USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=16 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 X(o=0,f=0) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN :FLIP amide:sc= -2.03 F(o=-5.3!,f=-2) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot -21:sc= 0.596 USER MOD Single : A 380 TYR OH : rot -146:sc= 1.03 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HE2:sc= -4.27 K(o=-4.3,f=-6.6!) USER MOD Single : A 387 TYR OH : rot 39:sc= -4.1! USER MOD Single : A 389 THR OG1 : rot 180:sc= 0 USER MOD Single : A 399 ASN : amide:sc= -0.469 X(o=-0.47,f=-0.074) USER MOD Single : A 400 SER OG : rot -120:sc= -1.05 USER MOD Single : A 404 CYS SG : rot 107:sc= -0.594 USER MOD Single : A 410 THR OG1 : rot 26:sc= 0.0764 USER MOD Single : A 414 THR OG1 : rot -129:sc= -0.877 USER MOD Single : A 419 ASN : amide:sc= -3.2 K(o=-3.2,f=-16!) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -1.16 X(o=-1.2,f=-0.8) USER MOD Single : A 435 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.209) USER MOD Single : A 436 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.277) USER MOD Single : A 437 MET CE :methyl -171:sc= -3.67! (180deg=-4.4!) USER MOD Single : A 441 TYR OH : rot 30:sc= -1.68! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.487 X(o=-0.49,f=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -4.203 -2.322 8.294 1.00 0.00 N ATOM 103 CA ASN A 369 -3.093 -1.950 9.160 1.00 0.00 C ATOM 104 C ASN A 369 -2.021 -1.224 8.361 1.00 0.00 C ATOM 105 O ASN A 369 -1.871 -0.006 8.464 1.00 0.00 O ATOM 106 CB ASN A 369 -2.507 -3.193 9.827 1.00 0.00 C ATOM 107 CG ASN A 369 -1.324 -2.872 10.720 1.00 0.00 C ATOM 108 OD1 ASN A 369 -1.491 -2.409 11.849 1.00 0.00 O ATOM 109 ND2 ASN A 369 -0.120 -3.119 10.219 1.00 0.00 N ATOM 0 HA ASN A 369 -3.463 -1.279 9.935 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -3.281 -3.683 10.418 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.196 -3.901 9.059 1.00 0.00 H new ATOM 0 HD21 ASN A 369 0.713 -2.925 10.774 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -0.028 -3.503 9.279 1.00 0.00 H new ATOM 116 N ALA A 370 -1.289 -1.977 7.553 1.00 0.00 N ATOM 117 CA ALA A 370 -0.242 -1.401 6.721 1.00 0.00 C ATOM 118 C ALA A 370 -0.835 -0.378 5.762 1.00 0.00 C ATOM 119 O ALA A 370 -0.177 0.594 5.388 1.00 0.00 O ATOM 120 CB ALA A 370 0.491 -2.491 5.956 1.00 0.00 C ATOM 0 H ALA A 370 -1.400 -2.986 7.456 1.00 0.00 H new ATOM 0 HA ALA A 370 0.477 -0.895 7.366 1.00 0.00 H new ATOM 0 HB1 ALA A 370 1.270 -2.042 5.340 1.00 0.00 H new ATOM 0 HB2 ALA A 370 0.943 -3.189 6.661 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.214 -3.025 5.318 1.00 0.00 H new ATOM 126 N LYS A 371 -2.091 -0.597 5.377 1.00 0.00 N ATOM 127 CA LYS A 371 -2.779 0.314 4.474 1.00 0.00 C ATOM 128 C LYS A 371 -3.176 1.583 5.214 1.00 0.00 C ATOM 129 O LYS A 371 -3.148 2.678 4.652 1.00 0.00 O ATOM 130 CB LYS A 371 -4.015 -0.358 3.874 1.00 0.00 C ATOM 131 CG LYS A 371 -4.498 0.296 2.589 1.00 0.00 C ATOM 132 CD LYS A 371 -6.015 0.386 2.541 1.00 0.00 C ATOM 133 CE LYS A 371 -6.509 1.750 2.998 1.00 0.00 C ATOM 134 NZ LYS A 371 -7.369 1.653 4.209 1.00 0.00 N ATOM 0 H LYS A 371 -2.649 -1.396 5.677 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.101 0.577 3.662 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -3.789 -1.406 3.676 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.821 -0.339 4.607 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -4.071 1.296 2.506 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -4.140 -0.275 1.733 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.360 0.195 1.525 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.446 -0.389 3.175 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -5.655 2.393 3.210 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -7.070 2.222 2.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -7.685 2.604 4.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.198 1.061 4.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -6.826 1.227 4.987 1.00 0.00 H new ATOM 148 N ARG A 372 -3.533 1.430 6.487 1.00 0.00 N ATOM 149 CA ARG A 372 -3.916 2.570 7.309 1.00 0.00 C ATOM 150 C ARG A 372 -2.690 3.411 7.637 1.00 0.00 C ATOM 151 O ARG A 372 -2.775 4.632 7.772 1.00 0.00 O ATOM 152 CB ARG A 372 -4.591 2.098 8.599 1.00 0.00 C ATOM 153 CG ARG A 372 -5.658 1.039 8.376 1.00 0.00 C ATOM 154 CD ARG A 372 -6.552 0.884 9.596 1.00 0.00 C ATOM 155 NE ARG A 372 -5.837 0.304 10.729 1.00 0.00 N ATOM 156 CZ ARG A 372 -6.258 0.382 11.991 1.00 0.00 C ATOM 157 NH1 ARG A 372 -7.388 1.015 12.282 1.00 0.00 N ATOM 158 NH2 ARG A 372 -5.547 -0.173 12.963 1.00 0.00 N ATOM 0 H ARG A 372 -3.564 0.531 6.968 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.626 3.180 6.750 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -3.831 1.700 9.272 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -5.041 2.956 9.098 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -6.264 1.308 7.511 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -5.183 0.085 8.148 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -6.951 1.858 9.879 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -7.404 0.252 9.343 1.00 0.00 H new ATOM 0 HE ARG A 372 -4.964 -0.190 10.544 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -7.938 1.444 11.538 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -7.706 1.072 13.249 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -4.678 -0.660 12.745 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -5.869 -0.113 13.929 1.00 0.00 H new ATOM 170 N GLN A 373 -1.545 2.745 7.749 1.00 0.00 N ATOM 171 CA GLN A 373 -0.291 3.421 8.046 1.00 0.00 C ATOM 172 C GLN A 373 0.096 4.345 6.899 1.00 0.00 C ATOM 173 O GLN A 373 0.440 5.507 7.110 1.00 0.00 O ATOM 174 CB GLN A 373 0.819 2.394 8.288 1.00 0.00 C ATOM 175 CG GLN A 373 1.763 2.774 9.416 1.00 0.00 C ATOM 176 CD GLN A 373 3.208 2.439 9.108 1.00 0.00 C ATOM 177 OE1 GLN A 373 4.002 3.463 8.821 1.00 0.00 O flip ATOM 178 NE2 GLN A 373 3.605 1.274 9.126 1.00 0.00 N flip ATOM 0 H GLN A 373 -1.462 1.734 7.638 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.423 4.018 8.949 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.366 1.428 8.514 1.00 0.00 H new ATOM 0 HB3 GLN A 373 1.394 2.270 7.370 1.00 0.00 H new ATOM 0 HG2 GLN A 373 1.676 3.843 9.612 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.461 2.257 10.327 1.00 0.00 H new ATOM 0 HE21 GLN A 373 2.958 0.518 9.352 1.00 0.00 H new ATOM 0 HE22 GLN A 373 4.581 1.064 8.915 1.00 0.00 H new ATOM 187 N LEU A 374 0.033 3.815 5.681 1.00 0.00 N ATOM 188 CA LEU A 374 0.373 4.582 4.490 1.00 0.00 C ATOM 189 C LEU A 374 -0.549 5.787 4.337 1.00 0.00 C ATOM 190 O LEU A 374 -0.098 6.899 4.065 1.00 0.00 O ATOM 191 CB LEU A 374 0.285 3.687 3.250 1.00 0.00 C ATOM 192 CG LEU A 374 1.151 4.112 2.059 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.555 4.488 2.511 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.208 2.996 1.025 1.00 0.00 C ATOM 0 H LEU A 374 -0.252 2.854 5.494 1.00 0.00 H new ATOM 0 HA LEU A 374 1.394 4.948 4.595 1.00 0.00 H new ATOM 0 HB2 LEU A 374 0.566 2.673 3.536 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.755 3.650 2.925 1.00 0.00 H new ATOM 0 HG LEU A 374 0.696 4.992 1.604 1.00 0.00 H new ATOM 0 HD11 LEU A 374 3.148 4.786 1.646 1.00 0.00 H new ATOM 0 HD12 LEU A 374 2.500 5.317 3.216 1.00 0.00 H new ATOM 0 HD13 LEU A 374 3.023 3.631 2.995 1.00 0.00 H new ATOM 0 HD21 LEU A 374 1.826 3.310 0.184 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.638 2.102 1.477 1.00 0.00 H new ATOM 0 HD23 LEU A 374 0.201 2.775 0.672 1.00 0.00 H new ATOM 206 N TYR A 375 -1.843 5.556 4.513 1.00 0.00 N ATOM 207 CA TYR A 375 -2.833 6.618 4.394 1.00 0.00 C ATOM 208 C TYR A 375 -2.697 7.628 5.528 1.00 0.00 C ATOM 209 O TYR A 375 -3.029 8.802 5.369 1.00 0.00 O ATOM 210 CB TYR A 375 -4.242 6.022 4.395 1.00 0.00 C ATOM 211 CG TYR A 375 -5.205 6.745 3.483 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.531 8.077 3.700 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.789 6.092 2.407 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.412 8.739 2.868 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.671 6.747 1.570 1.00 0.00 C ATOM 216 CZ TYR A 375 -6.980 8.070 1.804 1.00 0.00 C ATOM 217 OH TYR A 375 -7.858 8.727 0.972 1.00 0.00 O ATOM 0 H TYR A 375 -2.232 4.641 4.739 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.659 7.138 3.452 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.185 4.976 4.094 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.634 6.040 5.412 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -5.089 8.604 4.533 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.550 5.055 2.221 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -6.655 9.776 3.050 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.117 6.225 0.736 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.166 8.114 0.272 1.00 0.00 H new ATOM 227 N SER A 376 -2.214 7.164 6.675 1.00 0.00 N ATOM 228 CA SER A 376 -2.043 8.031 7.834 1.00 0.00 C ATOM 229 C SER A 376 -0.671 8.701 7.840 1.00 0.00 C ATOM 230 O SER A 376 -0.402 9.565 8.674 1.00 0.00 O ATOM 231 CB SER A 376 -2.234 7.231 9.124 1.00 0.00 C ATOM 232 OG SER A 376 -1.176 6.307 9.312 1.00 0.00 O ATOM 0 H SER A 376 -1.935 6.195 6.827 1.00 0.00 H new ATOM 0 HA SER A 376 -2.799 8.813 7.774 1.00 0.00 H new ATOM 0 HB2 SER A 376 -2.282 7.912 9.974 1.00 0.00 H new ATOM 0 HB3 SER A 376 -3.184 6.698 9.088 1.00 0.00 H new ATOM 0 HG SER A 376 -0.738 6.132 8.453 1.00 0.00 H new ATOM 238 N LEU A 377 0.203 8.299 6.917 1.00 0.00 N ATOM 239 CA LEU A 377 1.540 8.870 6.846 1.00 0.00 C ATOM 240 C LEU A 377 1.763 9.645 5.549 1.00 0.00 C ATOM 241 O LEU A 377 2.637 10.510 5.485 1.00 0.00 O ATOM 242 CB LEU A 377 2.597 7.771 6.982 1.00 0.00 C ATOM 243 CG LEU A 377 3.230 7.654 8.368 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.198 7.194 9.388 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.413 6.698 8.336 1.00 0.00 C ATOM 0 H LEU A 377 0.008 7.585 6.215 1.00 0.00 H new ATOM 0 HA LEU A 377 1.636 9.572 7.675 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.141 6.815 6.725 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.386 7.954 6.253 1.00 0.00 H new ATOM 0 HG LEU A 377 3.592 8.638 8.665 1.00 0.00 H new ATOM 0 HD11 LEU A 377 2.666 7.116 10.369 1.00 0.00 H new ATOM 0 HD12 LEU A 377 1.382 7.916 9.431 1.00 0.00 H new ATOM 0 HD13 LEU A 377 1.806 6.220 9.095 1.00 0.00 H new ATOM 0 HD21 LEU A 377 4.851 6.627 9.332 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.075 5.712 8.017 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.162 7.069 7.636 1.00 0.00 H new ATOM 257 N ILE A 378 0.988 9.336 4.512 1.00 0.00 N ATOM 258 CA ILE A 378 1.147 10.023 3.235 1.00 0.00 C ATOM 259 C ILE A 378 -0.192 10.381 2.589 1.00 0.00 C ATOM 260 O ILE A 378 -0.297 11.387 1.887 1.00 0.00 O ATOM 261 CB ILE A 378 1.992 9.187 2.250 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.266 7.900 1.853 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.344 8.861 2.863 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.676 7.377 0.495 1.00 0.00 C ATOM 0 H ILE A 378 0.256 8.626 4.530 1.00 0.00 H new ATOM 0 HA ILE A 378 1.670 10.954 3.456 1.00 0.00 H new ATOM 0 HB ILE A 378 2.145 9.780 1.348 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.462 7.134 2.604 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.191 8.082 1.855 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.930 8.271 2.158 1.00 0.00 H new ATOM 0 HG22 ILE A 378 3.873 9.786 3.090 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.199 8.291 3.781 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.124 6.463 0.275 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.455 8.126 -0.265 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.745 7.164 0.495 1.00 0.00 H new ATOM 276 N GLY A 379 -1.211 9.560 2.820 1.00 0.00 N ATOM 277 CA GLY A 379 -2.517 9.823 2.241 1.00 0.00 C ATOM 278 C GLY A 379 -3.168 11.070 2.806 1.00 0.00 C ATOM 279 O GLY A 379 -3.679 11.057 3.927 1.00 0.00 O ATOM 0 H GLY A 379 -1.157 8.720 3.396 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.416 9.929 1.161 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.167 8.967 2.418 1.00 0.00 H new ATOM 283 N TYR A 380 -3.155 12.152 2.031 1.00 0.00 N ATOM 284 CA TYR A 380 -3.756 13.409 2.466 1.00 0.00 C ATOM 285 C TYR A 380 -5.053 13.689 1.711 1.00 0.00 C ATOM 286 O TYR A 380 -6.027 14.166 2.291 1.00 0.00 O ATOM 287 CB TYR A 380 -2.784 14.581 2.280 1.00 0.00 C ATOM 288 CG TYR A 380 -1.794 14.404 1.148 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.203 14.451 -0.178 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.446 14.196 1.411 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.296 14.295 -1.211 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.467 14.041 0.387 1.00 0.00 C ATOM 293 CZ TYR A 380 0.037 14.090 -0.922 1.00 0.00 C ATOM 294 OH TYR A 380 0.943 13.935 -1.946 1.00 0.00 O ATOM 0 H TYR A 380 -2.736 12.183 1.102 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.983 13.309 3.527 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.360 15.489 2.103 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.232 14.729 3.208 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.246 14.612 -0.407 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -0.106 14.155 2.435 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.630 14.334 -2.237 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.512 13.882 0.610 1.00 0.00 H new ATOM 0 HH TYR A 380 1.643 13.306 -1.671 1.00 0.00 H new ATOM 304 N ALA A 381 -5.058 13.391 0.415 1.00 0.00 N ATOM 305 CA ALA A 381 -6.236 13.613 -0.418 1.00 0.00 C ATOM 306 C ALA A 381 -5.930 13.333 -1.886 1.00 0.00 C ATOM 307 O ALA A 381 -6.442 12.374 -2.465 1.00 0.00 O ATOM 308 CB ALA A 381 -6.751 15.038 -0.246 1.00 0.00 C ATOM 0 H ALA A 381 -4.260 12.995 -0.081 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.012 12.919 -0.095 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -7.629 15.186 -0.874 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -7.019 15.205 0.797 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -5.973 15.744 -0.538 1.00 0.00 H new ATOM 314 N SER A 382 -5.091 14.175 -2.483 1.00 0.00 N ATOM 315 CA SER A 382 -4.716 14.018 -3.885 1.00 0.00 C ATOM 316 C SER A 382 -4.184 12.613 -4.150 1.00 0.00 C ATOM 317 O SER A 382 -4.343 12.075 -5.246 1.00 0.00 O ATOM 318 CB SER A 382 -3.661 15.056 -4.273 1.00 0.00 C ATOM 319 OG SER A 382 -3.578 15.198 -5.680 1.00 0.00 O ATOM 0 H SER A 382 -4.658 14.973 -2.018 1.00 0.00 H new ATOM 0 HA SER A 382 -5.607 14.172 -4.493 1.00 0.00 H new ATOM 0 HB2 SER A 382 -3.908 16.017 -3.821 1.00 0.00 H new ATOM 0 HB3 SER A 382 -2.690 14.758 -3.877 1.00 0.00 H new ATOM 0 HG SER A 382 -2.898 15.868 -5.902 1.00 0.00 H new ATOM 325 N LEU A 383 -3.558 12.023 -3.138 1.00 0.00 N ATOM 326 CA LEU A 383 -3.008 10.680 -3.257 1.00 0.00 C ATOM 327 C LEU A 383 -4.041 9.635 -2.850 1.00 0.00 C ATOM 328 O LEU A 383 -3.987 9.089 -1.749 1.00 0.00 O ATOM 329 CB LEU A 383 -1.754 10.540 -2.391 1.00 0.00 C ATOM 330 CG LEU A 383 -0.774 9.456 -2.842 1.00 0.00 C ATOM 331 CD1 LEU A 383 0.212 10.017 -3.856 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.039 8.872 -1.645 1.00 0.00 C ATOM 0 H LEU A 383 -3.419 12.456 -2.225 1.00 0.00 H new ATOM 0 HA LEU A 383 -2.739 10.514 -4.300 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.232 11.497 -2.376 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.060 10.328 -1.367 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.339 8.656 -3.321 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.902 9.232 -4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.331 10.387 -4.726 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.773 10.835 -3.404 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.654 8.102 -1.984 1.00 0.00 H new ATOM 0 HD22 LEU A 383 0.515 9.662 -1.138 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.759 8.433 -0.954 1.00 0.00 H new ATOM 344 N ARG A 384 -4.985 9.366 -3.746 1.00 0.00 N ATOM 345 CA ARG A 384 -6.035 8.389 -3.484 1.00 0.00 C ATOM 346 C ARG A 384 -5.447 6.994 -3.308 1.00 0.00 C ATOM 347 O ARG A 384 -5.457 6.184 -4.235 1.00 0.00 O ATOM 348 CB ARG A 384 -7.057 8.391 -4.623 1.00 0.00 C ATOM 349 CG ARG A 384 -8.389 9.021 -4.244 1.00 0.00 C ATOM 350 CD ARG A 384 -9.192 8.117 -3.321 1.00 0.00 C ATOM 351 NE ARG A 384 -10.566 7.943 -3.785 1.00 0.00 N ATOM 352 CZ ARG A 384 -11.531 8.843 -3.600 1.00 0.00 C ATOM 353 NH1 ARG A 384 -11.276 9.980 -2.965 1.00 0.00 N ATOM 354 NH2 ARG A 384 -12.754 8.604 -4.054 1.00 0.00 N ATOM 0 H ARG A 384 -5.044 9.812 -4.661 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.537 8.668 -2.558 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.639 8.929 -5.474 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -7.229 7.365 -4.948 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.213 9.979 -3.754 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -8.965 9.226 -5.146 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -8.706 7.144 -3.254 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -9.199 8.539 -2.316 1.00 0.00 H new ATOM 0 HE ARG A 384 -10.800 7.082 -4.280 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -10.337 10.169 -2.615 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -12.019 10.665 -2.827 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -12.955 7.732 -4.544 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -13.494 9.292 -3.913 1.00 0.00 H new ATOM 366 N LEU A 385 -4.934 6.721 -2.113 1.00 0.00 N ATOM 367 CA LEU A 385 -4.340 5.423 -1.815 1.00 0.00 C ATOM 368 C LEU A 385 -5.357 4.301 -2.009 1.00 0.00 C ATOM 369 O LEU A 385 -6.264 4.124 -1.195 1.00 0.00 O ATOM 370 CB LEU A 385 -3.807 5.401 -0.381 1.00 0.00 C ATOM 371 CG LEU A 385 -3.097 4.106 0.026 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.590 4.311 0.053 1.00 0.00 C ATOM 373 CD2 LEU A 385 -3.595 3.626 1.381 1.00 0.00 C ATOM 0 H LEU A 385 -4.918 7.381 -1.335 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.513 5.262 -2.506 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -3.114 6.233 -0.254 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.639 5.572 0.302 1.00 0.00 H new ATOM 0 HG LEU A 385 -3.327 3.340 -0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.101 3.381 0.344 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.245 4.607 -0.938 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.342 5.092 0.772 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.079 2.705 1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -3.396 4.389 2.133 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -4.668 3.439 1.329 1.00 0.00 H new ATOM 385 N HIS A 386 -5.196 3.543 -3.089 1.00 0.00 N ATOM 386 CA HIS A 386 -6.096 2.436 -3.387 1.00 0.00 C ATOM 387 C HIS A 386 -5.314 1.228 -3.887 1.00 0.00 C ATOM 388 O HIS A 386 -4.525 1.332 -4.826 1.00 0.00 O ATOM 389 CB HIS A 386 -7.136 2.857 -4.428 1.00 0.00 C ATOM 390 CG HIS A 386 -6.541 3.363 -5.704 1.00 0.00 C ATOM 391 ND1 HIS A 386 -6.522 4.698 -6.049 1.00 0.00 N ATOM 392 CD2 HIS A 386 -5.943 2.705 -6.726 1.00 0.00 C ATOM 393 CE1 HIS A 386 -5.939 4.840 -7.225 1.00 0.00 C ATOM 394 NE2 HIS A 386 -5.578 3.646 -7.657 1.00 0.00 N ATOM 0 H HIS A 386 -4.450 3.676 -3.772 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.612 2.160 -2.468 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.779 2.006 -4.650 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -7.771 3.633 -4.001 1.00 0.00 H new ATOM 0 HD1 HIS A 386 -6.900 5.458 -5.483 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -5.783 1.639 -6.796 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -5.784 5.774 -7.745 1.00 0.00 H new ATOM 403 N TYR A 387 -5.530 0.084 -3.248 1.00 0.00 N ATOM 404 CA TYR A 387 -4.838 -1.141 -3.624 1.00 0.00 C ATOM 405 C TYR A 387 -5.634 -1.933 -4.653 1.00 0.00 C ATOM 406 O TYR A 387 -6.826 -2.185 -4.474 1.00 0.00 O ATOM 407 CB TYR A 387 -4.573 -2.000 -2.389 1.00 0.00 C ATOM 408 CG TYR A 387 -3.445 -1.476 -1.535 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.529 -0.225 -0.938 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.294 -2.224 -1.333 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.498 0.267 -0.163 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.258 -1.742 -0.559 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.364 -0.495 0.024 1.00 0.00 C ATOM 414 OH TYR A 387 -0.333 -0.009 0.794 1.00 0.00 O ATOM 0 H TYR A 387 -6.179 -0.020 -2.468 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.886 -0.862 -4.076 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.481 -2.053 -1.789 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.340 -3.017 -2.704 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.416 0.373 -1.083 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.207 -3.199 -1.789 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.579 1.242 0.294 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.369 -2.337 -0.410 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.699 0.470 1.567 1.00 0.00 H new ATOM 424 N VAL A 388 -4.963 -2.318 -5.732 1.00 0.00 N ATOM 425 CA VAL A 388 -5.597 -3.077 -6.797 1.00 0.00 C ATOM 426 C VAL A 388 -4.850 -4.382 -7.058 1.00 0.00 C ATOM 427 O VAL A 388 -3.686 -4.372 -7.459 1.00 0.00 O ATOM 428 CB VAL A 388 -5.652 -2.254 -8.096 1.00 0.00 C ATOM 429 CG1 VAL A 388 -6.307 -3.049 -9.219 1.00 0.00 C ATOM 430 CG2 VAL A 388 -6.385 -0.941 -7.863 1.00 0.00 C ATOM 0 H VAL A 388 -3.976 -2.115 -5.890 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.612 -3.307 -6.475 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.630 -2.028 -8.400 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -6.333 -2.444 -10.126 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.733 -3.957 -9.405 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -7.324 -3.315 -8.931 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -6.415 -0.371 -8.792 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -7.403 -1.146 -7.530 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.863 -0.364 -7.100 1.00 0.00 H new ATOM 440 N THR A 389 -5.526 -5.503 -6.831 1.00 0.00 N ATOM 441 CA THR A 389 -4.924 -6.813 -7.048 1.00 0.00 C ATOM 442 C THR A 389 -4.926 -7.164 -8.533 1.00 0.00 C ATOM 443 O THR A 389 -5.893 -6.889 -9.243 1.00 0.00 O ATOM 444 CB THR A 389 -5.671 -7.885 -6.253 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.869 -8.256 -6.912 1.00 0.00 O ATOM 446 CG2 THR A 389 -6.033 -7.447 -4.850 1.00 0.00 C ATOM 0 H THR A 389 -6.489 -5.531 -6.497 1.00 0.00 H new ATOM 0 HA THR A 389 -3.892 -6.776 -6.700 1.00 0.00 H new ATOM 0 HB THR A 389 -4.982 -8.727 -6.186 1.00 0.00 H new ATOM 0 HG1 THR A 389 -7.331 -8.944 -6.388 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.561 -8.254 -4.342 1.00 0.00 H new ATOM 0 HG22 THR A 389 -5.125 -7.204 -4.299 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.675 -6.567 -4.898 1.00 0.00 H new ATOM 594 N ASN A 399 0.511 -16.469 -6.857 1.00 0.00 N ATOM 595 CA ASN A 399 0.055 -15.938 -5.577 1.00 0.00 C ATOM 596 C ASN A 399 -0.843 -14.721 -5.784 1.00 0.00 C ATOM 597 O ASN A 399 -1.309 -14.464 -6.894 1.00 0.00 O ATOM 598 CB ASN A 399 1.250 -15.562 -4.698 1.00 0.00 C ATOM 599 CG ASN A 399 2.290 -16.661 -4.632 1.00 0.00 C ATOM 600 OD1 ASN A 399 2.375 -17.396 -3.648 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.091 -16.780 -5.684 1.00 0.00 N ATOM 0 HA ASN A 399 -0.523 -16.714 -5.075 1.00 0.00 H new ATOM 0 HB2 ASN A 399 1.710 -14.653 -5.086 1.00 0.00 H new ATOM 0 HB3 ASN A 399 0.899 -15.337 -3.691 1.00 0.00 H new ATOM 0 HD21 ASN A 399 3.811 -17.502 -5.697 1.00 0.00 H new ATOM 0 HD22 ASN A 399 2.986 -16.149 -6.479 1.00 0.00 H new ATOM 608 N SER A 400 -1.078 -13.971 -4.711 1.00 0.00 N ATOM 609 CA SER A 400 -1.913 -12.782 -4.779 1.00 0.00 C ATOM 610 C SER A 400 -1.051 -11.531 -4.890 1.00 0.00 C ATOM 611 O SER A 400 -0.577 -11.002 -3.886 1.00 0.00 O ATOM 612 CB SER A 400 -2.813 -12.689 -3.545 1.00 0.00 C ATOM 613 OG SER A 400 -3.660 -13.821 -3.443 1.00 0.00 O ATOM 0 H SER A 400 -0.700 -14.168 -3.784 1.00 0.00 H new ATOM 0 HA SER A 400 -2.541 -12.855 -5.667 1.00 0.00 H new ATOM 0 HB2 SER A 400 -2.198 -12.609 -2.648 1.00 0.00 H new ATOM 0 HB3 SER A 400 -3.417 -11.783 -3.599 1.00 0.00 H new ATOM 0 HG SER A 400 -4.596 -13.532 -3.465 1.00 0.00 H new ATOM 619 N ILE A 401 -0.846 -11.067 -6.116 1.00 0.00 N ATOM 620 CA ILE A 401 -0.034 -9.882 -6.353 1.00 0.00 C ATOM 621 C ILE A 401 -0.886 -8.616 -6.317 1.00 0.00 C ATOM 622 O ILE A 401 -1.892 -8.512 -7.021 1.00 0.00 O ATOM 623 CB ILE A 401 0.717 -9.981 -7.703 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.024 -9.190 -7.641 1.00 0.00 C ATOM 625 CG2 ILE A 401 -0.148 -9.497 -8.859 1.00 0.00 C ATOM 626 CD1 ILE A 401 1.826 -7.717 -7.358 1.00 0.00 C ATOM 0 H ILE A 401 -1.230 -11.493 -6.960 1.00 0.00 H new ATOM 0 HA ILE A 401 0.703 -9.825 -5.552 1.00 0.00 H new ATOM 0 HB ILE A 401 0.949 -11.031 -7.882 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.662 -9.618 -6.867 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.552 -9.302 -8.588 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.411 -9.580 -9.791 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -1.049 -10.108 -8.920 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -0.426 -8.456 -8.694 1.00 0.00 H new ATOM 0 HD11 ILE A 401 2.795 -7.219 -7.328 1.00 0.00 H new ATOM 0 HD12 ILE A 401 1.214 -7.274 -8.144 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.326 -7.595 -6.397 1.00 0.00 H new ATOM 638 N VAL A 402 -0.480 -7.656 -5.494 1.00 0.00 N ATOM 639 CA VAL A 402 -1.207 -6.403 -5.369 1.00 0.00 C ATOM 640 C VAL A 402 -0.278 -5.212 -5.565 1.00 0.00 C ATOM 641 O VAL A 402 0.929 -5.309 -5.342 1.00 0.00 O ATOM 642 CB VAL A 402 -1.899 -6.286 -3.998 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.786 -5.050 -3.949 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.706 -7.540 -3.700 1.00 0.00 C ATOM 0 H VAL A 402 0.349 -7.724 -4.904 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.969 -6.399 -6.148 1.00 0.00 H new ATOM 0 HB VAL A 402 -1.130 -6.184 -3.232 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -3.266 -4.985 -2.973 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -2.179 -4.160 -4.115 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.549 -5.119 -4.724 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -3.188 -7.440 -2.728 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.466 -7.675 -4.470 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -2.043 -8.405 -3.689 1.00 0.00 H new ATOM 654 N GLU A 403 -0.847 -4.089 -5.987 1.00 0.00 N ATOM 655 CA GLU A 403 -0.068 -2.881 -6.219 1.00 0.00 C ATOM 656 C GLU A 403 -0.841 -1.638 -5.792 1.00 0.00 C ATOM 657 O GLU A 403 -1.902 -1.336 -6.337 1.00 0.00 O ATOM 658 CB GLU A 403 0.316 -2.773 -7.696 1.00 0.00 C ATOM 659 CG GLU A 403 1.388 -3.763 -8.120 1.00 0.00 C ATOM 660 CD GLU A 403 1.838 -3.555 -9.553 1.00 0.00 C ATOM 661 OE1 GLU A 403 1.214 -4.141 -10.462 1.00 0.00 O ATOM 662 OE2 GLU A 403 2.815 -2.806 -9.766 1.00 0.00 O ATOM 0 H GLU A 403 -1.845 -3.991 -6.175 1.00 0.00 H new ATOM 0 HA GLU A 403 0.838 -2.945 -5.616 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.573 -2.930 -8.306 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.667 -1.761 -7.898 1.00 0.00 H new ATOM 0 HG2 GLU A 403 2.247 -3.669 -7.456 1.00 0.00 H new ATOM 0 HG3 GLU A 403 1.006 -4.778 -8.006 1.00 0.00 H new ATOM 669 N CYS A 404 -0.297 -0.919 -4.816 1.00 0.00 N ATOM 670 CA CYS A 404 -0.929 0.295 -4.319 1.00 0.00 C ATOM 671 C CYS A 404 -0.748 1.438 -5.310 1.00 0.00 C ATOM 672 O CYS A 404 0.366 1.919 -5.517 1.00 0.00 O ATOM 673 CB CYS A 404 -0.340 0.684 -2.963 1.00 0.00 C ATOM 674 SG CYS A 404 -1.059 2.180 -2.247 1.00 0.00 S ATOM 0 H CYS A 404 0.581 -1.157 -4.354 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.995 0.101 -4.200 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.481 -0.143 -2.267 1.00 0.00 H new ATOM 0 HB3 CYS A 404 0.735 0.828 -3.074 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.835 1.857 -1.255 1.00 0.00 H new ATOM 680 N ARG A 405 -1.845 1.869 -5.921 1.00 0.00 N ATOM 681 CA ARG A 405 -1.800 2.954 -6.888 1.00 0.00 C ATOM 682 C ARG A 405 -2.408 4.220 -6.305 1.00 0.00 C ATOM 683 O ARG A 405 -3.424 4.170 -5.611 1.00 0.00 O ATOM 684 CB ARG A 405 -2.537 2.561 -8.168 1.00 0.00 C ATOM 685 CG ARG A 405 -2.044 1.261 -8.781 1.00 0.00 C ATOM 686 CD ARG A 405 -3.070 0.671 -9.735 1.00 0.00 C ATOM 687 NE ARG A 405 -2.448 -0.168 -10.756 1.00 0.00 N ATOM 688 CZ ARG A 405 -1.626 0.295 -11.696 1.00 0.00 C ATOM 689 NH1 ARG A 405 -1.324 1.586 -11.746 1.00 0.00 N ATOM 690 NH2 ARG A 405 -1.106 -0.537 -12.588 1.00 0.00 N ATOM 0 H ARG A 405 -2.776 1.483 -5.763 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.755 3.149 -7.129 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.601 2.470 -7.951 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.429 3.362 -8.900 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -1.110 1.440 -9.314 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -1.827 0.544 -7.990 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -3.792 0.081 -9.171 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -3.624 1.477 -10.216 1.00 0.00 H new ATOM 0 HE ARG A 405 -2.655 -1.167 -10.749 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -1.722 2.230 -11.062 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -0.694 1.935 -12.468 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -1.336 -1.530 -12.554 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -0.476 -0.184 -13.309 1.00 0.00 H new ATOM 702 N VAL A 406 -1.781 5.352 -6.588 1.00 0.00 N ATOM 703 CA VAL A 406 -2.264 6.630 -6.088 1.00 0.00 C ATOM 704 C VAL A 406 -3.230 7.279 -7.075 1.00 0.00 C ATOM 705 O VAL A 406 -3.340 6.851 -8.223 1.00 0.00 O ATOM 706 CB VAL A 406 -1.101 7.599 -5.799 1.00 0.00 C ATOM 707 CG1 VAL A 406 -0.155 7.004 -4.767 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.352 7.940 -7.080 1.00 0.00 C ATOM 0 H VAL A 406 -0.939 5.412 -7.160 1.00 0.00 H new ATOM 0 HA VAL A 406 -2.791 6.426 -5.156 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.517 8.521 -5.393 1.00 0.00 H new ATOM 0 HG11 VAL A 406 0.660 7.702 -4.575 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -0.698 6.817 -3.841 1.00 0.00 H new ATOM 0 HG13 VAL A 406 0.252 6.066 -5.145 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.465 8.625 -6.853 1.00 0.00 H new ATOM 0 HG22 VAL A 406 0.051 7.028 -7.519 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -1.035 8.412 -7.786 1.00 0.00 H new ATOM 744 N THR A 410 0.134 6.302 -10.110 1.00 0.00 N ATOM 745 CA THR A 410 1.490 5.792 -9.947 1.00 0.00 C ATOM 746 C THR A 410 1.566 4.819 -8.773 1.00 0.00 C ATOM 747 O THR A 410 1.239 5.171 -7.639 1.00 0.00 O ATOM 748 CB THR A 410 2.468 6.948 -9.731 1.00 0.00 C ATOM 749 OG1 THR A 410 2.433 7.844 -10.828 1.00 0.00 O ATOM 750 CG2 THR A 410 3.902 6.496 -9.552 1.00 0.00 C ATOM 0 HA THR A 410 1.765 5.258 -10.857 1.00 0.00 H new ATOM 0 HB THR A 410 2.142 7.434 -8.812 1.00 0.00 H new ATOM 0 HG1 THR A 410 1.561 7.785 -11.271 1.00 0.00 H new ATOM 0 HG21 THR A 410 4.542 7.366 -9.403 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.971 5.842 -8.683 1.00 0.00 H new ATOM 0 HG23 THR A 410 4.226 5.955 -10.441 1.00 0.00 H new ATOM 758 N VAL A 411 2.002 3.595 -9.051 1.00 0.00 N ATOM 759 CA VAL A 411 2.121 2.574 -8.017 1.00 0.00 C ATOM 760 C VAL A 411 3.283 2.877 -7.080 1.00 0.00 C ATOM 761 O VAL A 411 4.435 2.960 -7.508 1.00 0.00 O ATOM 762 CB VAL A 411 2.318 1.173 -8.626 1.00 0.00 C ATOM 763 CG1 VAL A 411 2.276 0.107 -7.542 1.00 0.00 C ATOM 764 CG2 VAL A 411 1.269 0.899 -9.693 1.00 0.00 C ATOM 0 H VAL A 411 2.279 3.286 -9.983 1.00 0.00 H new ATOM 0 HA VAL A 411 1.188 2.586 -7.453 1.00 0.00 H new ATOM 0 HB VAL A 411 3.300 1.140 -9.098 1.00 0.00 H new ATOM 0 HG11 VAL A 411 2.417 -0.876 -7.992 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.070 0.292 -6.819 1.00 0.00 H new ATOM 0 HG13 VAL A 411 1.311 0.139 -7.037 1.00 0.00 H new ATOM 0 HG21 VAL A 411 1.426 -0.096 -10.111 1.00 0.00 H new ATOM 0 HG22 VAL A 411 0.275 0.953 -9.249 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.353 1.643 -10.486 1.00 0.00 H new ATOM 774 N LEU A 412 2.972 3.044 -5.800 1.00 0.00 N ATOM 775 CA LEU A 412 3.984 3.339 -4.797 1.00 0.00 C ATOM 776 C LEU A 412 4.352 2.090 -4.003 1.00 0.00 C ATOM 777 O LEU A 412 5.418 2.027 -3.389 1.00 0.00 O ATOM 778 CB LEU A 412 3.483 4.428 -3.848 1.00 0.00 C ATOM 779 CG LEU A 412 4.559 5.383 -3.330 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.708 6.575 -4.264 1.00 0.00 C ATOM 781 CD2 LEU A 412 4.227 5.847 -1.920 1.00 0.00 C ATOM 0 H LEU A 412 2.023 2.979 -5.433 1.00 0.00 H new ATOM 0 HA LEU A 412 4.877 3.692 -5.313 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.718 5.011 -4.361 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.001 3.951 -2.994 1.00 0.00 H new ATOM 0 HG LEU A 412 5.509 4.849 -3.301 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.478 7.244 -3.880 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.993 6.226 -5.257 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.760 7.110 -4.325 1.00 0.00 H new ATOM 0 HD21 LEU A 412 5.004 6.526 -1.568 1.00 0.00 H new ATOM 0 HD22 LEU A 412 3.268 6.364 -1.924 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.171 4.984 -1.257 1.00 0.00 H new ATOM 793 N GLY A 413 3.466 1.098 -4.010 1.00 0.00 N ATOM 794 CA GLY A 413 3.725 -0.129 -3.277 1.00 0.00 C ATOM 795 C GLY A 413 3.320 -1.374 -4.044 1.00 0.00 C ATOM 796 O GLY A 413 2.135 -1.612 -4.271 1.00 0.00 O ATOM 0 H GLY A 413 2.576 1.121 -4.508 1.00 0.00 H new ATOM 0 HA2 GLY A 413 4.787 -0.186 -3.038 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.186 -0.101 -2.330 1.00 0.00 H new ATOM 800 N THR A 414 4.309 -2.170 -4.438 1.00 0.00 N ATOM 801 CA THR A 414 4.057 -3.398 -5.177 1.00 0.00 C ATOM 802 C THR A 414 4.631 -4.601 -4.432 1.00 0.00 C ATOM 803 O THR A 414 5.838 -4.682 -4.205 1.00 0.00 O ATOM 804 CB THR A 414 4.676 -3.298 -6.572 1.00 0.00 C ATOM 805 OG1 THR A 414 4.030 -2.296 -7.336 1.00 0.00 O ATOM 806 CG2 THR A 414 4.610 -4.591 -7.360 1.00 0.00 C ATOM 0 H THR A 414 5.295 -1.984 -4.256 1.00 0.00 H new ATOM 0 HA THR A 414 2.980 -3.535 -5.271 1.00 0.00 H new ATOM 0 HB THR A 414 5.724 -3.054 -6.401 1.00 0.00 H new ATOM 0 HG1 THR A 414 3.770 -2.665 -8.206 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.068 -4.445 -8.338 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.146 -5.373 -6.822 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.569 -4.887 -7.487 1.00 0.00 H new ATOM 814 N GLY A 415 3.761 -5.533 -4.052 1.00 0.00 N ATOM 815 CA GLY A 415 4.213 -6.712 -3.335 1.00 0.00 C ATOM 816 C GLY A 415 3.280 -7.897 -3.497 1.00 0.00 C ATOM 817 O GLY A 415 2.074 -7.728 -3.682 1.00 0.00 O ATOM 0 H GLY A 415 2.757 -5.493 -4.227 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.206 -6.987 -3.689 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.307 -6.473 -2.276 1.00 0.00 H new ATOM 821 N VAL A 416 3.842 -9.100 -3.426 1.00 0.00 N ATOM 822 CA VAL A 416 3.069 -10.324 -3.561 1.00 0.00 C ATOM 823 C VAL A 416 2.665 -10.864 -2.193 1.00 0.00 C ATOM 824 O VAL A 416 3.232 -10.478 -1.171 1.00 0.00 O ATOM 825 CB VAL A 416 3.875 -11.398 -4.311 1.00 0.00 C ATOM 826 CG1 VAL A 416 3.033 -12.642 -4.555 1.00 0.00 C ATOM 827 CG2 VAL A 416 4.414 -10.847 -5.622 1.00 0.00 C ATOM 0 H VAL A 416 4.839 -9.250 -3.274 1.00 0.00 H new ATOM 0 HA VAL A 416 2.171 -10.085 -4.131 1.00 0.00 H new ATOM 0 HB VAL A 416 4.721 -11.683 -3.685 1.00 0.00 H new ATOM 0 HG11 VAL A 416 3.627 -13.385 -5.087 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.707 -13.054 -3.600 1.00 0.00 H new ATOM 0 HG13 VAL A 416 2.161 -12.379 -5.153 1.00 0.00 H new ATOM 0 HG21 VAL A 416 4.981 -11.623 -6.137 1.00 0.00 H new ATOM 0 HG22 VAL A 416 3.583 -10.527 -6.251 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.064 -9.996 -5.419 1.00 0.00 H new ATOM 837 N GLY A 417 1.683 -11.758 -2.179 1.00 0.00 N ATOM 838 CA GLY A 417 1.223 -12.333 -0.929 1.00 0.00 C ATOM 839 C GLY A 417 0.313 -13.526 -1.138 1.00 0.00 C ATOM 840 O GLY A 417 -0.272 -13.691 -2.208 1.00 0.00 O ATOM 0 H GLY A 417 1.197 -12.095 -3.010 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.084 -12.637 -0.334 1.00 0.00 H new ATOM 0 HA3 GLY A 417 0.693 -11.572 -0.356 1.00 0.00 H new ATOM 844 N ARG A 418 0.190 -14.362 -0.111 1.00 0.00 N ATOM 845 CA ARG A 418 -0.658 -15.545 -0.184 1.00 0.00 C ATOM 846 C ARG A 418 -2.101 -15.160 -0.493 1.00 0.00 C ATOM 847 O ARG A 418 -2.837 -15.920 -1.123 1.00 0.00 O ATOM 848 CB ARG A 418 -0.596 -16.326 1.130 1.00 0.00 C ATOM 849 CG ARG A 418 0.809 -16.769 1.507 1.00 0.00 C ATOM 850 CD ARG A 418 1.309 -17.871 0.586 1.00 0.00 C ATOM 851 NE ARG A 418 2.558 -18.458 1.065 1.00 0.00 N ATOM 852 CZ ARG A 418 3.752 -17.887 0.913 1.00 0.00 C ATOM 853 NH1 ARG A 418 3.862 -16.717 0.296 1.00 0.00 N ATOM 854 NH2 ARG A 418 4.837 -18.489 1.380 1.00 0.00 N ATOM 0 H ARG A 418 0.668 -14.241 0.782 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.288 -16.178 -0.991 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -1.000 -15.707 1.931 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -1.237 -17.204 1.052 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.486 -15.916 1.458 1.00 0.00 H new ATOM 0 HG3 ARG A 418 0.816 -17.123 2.538 1.00 0.00 H new ATOM 0 HD2 ARG A 418 0.550 -18.649 0.506 1.00 0.00 H new ATOM 0 HD3 ARG A 418 1.459 -17.467 -0.415 1.00 0.00 H new ATOM 0 HE ARG A 418 2.513 -19.358 1.544 1.00 0.00 H new ATOM 0 HH11 ARG A 418 3.030 -16.250 -0.065 1.00 0.00 H new ATOM 0 HH12 ARG A 418 4.779 -16.284 0.183 1.00 0.00 H new ATOM 0 HH21 ARG A 418 4.757 -19.388 1.855 1.00 0.00 H new ATOM 0 HH22 ARG A 418 5.752 -18.053 1.264 1.00 0.00 H new ATOM 866 N ASN A 419 -2.499 -13.974 -0.045 1.00 0.00 N ATOM 867 CA ASN A 419 -3.854 -13.483 -0.272 1.00 0.00 C ATOM 868 C ASN A 419 -3.899 -11.961 -0.186 1.00 0.00 C ATOM 869 O ASN A 419 -2.869 -11.308 -0.018 1.00 0.00 O ATOM 870 CB ASN A 419 -4.820 -14.097 0.744 1.00 0.00 C ATOM 871 CG ASN A 419 -4.316 -13.974 2.167 1.00 0.00 C ATOM 872 OD1 ASN A 419 -4.147 -12.869 2.685 1.00 0.00 O ATOM 873 ND2 ASN A 419 -4.073 -15.110 2.810 1.00 0.00 N ATOM 0 H ASN A 419 -1.902 -13.334 0.478 1.00 0.00 H new ATOM 0 HA ASN A 419 -4.161 -13.781 -1.275 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -5.790 -13.607 0.661 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -4.973 -15.149 0.505 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -3.733 -15.089 3.771 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -4.227 -16.004 2.343 1.00 0.00 H new ATOM 880 N ILE A 420 -5.099 -11.401 -0.307 1.00 0.00 N ATOM 881 CA ILE A 420 -5.280 -9.954 -0.245 1.00 0.00 C ATOM 882 C ILE A 420 -4.693 -9.376 1.040 1.00 0.00 C ATOM 883 O ILE A 420 -4.182 -8.255 1.051 1.00 0.00 O ATOM 884 CB ILE A 420 -6.772 -9.574 -0.336 1.00 0.00 C ATOM 885 CG1 ILE A 420 -6.936 -8.051 -0.383 1.00 0.00 C ATOM 886 CG2 ILE A 420 -7.546 -10.163 0.835 1.00 0.00 C ATOM 887 CD1 ILE A 420 -7.719 -7.568 -1.584 1.00 0.00 C ATOM 0 H ILE A 420 -5.961 -11.927 -0.449 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.751 -9.531 -1.099 1.00 0.00 H new ATOM 0 HB ILE A 420 -7.179 -9.991 -1.258 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -7.437 -7.719 0.526 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -5.950 -7.587 -0.391 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -8.597 -9.884 0.754 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -7.457 -11.249 0.821 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -7.140 -9.778 1.770 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -7.797 -6.481 -1.554 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -7.207 -7.870 -2.498 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.718 -8.004 -1.567 1.00 0.00 H new ATOM 899 N LYS A 421 -4.771 -10.145 2.120 1.00 0.00 N ATOM 900 CA LYS A 421 -4.248 -9.706 3.408 1.00 0.00 C ATOM 901 C LYS A 421 -2.732 -9.569 3.365 1.00 0.00 C ATOM 902 O LYS A 421 -2.187 -8.485 3.577 1.00 0.00 O ATOM 903 CB LYS A 421 -4.650 -10.691 4.508 1.00 0.00 C ATOM 904 CG LYS A 421 -4.583 -10.100 5.907 1.00 0.00 C ATOM 905 CD LYS A 421 -3.193 -10.241 6.506 1.00 0.00 C ATOM 906 CE LYS A 421 -3.117 -11.415 7.467 1.00 0.00 C ATOM 907 NZ LYS A 421 -1.870 -11.388 8.281 1.00 0.00 N ATOM 0 H LYS A 421 -5.191 -11.075 2.129 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.676 -8.728 3.629 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -5.665 -11.040 4.318 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -3.998 -11.563 4.459 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -4.860 -9.046 5.871 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.309 -10.599 6.549 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -2.464 -10.376 5.707 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -2.927 -9.323 7.030 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -3.983 -11.399 8.129 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -3.163 -12.348 6.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -1.857 -12.206 8.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -1.043 -11.429 7.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -1.838 -10.510 8.837 1.00 0.00 H new ATOM 921 N ILE A 422 -2.058 -10.677 3.092 1.00 0.00 N ATOM 922 CA ILE A 422 -0.602 -10.692 3.021 1.00 0.00 C ATOM 923 C ILE A 422 -0.095 -9.739 1.943 1.00 0.00 C ATOM 924 O ILE A 422 0.722 -8.858 2.213 1.00 0.00 O ATOM 925 CB ILE A 422 -0.069 -12.116 2.745 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.272 -13.005 3.974 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.403 -12.082 2.354 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.690 -13.508 4.132 1.00 0.00 C ATOM 0 H ILE A 422 -2.497 -11.581 2.915 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.230 -10.360 3.990 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.632 -12.534 1.910 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.402 -13.859 3.909 1.00 0.00 H new ATOM 0 HG13 ILE A 422 0.007 -12.445 4.867 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.753 -13.097 2.165 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.526 -11.482 1.452 1.00 0.00 H new ATOM 0 HG23 ILE A 422 1.985 -11.642 3.164 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.758 -14.131 5.024 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -2.368 -12.660 4.229 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -1.967 -14.096 3.257 1.00 0.00 H new ATOM 940 N ALA A 423 -0.581 -9.926 0.726 1.00 0.00 N ATOM 941 CA ALA A 423 -0.176 -9.090 -0.398 1.00 0.00 C ATOM 942 C ALA A 423 -0.374 -7.612 -0.083 1.00 0.00 C ATOM 943 O ALA A 423 0.477 -6.780 -0.396 1.00 0.00 O ATOM 944 CB ALA A 423 -0.950 -9.472 -1.650 1.00 0.00 C ATOM 0 H ALA A 423 -1.258 -10.651 0.489 1.00 0.00 H new ATOM 0 HA ALA A 423 0.886 -9.258 -0.577 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.636 -8.839 -2.479 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.753 -10.516 -1.895 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -2.017 -9.336 -1.474 1.00 0.00 H new ATOM 950 N GLY A 424 -1.501 -7.296 0.542 1.00 0.00 N ATOM 951 CA GLY A 424 -1.792 -5.921 0.895 1.00 0.00 C ATOM 952 C GLY A 424 -0.775 -5.350 1.863 1.00 0.00 C ATOM 953 O GLY A 424 -0.380 -4.190 1.747 1.00 0.00 O ATOM 0 H GLY A 424 -2.219 -7.969 0.811 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.812 -5.312 -0.009 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.786 -5.864 1.340 1.00 0.00 H new ATOM 957 N ILE A 425 -0.347 -6.170 2.817 1.00 0.00 N ATOM 958 CA ILE A 425 0.634 -5.744 3.805 1.00 0.00 C ATOM 959 C ILE A 425 2.016 -5.620 3.174 1.00 0.00 C ATOM 960 O ILE A 425 2.804 -4.750 3.545 1.00 0.00 O ATOM 961 CB ILE A 425 0.700 -6.728 4.991 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.670 -6.844 5.661 1.00 0.00 C ATOM 963 CG2 ILE A 425 1.751 -6.285 6.000 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.831 -8.098 6.493 1.00 0.00 C ATOM 0 H ILE A 425 -0.665 -7.133 2.926 1.00 0.00 H new ATOM 0 HA ILE A 425 0.318 -4.769 4.176 1.00 0.00 H new ATOM 0 HB ILE A 425 0.985 -7.708 4.610 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -0.830 -5.973 6.296 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.444 -6.825 4.894 1.00 0.00 H new ATOM 0 HG21 ILE A 425 1.781 -6.993 6.828 1.00 0.00 H new ATOM 0 HG22 ILE A 425 2.727 -6.250 5.517 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.498 -5.295 6.378 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.826 -8.114 6.938 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.703 -8.975 5.858 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -0.080 -8.110 7.283 1.00 0.00 H new ATOM 976 N ARG A 426 2.303 -6.497 2.218 1.00 0.00 N ATOM 977 CA ARG A 426 3.589 -6.484 1.532 1.00 0.00 C ATOM 978 C ARG A 426 3.706 -5.261 0.633 1.00 0.00 C ATOM 979 O ARG A 426 4.756 -4.622 0.570 1.00 0.00 O ATOM 980 CB ARG A 426 3.767 -7.761 0.709 1.00 0.00 C ATOM 981 CG ARG A 426 5.208 -8.027 0.304 1.00 0.00 C ATOM 982 CD ARG A 426 6.063 -8.408 1.502 1.00 0.00 C ATOM 983 NE ARG A 426 7.481 -8.488 1.160 1.00 0.00 N ATOM 984 CZ ARG A 426 8.463 -8.447 2.058 1.00 0.00 C ATOM 985 NH1 ARG A 426 8.186 -8.328 3.351 1.00 0.00 N ATOM 986 NH2 ARG A 426 9.726 -8.526 1.661 1.00 0.00 N ATOM 0 H ARG A 426 1.663 -7.225 1.901 1.00 0.00 H new ATOM 0 HA ARG A 426 4.377 -6.438 2.284 1.00 0.00 H new ATOM 0 HB2 ARG A 426 3.398 -8.609 1.285 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.152 -7.694 -0.189 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.237 -8.828 -0.435 1.00 0.00 H new ATOM 0 HG3 ARG A 426 5.623 -7.139 -0.172 1.00 0.00 H new ATOM 0 HD2 ARG A 426 5.922 -7.674 2.296 1.00 0.00 H new ATOM 0 HD3 ARG A 426 5.730 -9.369 1.894 1.00 0.00 H new ATOM 0 HE ARG A 426 7.733 -8.581 0.176 1.00 0.00 H new ATOM 0 HH11 ARG A 426 7.216 -8.267 3.661 1.00 0.00 H new ATOM 0 HH12 ARG A 426 8.943 -8.297 4.034 1.00 0.00 H new ATOM 0 HH21 ARG A 426 9.944 -8.618 0.669 1.00 0.00 H new ATOM 0 HH22 ARG A 426 10.479 -8.495 2.348 1.00 0.00 H new ATOM 998 N ALA A 427 2.618 -4.937 -0.055 1.00 0.00 N ATOM 999 CA ALA A 427 2.597 -3.784 -0.946 1.00 0.00 C ATOM 1000 C ALA A 427 2.738 -2.492 -0.153 1.00 0.00 C ATOM 1001 O ALA A 427 3.532 -1.618 -0.504 1.00 0.00 O ATOM 1002 CB ALA A 427 1.315 -3.770 -1.766 1.00 0.00 C ATOM 0 H ALA A 427 1.740 -5.455 -0.013 1.00 0.00 H new ATOM 0 HA ALA A 427 3.443 -3.861 -1.629 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.315 -2.903 -2.426 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.255 -4.680 -2.363 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.456 -3.717 -1.097 1.00 0.00 H new ATOM 1008 N ALA A 428 1.972 -2.385 0.925 1.00 0.00 N ATOM 1009 CA ALA A 428 2.018 -1.206 1.780 1.00 0.00 C ATOM 1010 C ALA A 428 3.388 -1.077 2.428 1.00 0.00 C ATOM 1011 O ALA A 428 3.920 0.025 2.568 1.00 0.00 O ATOM 1012 CB ALA A 428 0.931 -1.278 2.843 1.00 0.00 C ATOM 0 H ALA A 428 1.311 -3.101 1.228 1.00 0.00 H new ATOM 0 HA ALA A 428 1.841 -0.324 1.165 1.00 0.00 H new ATOM 0 HB1 ALA A 428 0.979 -0.390 3.473 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -0.046 -1.329 2.362 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.080 -2.167 3.456 1.00 0.00 H new ATOM 1018 N GLU A 429 3.960 -2.214 2.808 1.00 0.00 N ATOM 1019 CA GLU A 429 5.277 -2.232 3.426 1.00 0.00 C ATOM 1020 C GLU A 429 6.323 -1.740 2.436 1.00 0.00 C ATOM 1021 O GLU A 429 7.289 -1.074 2.810 1.00 0.00 O ATOM 1022 CB GLU A 429 5.625 -3.642 3.904 1.00 0.00 C ATOM 1023 CG GLU A 429 5.175 -3.926 5.327 1.00 0.00 C ATOM 1024 CD GLU A 429 6.198 -4.719 6.115 1.00 0.00 C ATOM 1025 OE1 GLU A 429 6.514 -5.856 5.705 1.00 0.00 O ATOM 1026 OE2 GLU A 429 6.684 -4.203 7.144 1.00 0.00 O ATOM 0 H GLU A 429 3.532 -3.133 2.698 1.00 0.00 H new ATOM 0 HA GLU A 429 5.266 -1.568 4.290 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.165 -4.368 3.234 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.704 -3.784 3.837 1.00 0.00 H new ATOM 0 HG2 GLU A 429 4.980 -2.983 5.838 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.234 -4.476 5.304 1.00 0.00 H new ATOM 1033 N ASN A 430 6.110 -2.062 1.163 1.00 0.00 N ATOM 1034 CA ASN A 430 7.019 -1.642 0.108 1.00 0.00 C ATOM 1035 C ASN A 430 6.954 -0.129 -0.066 1.00 0.00 C ATOM 1036 O ASN A 430 7.949 0.515 -0.399 1.00 0.00 O ATOM 1037 CB ASN A 430 6.667 -2.344 -1.208 1.00 0.00 C ATOM 1038 CG ASN A 430 7.740 -3.322 -1.645 1.00 0.00 C ATOM 1039 OD1 ASN A 430 8.933 -3.025 -1.574 1.00 0.00 O ATOM 1040 ND2 ASN A 430 7.321 -4.497 -2.099 1.00 0.00 N ATOM 0 H ASN A 430 5.315 -2.613 0.840 1.00 0.00 H new ATOM 0 HA ASN A 430 8.035 -1.920 0.388 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.721 -2.874 -1.093 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.521 -1.597 -1.988 1.00 0.00 H new ATOM 0 HD21 ASN A 430 7.998 -5.196 -2.406 1.00 0.00 H new ATOM 0 HD22 ASN A 430 6.322 -4.701 -2.141 1.00 0.00 H new ATOM 1047 N ALA A 431 5.771 0.429 0.172 1.00 0.00 N ATOM 1048 CA ALA A 431 5.565 1.866 0.057 1.00 0.00 C ATOM 1049 C ALA A 431 6.031 2.580 1.321 1.00 0.00 C ATOM 1050 O ALA A 431 6.491 3.720 1.269 1.00 0.00 O ATOM 1051 CB ALA A 431 4.097 2.166 -0.213 1.00 0.00 C ATOM 0 H ALA A 431 4.940 -0.095 0.446 1.00 0.00 H new ATOM 0 HA ALA A 431 6.158 2.234 -0.780 1.00 0.00 H new ATOM 0 HB1 ALA A 431 3.955 3.243 -0.297 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.793 1.686 -1.143 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.490 1.783 0.608 1.00 0.00 H new ATOM 1057 N LEU A 432 5.910 1.897 2.457 1.00 0.00 N ATOM 1058 CA LEU A 432 6.323 2.461 3.737 1.00 0.00 C ATOM 1059 C LEU A 432 7.827 2.299 3.942 1.00 0.00 C ATOM 1060 O LEU A 432 8.449 3.073 4.671 1.00 0.00 O ATOM 1061 CB LEU A 432 5.566 1.788 4.884 1.00 0.00 C ATOM 1062 CG LEU A 432 4.043 1.941 4.835 1.00 0.00 C ATOM 1063 CD1 LEU A 432 3.364 0.673 5.329 1.00 0.00 C ATOM 1064 CD2 LEU A 432 3.601 3.140 5.661 1.00 0.00 C ATOM 0 H LEU A 432 5.529 0.953 2.516 1.00 0.00 H new ATOM 0 HA LEU A 432 6.086 3.525 3.730 1.00 0.00 H new ATOM 0 HB2 LEU A 432 5.809 0.725 4.885 1.00 0.00 H new ATOM 0 HB3 LEU A 432 5.927 2.198 5.827 1.00 0.00 H new ATOM 0 HG LEU A 432 3.747 2.109 3.800 1.00 0.00 H new ATOM 0 HD11 LEU A 432 2.282 0.800 5.287 1.00 0.00 H new ATOM 0 HD12 LEU A 432 3.656 -0.166 4.697 1.00 0.00 H new ATOM 0 HD13 LEU A 432 3.667 0.475 6.357 1.00 0.00 H new ATOM 0 HD21 LEU A 432 2.516 3.234 5.615 1.00 0.00 H new ATOM 0 HD22 LEU A 432 3.910 3.002 6.697 1.00 0.00 H new ATOM 0 HD23 LEU A 432 4.060 4.045 5.263 1.00 0.00 H new ATOM 1076 N ARG A 433 8.405 1.288 3.298 1.00 0.00 N ATOM 1077 CA ARG A 433 9.836 1.026 3.413 1.00 0.00 C ATOM 1078 C ARG A 433 10.653 2.245 2.996 1.00 0.00 C ATOM 1079 O ARG A 433 11.636 2.599 3.647 1.00 0.00 O ATOM 1080 CB ARG A 433 10.224 -0.182 2.557 1.00 0.00 C ATOM 1081 CG ARG A 433 10.441 -1.453 3.363 1.00 0.00 C ATOM 1082 CD ARG A 433 11.872 -1.953 3.248 1.00 0.00 C ATOM 1083 NE ARG A 433 12.152 -2.518 1.930 1.00 0.00 N ATOM 1084 CZ ARG A 433 13.377 -2.678 1.436 1.00 0.00 C ATOM 1085 NH1 ARG A 433 14.439 -2.319 2.146 1.00 0.00 N ATOM 1086 NH2 ARG A 433 13.541 -3.200 0.227 1.00 0.00 N ATOM 0 H ARG A 433 7.905 0.638 2.692 1.00 0.00 H new ATOM 0 HA ARG A 433 10.056 0.809 4.458 1.00 0.00 H new ATOM 0 HB2 ARG A 433 9.443 -0.359 1.818 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.136 0.050 2.007 1.00 0.00 H new ATOM 0 HG2 ARG A 433 10.204 -1.265 4.410 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.756 -2.226 3.015 1.00 0.00 H new ATOM 0 HD2 ARG A 433 12.560 -1.130 3.443 1.00 0.00 H new ATOM 0 HD3 ARG A 433 12.054 -2.709 4.012 1.00 0.00 H new ATOM 0 HE ARG A 433 11.361 -2.807 1.354 1.00 0.00 H new ATOM 0 HH11 ARG A 433 14.319 -1.918 3.076 1.00 0.00 H new ATOM 0 HH12 ARG A 433 15.375 -2.444 1.762 1.00 0.00 H new ATOM 0 HH21 ARG A 433 12.728 -3.478 -0.323 1.00 0.00 H new ATOM 0 HH22 ARG A 433 14.480 -3.323 -0.152 1.00 0.00 H new ATOM 1098 N ASP A 434 10.236 2.883 1.910 1.00 0.00 N ATOM 1099 CA ASP A 434 10.927 4.064 1.404 1.00 0.00 C ATOM 1100 C ASP A 434 10.796 5.227 2.383 1.00 0.00 C ATOM 1101 O ASP A 434 9.995 6.138 2.175 1.00 0.00 O ATOM 1102 CB ASP A 434 10.367 4.463 0.038 1.00 0.00 C ATOM 1103 CG ASP A 434 10.494 3.351 -0.985 1.00 0.00 C ATOM 1104 OD1 ASP A 434 9.638 2.442 -0.984 1.00 0.00 O ATOM 1105 OD2 ASP A 434 11.449 3.391 -1.789 1.00 0.00 O ATOM 0 H ASP A 434 9.423 2.603 1.362 1.00 0.00 H new ATOM 0 HA ASP A 434 11.984 3.820 1.295 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.317 4.737 0.144 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.892 5.347 -0.323 1.00 0.00 H new ATOM 1110 N LYS A 435 11.588 5.187 3.450 1.00 0.00 N ATOM 1111 CA LYS A 435 11.562 6.233 4.466 1.00 0.00 C ATOM 1112 C LYS A 435 11.737 7.614 3.840 1.00 0.00 C ATOM 1113 O LYS A 435 11.178 8.598 4.325 1.00 0.00 O ATOM 1114 CB LYS A 435 12.653 5.982 5.507 1.00 0.00 C ATOM 1115 CG LYS A 435 14.039 5.809 4.909 1.00 0.00 C ATOM 1116 CD LYS A 435 15.077 6.632 5.657 1.00 0.00 C ATOM 1117 CE LYS A 435 15.419 6.011 7.001 1.00 0.00 C ATOM 1118 NZ LYS A 435 14.647 6.631 8.113 1.00 0.00 N ATOM 0 H LYS A 435 12.257 4.439 3.633 1.00 0.00 H new ATOM 0 HA LYS A 435 10.589 6.206 4.956 1.00 0.00 H new ATOM 0 HB2 LYS A 435 12.671 6.815 6.209 1.00 0.00 H new ATOM 0 HB3 LYS A 435 12.399 5.089 6.078 1.00 0.00 H new ATOM 0 HG2 LYS A 435 14.319 4.756 4.937 1.00 0.00 H new ATOM 0 HG3 LYS A 435 14.024 6.107 3.861 1.00 0.00 H new ATOM 0 HD2 LYS A 435 15.981 6.715 5.053 1.00 0.00 H new ATOM 0 HD3 LYS A 435 14.700 7.644 5.808 1.00 0.00 H new ATOM 0 HE2 LYS A 435 15.213 4.941 6.969 1.00 0.00 H new ATOM 0 HE3 LYS A 435 16.486 6.125 7.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 15.069 6.357 9.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 14.671 7.666 8.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 13.661 6.303 8.076 1.00 0.00 H new ATOM 1132 N LYS A 436 12.502 7.680 2.755 1.00 0.00 N ATOM 1133 CA LYS A 436 12.730 8.945 2.063 1.00 0.00 C ATOM 1134 C LYS A 436 11.442 9.423 1.415 1.00 0.00 C ATOM 1135 O LYS A 436 10.926 10.493 1.737 1.00 0.00 O ATOM 1136 CB LYS A 436 13.818 8.792 1.001 1.00 0.00 C ATOM 1137 CG LYS A 436 15.226 8.756 1.569 1.00 0.00 C ATOM 1138 CD LYS A 436 15.433 7.542 2.458 1.00 0.00 C ATOM 1139 CE LYS A 436 16.891 7.117 2.494 1.00 0.00 C ATOM 1140 NZ LYS A 436 17.707 8.004 3.368 1.00 0.00 N ATOM 0 H LYS A 436 12.973 6.877 2.337 1.00 0.00 H new ATOM 0 HA LYS A 436 13.060 9.682 2.795 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.639 7.875 0.440 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.742 9.618 0.294 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.949 8.739 0.753 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.413 9.665 2.142 1.00 0.00 H new ATOM 0 HD2 LYS A 436 15.095 7.769 3.469 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.822 6.716 2.095 1.00 0.00 H new ATOM 0 HE2 LYS A 436 16.961 6.090 2.853 1.00 0.00 H new ATOM 0 HE3 LYS A 436 17.298 7.130 1.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 18.541 7.484 3.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 18.015 8.837 2.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 17.135 8.312 4.181 1.00 0.00 H new ATOM 1154 N MET A 437 10.923 8.610 0.505 1.00 0.00 N ATOM 1155 CA MET A 437 9.685 8.928 -0.190 1.00 0.00 C ATOM 1156 C MET A 437 8.555 9.149 0.811 1.00 0.00 C ATOM 1157 O MET A 437 7.600 9.875 0.536 1.00 0.00 O ATOM 1158 CB MET A 437 9.319 7.803 -1.161 1.00 0.00 C ATOM 1159 CG MET A 437 7.977 8.000 -1.851 1.00 0.00 C ATOM 1160 SD MET A 437 8.105 7.970 -3.650 1.00 0.00 S ATOM 1161 CE MET A 437 6.848 9.163 -4.100 1.00 0.00 C ATOM 0 H MET A 437 11.343 7.722 0.231 1.00 0.00 H new ATOM 0 HA MET A 437 9.831 9.847 -0.757 1.00 0.00 H new ATOM 0 HB2 MET A 437 10.098 7.722 -1.919 1.00 0.00 H new ATOM 0 HB3 MET A 437 9.303 6.858 -0.618 1.00 0.00 H new ATOM 0 HG2 MET A 437 7.289 7.219 -1.527 1.00 0.00 H new ATOM 0 HG3 MET A 437 7.549 8.952 -1.538 1.00 0.00 H new ATOM 0 HE1 MET A 437 6.694 9.140 -5.179 1.00 0.00 H new ATOM 0 HE2 MET A 437 5.914 8.916 -3.595 1.00 0.00 H new ATOM 0 HE3 MET A 437 7.169 10.161 -3.801 1.00 0.00 H new ATOM 1171 N LEU A 438 8.678 8.525 1.980 1.00 0.00 N ATOM 1172 CA LEU A 438 7.674 8.663 3.025 1.00 0.00 C ATOM 1173 C LEU A 438 7.811 10.015 3.712 1.00 0.00 C ATOM 1174 O LEU A 438 6.818 10.665 4.036 1.00 0.00 O ATOM 1175 CB LEU A 438 7.811 7.536 4.051 1.00 0.00 C ATOM 1176 CG LEU A 438 6.488 6.937 4.534 1.00 0.00 C ATOM 1177 CD1 LEU A 438 5.662 7.982 5.272 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.706 6.365 3.360 1.00 0.00 C ATOM 0 H LEU A 438 9.462 7.921 2.225 1.00 0.00 H new ATOM 0 HA LEU A 438 6.687 8.599 2.567 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.415 6.740 3.616 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.357 7.915 4.914 1.00 0.00 H new ATOM 0 HG LEU A 438 6.709 6.127 5.229 1.00 0.00 H new ATOM 0 HD11 LEU A 438 4.726 7.536 5.607 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.221 8.344 6.135 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.448 8.815 4.603 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.768 5.943 3.719 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.496 7.158 2.642 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.294 5.584 2.877 1.00 0.00 H new ATOM 1190 N ASP A 439 9.053 10.436 3.922 1.00 0.00 N ATOM 1191 CA ASP A 439 9.328 11.716 4.560 1.00 0.00 C ATOM 1192 C ASP A 439 8.768 12.859 3.722 1.00 0.00 C ATOM 1193 O ASP A 439 8.266 13.848 4.256 1.00 0.00 O ATOM 1194 CB ASP A 439 10.835 11.898 4.763 1.00 0.00 C ATOM 1195 CG ASP A 439 11.191 12.198 6.206 1.00 0.00 C ATOM 1196 OD1 ASP A 439 10.791 13.272 6.705 1.00 0.00 O ATOM 1197 OD2 ASP A 439 11.869 11.360 6.838 1.00 0.00 O ATOM 0 H ASP A 439 9.885 9.908 3.659 1.00 0.00 H new ATOM 0 HA ASP A 439 8.841 11.727 5.535 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.354 10.994 4.444 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.189 12.710 4.128 1.00 0.00 H new ATOM 1202 N PHE A 440 8.855 12.712 2.403 1.00 0.00 N ATOM 1203 CA PHE A 440 8.352 13.729 1.487 1.00 0.00 C ATOM 1204 C PHE A 440 6.845 13.895 1.641 1.00 0.00 C ATOM 1205 O PHE A 440 6.323 15.009 1.586 1.00 0.00 O ATOM 1206 CB PHE A 440 8.690 13.356 0.044 1.00 0.00 C ATOM 1207 CG PHE A 440 9.171 14.517 -0.779 1.00 0.00 C ATOM 1208 CD1 PHE A 440 8.269 15.324 -1.454 1.00 0.00 C ATOM 1209 CD2 PHE A 440 10.523 14.802 -0.878 1.00 0.00 C ATOM 1210 CE1 PHE A 440 8.707 16.393 -2.212 1.00 0.00 C ATOM 1211 CE2 PHE A 440 10.968 15.869 -1.635 1.00 0.00 C ATOM 1212 CZ PHE A 440 10.059 16.666 -2.303 1.00 0.00 C ATOM 0 H PHE A 440 9.269 11.899 1.946 1.00 0.00 H new ATOM 0 HA PHE A 440 8.833 14.676 1.732 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.457 12.581 0.048 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.806 12.928 -0.429 1.00 0.00 H new ATOM 0 HD1 PHE A 440 7.212 15.115 -1.387 1.00 0.00 H new ATOM 0 HD2 PHE A 440 11.238 14.183 -0.357 1.00 0.00 H new ATOM 0 HE1 PHE A 440 7.994 17.015 -2.733 1.00 0.00 H new ATOM 0 HE2 PHE A 440 12.025 16.079 -1.704 1.00 0.00 H new ATOM 0 HZ PHE A 440 10.404 17.501 -2.895 1.00 0.00 H new ATOM 1222 N TYR A 441 6.150 12.779 1.841 1.00 0.00 N ATOM 1223 CA TYR A 441 4.705 12.800 2.012 1.00 0.00 C ATOM 1224 C TYR A 441 4.354 13.150 3.446 1.00 0.00 C ATOM 1225 O TYR A 441 3.468 13.964 3.696 1.00 0.00 O ATOM 1226 CB TYR A 441 4.101 11.449 1.637 1.00 0.00 C ATOM 1227 CG TYR A 441 3.767 11.321 0.167 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.730 10.920 -0.751 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.490 11.599 -0.300 1.00 0.00 C ATOM 1230 CE1 TYR A 441 4.428 10.803 -2.094 1.00 0.00 C ATOM 1231 CE2 TYR A 441 2.179 11.483 -1.640 1.00 0.00 C ATOM 1232 CZ TYR A 441 3.152 11.084 -2.534 1.00 0.00 C ATOM 1233 OH TYR A 441 2.847 10.968 -3.870 1.00 0.00 O ATOM 0 H TYR A 441 6.567 11.849 1.888 1.00 0.00 H new ATOM 0 HA TYR A 441 4.289 13.560 1.351 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.800 10.659 1.912 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.195 11.291 2.222 1.00 0.00 H new ATOM 0 HD1 TYR A 441 5.730 10.696 -0.409 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.726 11.911 0.397 1.00 0.00 H new ATOM 0 HE1 TYR A 441 5.188 10.493 -2.796 1.00 0.00 H new ATOM 0 HE2 TYR A 441 1.180 11.703 -1.987 1.00 0.00 H new ATOM 0 HH TYR A 441 3.407 10.273 -4.274 1.00 0.00 H new ATOM 1243 N ALA A 442 5.063 12.545 4.387 1.00 0.00 N ATOM 1244 CA ALA A 442 4.829 12.815 5.796 1.00 0.00 C ATOM 1245 C ALA A 442 4.953 14.309 6.079 1.00 0.00 C ATOM 1246 O ALA A 442 4.283 14.843 6.963 1.00 0.00 O ATOM 1247 CB ALA A 442 5.798 12.022 6.660 1.00 0.00 C ATOM 0 H ALA A 442 5.802 11.867 4.201 1.00 0.00 H new ATOM 0 HA ALA A 442 3.815 12.501 6.045 1.00 0.00 H new ATOM 0 HB1 ALA A 442 5.608 12.237 7.711 1.00 0.00 H new ATOM 0 HB2 ALA A 442 5.660 10.956 6.477 1.00 0.00 H new ATOM 0 HB3 ALA A 442 6.821 12.304 6.412 1.00 0.00 H new ATOM 1253 N LYS A 443 5.805 14.981 5.308 1.00 0.00 N ATOM 1254 CA LYS A 443 6.002 16.418 5.461 1.00 0.00 C ATOM 1255 C LYS A 443 4.995 17.193 4.614 1.00 0.00 C ATOM 1256 O LYS A 443 4.998 18.423 4.596 1.00 0.00 O ATOM 1257 CB LYS A 443 7.429 16.806 5.068 1.00 0.00 C ATOM 1258 CG LYS A 443 8.396 16.839 6.240 1.00 0.00 C ATOM 1259 CD LYS A 443 8.187 18.073 7.103 1.00 0.00 C ATOM 1260 CE LYS A 443 7.510 17.727 8.420 1.00 0.00 C ATOM 1261 NZ LYS A 443 6.845 18.911 9.032 1.00 0.00 N ATOM 0 H LYS A 443 6.368 14.553 4.573 1.00 0.00 H new ATOM 0 HA LYS A 443 5.844 16.674 6.509 1.00 0.00 H new ATOM 0 HB2 LYS A 443 7.797 16.099 4.324 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.412 17.787 4.594 1.00 0.00 H new ATOM 0 HG2 LYS A 443 8.264 15.943 6.847 1.00 0.00 H new ATOM 0 HG3 LYS A 443 9.420 16.824 5.868 1.00 0.00 H new ATOM 0 HD2 LYS A 443 9.149 18.546 7.301 1.00 0.00 H new ATOM 0 HD3 LYS A 443 7.580 18.798 6.561 1.00 0.00 H new ATOM 0 HE2 LYS A 443 6.772 16.942 8.253 1.00 0.00 H new ATOM 0 HE3 LYS A 443 8.249 17.327 9.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 6.396 18.632 9.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 7.553 19.651 9.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 6.121 19.278 8.381 1.00 0.00 H new ATOM 1275 N GLN A 444 4.126 16.460 3.921 1.00 0.00 N ATOM 1276 CA GLN A 444 3.102 17.063 3.085 1.00 0.00 C ATOM 1277 C GLN A 444 1.726 16.780 3.669 1.00 0.00 C ATOM 1278 O GLN A 444 0.890 17.674 3.780 1.00 0.00 O ATOM 1279 CB GLN A 444 3.189 16.526 1.655 1.00 0.00 C ATOM 1280 CG GLN A 444 4.261 17.203 0.816 1.00 0.00 C ATOM 1281 CD GLN A 444 4.199 16.801 -0.644 1.00 0.00 C ATOM 1282 OE1 GLN A 444 4.291 17.644 -1.537 1.00 0.00 O ATOM 1283 NE2 GLN A 444 4.043 15.506 -0.895 1.00 0.00 N ATOM 0 H GLN A 444 4.115 15.440 3.926 1.00 0.00 H new ATOM 0 HA GLN A 444 3.264 18.141 3.057 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.388 15.455 1.689 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.223 16.655 1.168 1.00 0.00 H new ATOM 0 HG2 GLN A 444 4.151 18.284 0.896 1.00 0.00 H new ATOM 0 HG3 GLN A 444 5.243 16.952 1.217 1.00 0.00 H new ATOM 0 HE21 GLN A 444 3.971 14.842 -0.124 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.995 15.175 -1.859 1.00 0.00 H new ATOM 1292 N ARG A 445 1.505 15.528 4.052 1.00 0.00 N ATOM 1293 CA ARG A 445 0.234 15.124 4.642 1.00 0.00 C ATOM 1294 C ARG A 445 0.027 15.808 5.987 1.00 0.00 C ATOM 1295 O ARG A 445 -1.008 16.428 6.232 1.00 0.00 O ATOM 1296 CB ARG A 445 0.185 13.605 4.822 1.00 0.00 C ATOM 1297 CG ARG A 445 -1.206 13.072 5.127 1.00 0.00 C ATOM 1298 CD ARG A 445 -1.326 12.622 6.575 1.00 0.00 C ATOM 1299 NE ARG A 445 -2.675 12.164 6.897 1.00 0.00 N ATOM 1300 CZ ARG A 445 -3.147 12.062 8.137 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -2.384 12.382 9.174 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -4.387 11.636 8.341 1.00 0.00 N ATOM 0 H ARG A 445 2.188 14.776 3.965 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.565 15.427 3.965 1.00 0.00 H new ATOM 0 HB2 ARG A 445 0.557 13.128 3.915 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.859 13.322 5.631 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -1.946 13.846 4.923 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -1.429 12.235 4.465 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -0.615 11.817 6.764 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -1.056 13.447 7.234 1.00 0.00 H new ATOM 0 HE ARG A 445 -3.292 11.907 6.126 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -1.429 12.709 9.023 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -2.752 12.302 10.122 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -4.978 11.387 7.548 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -4.749 11.558 9.291 1.00 0.00 H new ATOM 1314 N ALA A 446 1.023 15.691 6.852 1.00 0.00 N ATOM 1315 CA ALA A 446 0.968 16.296 8.178 1.00 0.00 C ATOM 1316 C ALA A 446 1.138 17.809 8.100 1.00 0.00 C ATOM 1317 O ALA A 446 0.737 18.536 9.010 1.00 0.00 O ATOM 1318 CB ALA A 446 2.036 15.689 9.076 1.00 0.00 C ATOM 0 H ALA A 446 1.885 15.180 6.660 1.00 0.00 H new ATOM 0 HA ALA A 446 -0.014 16.090 8.605 1.00 0.00 H new ATOM 0 HB1 ALA A 446 1.985 16.148 10.063 1.00 0.00 H new ATOM 0 HB2 ALA A 446 1.869 14.616 9.166 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.020 15.868 8.643 1.00 0.00 H new