00 C ATOM 599 CG ASN A 399 2.715 -15.508 -4.209 1.00 0.00 C ATOM 600 OD1 ASN A 399 3.350 -14.735 -3.490 1.00 0.00 O ATOM 601 ND2 ASN A 399 2.406 -16.742 -3.834 1.00 0.00 N ATOM 0 HA ASN A 399 0.547 -16.331 -5.161 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.940 -15.460 -6.337 1.00 0.00 H new ATOM 0 HB3 ASN A 399 2.263 -13.995 -5.654 1.00 0.00 H new ATOM 0 HD21 ASN A 399 2.696 -17.084 -2.918 1.00 0.00 H new ATOM 0 HD22 ASN A 399 1.878 -17.349 -4.462 1.00 0.00 H new ATOM 608 N SER A 400 -0.337 -13.881 -4.642 1.00 0.00 N ATOM 609 CA SER A 400 -1.252 -12.767 -4.450 1.00 0.00 C ATOM 610 C SER A 400 -0.511 -11.449 -4.607 1.00 0.00 C ATOM 611 O SER A 400 -0.062 -10.853 -3.627 1.00 0.00 O ATOM 612 CB SER A 400 -1.913 -12.841 -3.072 1.00 0.00 C ATOM 613 OG SER A 400 -2.181 -14.184 -2.708 1.00 0.00 O ATOM 0 H SER A 400 0.140 -14.188 -3.794 1.00 0.00 H new ATOM 0 HA SER A 400 -2.033 -12.827 -5.208 1.00 0.00 H new ATOM 0 HB2 SER A 400 -1.262 -12.382 -2.328 1.00 0.00 H new ATOM 0 HB3 SER A 400 -2.842 -12.270 -3.079 1.00 0.00 H new ATOM 0 HG SER A 400 -3.076 -14.435 -3.019 1.00 0.00 H new ATOM 619 N ILE A 401 -0.371 -11.009 -5.851 1.00 0.00 N ATOM 620 CA ILE A 401 0.329 -9.771 -6.151 1.00 0.00 C ATOM 621 C ILE A 401 -0.595 -8.564 -5.995 1.00 0.00 C ATOM 622 O ILE A 401 -1.687 -8.527 -6.562 1.00 0.00 O ATOM 623 CB ILE A 401 0.930 -9.811 -7.580 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.404 -9.405 -7.547 1.00 0.00 C ATOM 625 CG2 ILE A 401 0.152 -8.924 -8.546 1.00 0.00 C ATOM 626 CD1 ILE A 401 2.625 -7.962 -7.146 1.00 0.00 C ATOM 0 H ILE A 401 -0.735 -11.495 -6.670 1.00 0.00 H new ATOM 0 HA ILE A 401 1.145 -9.669 -5.435 1.00 0.00 H new ATOM 0 HB ILE A 401 0.852 -10.836 -7.943 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.935 -10.053 -6.850 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.840 -9.571 -8.532 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.605 -8.980 -9.536 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -0.882 -9.264 -8.600 1.00 0.00 H new ATOM 0 HG23 ILE A 401 0.177 -7.893 -8.193 1.00 0.00 H new ATOM 0 HD11 ILE A 401 3.693 -7.744 -7.144 1.00 0.00 H new ATOM 0 HD12 ILE A 401 2.122 -7.306 -7.857 1.00 0.00 H new ATOM 0 HD13 ILE A 401 2.219 -7.795 -6.148 1.00 0.00 H new ATOM 638 N VAL A 402 -0.146 -7.578 -5.226 1.00 0.00 N ATOM 639 CA VAL A 402 -0.927 -6.370 -5.000 1.00 0.00 C ATOM 640 C VAL A 402 -0.071 -5.125 -5.206 1.00 0.00 C ATOM 641 O VAL A 402 1.118 -5.116 -4.887 1.00 0.00 O ATOM 642 CB VAL A 402 -1.531 -6.343 -3.583 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.431 -5.129 -3.405 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.297 -7.628 -3.307 1.00 0.00 C ATOM 0 H VAL A 402 0.755 -7.593 -4.749 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.740 -6.375 -5.726 1.00 0.00 H new ATOM 0 HB VAL A 402 -0.716 -6.268 -2.863 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -2.847 -5.129 -2.398 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -1.850 -4.220 -3.557 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.242 -5.167 -4.133 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -2.717 -7.592 -2.302 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.103 -7.735 -4.033 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.621 -8.479 -3.388 1.00 0.00 H new ATOM 654 N GLU A 403 -0.682 -4.076 -5.745 1.00 0.00 N ATOM 655 CA GLU A 403 0.026 -2.828 -5.998 1.00 0.00 C ATOM 656 C GLU A 403 -0.801 -1.628 -5.553 1.00 0.00 C ATOM 657 O GLU A 403 -1.907 -1.404 -6.047 1.00 0.00 O ATOM 658 CB GLU A 403 0.366 -2.704 -7.484 1.00 0.00 C ATOM 659 CG GLU A 403 1.490 -3.626 -7.929 1.00 0.00 C ATOM 660 CD GLU A 403 2.109 -3.196 -9.244 1.00 0.00 C ATOM 661 OE1 GLU A 403 1.538 -3.524 -10.305 1.00 0.00 O ATOM 662 OE2 GLU A 403 3.166 -2.531 -9.212 1.00 0.00 O ATOM 0 H GLU A 403 -1.666 -4.066 -6.015 1.00 0.00 H new ATOM 0 HA GLU A 403 0.949 -2.842 -5.419 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.526 -2.922 -8.072 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.646 -1.673 -7.700 1.00 0.00 H new ATOM 0 HG2 GLU A 403 2.261 -3.651 -7.159 1.00 0.00 H new ATOM 0 HG3 GLU A 403 1.105 -4.641 -8.027 1.00 0.00 H new ATOM 669 N CYS A 404 -0.256 -0.857 -4.619 1.00 0.00 N ATOM 670 CA CYS A 404 -0.938 0.325 -4.108 1.00 0.00 C ATOM 671 C CYS A 404 -0.737 1.510 -5.045 1.00 0.00 C ATOM 672 O CYS A 404 0.384 1.987 -5.225 1.00 0.00 O ATOM 673 CB CYS A 404 -0.420 0.675 -2.712 1.00 0.00 C ATOM 674 SG CYS A 404 -1.199 2.132 -1.977 1.00 0.00 S ATOM 0 H CYS A 404 0.658 -1.030 -4.200 1.00 0.00 H new ATOM 0 HA CYS A 404 -2.004 0.103 -4.048 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.578 -0.179 -2.053 1.00 0.00 H new ATOM 0 HB3 CYS A 404 0.656 0.841 -2.767 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.973 1.764 -0.999 1.00 0.00 H new ATOM 680 N ARG A 405 -1.827 1.982 -5.638 1.00 0.00 N ATOM 681 CA ARG A 405 -1.770 3.111 -6.552 1.00 0.00 C ATOM 682 C ARG A 405 -2.428 4.335 -5.932 1.00 0.00 C ATOM 683 O ARG A 405 -3.441 4.225 -5.241 1.00 0.00 O ATOM 684 CB ARG A 405 -2.452 2.764 -7.875 1.00 0.00 C ATOM 685 CG ARG A 405 -1.601 1.890 -8.785 1.00 0.00 C ATOM 686 CD ARG A 405 -2.114 0.459 -8.835 1.00 0.00 C ATOM 687 NE ARG A 405 -2.569 0.089 -10.172 1.00 0.00 N ATOM 688 CZ ARG A 405 -2.697 -1.169 -10.592 1.00 0.00 C ATOM 689 NH1 ARG A 405 -2.410 -2.180 -9.782 1.00 0.00 N ATOM 690 NH2 ARG A 405 -3.115 -1.414 -11.826 1.00 0.00 N ATOM 0 H ARG A 405 -2.762 1.598 -5.500 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.722 3.339 -6.747 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.391 2.252 -7.667 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.701 3.687 -8.399 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -1.596 2.310 -9.791 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -0.570 1.894 -8.432 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -1.323 -0.221 -8.520 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -2.935 0.343 -8.127 1.00 0.00 H new ATOM 0 HE ARG A 405 -2.803 0.838 -10.823 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -2.089 -1.997 -8.831 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -2.510 -3.141 -10.110 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -3.338 -0.640 -12.452 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -3.214 -2.376 -12.149 1.00 0.00 H new ATOM 702 N VAL A 406 -1.844 5.500 -6.177 1.00 0.00 N ATOM 703 CA VAL A 406 -2.375 6.742 -5.635 1.00 0.00 C ATOM 704 C VAL A 406 -3.506 7.286 -6.503 1.00 0.00 C ATOM 705 O VAL A 406 -3.760 6.784 -7.597 1.00 0.00 O ATOM 706 CB VAL A 406 -1.276 7.816 -5.502 1.00 0.00 C ATOM 707 CG1 VAL A 406 -0.177 7.342 -4.564 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.704 8.170 -6.868 1.00 0.00 C ATOM 0 H VAL A 406 -1.005 5.611 -6.746 1.00 0.00 H new ATOM 0 HA VAL A 406 -2.765 6.511 -4.644 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.723 8.715 -5.077 1.00 0.00 H new ATOM 0 HG11 VAL A 406 0.589 8.113 -4.483 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -0.600 7.145 -3.579 1.00 0.00 H new ATOM 0 HG13 VAL A 406 0.268 6.428 -4.957 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.070 8.929 -6.753 1.00 0.00 H new ATOM 0 HG22 VAL A 406 -0.273 7.279 -7.324 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -1.499 8.556 -7.506 1.00 0.00 H new ATOM 744 N THR A 410 -0.133 6.152 -10.087 1.00 0.00 N ATOM 745 CA THR A 410 1.266 5.910 -9.754 1.00 0.00 C ATOM 746 C THR A 410 1.387 4.976 -8.554 1.00 0.00 C ATOM 747 O THR A 410 1.061 5.353 -7.429 1.00 0.00 O ATOM 748 CB THR A 410 1.978 7.232 -9.461 1.00 0.00 C ATOM 749 OG1 THR A 410 1.869 8.116 -10.562 1.00 0.00 O ATOM 750 CG2 THR A 410 3.450 7.064 -9.151 1.00 0.00 C ATOM 0 HA THR A 410 1.740 5.432 -10.611 1.00 0.00 H new ATOM 0 HB THR A 410 1.482 7.637 -8.579 1.00 0.00 H new ATOM 0 HG1 THR A 410 1.065 7.897 -11.079 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.894 8.040 -8.953 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.567 6.427 -8.274 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.951 6.604 -10.003 1.00 0.00 H new ATOM 758 N VAL A 411 1.857 3.758 -8.803 1.00 0.00 N ATOM 759 CA VAL A 411 2.021 2.773 -7.741 1.00 0.00 C ATOM 760 C VAL A 411 3.206 3.121 -6.849 1.00 0.00 C ATOM 761 O VAL A 411 4.347 3.179 -7.308 1.00 0.00 O ATOM 762 CB VAL A 411 2.215 1.355 -8.316 1.00 0.00 C ATOM 763 CG1 VAL A 411 3.473 1.288 -9.169 1.00 0.00 C ATOM 764 CG2 VAL A 411 2.267 0.326 -7.195 1.00 0.00 C ATOM 0 H VAL A 411 2.130 3.430 -9.729 1.00 0.00 H new ATOM 0 HA VAL A 411 1.108 2.791 -7.146 1.00 0.00 H new ATOM 0 HB VAL A 411 1.361 1.123 -8.953 1.00 0.00 H new ATOM 0 HG11 VAL A 411 3.591 0.279 -9.565 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.391 1.995 -9.995 1.00 0.00 H new ATOM 0 HG13 VAL A 411 4.340 1.542 -8.559 1.00 0.00 H new ATOM 0 HG21 VAL A 411 2.404 -0.668 -7.620 1.00 0.00 H new ATOM 0 HG22 VAL A 411 3.100 0.554 -6.530 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.334 0.354 -6.632 1.00 0.00 H new ATOM 774 N LEU A 412 2.925 3.355 -5.573 1.00 0.00 N ATOM 775 CA LEU A 412 3.964 3.701 -4.612 1.00 0.00 C ATOM 776 C LEU A 412 4.356 2.494 -3.764 1.00 0.00 C ATOM 777 O LEU A 412 5.438 2.464 -3.177 1.00 0.00 O ATOM 778 CB LEU A 412 3.487 4.837 -3.706 1.00 0.00 C ATOM 779 CG LEU A 412 4.590 5.764 -3.196 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.785 6.934 -4.147 1.00 0.00 C ATOM 781 CD2 LEU A 412 4.263 6.261 -1.795 1.00 0.00 C ATOM 0 H LEU A 412 1.985 3.311 -5.180 1.00 0.00 H new ATOM 0 HA LEU A 412 4.842 4.027 -5.170 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.755 5.433 -4.251 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.971 4.405 -2.849 1.00 0.00 H new ATOM 0 HG LEU A 412 5.522 5.200 -3.151 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.574 7.583 -3.768 1.00 0.00 H new ATOM 0 HD12 LEU A 412 5.065 6.560 -5.132 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.856 7.499 -4.224 1.00 0.00 H new ATOM 0 HD21 LEU A 412 5.059 6.920 -1.448 1.00 0.00 H new ATOM 0 HD22 LEU A 412 3.321 6.809 -1.814 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.175 5.411 -1.119 1.00 0.00 H new ATOM 793 N GLY A 413 3.472 1.503 -3.697 1.00 0.00 N ATOM 794 CA GLY A 413 3.754 0.317 -2.909 1.00 0.00 C ATOM 795 C GLY A 413 3.352 -0.967 -3.608 1.00 0.00 C ATOM 796 O GLY A 413 2.165 -1.260 -3.750 1.00 0.00 O ATOM 0 H GLY A 413 2.569 1.500 -4.172 1.00 0.00 H new ATOM 0 HA2 GLY A 413 4.820 0.283 -2.682 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.228 0.386 -1.957 1.00 0.00 H new ATOM 800 N THR A 414 4.346 -1.738 -4.041 1.00 0.00 N ATOM 801 CA THR A 414 4.096 -3.000 -4.724 1.00 0.00 C ATOM 802 C THR A 414 4.657 -4.167 -3.915 1.00 0.00 C ATOM 803 O THR A 414 5.847 -4.201 -3.603 1.00 0.00 O ATOM 804 CB THR A 414 4.722 -2.974 -6.118 1.00 0.00 C ATOM 805 OG1 THR A 414 4.096 -1.997 -6.930 1.00 0.00 O ATOM 806 CG2 THR A 414 4.635 -4.299 -6.847 1.00 0.00 C ATOM 0 H THR A 414 5.334 -1.508 -3.930 1.00 0.00 H new ATOM 0 HA THR A 414 3.019 -3.135 -4.822 1.00 0.00 H new ATOM 0 HB THR A 414 5.774 -2.740 -5.953 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.110 -2.291 -7.865 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.099 -4.205 -7.829 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.154 -5.066 -6.272 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.589 -4.581 -6.966 1.00 0.00 H new ATOM 814 N GLY A 415 3.795 -5.123 -3.579 1.00 0.00 N ATOM 815 CA GLY A 415 4.232 -6.273 -2.811 1.00 0.00 C ATOM 816 C GLY A 415 3.315 -7.468 -2.973 1.00 0.00 C ATOM 817 O GLY A 415 2.092 -7.327 -2.974 1.00 0.00 O ATOM 0 H GLY A 415 2.805 -5.121 -3.825 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.240 -6.549 -3.120 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.285 -6.002 -1.757 1.00 0.00 H new ATOM 821 N VAL A 416 3.909 -8.650 -3.110 1.00 0.00 N ATOM 822 CA VAL A 416 3.143 -9.877 -3.272 1.00 0.00 C ATOM 823 C VAL A 416 2.831 -10.512 -1.926 1.00 0.00 C ATOM 824 O VAL A 416 3.230 -10.011 -0.875 1.00 0.00 O ATOM 825 CB VAL A 416 3.892 -10.897 -4.157 1.00 0.00 C ATOM 826 CG1 VAL A 416 4.936 -11.671 -3.360 1.00 0.00 C ATOM 827 CG2 VAL A 416 2.919 -11.846 -4.835 1.00 0.00 C ATOM 0 H VAL A 416 4.920 -8.782 -3.112 1.00 0.00 H new ATOM 0 HA VAL A 416 2.209 -9.604 -3.763 1.00 0.00 H new ATOM 0 HB VAL A 416 4.417 -10.335 -4.930 1.00 0.00 H new ATOM 0 HG11 VAL A 416 5.443 -12.379 -4.016 1.00 0.00 H new ATOM 0 HG12 VAL A 416 5.665 -10.976 -2.944 1.00 0.00 H new ATOM 0 HG13 VAL A 416 4.447 -12.212 -2.550 1.00 0.00 H new ATOM 0 HG21 VAL A 416 3.472 -12.554 -5.452 1.00 0.00 H new ATOM 0 HG22 VAL A 416 2.353 -12.389 -4.078 1.00 0.00 H new ATOM 0 HG23 VAL A 416 2.233 -11.277 -5.462 1.00 0.00 H new ATOM 837 N GLY A 417 2.117 -11.619 -1.980 1.00 0.00 N ATOM 838 CA GLY A 417 1.751 -12.329 -0.767 1.00 0.00 C ATOM 839 C GLY A 417 0.947 -13.583 -1.046 1.00 0.00 C ATOM 840 O GLY A 417 0.474 -13.788 -2.163 1.00 0.00 O ATOM 0 H GLY A 417 1.780 -12.045 -2.843 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.655 -12.596 -0.220 1.00 0.00 H new ATOM 0 HA3 GLY A 417 1.172 -11.667 -0.123 1.00 0.00 H new ATOM 844 N ARG A 418 0.787 -14.422 -0.027 1.00 0.00 N ATOM 845 CA ARG A 418 0.025 -15.656 -0.174 1.00 0.00 C ATOM 846 C ARG A 418 -1.457 -15.349 -0.363 1.00 0.00 C ATOM 847 O ARG A 418 -2.187 -16.120 -0.986 1.00 0.00 O ATOM 848 CB ARG A 418 0.226 -16.575 1.036 1.00 0.00 C ATOM 849 CG ARG A 418 0.283 -15.843 2.369 1.00 0.00 C ATOM 850 CD ARG A 418 -0.126 -16.753 3.517 1.00 0.00 C ATOM 851 NE ARG A 418 0.395 -16.286 4.800 1.00 0.00 N ATOM 852 CZ ARG A 418 -0.105 -16.648 5.980 1.00 0.00 C ATOM 853 NH1 ARG A 418 -1.135 -17.483 6.043 1.00 0.00 N ATOM 854 NH2 ARG A 418 0.427 -16.177 7.098 1.00 0.00 N ATOM 0 H ARG A 418 1.173 -14.270 0.905 1.00 0.00 H new ATOM 0 HA ARG A 418 0.392 -16.174 -1.060 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -0.587 -17.301 1.067 1.00 0.00 H new ATOM 0 HB3 ARG A 418 1.150 -17.137 0.902 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.293 -15.471 2.539 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -0.375 -14.975 2.338 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -1.214 -16.808 3.566 1.00 0.00 H new ATOM 0 HD3 ARG A 418 0.236 -17.763 3.325 1.00 0.00 H new ATOM 0 HE ARG A 418 1.188 -15.645 4.791 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -1.547 -17.850 5.185 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -1.514 -17.757 6.949 1.00 0.00 H new ATOM 0 HH21 ARG A 418 1.220 -15.537 7.055 1.00 0.00 H new ATOM 0 HH22 ARG A 418 0.044 -16.455 8.002 1.00 0.00 H new ATOM 866 N ASN A 419 -1.892 -14.208 0.166 1.00 0.00 N ATOM 867 CA ASN A 419 -3.284 -13.786 0.043 1.00 0.00 C ATOM 868 C ASN A 419 -3.397 -12.267 0.135 1.00 0.00 C ATOM 869 O ASN A 419 -2.395 -11.570 0.286 1.00 0.00 O ATOM 870 CB ASN A 419 -4.155 -14.447 1.117 1.00 0.00 C ATOM 871 CG ASN A 419 -3.481 -14.494 2.473 1.00 0.00 C ATOM 872 OD1 ASN A 419 -2.539 -15.257 2.683 1.00 0.00 O ATOM 873 ND2 ASN A 419 -3.966 -13.682 3.406 1.00 0.00 N ATOM 0 H ASN A 419 -1.300 -13.559 0.684 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.644 -14.104 -0.935 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -5.095 -13.902 1.202 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -4.402 -15.461 0.804 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -3.556 -13.675 4.340 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -4.749 -13.065 3.189 1.00 0.00 H new ATOM 880 N ILE A 420 -4.622 -11.761 0.034 1.00 0.00 N ATOM 881 CA ILE A 420 -4.864 -10.323 0.097 1.00 0.00 C ATOM 882 C ILE A 420 -4.275 -9.707 1.362 1.00 0.00 C ATOM 883 O ILE A 420 -3.729 -8.603 1.330 1.00 0.00 O ATOM 884 CB ILE A 420 -6.369 -10.007 0.039 1.00 0.00 C ATOM 885 CG1 ILE A 420 -7.016 -10.759 -1.133 1.00 0.00 C ATOM 886 CG2 ILE A 420 -6.586 -8.503 -0.080 1.00 0.00 C ATOM 887 CD1 ILE A 420 -8.224 -10.064 -1.725 1.00 0.00 C ATOM 0 H ILE A 420 -5.463 -12.325 -0.092 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.370 -9.887 -0.771 1.00 0.00 H new ATOM 0 HB ILE A 420 -6.844 -10.342 0.961 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -6.271 -10.898 -1.916 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -7.312 -11.752 -0.794 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -7.655 -8.292 -0.120 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.149 -8.003 0.785 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -6.109 -8.137 -0.990 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -8.621 -10.661 -2.547 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -8.990 -9.949 -0.958 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -7.933 -9.082 -2.097 1.00 0.00 H new ATOM 899 N LYS A 421 -4.393 -10.422 2.472 1.00 0.00 N ATOM 900 CA LYS A 421 -3.876 -9.944 3.750 1.00 0.00 C ATOM 901 C LYS A 421 -2.373 -9.703 3.678 1.00 0.00 C ATOM 902 O LYS A 421 -1.901 -8.582 3.872 1.00 0.00 O ATOM 903 CB LYS A 421 -4.189 -10.948 4.861 1.00 0.00 C ATOM 904 CG LYS A 421 -4.135 -10.347 6.256 1.00 0.00 C ATOM 905 CD LYS A 421 -2.762 -10.522 6.885 1.00 0.00 C ATOM 906 CE LYS A 421 -2.731 -11.714 7.829 1.00 0.00 C ATOM 907 NZ LYS A 421 -1.479 -11.752 8.634 1.00 0.00 N ATOM 0 H LYS A 421 -4.843 -11.337 2.515 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.366 -8.997 3.976 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -5.181 -11.366 4.693 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -3.481 -11.775 4.803 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -4.381 -9.286 6.206 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -4.888 -10.820 6.886 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -2.016 -10.657 6.102 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -2.492 -9.617 7.430 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -3.591 -11.670 8.497 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -2.821 -12.635 7.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -1.497 -12.579 9.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -0.659 -11.819 7.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -1.406 -10.884 9.203 1.00 0.00 H new ATOM 921 N ILE A 422 -1.630 -10.764 3.401 1.00 0.00 N ATOM 922 CA ILE A 422 -0.178 -10.680 3.304 1.00 0.00 C ATOM 923 C ILE A 422 0.244 -9.709 2.207 1.00 0.00 C ATOM 924 O ILE A 422 1.008 -8.775 2.450 1.00 0.00 O ATOM 925 CB ILE A 422 0.446 -12.069 3.041 1.00 0.00 C ATOM 926 CG1 ILE A 422 0.364 -12.931 4.302 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.892 -11.941 2.584 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.033 -13.415 4.617 1.00 0.00 C ATOM 0 H ILE A 422 -2.009 -11.697 3.239 1.00 0.00 H new ATOM 0 HA ILE A 422 0.189 -10.309 4.261 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.120 -12.551 2.244 1.00 0.00 H new ATOM 0 HG12 ILE A 422 1.020 -13.794 4.185 1.00 0.00 H new ATOM 0 HG13 ILE A 422 0.740 -12.357 5.149 1.00 0.00 H new ATOM 0 HG21 ILE A 422 2.307 -12.933 2.406 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.932 -11.360 1.662 1.00 0.00 H new ATOM 0 HG23 ILE A 422 2.474 -11.438 3.356 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.013 -14.019 5.524 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -1.690 -12.558 4.767 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -1.405 -14.017 3.788 1.00 0.00 H new ATOM 940 N ALA A 423 -0.257 -9.934 1.000 1.00 0.00 N ATOM 941 CA ALA A 423 0.069 -9.079 -0.136 1.00 0.00 C ATOM 942 C ALA A 423 -0.167 -7.611 0.199 1.00 0.00 C ATOM 943 O ALA A 423 0.590 -6.737 -0.222 1.00 0.00 O ATOM 944 CB ALA A 423 -0.744 -9.482 -1.356 1.00 0.00 C ATOM 0 H ALA A 423 -0.892 -10.702 0.781 1.00 0.00 H new ATOM 0 HA ALA A 423 1.127 -9.209 -0.363 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.488 -8.834 -2.194 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.521 -10.517 -1.616 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.807 -9.385 -1.133 1.00 0.00 H new ATOM 950 N GLY A 424 -1.219 -7.351 0.966 1.00 0.00 N ATOM 951 CA GLY A 424 -1.533 -5.990 1.354 1.00 0.00 C ATOM 952 C GLY A 424 -0.462 -5.392 2.242 1.00 0.00 C ATOM 953 O GLY A 424 -0.050 -4.249 2.048 1.00 0.00 O ATOM 0 H GLY A 424 -1.860 -8.058 1.326 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.648 -5.376 0.461 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.489 -5.974 1.878 1.00 0.00 H new ATOM 957 N ILE A 425 -0.003 -6.175 3.214 1.00 0.00 N ATOM 958 CA ILE A 425 1.035 -5.724 4.129 1.00 0.00 C ATOM 959 C ILE A 425 2.361 -5.560 3.393 1.00 0.00 C ATOM 960 O ILE A 425 3.162 -4.685 3.722 1.00 0.00 O ATOM 961 CB ILE A 425 1.223 -6.715 5.298 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.081 -6.866 6.082 1.00 0.00 C ATOM 963 CG2 ILE A 425 2.346 -6.257 6.216 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.316 -8.270 6.595 1.00 0.00 C ATOM 0 H ILE A 425 -0.335 -7.124 3.386 1.00 0.00 H new ATOM 0 HA ILE A 425 0.718 -4.762 4.532 1.00 0.00 H new ATOM 0 HB ILE A 425 1.495 -7.686 4.885 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -0.071 -6.176 6.926 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -0.916 -6.576 5.444 1.00 0.00 H new ATOM 0 HG21 ILE A 425 2.462 -6.969 7.033 1.00 0.00 H new ATOM 0 HG22 ILE A 425 3.276 -6.198 5.651 1.00 0.00 H new ATOM 0 HG23 ILE A 425 2.106 -5.275 6.623 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.258 -8.305 7.142 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.358 -8.962 5.754 1.00 0.00 H new ATOM 0 HD13 ILE A 425 0.499 -8.556 7.259 1.00 0.00 H new ATOM 976 N ARG A 426 2.581 -6.409 2.395 1.00 0.00 N ATOM 977 CA ARG A 426 3.806 -6.361 1.607 1.00 0.00 C ATOM 978 C ARG A 426 3.840 -5.108 0.739 1.00 0.00 C ATOM 979 O ARG A 426 4.846 -4.399 0.695 1.00 0.00 O ATOM 980 CB ARG A 426 3.926 -7.614 0.734 1.00 0.00 C ATOM 981 CG ARG A 426 5.130 -8.478 1.074 1.00 0.00 C ATOM 982 CD ARG A 426 4.758 -9.609 2.018 1.00 0.00 C ATOM 983 NE ARG A 426 5.696 -9.725 3.132 1.00 0.00 N ATOM 984 CZ ARG A 426 6.892 -10.302 3.039 1.00 0.00 C ATOM 985 NH1 ARG A 426 7.300 -10.816 1.885 1.00 0.00 N ATOM 986 NH2 ARG A 426 7.682 -10.364 4.101 1.00 0.00 N ATOM 0 H ARG A 426 1.926 -7.139 2.113 1.00 0.00 H new ATOM 0 HA ARG A 426 4.653 -6.328 2.292 1.00 0.00 H new ATOM 0 HB2 ARG A 426 3.020 -8.210 0.841 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.988 -7.314 -0.312 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.552 -8.892 0.158 1.00 0.00 H new ATOM 0 HG3 ARG A 426 5.904 -7.861 1.531 1.00 0.00 H new ATOM 0 HD2 ARG A 426 3.753 -9.441 2.406 1.00 0.00 H new ATOM 0 HD3 ARG A 426 4.733 -10.548 1.466 1.00 0.00 H new ATOM 0 HE ARG A 426 5.418 -9.341 4.035 1.00 0.00 H new ATOM 0 HH11 ARG A 426 6.696 -10.770 1.064 1.00 0.00 H new ATOM 0 HH12 ARG A 426 8.217 -11.257 1.819 1.00 0.00 H new ATOM 0 HH21 ARG A 426 7.374 -9.970 4.990 1.00 0.00 H new ATOM 0 HH22 ARG A 426 8.598 -10.806 4.030 1.00 0.00 H new ATOM 998 N ALA A 427 2.734 -4.840 0.058 1.00 0.00 N ATOM 999 CA ALA A 427 2.636 -3.668 -0.803 1.00 0.00 C ATOM 1000 C ALA A 427 2.772 -2.393 0.016 1.00 0.00 C ATOM 1001 O ALA A 427 3.548 -1.500 -0.326 1.00 0.00 O ATOM 1002 CB ALA A 427 1.321 -3.677 -1.567 1.00 0.00 C ATOM 0 H ALA A 427 1.893 -5.417 0.085 1.00 0.00 H new ATOM 0 HA ALA A 427 3.452 -3.700 -1.525 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.265 -2.795 -2.205 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.264 -4.574 -2.183 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.490 -3.668 -0.861 1.00 0.00 H new ATOM 1008 N ALA A 428 2.023 -2.322 1.108 1.00 0.00 N ATOM 1009 CA ALA A 428 2.069 -1.166 1.992 1.00 0.00 C ATOM 1010 C ALA A 428 3.456 -1.030 2.604 1.00 0.00 C ATOM 1011 O ALA A 428 3.974 0.076 2.759 1.00 0.00 O ATOM 1012 CB ALA A 428 1.015 -1.287 3.081 1.00 0.00 C ATOM 0 H ALA A 428 1.375 -3.053 1.403 1.00 0.00 H new ATOM 0 HA ALA A 428 1.856 -0.270 1.408 1.00 0.00 H new ATOM 0 HB1 ALA A 428 1.063 -0.415 3.733 1.00 0.00 H new ATOM 0 HB2 ALA A 428 0.026 -1.345 2.626 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.199 -2.188 3.666 1.00 0.00 H new ATOM 1018 N GLU A 429 4.054 -2.169 2.936 1.00 0.00 N ATOM 1019 CA GLU A 429 5.390 -2.184 3.516 1.00 0.00 C ATOM 1020 C GLU A 429 6.398 -1.639 2.515 1.00 0.00 C ATOM 1021 O GLU A 429 7.321 -0.908 2.877 1.00 0.00 O ATOM 1022 CB GLU A 429 5.777 -3.604 3.932 1.00 0.00 C ATOM 1023 CG GLU A 429 5.354 -3.960 5.347 1.00 0.00 C ATOM 1024 CD GLU A 429 5.642 -5.407 5.696 1.00 0.00 C ATOM 1025 OE1 GLU A 429 5.653 -6.249 4.774 1.00 0.00 O ATOM 1026 OE2 GLU A 429 5.856 -5.697 6.892 1.00 0.00 O ATOM 0 H GLU A 429 3.635 -3.091 2.813 1.00 0.00 H new ATOM 0 HA GLU A 429 5.392 -1.551 4.403 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.326 -4.313 3.238 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.858 -3.717 3.845 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.873 -3.310 6.052 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.287 -3.768 5.462 1.00 0.00 H new ATOM 1033 N ASN A 430 6.202 -1.991 1.249 1.00 0.00 N ATOM 1034 CA ASN A 430 7.079 -1.528 0.184 1.00 0.00 C ATOM 1035 C ASN A 430 6.993 -0.012 0.061 1.00 0.00 C ATOM 1036 O ASN A 430 7.976 0.655 -0.264 1.00 0.00 O ATOM 1037 CB ASN A 430 6.697 -2.188 -1.144 1.00 0.00 C ATOM 1038 CG ASN A 430 7.657 -3.294 -1.538 1.00 0.00 C ATOM 1039 OD1 ASN A 430 7.705 -4.347 -0.902 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.431 -3.058 -2.592 1.00 0.00 N ATOM 0 H ASN A 430 5.442 -2.596 0.937 1.00 0.00 H new ATOM 0 HA ASN A 430 8.104 -1.806 0.428 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.689 -2.596 -1.067 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.676 -1.432 -1.929 1.00 0.00 H new ATOM 0 HD21 ASN A 430 9.098 -3.764 -2.903 1.00 0.00 H new ATOM 0 HD22 ASN A 430 8.358 -2.171 -3.090 1.00 0.00 H new ATOM 1047 N ALA A 431 5.809 0.524 0.338 1.00 0.00 N ATOM 1048 CA ALA A 431 5.584 1.960 0.274 1.00 0.00 C ATOM 1049 C ALA A 431 6.108 2.642 1.534 1.00 0.00 C ATOM 1050 O ALA A 431 6.498 3.809 1.505 1.00 0.00 O ATOM 1051 CB ALA A 431 4.103 2.255 0.087 1.00 0.00 C ATOM 0 H ALA A 431 4.989 -0.018 0.610 1.00 0.00 H new ATOM 0 HA ALA A 431 6.129 2.357 -0.583 1.00 0.00 H new ATOM 0 HB1 ALA A 431 3.950 3.333 0.041 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.755 1.799 -0.840 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.541 1.844 0.926 1.00 0.00 H new ATOM 1057 N LEU A 432 6.116 1.901 2.640 1.00 0.00 N ATOM 1058 CA LEU A 432 6.596 2.428 3.911 1.00 0.00 C ATOM 1059 C LEU A 432 8.121 2.447 3.949 1.00 0.00 C ATOM 1060 O LEU A 432 8.725 3.276 4.632 1.00 0.00 O ATOM 1061 CB LEU A 432 6.053 1.588 5.072 1.00 0.00 C ATOM 1062 CG LEU A 432 4.783 2.131 5.729 1.00 0.00 C ATOM 1063 CD1 LEU A 432 3.595 1.992 4.790 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.515 1.413 7.043 1.00 0.00 C ATOM 0 H LEU A 432 5.795 0.934 2.679 1.00 0.00 H new ATOM 0 HA LEU A 432 6.236 3.452 4.013 1.00 0.00 H new ATOM 0 HB2 LEU A 432 5.852 0.580 4.708 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.829 1.504 5.833 1.00 0.00 H new ATOM 0 HG LEU A 432 4.930 3.190 5.940 1.00 0.00 H new ATOM 0 HD11 LEU A 432 2.701 2.383 5.275 1.00 0.00 H new ATOM 0 HD12 LEU A 432 3.787 2.552 3.875 1.00 0.00 H new ATOM 0 HD13 LEU A 432 3.445 0.940 4.546 1.00 0.00 H new ATOM 0 HD21 LEU A 432 3.608 1.812 7.497 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.389 0.347 6.856 1.00 0.00 H new ATOM 0 HD23 LEU A 432 5.356 1.565 7.719 1.00 0.00 H new ATOM 1076 N ARG A 433 8.740 1.526 3.215 1.00 0.00 N ATOM 1077 CA ARG A 433 10.195 1.437 3.168 1.00 0.00 C ATOM 1078 C ARG A 433 10.800 2.679 2.522 1.00 0.00 C ATOM 1079 O ARG A 433 11.832 3.182 2.967 1.00 0.00 O ATOM 1080 CB ARG A 433 10.626 0.187 2.397 1.00 0.00 C ATOM 1081 CG ARG A 433 10.522 -1.094 3.209 1.00 0.00 C ATOM 1082 CD ARG A 433 11.323 -2.223 2.580 1.00 0.00 C ATOM 1083 NE ARG A 433 12.736 -2.167 2.953 1.00 0.00 N ATOM 1084 CZ ARG A 433 13.676 -1.559 2.230 1.00 0.00 C ATOM 1085 NH1 ARG A 433 13.366 -0.949 1.092 1.00 0.00 N ATOM 1086 NH2 ARG A 433 14.934 -1.561 2.649 1.00 0.00 N ATOM 0 H ARG A 433 8.256 0.832 2.645 1.00 0.00 H new ATOM 0 HA ARG A 433 10.561 1.370 4.193 1.00 0.00 H new ATOM 0 HB2 ARG A 433 10.010 0.092 1.503 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.656 0.313 2.063 1.00 0.00 H new ATOM 0 HG2 ARG A 433 10.881 -0.913 4.222 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.476 -1.390 3.290 1.00 0.00 H new ATOM 0 HD2 ARG A 433 10.904 -3.181 2.889 1.00 0.00 H new ATOM 0 HD3 ARG A 433 11.232 -2.171 1.495 1.00 0.00 H new ATOM 0 HE ARG A 433 13.020 -2.622 3.821 1.00 0.00 H new ATOM 0 HH11 ARG A 433 12.400 -0.943 0.763 1.00 0.00 H new ATOM 0 HH12 ARG A 433 14.093 -0.487 0.547 1.00 0.00 H new ATOM 0 HH21 ARG A 433 15.180 -2.027 3.522 1.00 0.00 H new ATOM 0 HH22 ARG A 433 15.656 -1.097 2.098 1.00 0.00 H new ATOM 1098 N ASP A 434 10.151 3.167 1.472 1.00 0.00 N ATOM 1099 CA ASP A 434 10.623 4.352 0.764 1.00 0.00 C ATOM 1100 C ASP A 434 10.634 5.566 1.684 1.00 0.00 C ATOM 1101 O ASP A 434 9.686 6.351 1.706 1.00 0.00 O ATOM 1102 CB ASP A 434 9.743 4.628 -0.456 1.00 0.00 C ATOM 1103 CG ASP A 434 10.538 5.142 -1.639 1.00 0.00 C ATOM 1104 OD1 ASP A 434 11.662 5.644 -1.426 1.00 0.00 O ATOM 1105 OD2 ASP A 434 10.039 5.041 -2.779 1.00 0.00 O ATOM 0 H ASP A 434 9.296 2.761 1.091 1.00 0.00 H new ATOM 0 HA ASP A 434 11.643 4.163 0.430 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.224 3.713 -0.741 1.00 0.00 H new ATOM 0 HB3 ASP A 434 8.978 5.358 -0.191 1.00 0.00 H new ATOM 1110 N LYS A 435 11.713 5.715 2.445 1.00 0.00 N ATOM 1111 CA LYS A 435 11.848 6.834 3.370 1.00 0.00 C ATOM 1112 C LYS A 435 11.915 8.157 2.617 1.00 0.00 C ATOM 1113 O LYS A 435 11.370 9.166 3.065 1.00 0.00 O ATOM 1114 CB LYS A 435 13.095 6.662 4.239 1.00 0.00 C ATOM 1115 CG LYS A 435 13.017 7.393 5.569 1.00 0.00 C ATOM 1116 CD LYS A 435 14.399 7.724 6.107 1.00 0.00 C ATOM 1117 CE LYS A 435 14.435 9.105 6.742 1.00 0.00 C ATOM 1118 NZ LYS A 435 15.254 9.124 7.985 1.00 0.00 N ATOM 0 H LYS A 435 12.507 5.075 2.439 1.00 0.00 H new ATOM 0 HA LYS A 435 10.968 6.847 4.013 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.253 5.600 4.427 1.00 0.00 H new ATOM 0 HB3 LYS A 435 13.964 7.021 3.687 1.00 0.00 H new ATOM 0 HG2 LYS A 435 12.444 8.312 5.447 1.00 0.00 H new ATOM 0 HG3 LYS A 435 12.482 6.778 6.292 1.00 0.00 H new ATOM 0 HD2 LYS A 435 14.692 6.976 6.844 1.00 0.00 H new ATOM 0 HD3 LYS A 435 15.127 7.676 5.297 1.00 0.00 H new ATOM 0 HE2 LYS A 435 14.841 9.822 6.029 1.00 0.00 H new ATOM 0 HE3 LYS A 435 13.419 9.425 6.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 15.253 10.083 8.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 14.852 8.459 8.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 16.230 8.843 7.762 1.00 0.00 H new ATOM 1132 N LYS A 436 12.579 8.145 1.469 1.00 0.00 N ATOM 1133 CA LYS A 436 12.705 9.346 0.653 1.00 0.00 C ATOM 1134 C LYS A 436 11.339 9.782 0.152 1.00 0.00 C ATOM 1135 O LYS A 436 10.885 10.891 0.431 1.00 0.00 O ATOM 1136 CB LYS A 436 13.636 9.099 -0.532 1.00 0.00 C ATOM 1137 CG LYS A 436 15.026 8.632 -0.131 1.00 0.00 C ATOM 1138 CD LYS A 436 15.102 7.115 -0.050 1.00 0.00 C ATOM 1139 CE LYS A 436 16.331 6.577 -0.765 1.00 0.00 C ATOM 1140 NZ LYS A 436 16.227 5.114 -1.026 1.00 0.00 N ATOM 0 H LYS A 436 13.037 7.320 1.082 1.00 0.00 H new ATOM 0 HA LYS A 436 13.131 10.137 1.271 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.186 8.352 -1.186 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.724 10.018 -1.111 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.756 8.996 -0.854 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.291 9.063 0.834 1.00 0.00 H new ATOM 0 HD2 LYS A 436 15.124 6.807 0.995 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.205 6.681 -0.491 1.00 0.00 H new ATOM 0 HE2 LYS A 436 16.462 7.106 -1.709 1.00 0.00 H new ATOM 0 HE3 LYS A 436 17.217 6.776 -0.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 17.085 4.787 -1.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 16.128 4.607 -0.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 15.396 4.926 -1.622 1.00 0.00 H new ATOM 1154 N MET A 437 10.685 8.891 -0.579 1.00 0.00 N ATOM 1155 CA MET A 437 9.360 9.169 -1.111 1.00 0.00 C ATOM 1156 C MET A 437 8.392 9.458 0.026 1.00 0.00 C ATOM 1157 O MET A 437 7.511 10.308 -0.094 1.00 0.00 O ATOM 1158 CB MET A 437 8.858 7.987 -1.943 1.00 0.00 C ATOM 1159 CG MET A 437 7.507 8.231 -2.594 1.00 0.00 C ATOM 1160 SD MET A 437 7.647 9.001 -4.219 1.00 0.00 S ATOM 1161 CE MET A 437 8.712 7.832 -5.059 1.00 0.00 C ATOM 0 H MET A 437 11.051 7.969 -0.817 1.00 0.00 H new ATOM 0 HA MET A 437 9.421 10.045 -1.756 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.590 7.762 -2.719 1.00 0.00 H new ATOM 0 HB3 MET A 437 8.790 7.107 -1.304 1.00 0.00 H new ATOM 0 HG2 MET A 437 6.978 7.283 -2.690 1.00 0.00 H new ATOM 0 HG3 MET A 437 6.905 8.868 -1.945 1.00 0.00 H new ATOM 0 HE1 MET A 437 8.448 7.793 -6.116 1.00 0.00 H new ATOM 0 HE2 MET A 437 9.750 8.147 -4.956 1.00 0.00 H new ATOM 0 HE3 MET A 437 8.587 6.843 -4.617 1.00 0.00 H new ATOM 1171 N LEU A 438 8.572 8.750 1.136 1.00 0.00 N ATOM 1172 CA LEU A 438 7.728 8.936 2.300 1.00 0.00 C ATOM 1173 C LEU A 438 8.003 10.285 2.947 1.00 0.00 C ATOM 1174 O LEU A 438 7.107 10.905 3.513 1.00 0.00 O ATOM 1175 CB LEU A 438 7.965 7.822 3.313 1.00 0.00 C ATOM 1176 CG LEU A 438 7.041 7.861 4.525 1.00 0.00 C ATOM 1177 CD1 LEU A 438 5.594 7.981 4.075 1.00 0.00 C ATOM 1178 CD2 LEU A 438 7.242 6.626 5.384 1.00 0.00 C ATOM 0 H LEU A 438 9.297 8.042 1.249 1.00 0.00 H new ATOM 0 HA LEU A 438 6.688 8.905 1.975 1.00 0.00 H new ATOM 0 HB2 LEU A 438 7.846 6.861 2.812 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.998 7.876 3.658 1.00 0.00 H new ATOM 0 HG LEU A 438 7.286 8.735 5.128 1.00 0.00 H new ATOM 0 HD11 LEU A 438 4.942 8.008 4.948 1.00 0.00 H new ATOM 0 HD12 LEU A 438 5.467 8.898 3.499 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.334 7.124 3.454 1.00 0.00 H new ATOM 0 HD21 LEU A 438 6.575 6.669 6.245 1.00 0.00 H new ATOM 0 HD22 LEU A 438 7.020 5.735 4.797 1.00 0.00 H new ATOM 0 HD23 LEU A 438 8.276 6.586 5.727 1.00 0.00 H new ATOM 1190 N ASP A 439 9.250 10.734 2.859 1.00 0.00 N ATOM 1191 CA ASP A 439 9.636 12.014 3.435 1.00 0.00 C ATOM 1192 C ASP A 439 8.909 13.149 2.727 1.00 0.00 C ATOM 1193 O ASP A 439 8.423 14.082 3.363 1.00 0.00 O ATOM 1194 CB ASP A 439 11.150 12.212 3.332 1.00 0.00 C ATOM 1195 CG ASP A 439 11.872 11.815 4.606 1.00 0.00 C ATOM 1196 OD1 ASP A 439 11.299 11.033 5.394 1.00 0.00 O ATOM 1197 OD2 ASP A 439 13.010 12.286 4.815 1.00 0.00 O ATOM 0 H ASP A 439 10.007 10.232 2.396 1.00 0.00 H new ATOM 0 HA ASP A 439 9.356 12.019 4.488 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.535 11.622 2.500 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.363 13.257 3.107 1.00 0.00 H new ATOM 1202 N PHE A 440 8.834 13.053 1.406 1.00 0.00 N ATOM 1203 CA PHE A 440 8.161 14.065 0.604 1.00 0.00 C ATOM 1204 C PHE A 440 6.690 14.178 0.991 1.00 0.00 C ATOM 1205 O PHE A 440 6.143 15.278 1.076 1.00 0.00 O ATOM 1206 CB PHE A 440 8.275 13.723 -0.878 1.00 0.00 C ATOM 1207 CG PHE A 440 7.991 14.883 -1.789 1.00 0.00 C ATOM 1208 CD1 PHE A 440 8.670 16.081 -1.640 1.00 0.00 C ATOM 1209 CD2 PHE A 440 7.043 14.774 -2.796 1.00 0.00 C ATOM 1210 CE1 PHE A 440 8.411 17.150 -2.476 1.00 0.00 C ATOM 1211 CE2 PHE A 440 6.780 15.840 -3.635 1.00 0.00 C ATOM 1212 CZ PHE A 440 7.464 17.029 -3.476 1.00 0.00 C ATOM 0 H PHE A 440 9.232 12.284 0.867 1.00 0.00 H new ATOM 0 HA PHE A 440 8.646 15.023 0.793 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.280 13.351 -1.080 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.583 12.913 -1.109 1.00 0.00 H new ATOM 0 HD1 PHE A 440 9.411 16.181 -0.861 1.00 0.00 H new ATOM 0 HD2 PHE A 440 6.505 13.847 -2.926 1.00 0.00 H new ATOM 0 HE1 PHE A 440 8.947 18.079 -2.349 1.00 0.00 H new ATOM 0 HE2 PHE A 440 6.039 15.743 -4.415 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.260 17.863 -4.131 1.00 0.00 H new ATOM 1222 N TYR A 441 6.054 13.035 1.228 1.00 0.00 N ATOM 1223 CA TYR A 441 4.651 13.007 1.610 1.00 0.00 C ATOM 1224 C TYR A 441 4.504 13.291 3.090 1.00 0.00 C ATOM 1225 O TYR A 441 3.670 14.094 3.499 1.00 0.00 O ATOM 1226 CB TYR A 441 4.033 11.652 1.279 1.00 0.00 C ATOM 1227 CG TYR A 441 3.578 11.523 -0.155 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.459 11.123 -1.152 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.265 11.801 -0.512 1.00 0.00 C ATOM 1230 CE1 TYR A 441 4.044 11.004 -2.464 1.00 0.00 C ATOM 1231 CE2 TYR A 441 1.842 11.683 -1.822 1.00 0.00 C ATOM 1232 CZ TYR A 441 2.735 11.284 -2.795 1.00 0.00 C ATOM 1233 OH TYR A 441 2.317 11.166 -4.100 1.00 0.00 O ATOM 0 H TYR A 441 6.491 12.116 1.161 1.00 0.00 H new ATOM 0 HA TYR A 441 4.127 13.779 1.046 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.762 10.869 1.491 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.181 11.481 1.937 1.00 0.00 H new ATOM 0 HD1 TYR A 441 5.485 10.902 -0.897 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.563 12.115 0.247 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.742 10.693 -3.227 1.00 0.00 H new ATOM 0 HE2 TYR A 441 0.817 11.902 -2.083 1.00 0.00 H new ATOM 0 HH TYR A 441 1.367 11.399 -4.162 1.00 0.00 H new ATOM 1243 N ALA A 442 5.326 12.633 3.893 1.00 0.00 N ATOM 1244 CA ALA A 442 5.290 12.825 5.331 1.00 0.00 C ATOM 1245 C ALA A 442 5.448 14.300 5.679 1.00 0.00 C ATOM 1246 O ALA A 442 4.910 14.773 6.681 1.00 0.00 O ATOM 1247 CB ALA A 442 6.370 11.996 6.010 1.00 0.00 C ATOM 0 H ALA A 442 6.025 11.963 3.572 1.00 0.00 H new ATOM 0 HA ALA A 442 4.320 12.488 5.697 1.00 0.00 H new ATOM 0 HB1 ALA A 442 6.326 12.154 7.088 1.00 0.00 H new ATOM 0 HB2 ALA A 442 6.210 10.940 5.791 1.00 0.00 H new ATOM 0 HB3 ALA A 442 7.349 12.299 5.638 1.00 0.00 H new ATOM 1253 N LYS A 443 6.177 15.026 4.835 1.00 0.00 N ATOM 1254 CA LYS A 443 6.386 16.455 5.050 1.00 0.00 C ATOM 1255 C LYS A 443 5.216 17.265 4.491 1.00 0.00 C ATOM 1256 O LYS A 443 5.174 18.487 4.629 1.00 0.00 O ATOM 1257 CB LYS A 443 7.695 16.910 4.401 1.00 0.00 C ATOM 1258 CG LYS A 443 8.430 17.973 5.201 1.00 0.00 C ATOM 1259 CD LYS A 443 9.242 17.360 6.332 1.00 0.00 C ATOM 1260 CE LYS A 443 8.970 18.053 7.657 1.00 0.00 C ATOM 1261 NZ LYS A 443 9.881 17.575 8.733 1.00 0.00 N ATOM 0 H LYS A 443 6.630 14.651 4.001 1.00 0.00 H new ATOM 0 HA LYS A 443 6.447 16.629 6.124 1.00 0.00 H new ATOM 0 HB2 LYS A 443 8.348 16.046 4.273 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.482 17.298 3.405 1.00 0.00 H new ATOM 0 HG2 LYS A 443 9.091 18.534 4.541 1.00 0.00 H new ATOM 0 HG3 LYS A 443 7.711 18.683 5.611 1.00 0.00 H new ATOM 0 HD2 LYS A 443 9.003 16.300 6.419 1.00 0.00 H new ATOM 0 HD3 LYS A 443 10.304 17.428 6.096 1.00 0.00 H new ATOM 0 HE2 LYS A 443 9.088 19.130 7.534 1.00 0.00 H new ATOM 0 HE3 LYS A 443 7.936 17.877 7.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 9.662 18.073 9.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 9.751 16.552 8.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 10.867 17.766 8.463 1.00 0.00 H new ATOM 1275 N GLN A 444 4.265 16.574 3.867 1.00 0.00 N ATOM 1276 CA GLN A 444 3.091 17.220 3.297 1.00 0.00 C ATOM 1277 C GLN A 444 1.837 16.791 4.046 1.00 0.00 C ATOM 1278 O GLN A 444 1.017 17.623 4.430 1.00 0.00 O ATOM 1279 CB GLN A 444 2.961 16.878 1.812 1.00 0.00 C ATOM 1280 CG GLN A 444 3.970 17.596 0.931 1.00 0.00 C ATOM 1281 CD GLN A 444 3.745 17.334 -0.544 1.00 0.00 C ATOM 1282 OE1 GLN A 444 3.656 18.265 -1.346 1.00 0.00 O ATOM 1283 NE2 GLN A 444 3.651 16.062 -0.913 1.00 0.00 N ATOM 0 H GLN A 444 4.287 15.562 3.744 1.00 0.00 H new ATOM 0 HA GLN A 444 3.208 18.299 3.397 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.080 15.802 1.684 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.955 17.129 1.477 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.913 18.668 1.119 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.976 17.278 1.204 1.00 0.00 H new ATOM 0 HE21 GLN A 444 3.731 15.322 -0.216 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.499 15.825 -1.893 1.00 0.00 H new ATOM 1292 N ARG A 445 1.702 15.487 4.257 1.00 0.00 N ATOM 1293 CA ARG A 445 0.553 14.945 4.971 1.00 0.00 C ATOM 1294 C ARG A 445 0.579 15.383 6.429 1.00 0.00 C ATOM 1295 O ARG A 445 -0.425 15.842 6.972 1.00 0.00 O ATOM 1296 CB ARG A 445 0.543 13.417 4.886 1.00 0.00 C ATOM 1297 CG ARG A 445 -0.787 12.795 5.280 1.00 0.00 C ATOM 1298 CD ARG A 445 -0.968 12.776 6.789 1.00 0.00 C ATOM 1299 NE ARG A 445 -1.999 11.828 7.205 1.00 0.00 N ATOM 1300 CZ ARG A 445 -3.305 12.074 7.132 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -3.744 13.236 6.663 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -4.176 11.155 7.529 1.00 0.00 N ATOM 0 H ARG A 445 2.374 14.786 3.944 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.353 15.329 4.503 1.00 0.00 H new ATOM 0 HB2 ARG A 445 0.788 13.116 3.867 1.00 0.00 H new ATOM 0 HB3 ARG A 445 1.326 13.020 5.532 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -1.602 13.356 4.822 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -0.843 11.778 4.893 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -0.022 12.515 7.264 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -1.233 13.775 7.135 1.00 0.00 H new ATOM 0 HE ARG A 445 -1.700 10.925 7.573 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -3.079 13.946 6.356 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -4.746 13.419 6.610 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -3.845 10.260 7.890 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -5.177 11.343 7.473 1.00 0.00 H new ATOM 1314 N ALA A 446 1.741 15.242 7.053 1.00 0.00 N ATOM 1315 CA ALA A 446 1.916 15.626 8.447 1.00 0.00 C ATOM 1316 C ALA A 446 1.987 17.142 8.585 1.00 0.00 C ATOM 1317 O ALA A 446 1.622 17.700 9.621 1.00 0.00 O ATOM 1318 CB ALA A 446 3.173 14.984 9.016 1.00 0.00 C ATOM 0 H ALA A 446 2.580 14.863 6.613 1.00 0.00 H new ATOM 0 HA ALA A 446 1.054 15.272 9.012 1.00 0.00 H new ATOM 0 HB1 ALA A 446 3.292 15.279 10.059 1.00 0.00 H new ATOM 0 HB2 ALA A 446 3.088 13.899 8.953 1.00 0.00 H new ATOM 0 HB3 ALA A 446 4.041 15.313 8.444 1.00 0.00 H new