USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 721 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 365 SER OG : rot -64:sc= 0.477 USER MOD Single : A 368 MET CE :methyl -167:sc= 0 (180deg=-0.146) USER MOD Single : A 369 ASN : amide:sc= -0.133 K(o=-0.13,f=-0.94) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN : amide:sc= -0.0638 X(o=-0.064,f=-0.31) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 380 TYR OH : rot 180:sc= 0 USER MOD Single : A 382 SER OG : rot -150:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -6.18! C(o=-6.2!,f=-5.9!) USER MOD Single : A 387 TYR OH : rot 158:sc= -4.96! USER MOD Single : A 389 THR OG1 : rot 150:sc= -1.83! USER MOD Single : A 391 LYS NZ :NH3+ -169:sc= -0.143 (180deg=-0.465) USER MOD Single : A 392 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 394 THR OG1 : rot 105:sc= -2.03! USER MOD Single : A 399 ASN : amide:sc= -0.096 X(o=-0.096,f=0) USER MOD Single : A 400 SER OG : rot 2:sc= -0.468 USER MOD Single : A 404 CYS SG : rot -75:sc= -2.95 USER MOD Single : A 410 THR OG1 : rot 180:sc= -0.812 USER MOD Single : A 414 THR OG1 : rot -9:sc= 1.07 USER MOD Single : A 419 ASN : amide:sc= -1.32 K(o=-1.3,f=-6.5!) USER MOD Single : A 421 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.0111) USER MOD Single : A 430 ASN : amide:sc= -1.95! C(o=-1.9!,f=-6.1!) 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 -179:sc= 0 (180deg=-0.000876) USER MOD Single : A 441 TYR OH : rot 107:sc= -2.06! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.51 X(o=-0.51,f=-0.09) USER MOD Single : A 451 SER OG : rot -140:sc= 0 USER MOD Single : A 453 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 364 -3.787 -12.993 11.585 1.00 0.00 N ATOM 2 CA GLY A 364 -3.200 -11.734 12.123 1.00 0.00 C ATOM 3 C GLY A 364 -4.150 -10.558 12.018 1.00 0.00 C ATOM 4 O GLY A 364 -5.362 -10.716 12.155 1.00 0.00 O ATOM 0 HA2 GLY A 364 -2.925 -11.883 13.167 1.00 0.00 H new ATOM 0 HA3 GLY A 364 -2.282 -11.505 11.581 1.00 0.00 H new ATOM 10 N SER A 365 -3.597 -9.372 11.774 1.00 0.00 N ATOM 11 CA SER A 365 -4.403 -8.163 11.650 1.00 0.00 C ATOM 12 C SER A 365 -4.729 -7.870 10.189 1.00 0.00 C ATOM 13 O SER A 365 -4.123 -6.994 9.571 1.00 0.00 O ATOM 14 CB SER A 365 -3.669 -6.971 12.269 1.00 0.00 C ATOM 15 OG SER A 365 -4.291 -5.749 11.913 1.00 0.00 O ATOM 0 H SER A 365 -2.594 -9.224 11.659 1.00 0.00 H new ATOM 0 HA SER A 365 -5.339 -8.325 12.185 1.00 0.00 H new ATOM 0 HB2 SER A 365 -3.654 -7.073 13.354 1.00 0.00 H new ATOM 0 HB3 SER A 365 -2.631 -6.965 11.935 1.00 0.00 H new ATOM 0 HG SER A 365 -4.231 -5.622 10.943 1.00 0.00 H new ATOM 21 N LEU A 366 -5.690 -8.609 9.641 1.00 0.00 N ATOM 22 CA LEU A 366 -6.096 -8.427 8.252 1.00 0.00 C ATOM 23 C LEU A 366 -7.463 -7.753 8.167 1.00 0.00 C ATOM 24 O LEU A 366 -8.339 -7.996 8.998 1.00 0.00 O ATOM 25 CB LEU A 366 -6.139 -9.777 7.531 1.00 0.00 C ATOM 26 CG LEU A 366 -5.220 -9.893 6.314 1.00 0.00 C ATOM 27 CD1 LEU A 366 -5.572 -8.838 5.276 1.00 0.00 C ATOM 28 CD2 LEU A 366 -3.762 -9.764 6.732 1.00 0.00 C ATOM 0 H LEU A 366 -6.201 -9.339 10.138 1.00 0.00 H new ATOM 0 HA LEU A 366 -5.361 -7.784 7.767 1.00 0.00 H new ATOM 0 HB2 LEU A 366 -5.875 -10.560 8.242 1.00 0.00 H new ATOM 0 HB3 LEU A 366 -7.164 -9.969 7.212 1.00 0.00 H new ATOM 0 HG LEU A 366 -5.365 -10.877 5.867 1.00 0.00 H new ATOM 0 HD11 LEU A 366 -4.908 -8.936 4.418 1.00 0.00 H new ATOM 0 HD12 LEU A 366 -6.604 -8.975 4.954 1.00 0.00 H new ATOM 0 HD13 LEU A 366 -5.457 -7.846 5.712 1.00 0.00 H new ATOM 0 HD21 LEU A 366 -3.123 -9.849 5.853 1.00 0.00 H new ATOM 0 HD22 LEU A 366 -3.603 -8.794 7.204 1.00 0.00 H new ATOM 0 HD23 LEU A 366 -3.515 -10.556 7.439 1.00 0.00 H new ATOM 40 N ASP A 367 -7.639 -6.907 7.156 1.00 0.00 N ATOM 41 CA ASP A 367 -8.900 -6.197 6.961 1.00 0.00 C ATOM 42 C ASP A 367 -9.649 -6.743 5.748 1.00 0.00 C ATOM 43 O ASP A 367 -9.271 -7.772 5.188 1.00 0.00 O ATOM 44 CB ASP A 367 -8.642 -4.700 6.787 1.00 0.00 C ATOM 45 CG ASP A 367 -8.512 -3.977 8.114 1.00 0.00 C ATOM 46 OD1 ASP A 367 -7.616 -4.344 8.903 1.00 0.00 O ATOM 47 OD2 ASP A 367 -9.307 -3.047 8.364 1.00 0.00 O ATOM 0 H ASP A 367 -6.925 -6.696 6.459 1.00 0.00 H new ATOM 0 HA ASP A 367 -9.518 -6.351 7.845 1.00 0.00 H new ATOM 0 HB2 ASP A 367 -7.730 -4.556 6.207 1.00 0.00 H new ATOM 0 HB3 ASP A 367 -9.457 -4.258 6.214 1.00 0.00 H new ATOM 52 N MET A 368 -10.715 -6.054 5.348 1.00 0.00 N ATOM 53 CA MET A 368 -11.511 -6.486 4.204 1.00 0.00 C ATOM 54 C MET A 368 -11.153 -5.700 2.947 1.00 0.00 C ATOM 55 O MET A 368 -10.945 -6.281 1.883 1.00 0.00 O ATOM 56 CB MET A 368 -13.002 -6.329 4.508 1.00 0.00 C ATOM 57 CG MET A 368 -13.624 -7.564 5.138 1.00 0.00 C ATOM 58 SD MET A 368 -15.294 -7.269 5.748 1.00 0.00 S ATOM 59 CE MET A 368 -14.953 -6.334 7.237 1.00 0.00 C ATOM 0 H MET A 368 -11.045 -5.200 5.796 1.00 0.00 H new ATOM 0 HA MET A 368 -11.287 -7.537 4.022 1.00 0.00 H new ATOM 0 HB2 MET A 368 -13.141 -5.480 5.177 1.00 0.00 H new ATOM 0 HB3 MET A 368 -13.531 -6.096 3.584 1.00 0.00 H new ATOM 0 HG2 MET A 368 -13.647 -8.369 4.403 1.00 0.00 H new ATOM 0 HG3 MET A 368 -12.995 -7.902 5.962 1.00 0.00 H new ATOM 0 HE1 MET A 368 -15.856 -6.275 7.844 1.00 0.00 H new ATOM 0 HE2 MET A 368 -14.165 -6.829 7.805 1.00 0.00 H new ATOM 0 HE3 MET A 368 -14.630 -5.328 6.969 1.00 0.00 H new ATOM 69 N ASN A 369 -11.086 -4.381 3.072 1.00 0.00 N ATOM 70 CA ASN A 369 -10.755 -3.530 1.934 1.00 0.00 C ATOM 71 C ASN A 369 -9.584 -2.606 2.253 1.00 0.00 C ATOM 72 O ASN A 369 -9.770 -1.421 2.527 1.00 0.00 O ATOM 73 CB ASN A 369 -11.976 -2.704 1.536 1.00 0.00 C ATOM 74 CG ASN A 369 -12.846 -3.412 0.514 1.00 0.00 C ATOM 75 OD1 ASN A 369 -12.730 -4.621 0.316 1.00 0.00 O ATOM 76 ND2 ASN A 369 -13.725 -2.660 -0.138 1.00 0.00 N ATOM 0 H ASN A 369 -11.255 -3.879 3.943 1.00 0.00 H new ATOM 0 HA ASN A 369 -10.460 -4.172 1.104 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -12.569 -2.486 2.424 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -11.647 -1.748 1.129 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -14.339 -3.081 -0.835 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -13.787 -1.661 0.059 1.00 0.00 H new ATOM 83 N ALA A 370 -8.380 -3.157 2.198 1.00 0.00 N ATOM 84 CA ALA A 370 -7.168 -2.387 2.463 1.00 0.00 C ATOM 85 C ALA A 370 -6.718 -1.623 1.227 1.00 0.00 C ATOM 86 O ALA A 370 -6.607 -0.401 1.246 1.00 0.00 O ATOM 87 CB ALA A 370 -6.052 -3.289 2.954 1.00 0.00 C ATOM 0 H ALA A 370 -8.214 -4.138 1.972 1.00 0.00 H new ATOM 0 HA ALA A 370 -7.403 -1.664 3.244 1.00 0.00 H new ATOM 0 HB1 ALA A 370 -5.160 -2.693 3.145 1.00 0.00 H new ATOM 0 HB2 ALA A 370 -6.362 -3.783 3.875 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -5.831 -4.040 2.196 1.00 0.00 H new ATOM 93 N LYS A 371 -6.461 -2.355 0.149 1.00 0.00 N ATOM 94 CA LYS A 371 -6.027 -1.745 -1.104 1.00 0.00 C ATOM 95 C LYS A 371 -7.071 -0.747 -1.583 1.00 0.00 C ATOM 96 O LYS A 371 -6.765 0.207 -2.290 1.00 0.00 O ATOM 97 CB LYS A 371 -5.802 -2.820 -2.170 1.00 0.00 C ATOM 98 CG LYS A 371 -7.087 -3.454 -2.675 1.00 0.00 C ATOM 99 CD LYS A 371 -7.459 -4.684 -1.864 1.00 0.00 C ATOM 100 CE LYS A 371 -8.618 -5.437 -2.496 1.00 0.00 C ATOM 101 NZ LYS A 371 -9.884 -4.656 -2.438 1.00 0.00 N ATOM 0 H LYS A 371 -6.545 -3.371 0.117 1.00 0.00 H new ATOM 0 HA LYS A 371 -5.086 -1.223 -0.932 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -5.269 -2.379 -3.012 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.160 -3.599 -1.759 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -7.897 -2.726 -2.625 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -6.970 -3.730 -3.723 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.595 -5.344 -1.784 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -7.727 -4.386 -0.850 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -8.379 -5.665 -3.535 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -8.755 -6.389 -1.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -10.650 -5.204 -2.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -10.126 -4.460 -1.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -9.762 -3.758 -2.949 1.00 0.00 H new ATOM 115 N ARG A 372 -8.299 -0.976 -1.151 1.00 0.00 N ATOM 116 CA ARG A 372 -9.403 -0.096 -1.497 1.00 0.00 C ATOM 117 C ARG A 372 -9.385 1.130 -0.606 1.00 0.00 C ATOM 118 O ARG A 372 -9.332 2.263 -1.085 1.00 0.00 O ATOM 119 CB ARG A 372 -10.750 -0.804 -1.365 1.00 0.00 C ATOM 120 CG ARG A 372 -11.935 0.154 -1.365 1.00 0.00 C ATOM 121 CD ARG A 372 -12.695 0.094 -2.677 1.00 0.00 C ATOM 122 NE ARG A 372 -13.622 1.212 -2.824 1.00 0.00 N ATOM 123 CZ ARG A 372 -14.718 1.166 -3.573 1.00 0.00 C ATOM 124 NH1 ARG A 372 -15.024 0.060 -4.238 1.00 0.00 N ATOM 125 NH2 ARG A 372 -15.510 2.226 -3.658 1.00 0.00 N ATOM 0 H ARG A 372 -8.558 -1.765 -0.559 1.00 0.00 H new ATOM 0 HA ARG A 372 -9.277 0.201 -2.538 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -10.863 -1.511 -2.186 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -10.760 -1.383 -0.442 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -12.606 -0.094 -0.542 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -11.583 1.171 -1.193 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -11.988 0.098 -3.506 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -13.247 -0.844 -2.734 1.00 0.00 H new ATOM 0 HE ARG A 372 -13.417 2.077 -2.324 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -14.417 -0.757 -4.175 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -15.866 0.027 -4.813 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -15.278 3.078 -3.148 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -16.351 2.189 -4.234 1.00 0.00 H new ATOM 139 N GLN A 373 -9.433 0.893 0.695 1.00 0.00 N ATOM 140 CA GLN A 373 -9.426 1.978 1.659 1.00 0.00 C ATOM 141 C GLN A 373 -8.181 2.832 1.477 1.00 0.00 C ATOM 142 O GLN A 373 -8.260 4.048 1.346 1.00 0.00 O ATOM 143 CB GLN A 373 -9.496 1.406 3.069 1.00 0.00 C ATOM 144 CG GLN A 373 -9.676 2.460 4.138 1.00 0.00 C ATOM 145 CD GLN A 373 -11.049 2.418 4.779 1.00 0.00 C ATOM 146 OE1 GLN A 373 -11.557 1.349 5.114 1.00 0.00 O ATOM 147 NE2 GLN A 373 -11.656 3.586 4.953 1.00 0.00 N ATOM 0 H GLN A 373 -9.477 -0.040 1.106 1.00 0.00 H new ATOM 0 HA GLN A 373 -10.296 2.614 1.498 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -10.323 0.698 3.125 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -8.583 0.846 3.272 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -8.916 2.324 4.908 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -9.514 3.445 3.701 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -11.197 4.448 4.660 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -12.582 3.621 5.380 1.00 0.00 H new ATOM 156 N LEU A 374 -7.043 2.171 1.422 1.00 0.00 N ATOM 157 CA LEU A 374 -5.786 2.850 1.209 1.00 0.00 C ATOM 158 C LEU A 374 -5.892 3.723 -0.037 1.00 0.00 C ATOM 159 O LEU A 374 -5.757 4.945 0.032 1.00 0.00 O ATOM 160 CB LEU A 374 -4.658 1.833 1.058 1.00 0.00 C ATOM 161 CG LEU A 374 -3.266 2.426 0.869 1.00 0.00 C ATOM 162 CD1 LEU A 374 -3.011 2.720 -0.597 1.00 0.00 C ATOM 163 CD2 LEU A 374 -3.102 3.685 1.707 1.00 0.00 C ATOM 0 H LEU A 374 -6.965 1.159 1.523 1.00 0.00 H new ATOM 0 HA LEU A 374 -5.561 3.481 2.069 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -4.646 1.195 1.942 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -4.881 1.192 0.205 1.00 0.00 H new ATOM 0 HG LEU A 374 -2.530 1.696 1.206 1.00 0.00 H new ATOM 0 HD11 LEU A 374 -2.013 3.143 -0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 374 -3.084 1.796 -1.171 1.00 0.00 H new ATOM 0 HD13 LEU A 374 -3.752 3.432 -0.960 1.00 0.00 H new ATOM 0 HD21 LEU A 374 -2.102 4.093 1.559 1.00 0.00 H new ATOM 0 HD22 LEU A 374 -3.844 4.423 1.404 1.00 0.00 H new ATOM 0 HD23 LEU A 374 -3.242 3.442 2.760 1.00 0.00 H new ATOM 175 N TYR A 375 -6.129 3.079 -1.175 1.00 0.00 N ATOM 176 CA TYR A 375 -6.246 3.795 -2.446 1.00 0.00 C ATOM 177 C TYR A 375 -7.103 5.036 -2.271 1.00 0.00 C ATOM 178 O TYR A 375 -6.873 6.070 -2.898 1.00 0.00 O ATOM 179 CB TYR A 375 -6.849 2.908 -3.528 1.00 0.00 C ATOM 180 CG TYR A 375 -6.381 3.249 -4.928 1.00 0.00 C ATOM 181 CD1 TYR A 375 -5.085 3.702 -5.167 1.00 0.00 C ATOM 182 CD2 TYR A 375 -7.238 3.116 -6.015 1.00 0.00 C ATOM 183 CE1 TYR A 375 -4.665 4.012 -6.446 1.00 0.00 C ATOM 184 CE2 TYR A 375 -6.822 3.425 -7.295 1.00 0.00 C ATOM 185 CZ TYR A 375 -5.535 3.872 -7.505 1.00 0.00 C ATOM 186 OH TYR A 375 -5.117 4.181 -8.780 1.00 0.00 O ATOM 0 H TYR A 375 -6.244 2.068 -1.246 1.00 0.00 H new ATOM 0 HA TYR A 375 -5.243 4.085 -2.758 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -6.599 1.869 -3.314 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -7.935 2.989 -3.488 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.399 3.812 -4.340 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -8.247 2.765 -5.855 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -3.658 4.363 -6.615 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -7.502 3.317 -8.127 1.00 0.00 H new ATOM 0 HH TYR A 375 -5.851 4.026 -9.411 1.00 0.00 H new ATOM 196 N SER A 376 -8.077 4.920 -1.390 1.00 0.00 N ATOM 197 CA SER A 376 -8.966 6.029 -1.088 1.00 0.00 C ATOM 198 C SER A 376 -8.220 7.042 -0.225 1.00 0.00 C ATOM 199 O SER A 376 -8.274 8.250 -0.456 1.00 0.00 O ATOM 200 CB SER A 376 -10.219 5.521 -0.364 1.00 0.00 C ATOM 201 OG SER A 376 -10.810 6.547 0.415 1.00 0.00 O ATOM 0 H SER A 376 -8.275 4.066 -0.868 1.00 0.00 H new ATOM 0 HA SER A 376 -9.283 6.509 -2.014 1.00 0.00 H new ATOM 0 HB2 SER A 376 -10.940 5.153 -1.094 1.00 0.00 H new ATOM 0 HB3 SER A 376 -9.956 4.679 0.277 1.00 0.00 H new ATOM 0 HG SER A 376 -11.608 6.198 0.865 1.00 0.00 H new ATOM 207 N LEU A 377 -7.531 6.515 0.778 1.00 0.00 N ATOM 208 CA LEU A 377 -6.762 7.318 1.714 1.00 0.00 C ATOM 209 C LEU A 377 -5.576 8.003 1.032 1.00 0.00 C ATOM 210 O LEU A 377 -5.528 9.230 0.942 1.00 0.00 O ATOM 211 CB LEU A 377 -6.282 6.426 2.860 1.00 0.00 C ATOM 212 CG LEU A 377 -7.244 6.348 4.047 1.00 0.00 C ATOM 213 CD1 LEU A 377 -8.603 5.854 3.587 1.00 0.00 C ATOM 214 CD2 LEU A 377 -6.692 5.436 5.129 1.00 0.00 C ATOM 0 H LEU A 377 -7.491 5.513 0.965 1.00 0.00 H new ATOM 0 HA LEU A 377 -7.404 8.107 2.105 1.00 0.00 H new ATOM 0 HB2 LEU A 377 -6.116 5.420 2.476 1.00 0.00 H new ATOM 0 HB3 LEU A 377 -5.319 6.795 3.212 1.00 0.00 H new ATOM 0 HG LEU A 377 -7.354 7.348 4.466 1.00 0.00 H new ATOM 0 HD11 LEU A 377 -9.279 5.802 4.440 1.00 0.00 H new ATOM 0 HD12 LEU A 377 -9.008 6.541 2.844 1.00 0.00 H new ATOM 0 HD13 LEU A 377 -8.500 4.863 3.146 1.00 0.00 H new ATOM 0 HD21 LEU A 377 -7.393 5.396 5.963 1.00 0.00 H new ATOM 0 HD22 LEU A 377 -6.552 4.434 4.724 1.00 0.00 H new ATOM 0 HD23 LEU A 377 -5.735 5.823 5.478 1.00 0.00 H new ATOM 226 N ILE A 378 -4.618 7.211 0.563 1.00 0.00 N ATOM 227 CA ILE A 378 -3.432 7.754 -0.099 1.00 0.00 C ATOM 228 C ILE A 378 -3.546 7.645 -1.618 1.00 0.00 C ATOM 229 O ILE A 378 -3.216 8.588 -2.337 1.00 0.00 O ATOM 230 CB ILE A 378 -2.182 6.997 0.385 1.00 0.00 C ATOM 231 CG1 ILE A 378 -1.975 7.222 1.882 1.00 0.00 C ATOM 232 CG2 ILE A 378 -0.960 7.421 -0.394 1.00 0.00 C ATOM 233 CD1 ILE A 378 -0.926 6.317 2.490 1.00 0.00 C ATOM 0 H ILE A 378 -4.637 6.193 0.627 1.00 0.00 H new ATOM 0 HA ILE A 378 -3.349 8.810 0.158 1.00 0.00 H new ATOM 0 HB ILE A 378 -2.336 5.932 0.212 1.00 0.00 H new ATOM 0 HG12 ILE A 378 -1.688 8.260 2.049 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -2.922 7.066 2.399 1.00 0.00 H new ATOM 0 HG21 ILE A 378 -0.090 6.872 -0.033 1.00 0.00 H new ATOM 0 HG22 ILE A 378 -1.111 7.207 -1.452 1.00 0.00 H new ATOM 0 HG23 ILE A 378 -0.796 8.490 -0.260 1.00 0.00 H new ATOM 0 HD11 ILE A 378 -0.832 6.532 3.554 1.00 0.00 H new ATOM 0 HD12 ILE A 378 -1.221 5.276 2.355 1.00 0.00 H new ATOM 0 HD13 ILE A 378 0.032 6.489 1.999 1.00 0.00 H new ATOM 245 N GLY A 379 -3.999 6.486 -2.092 1.00 0.00 N ATOM 246 CA GLY A 379 -4.142 6.251 -3.523 1.00 0.00 C ATOM 247 C GLY A 379 -4.322 7.523 -4.331 1.00 0.00 C ATOM 248 O GLY A 379 -5.326 8.221 -4.190 1.00 0.00 O ATOM 0 H GLY A 379 -4.272 5.698 -1.505 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -3.261 5.721 -3.886 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -4.999 5.598 -3.692 1.00 0.00 H new ATOM 252 N TYR A 380 -3.346 7.819 -5.183 1.00 0.00 N ATOM 253 CA TYR A 380 -3.394 9.007 -6.027 1.00 0.00 C ATOM 254 C TYR A 380 -2.681 8.753 -7.350 1.00 0.00 C ATOM 255 O TYR A 380 -1.651 8.079 -7.391 1.00 0.00 O ATOM 256 CB TYR A 380 -2.754 10.197 -5.311 1.00 0.00 C ATOM 257 CG TYR A 380 -3.711 10.955 -4.419 1.00 0.00 C ATOM 258 CD1 TYR A 380 -4.852 11.550 -4.940 1.00 0.00 C ATOM 259 CD2 TYR A 380 -3.469 11.076 -3.057 1.00 0.00 C ATOM 260 CE1 TYR A 380 -5.728 12.246 -4.127 1.00 0.00 C ATOM 261 CE2 TYR A 380 -4.339 11.770 -2.237 1.00 0.00 C ATOM 262 CZ TYR A 380 -5.466 12.352 -2.778 1.00 0.00 C ATOM 263 OH TYR A 380 -6.335 13.043 -1.965 1.00 0.00 O ATOM 0 H TYR A 380 -2.509 7.250 -5.307 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.440 9.238 -6.231 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -1.916 9.841 -4.711 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.346 10.881 -6.055 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -5.059 11.468 -5.997 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -2.587 10.621 -2.632 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -6.612 12.704 -4.547 1.00 0.00 H new ATOM 0 HE2 TYR A 380 -4.137 11.856 -1.179 1.00 0.00 H new ATOM 0 HH TYR A 380 -6.006 13.023 -1.042 1.00 0.00 H new ATOM 273 N ALA A 381 -3.234 9.292 -8.430 1.00 0.00 N ATOM 274 CA ALA A 381 -2.649 9.119 -9.753 1.00 0.00 C ATOM 275 C ALA A 381 -1.215 9.638 -9.793 1.00 0.00 C ATOM 276 O ALA A 381 -0.417 9.223 -10.632 1.00 0.00 O ATOM 277 CB ALA A 381 -3.490 9.813 -10.814 1.00 0.00 C ATOM 0 H ALA A 381 -4.086 9.852 -8.415 1.00 0.00 H new ATOM 0 HA ALA A 381 -2.632 8.051 -9.968 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -3.032 9.669 -11.793 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -4.494 9.389 -10.817 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -3.547 10.879 -10.593 1.00 0.00 H new ATOM 283 N SER A 382 -0.895 10.551 -8.881 1.00 0.00 N ATOM 284 CA SER A 382 0.442 11.128 -8.815 1.00 0.00 C ATOM 285 C SER A 382 1.348 10.319 -7.891 1.00 0.00 C ATOM 286 O SER A 382 2.570 10.329 -8.043 1.00 0.00 O ATOM 287 CB SER A 382 0.370 12.579 -8.336 1.00 0.00 C ATOM 288 OG SER A 382 -0.630 13.299 -9.034 1.00 0.00 O ATOM 0 H SER A 382 -1.543 10.907 -8.178 1.00 0.00 H new ATOM 0 HA SER A 382 0.868 11.102 -9.818 1.00 0.00 H new ATOM 0 HB2 SER A 382 0.159 12.602 -7.267 1.00 0.00 H new ATOM 0 HB3 SER A 382 1.337 13.061 -8.481 1.00 0.00 H new ATOM 0 HG SER A 382 -0.373 14.243 -9.092 1.00 0.00 H new ATOM 294 N LEU A 383 0.745 9.625 -6.930 1.00 0.00 N ATOM 295 CA LEU A 383 1.506 8.819 -5.981 1.00 0.00 C ATOM 296 C LEU A 383 1.821 7.443 -6.557 1.00 0.00 C ATOM 297 O LEU A 383 2.653 6.713 -6.020 1.00 0.00 O ATOM 298 CB LEU A 383 0.722 8.663 -4.679 1.00 0.00 C ATOM 299 CG LEU A 383 1.448 9.139 -3.422 1.00 0.00 C ATOM 300 CD1 LEU A 383 0.894 8.441 -2.194 1.00 0.00 C ATOM 301 CD2 LEU A 383 2.944 8.895 -3.545 1.00 0.00 C ATOM 0 H LEU A 383 -0.265 9.604 -6.788 1.00 0.00 H new ATOM 0 HA LEU A 383 2.446 9.333 -5.781 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -0.214 9.214 -4.769 1.00 0.00 H new ATOM 0 HB3 LEU A 383 0.463 7.612 -4.553 1.00 0.00 H new ATOM 0 HG LEU A 383 1.283 10.211 -3.313 1.00 0.00 H new ATOM 0 HD11 LEU A 383 1.422 8.791 -1.307 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.168 8.665 -2.096 1.00 0.00 H new ATOM 0 HD13 LEU A 383 1.030 7.364 -2.295 1.00 0.00 H new ATOM 0 HD21 LEU A 383 3.445 9.240 -2.640 1.00 0.00 H new ATOM 0 HD22 LEU A 383 3.129 7.829 -3.678 1.00 0.00 H new ATOM 0 HD23 LEU A 383 3.332 9.441 -4.405 1.00 0.00 H new ATOM 313 N ARG A 384 1.153 7.104 -7.652 1.00 0.00 N ATOM 314 CA ARG A 384 1.354 5.821 -8.316 1.00 0.00 C ATOM 315 C ARG A 384 1.740 4.723 -7.328 1.00 0.00 C ATOM 316 O ARG A 384 2.665 3.950 -7.581 1.00 0.00 O ATOM 317 CB ARG A 384 2.430 5.948 -9.395 1.00 0.00 C ATOM 318 CG ARG A 384 1.976 5.478 -10.768 1.00 0.00 C ATOM 319 CD ARG A 384 1.551 4.018 -10.743 1.00 0.00 C ATOM 320 NE ARG A 384 0.710 3.676 -11.886 1.00 0.00 N ATOM 321 CZ ARG A 384 1.167 3.563 -13.130 1.00 0.00 C ATOM 322 NH1 ARG A 384 2.453 3.766 -13.386 1.00 0.00 N ATOM 323 NH2 ARG A 384 0.340 3.247 -14.117 1.00 0.00 N ATOM 0 H ARG A 384 0.462 7.704 -8.102 1.00 0.00 H new ATOM 0 HA ARG A 384 0.406 5.539 -8.775 1.00 0.00 H new ATOM 0 HB2 ARG A 384 2.743 6.990 -9.462 1.00 0.00 H new ATOM 0 HB3 ARG A 384 3.304 5.371 -9.094 1.00 0.00 H new ATOM 0 HG2 ARG A 384 1.144 6.095 -11.109 1.00 0.00 H new ATOM 0 HG3 ARG A 384 2.786 5.610 -11.486 1.00 0.00 H new ATOM 0 HD2 ARG A 384 2.436 3.382 -10.741 1.00 0.00 H new ATOM 0 HD3 ARG A 384 1.009 3.813 -9.820 1.00 0.00 H new ATOM 0 HE ARG A 384 -0.284 3.515 -11.722 1.00 0.00 H new ATOM 0 HH11 ARG A 384 3.092 4.009 -12.629 1.00 0.00 H new ATOM 0 HH12 ARG A 384 2.803 3.679 -14.340 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -0.649 3.090 -13.923 1.00 0.00 H new ATOM 0 HH22 ARG A 384 0.693 3.161 -15.070 1.00 0.00 H new ATOM 337 N LEU A 385 1.023 4.642 -6.209 1.00 0.00 N ATOM 338 CA LEU A 385 1.296 3.620 -5.209 1.00 0.00 C ATOM 339 C LEU A 385 1.040 2.240 -5.808 1.00 0.00 C ATOM 340 O LEU A 385 0.187 2.087 -6.683 1.00 0.00 O ATOM 341 CB LEU A 385 0.426 3.854 -3.965 1.00 0.00 C ATOM 342 CG LEU A 385 -1.040 4.181 -4.248 1.00 0.00 C ATOM 343 CD1 LEU A 385 -1.616 3.230 -5.284 1.00 0.00 C ATOM 344 CD2 LEU A 385 -1.846 4.125 -2.964 1.00 0.00 C ATOM 0 H LEU A 385 0.253 5.269 -5.976 1.00 0.00 H new ATOM 0 HA LEU A 385 2.341 3.677 -4.903 1.00 0.00 H new ATOM 0 HB2 LEU A 385 0.468 2.963 -3.339 1.00 0.00 H new ATOM 0 HB3 LEU A 385 0.859 4.671 -3.387 1.00 0.00 H new ATOM 0 HG LEU A 385 -1.096 5.192 -4.651 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -2.660 3.482 -5.469 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.052 3.318 -6.212 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.550 2.207 -4.915 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -2.889 4.360 -3.178 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -1.780 3.125 -2.536 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -1.449 4.850 -2.254 1.00 0.00 H new ATOM 356 N HIS A 386 1.787 1.238 -5.359 1.00 0.00 N ATOM 357 CA HIS A 386 1.628 -0.113 -5.884 1.00 0.00 C ATOM 358 C HIS A 386 2.045 -1.157 -4.859 1.00 0.00 C ATOM 359 O HIS A 386 2.623 -0.832 -3.823 1.00 0.00 O ATOM 360 CB HIS A 386 2.454 -0.295 -7.160 1.00 0.00 C ATOM 361 CG HIS A 386 3.925 -0.075 -6.963 1.00 0.00 C ATOM 362 ND1 HIS A 386 4.782 -1.043 -6.470 1.00 0.00 N ATOM 363 CD2 HIS A 386 4.692 1.013 -7.206 1.00 0.00 C ATOM 364 CE1 HIS A 386 6.008 -0.555 -6.420 1.00 0.00 C ATOM 365 NE2 HIS A 386 5.981 0.689 -6.861 1.00 0.00 N ATOM 0 H HIS A 386 2.503 1.334 -4.639 1.00 0.00 H new ATOM 0 HA HIS A 386 0.572 -0.252 -6.113 1.00 0.00 H new ATOM 0 HB2 HIS A 386 2.295 -1.302 -7.545 1.00 0.00 H new ATOM 0 HB3 HIS A 386 2.091 0.397 -7.919 1.00 0.00 H new ATOM 0 HD2 HIS A 386 4.353 1.960 -7.598 1.00 0.00 H new ATOM 0 HE1 HIS A 386 6.885 -1.084 -6.076 1.00 0.00 H new ATOM 0 HE2 HIS A 386 6.787 1.309 -6.934 1.00 0.00 H new ATOM 374 N TYR A 387 1.754 -2.414 -5.166 1.00 0.00 N ATOM 375 CA TYR A 387 2.102 -3.516 -4.286 1.00 0.00 C ATOM 376 C TYR A 387 3.199 -4.367 -4.909 1.00 0.00 C ATOM 377 O TYR A 387 3.062 -4.855 -6.032 1.00 0.00 O ATOM 378 CB TYR A 387 0.869 -4.370 -3.992 1.00 0.00 C ATOM 379 CG TYR A 387 -0.327 -3.555 -3.563 1.00 0.00 C ATOM 380 CD1 TYR A 387 -0.438 -3.085 -2.261 1.00 0.00 C ATOM 381 CD2 TYR A 387 -1.339 -3.243 -4.462 1.00 0.00 C ATOM 382 CE1 TYR A 387 -1.523 -2.330 -1.866 1.00 0.00 C ATOM 383 CE2 TYR A 387 -2.430 -2.489 -4.073 1.00 0.00 C ATOM 384 CZ TYR A 387 -2.517 -2.035 -2.774 1.00 0.00 C ATOM 385 OH TYR A 387 -3.599 -1.281 -2.384 1.00 0.00 O ATOM 0 H TYR A 387 1.276 -2.694 -6.022 1.00 0.00 H new ATOM 0 HA TYR A 387 2.473 -3.106 -3.347 1.00 0.00 H new ATOM 0 HB2 TYR A 387 0.610 -4.943 -4.883 1.00 0.00 H new ATOM 0 HB3 TYR A 387 1.111 -5.089 -3.209 1.00 0.00 H new ATOM 0 HD1 TYR A 387 0.338 -3.314 -1.546 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.272 -3.595 -5.481 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -1.593 -1.972 -0.850 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -3.210 -2.257 -4.783 1.00 0.00 H new ATOM 0 HH TYR A 387 -4.013 -0.871 -3.172 1.00 0.00 H new ATOM 395 N VAL A 388 4.289 -4.534 -4.176 1.00 0.00 N ATOM 396 CA VAL A 388 5.416 -5.320 -4.653 1.00 0.00 C ATOM 397 C VAL A 388 5.484 -6.659 -3.933 1.00 0.00 C ATOM 398 O VAL A 388 5.336 -6.721 -2.718 1.00 0.00 O ATOM 399 CB VAL A 388 6.745 -4.567 -4.454 1.00 0.00 C ATOM 400 CG1 VAL A 388 6.789 -3.902 -3.087 1.00 0.00 C ATOM 401 CG2 VAL A 388 7.921 -5.507 -4.631 1.00 0.00 C ATOM 0 H VAL A 388 4.417 -4.135 -3.246 1.00 0.00 H new ATOM 0 HA VAL A 388 5.264 -5.491 -5.719 1.00 0.00 H new ATOM 0 HB VAL A 388 6.812 -3.787 -5.212 1.00 0.00 H new ATOM 0 HG11 VAL A 388 7.736 -3.376 -2.968 1.00 0.00 H new ATOM 0 HG12 VAL A 388 5.967 -3.192 -3.001 1.00 0.00 H new ATOM 0 HG13 VAL A 388 6.696 -4.661 -2.310 1.00 0.00 H new ATOM 0 HG21 VAL A 388 8.851 -4.957 -4.487 1.00 0.00 H new ATOM 0 HG22 VAL A 388 7.857 -6.311 -3.898 1.00 0.00 H new ATOM 0 HG23 VAL A 388 7.901 -5.929 -5.636 1.00 0.00 H new ATOM 411 N THR A 389 5.708 -7.728 -4.689 1.00 0.00 N ATOM 412 CA THR A 389 5.791 -9.060 -4.108 1.00 0.00 C ATOM 413 C THR A 389 7.237 -9.457 -3.830 1.00 0.00 C ATOM 414 O THR A 389 8.001 -9.746 -4.750 1.00 0.00 O ATOM 415 CB THR A 389 5.148 -10.119 -5.023 1.00 0.00 C ATOM 416 OG1 THR A 389 3.848 -9.707 -5.460 1.00 0.00 O ATOM 417 CG2 THR A 389 5.017 -11.452 -4.300 1.00 0.00 C ATOM 0 H THR A 389 5.835 -7.697 -5.701 1.00 0.00 H new ATOM 0 HA THR A 389 5.242 -9.022 -3.167 1.00 0.00 H new ATOM 0 HB THR A 389 5.801 -10.232 -5.888 1.00 0.00 H new ATOM 0 HG1 THR A 389 3.665 -10.087 -6.344 1.00 0.00 H new ATOM 0 HG21 THR A 389 4.560 -12.184 -4.966 1.00 0.00 H new ATOM 0 HG22 THR A 389 6.005 -11.801 -3.999 1.00 0.00 H new ATOM 0 HG23 THR A 389 4.392 -11.326 -3.416 1.00 0.00 H new ATOM 425 N VAL A 390 7.597 -9.481 -2.552 1.00 0.00 N ATOM 426 CA VAL A 390 8.948 -9.858 -2.147 1.00 0.00 C ATOM 427 C VAL A 390 9.045 -11.368 -1.994 1.00 0.00 C ATOM 428 O VAL A 390 10.073 -11.973 -2.299 1.00 0.00 O ATOM 429 CB VAL A 390 9.375 -9.196 -0.816 1.00 0.00 C ATOM 430 CG1 VAL A 390 10.565 -8.276 -1.033 1.00 0.00 C ATOM 431 CG2 VAL A 390 8.221 -8.437 -0.182 1.00 0.00 C ATOM 0 H VAL A 390 6.975 -9.245 -1.779 1.00 0.00 H new ATOM 0 HA VAL A 390 9.619 -9.507 -2.931 1.00 0.00 H new ATOM 0 HB VAL A 390 9.671 -9.989 -0.129 1.00 0.00 H new ATOM 0 HG11 VAL A 390 10.850 -7.820 -0.085 1.00 0.00 H new ATOM 0 HG12 VAL A 390 11.403 -8.852 -1.425 1.00 0.00 H new ATOM 0 HG13 VAL A 390 10.296 -7.495 -1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 390 8.553 -7.983 0.752 1.00 0.00 H new ATOM 0 HG22 VAL A 390 7.880 -7.657 -0.863 1.00 0.00 H new ATOM 0 HG23 VAL A 390 7.401 -9.125 0.021 1.00 0.00 H new ATOM 441 N LYS A 391 7.957 -11.970 -1.527 1.00 0.00 N ATOM 442 CA LYS A 391 7.900 -13.413 -1.337 1.00 0.00 C ATOM 443 C LYS A 391 6.505 -13.939 -1.669 1.00 0.00 C ATOM 444 O LYS A 391 5.528 -13.193 -1.635 1.00 0.00 O ATOM 445 CB LYS A 391 8.303 -13.779 0.105 1.00 0.00 C ATOM 446 CG LYS A 391 7.183 -14.367 0.955 1.00 0.00 C ATOM 447 CD LYS A 391 7.734 -15.133 2.146 1.00 0.00 C ATOM 448 CE LYS A 391 8.051 -16.576 1.784 1.00 0.00 C ATOM 449 NZ LYS A 391 8.874 -17.243 2.830 1.00 0.00 N ATOM 0 H LYS A 391 7.100 -11.478 -1.273 1.00 0.00 H new ATOM 0 HA LYS A 391 8.609 -13.886 -2.017 1.00 0.00 H new ATOM 0 HB2 LYS A 391 9.124 -14.495 0.067 1.00 0.00 H new ATOM 0 HB3 LYS A 391 8.683 -12.884 0.599 1.00 0.00 H new ATOM 0 HG2 LYS A 391 6.532 -13.566 1.305 1.00 0.00 H new ATOM 0 HG3 LYS A 391 6.571 -15.031 0.345 1.00 0.00 H new ATOM 0 HD2 LYS A 391 8.636 -14.642 2.510 1.00 0.00 H new ATOM 0 HD3 LYS A 391 7.009 -15.112 2.960 1.00 0.00 H new ATOM 0 HE2 LYS A 391 7.121 -17.128 1.647 1.00 0.00 H new ATOM 0 HE3 LYS A 391 8.582 -16.603 0.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 391 9.224 -18.153 2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 391 9.681 -16.635 3.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 391 8.293 -17.408 3.677 1.00 0.00 H new ATOM 463 N LYS A 392 6.423 -15.226 -1.982 1.00 0.00 N ATOM 464 CA LYS A 392 5.149 -15.855 -2.313 1.00 0.00 C ATOM 465 C LYS A 392 5.058 -17.240 -1.687 1.00 0.00 C ATOM 466 O LYS A 392 6.046 -17.766 -1.175 1.00 0.00 O ATOM 467 CB LYS A 392 4.978 -15.960 -3.829 1.00 0.00 C ATOM 468 CG LYS A 392 6.087 -15.285 -4.619 1.00 0.00 C ATOM 469 CD LYS A 392 7.308 -16.183 -4.743 1.00 0.00 C ATOM 470 CE LYS A 392 8.142 -15.821 -5.961 1.00 0.00 C ATOM 471 NZ LYS A 392 8.280 -16.967 -6.901 1.00 0.00 N ATOM 0 H LYS A 392 7.224 -15.856 -2.014 1.00 0.00 H new ATOM 0 HA LYS A 392 4.350 -15.232 -1.911 1.00 0.00 H new ATOM 0 HB2 LYS A 392 4.934 -17.013 -4.108 1.00 0.00 H new ATOM 0 HB3 LYS A 392 4.023 -15.516 -4.109 1.00 0.00 H new ATOM 0 HG2 LYS A 392 5.722 -15.026 -5.613 1.00 0.00 H new ATOM 0 HG3 LYS A 392 6.368 -14.352 -4.130 1.00 0.00 H new ATOM 0 HD2 LYS A 392 7.918 -16.096 -3.844 1.00 0.00 H new ATOM 0 HD3 LYS A 392 6.991 -17.223 -4.814 1.00 0.00 H new ATOM 0 HE2 LYS A 392 7.681 -14.980 -6.479 1.00 0.00 H new ATOM 0 HE3 LYS A 392 9.131 -15.494 -5.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 392 8.855 -16.679 -7.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 392 8.743 -17.761 -6.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 392 7.338 -17.263 -7.228 1.00 0.00 H new ATOM 485 N PRO A 393 3.867 -17.855 -1.726 1.00 0.00 N ATOM 486 CA PRO A 393 3.659 -19.190 -1.162 1.00 0.00 C ATOM 487 C PRO A 393 4.503 -20.239 -1.874 1.00 0.00 C ATOM 488 O PRO A 393 4.531 -20.299 -3.104 1.00 0.00 O ATOM 489 CB PRO A 393 2.166 -19.454 -1.393 1.00 0.00 C ATOM 490 CG PRO A 393 1.769 -18.518 -2.483 1.00 0.00 C ATOM 491 CD PRO A 393 2.641 -17.306 -2.323 1.00 0.00 C ATOM 0 HA PRO A 393 3.949 -19.243 -0.113 1.00 0.00 H new ATOM 0 HB2 PRO A 393 1.989 -20.491 -1.680 1.00 0.00 H new ATOM 0 HB3 PRO A 393 1.589 -19.271 -0.487 1.00 0.00 H new ATOM 0 HG2 PRO A 393 1.912 -18.975 -3.462 1.00 0.00 H new ATOM 0 HG3 PRO A 393 0.714 -18.253 -2.406 1.00 0.00 H new ATOM 0 HD2 PRO A 393 2.840 -16.823 -3.280 1.00 0.00 H new ATOM 0 HD3 PRO A 393 2.178 -16.559 -1.679 1.00 0.00 H new ATOM 499 N THR A 394 5.195 -21.060 -1.095 1.00 0.00 N ATOM 500 CA THR A 394 6.045 -22.102 -1.653 1.00 0.00 C ATOM 501 C THR A 394 6.039 -23.343 -0.767 1.00 0.00 C ATOM 502 O THR A 394 5.633 -23.285 0.395 1.00 0.00 O ATOM 503 CB THR A 394 7.494 -21.609 -1.828 1.00 0.00 C ATOM 504 OG1 THR A 394 8.338 -22.078 -0.768 1.00 0.00 O ATOM 505 CG2 THR A 394 7.553 -20.087 -1.854 1.00 0.00 C ATOM 0 H THR A 394 5.184 -21.024 -0.076 1.00 0.00 H new ATOM 0 HA THR A 394 5.639 -22.357 -2.632 1.00 0.00 H new ATOM 0 HB THR A 394 7.850 -22.009 -2.778 1.00 0.00 H new ATOM 0 HG1 THR A 394 8.907 -22.804 -1.100 1.00 0.00 H new ATOM 0 HG21 THR A 394 8.587 -19.765 -1.978 1.00 0.00 H new ATOM 0 HG22 THR A 394 6.954 -19.714 -2.685 1.00 0.00 H new ATOM 0 HG23 THR A 394 7.160 -19.692 -0.917 1.00 0.00 H new ATOM 513 N ALA A 395 6.489 -24.464 -1.319 1.00 0.00 N ATOM 514 CA ALA A 395 6.532 -25.716 -0.575 1.00 0.00 C ATOM 515 C ALA A 395 7.233 -25.532 0.766 1.00 0.00 C ATOM 516 O ALA A 395 6.730 -25.960 1.805 1.00 0.00 O ATOM 517 CB ALA A 395 7.217 -26.808 -1.382 1.00 0.00 C ATOM 0 H ALA A 395 6.829 -24.531 -2.278 1.00 0.00 H new ATOM 0 HA ALA A 395 5.503 -26.022 -0.386 1.00 0.00 H new ATOM 0 HB1 ALA A 395 7.235 -27.731 -0.803 1.00 0.00 H new ATOM 0 HB2 ALA A 395 6.669 -26.972 -2.310 1.00 0.00 H new ATOM 0 HB3 ALA A 395 8.238 -26.504 -1.612 1.00 0.00 H new ATOM 523 N VAL A 396 8.395 -24.894 0.733 1.00 0.00 N ATOM 524 CA VAL A 396 9.169 -24.652 1.939 1.00 0.00 C ATOM 525 C VAL A 396 8.465 -23.654 2.852 1.00 0.00 C ATOM 526 O VAL A 396 8.469 -23.803 4.074 1.00 0.00 O ATOM 527 CB VAL A 396 10.578 -24.129 1.595 1.00 0.00 C ATOM 528 CG1 VAL A 396 11.134 -24.863 0.386 1.00 0.00 C ATOM 529 CG2 VAL A 396 10.564 -22.625 1.349 1.00 0.00 C ATOM 0 H VAL A 396 8.822 -24.534 -0.120 1.00 0.00 H new ATOM 0 HA VAL A 396 9.262 -25.604 2.462 1.00 0.00 H new ATOM 0 HB VAL A 396 11.227 -24.321 2.450 1.00 0.00 H new ATOM 0 HG11 VAL A 396 12.129 -24.483 0.155 1.00 0.00 H new ATOM 0 HG12 VAL A 396 11.194 -25.929 0.604 1.00 0.00 H new ATOM 0 HG13 VAL A 396 10.478 -24.704 -0.470 1.00 0.00 H new ATOM 0 HG21 VAL A 396 11.572 -22.286 1.109 1.00 0.00 H new ATOM 0 HG22 VAL A 396 9.897 -22.399 0.517 1.00 0.00 H new ATOM 0 HG23 VAL A 396 10.213 -22.113 2.245 1.00 0.00 H new ATOM 539 N ASP A 397 7.868 -22.635 2.247 1.00 0.00 N ATOM 540 CA ASP A 397 7.163 -21.607 3.000 1.00 0.00 C ATOM 541 C ASP A 397 5.962 -21.082 2.221 1.00 0.00 C ATOM 542 O ASP A 397 6.115 -20.322 1.264 1.00 0.00 O ATOM 543 CB ASP A 397 8.109 -20.452 3.334 1.00 0.00 C ATOM 544 CG ASP A 397 8.515 -20.442 4.794 1.00 0.00 C ATOM 545 OD1 ASP A 397 9.084 -21.451 5.260 1.00 0.00 O ATOM 546 OD2 ASP A 397 8.265 -19.423 5.473 1.00 0.00 O ATOM 0 H ASP A 397 7.858 -22.499 1.236 1.00 0.00 H new ATOM 0 HA ASP A 397 6.803 -22.057 3.925 1.00 0.00 H new ATOM 0 HB2 ASP A 397 9.001 -20.525 2.712 1.00 0.00 H new ATOM 0 HB3 ASP A 397 7.625 -19.507 3.088 1.00 0.00 H new ATOM 551 N PRO A 398 4.747 -21.484 2.621 1.00 0.00 N ATOM 552 CA PRO A 398 3.508 -21.062 1.968 1.00 0.00 C ATOM 553 C PRO A 398 3.089 -19.648 2.367 1.00 0.00 C ATOM 554 O PRO A 398 1.912 -19.390 2.616 1.00 0.00 O ATOM 555 CB PRO A 398 2.466 -22.080 2.462 1.00 0.00 C ATOM 556 CG PRO A 398 3.212 -23.067 3.307 1.00 0.00 C ATOM 557 CD PRO A 398 4.478 -22.386 3.741 1.00 0.00 C ATOM 0 HA PRO A 398 3.618 -21.036 0.884 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.684 -21.587 3.039 1.00 0.00 H new ATOM 0 HB3 PRO A 398 1.979 -22.576 1.623 1.00 0.00 H new ATOM 0 HG2 PRO A 398 2.617 -23.367 4.170 1.00 0.00 H new ATOM 0 HG3 PRO A 398 3.433 -23.973 2.742 1.00 0.00 H new ATOM 0 HD2 PRO A 398 4.348 -21.844 4.677 1.00 0.00 H new ATOM 0 HD3 PRO A 398 5.290 -23.097 3.895 1.00 0.00 H new ATOM 565 N ASN A 399 4.055 -18.735 2.427 1.00 0.00 N ATOM 566 CA ASN A 399 3.776 -17.352 2.798 1.00 0.00 C ATOM 567 C ASN A 399 4.201 -16.390 1.694 1.00 0.00 C ATOM 568 O ASN A 399 5.002 -16.736 0.828 1.00 0.00 O ATOM 569 CB ASN A 399 4.491 -16.997 4.103 1.00 0.00 C ATOM 570 CG ASN A 399 4.276 -18.038 5.184 1.00 0.00 C ATOM 571 OD1 ASN A 399 3.383 -17.907 6.021 1.00 0.00 O ATOM 572 ND2 ASN A 399 5.098 -19.081 5.171 1.00 0.00 N ATOM 0 H ASN A 399 5.036 -18.928 2.224 1.00 0.00 H new ATOM 0 HA ASN A 399 2.700 -17.254 2.942 1.00 0.00 H new ATOM 0 HB2 ASN A 399 5.559 -16.892 3.912 1.00 0.00 H new ATOM 0 HB3 ASN A 399 4.134 -16.030 4.458 1.00 0.00 H new ATOM 0 HD21 ASN A 399 5.003 -19.814 5.874 1.00 0.00 H new ATOM 0 HD22 ASN A 399 5.825 -19.149 4.458 1.00 0.00 H new ATOM 579 N SER A 400 3.659 -15.178 1.743 1.00 0.00 N ATOM 580 CA SER A 400 3.976 -14.150 0.757 1.00 0.00 C ATOM 581 C SER A 400 4.263 -12.821 1.445 1.00 0.00 C ATOM 582 O SER A 400 3.731 -12.541 2.519 1.00 0.00 O ATOM 583 CB SER A 400 2.816 -13.982 -0.226 1.00 0.00 C ATOM 584 OG SER A 400 3.221 -13.264 -1.379 1.00 0.00 O ATOM 0 H SER A 400 2.995 -14.882 2.458 1.00 0.00 H new ATOM 0 HA SER A 400 4.865 -14.463 0.210 1.00 0.00 H new ATOM 0 HB2 SER A 400 2.439 -14.962 -0.518 1.00 0.00 H new ATOM 0 HB3 SER A 400 1.995 -13.457 0.263 1.00 0.00 H new ATOM 0 HG SER A 400 4.177 -13.057 -1.316 1.00 0.00 H new ATOM 590 N ILE A 401 5.096 -11.998 0.819 1.00 0.00 N ATOM 591 CA ILE A 401 5.434 -10.695 1.373 1.00 0.00 C ATOM 592 C ILE A 401 5.095 -9.589 0.384 1.00 0.00 C ATOM 593 O ILE A 401 5.200 -9.774 -0.829 1.00 0.00 O ATOM 594 CB ILE A 401 6.924 -10.592 1.755 1.00 0.00 C ATOM 595 CG1 ILE A 401 7.295 -11.696 2.756 1.00 0.00 C ATOM 596 CG2 ILE A 401 7.218 -9.208 2.320 1.00 0.00 C ATOM 597 CD1 ILE A 401 8.232 -11.249 3.863 1.00 0.00 C ATOM 0 H ILE A 401 5.548 -12.210 -0.070 1.00 0.00 H new ATOM 0 HA ILE A 401 4.841 -10.577 2.280 1.00 0.00 H new ATOM 0 HB ILE A 401 7.536 -10.733 0.864 1.00 0.00 H new ATOM 0 HG12 ILE A 401 6.381 -12.085 3.205 1.00 0.00 H new ATOM 0 HG13 ILE A 401 7.759 -12.520 2.214 1.00 0.00 H new ATOM 0 HG21 ILE A 401 8.272 -9.141 2.588 1.00 0.00 H new ATOM 0 HG22 ILE A 401 6.986 -8.452 1.570 1.00 0.00 H new ATOM 0 HG23 ILE A 401 6.607 -9.040 3.207 1.00 0.00 H new ATOM 0 HD11 ILE A 401 8.442 -12.090 4.524 1.00 0.00 H new ATOM 0 HD12 ILE A 401 9.164 -10.889 3.427 1.00 0.00 H new ATOM 0 HD13 ILE A 401 7.764 -10.447 4.434 1.00 0.00 H new ATOM 609 N VAL A 402 4.689 -8.437 0.905 1.00 0.00 N ATOM 610 CA VAL A 402 4.344 -7.313 0.046 1.00 0.00 C ATOM 611 C VAL A 402 4.709 -5.970 0.666 1.00 0.00 C ATOM 612 O VAL A 402 4.666 -5.795 1.885 1.00 0.00 O ATOM 613 CB VAL A 402 2.849 -7.312 -0.319 1.00 0.00 C ATOM 614 CG1 VAL A 402 2.482 -6.039 -1.065 1.00 0.00 C ATOM 615 CG2 VAL A 402 2.500 -8.542 -1.145 1.00 0.00 C ATOM 0 H VAL A 402 4.592 -8.258 1.905 1.00 0.00 H new ATOM 0 HA VAL A 402 4.935 -7.445 -0.861 1.00 0.00 H new ATOM 0 HB VAL A 402 2.269 -7.345 0.603 1.00 0.00 H new ATOM 0 HG11 VAL A 402 1.421 -6.057 -1.315 1.00 0.00 H new ATOM 0 HG12 VAL A 402 2.692 -5.175 -0.435 1.00 0.00 H new ATOM 0 HG13 VAL A 402 3.069 -5.972 -1.981 1.00 0.00 H new ATOM 0 HG21 VAL A 402 1.439 -8.524 -1.394 1.00 0.00 H new ATOM 0 HG22 VAL A 402 3.088 -8.543 -2.063 1.00 0.00 H new ATOM 0 HG23 VAL A 402 2.723 -9.441 -0.571 1.00 0.00 H new ATOM 625 N GLU A 403 5.057 -5.024 -0.198 1.00 0.00 N ATOM 626 CA GLU A 403 5.427 -3.676 0.224 1.00 0.00 C ATOM 627 C GLU A 403 4.747 -2.641 -0.667 1.00 0.00 C ATOM 628 O GLU A 403 4.988 -2.599 -1.871 1.00 0.00 O ATOM 629 CB GLU A 403 6.945 -3.500 0.167 1.00 0.00 C ATOM 630 CG GLU A 403 7.710 -4.813 0.195 1.00 0.00 C ATOM 631 CD GLU A 403 9.172 -4.645 -0.169 1.00 0.00 C ATOM 632 OE1 GLU A 403 9.455 -4.190 -1.298 1.00 0.00 O ATOM 633 OE2 GLU A 403 10.035 -4.968 0.674 1.00 0.00 O ATOM 0 H GLU A 403 5.091 -5.167 -1.207 1.00 0.00 H new ATOM 0 HA GLU A 403 5.096 -3.530 1.252 1.00 0.00 H new ATOM 0 HB2 GLU A 403 7.206 -2.956 -0.741 1.00 0.00 H new ATOM 0 HB3 GLU A 403 7.263 -2.885 1.009 1.00 0.00 H new ATOM 0 HG2 GLU A 403 7.635 -5.251 1.190 1.00 0.00 H new ATOM 0 HG3 GLU A 403 7.245 -5.515 -0.498 1.00 0.00 H new ATOM 640 N CYS A 404 3.883 -1.813 -0.089 1.00 0.00 N ATOM 641 CA CYS A 404 3.184 -0.811 -0.877 1.00 0.00 C ATOM 642 C CYS A 404 4.082 0.377 -1.197 1.00 0.00 C ATOM 643 O CYS A 404 4.212 1.297 -0.390 1.00 0.00 O ATOM 644 CB CYS A 404 1.968 -0.306 -0.105 1.00 0.00 C ATOM 645 SG CYS A 404 0.690 -1.552 0.182 1.00 0.00 S ATOM 0 H CYS A 404 3.654 -1.816 0.905 1.00 0.00 H new ATOM 0 HA CYS A 404 2.879 -1.281 -1.812 1.00 0.00 H new ATOM 0 HB2 CYS A 404 2.301 0.083 0.857 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.528 0.528 -0.651 1.00 0.00 H new ATOM 0 HG CYS A 404 0.031 -1.759 -0.919 1.00 0.00 H new ATOM 651 N ARG A 405 4.706 0.358 -2.371 1.00 0.00 N ATOM 652 CA ARG A 405 5.594 1.440 -2.771 1.00 0.00 C ATOM 653 C ARG A 405 4.825 2.555 -3.466 1.00 0.00 C ATOM 654 O ARG A 405 3.609 2.468 -3.642 1.00 0.00 O ATOM 655 CB ARG A 405 6.697 0.903 -3.683 1.00 0.00 C ATOM 656 CG ARG A 405 6.999 -0.570 -3.452 1.00 0.00 C ATOM 657 CD ARG A 405 8.493 -0.847 -3.460 1.00 0.00 C ATOM 658 NE ARG A 405 8.881 -1.714 -4.568 1.00 0.00 N ATOM 659 CZ ARG A 405 10.101 -1.730 -5.097 1.00 0.00 C ATOM 660 NH1 ARG A 405 11.043 -0.929 -4.621 1.00 0.00 N ATOM 661 NH2 ARG A 405 10.378 -2.549 -6.103 1.00 0.00 N ATOM 0 H ARG A 405 4.613 -0.391 -3.057 1.00 0.00 H new ATOM 0 HA ARG A 405 6.048 1.858 -1.873 1.00 0.00 H new ATOM 0 HB2 ARG A 405 6.403 1.049 -4.723 1.00 0.00 H new ATOM 0 HB3 ARG A 405 7.606 1.483 -3.524 1.00 0.00 H new ATOM 0 HG2 ARG A 405 6.576 -0.882 -2.497 1.00 0.00 H new ATOM 0 HG3 ARG A 405 6.515 -1.166 -4.225 1.00 0.00 H new ATOM 0 HD2 ARG A 405 9.036 0.095 -3.529 1.00 0.00 H new ATOM 0 HD3 ARG A 405 8.781 -1.312 -2.517 1.00 0.00 H new ATOM 0 HE ARG A 405 8.178 -2.342 -4.958 1.00 0.00 H new ATOM 0 HH11 ARG A 405 10.833 -0.298 -3.847 1.00 0.00 H new ATOM 0 HH12 ARG A 405 11.978 -0.943 -5.028 1.00 0.00 H new ATOM 0 HH21 ARG A 405 9.655 -3.167 -6.471 1.00 0.00 H new ATOM 0 HH22 ARG A 405 11.314 -2.561 -6.508 1.00 0.00 H new ATOM 675 N VAL A 406 5.538 3.609 -3.846 1.00 0.00 N ATOM 676 CA VAL A 406 4.917 4.748 -4.507 1.00 0.00 C ATOM 677 C VAL A 406 5.841 5.354 -5.561 1.00 0.00 C ATOM 678 O VAL A 406 7.056 5.163 -5.521 1.00 0.00 O ATOM 679 CB VAL A 406 4.511 5.831 -3.485 1.00 0.00 C ATOM 680 CG1 VAL A 406 3.014 5.785 -3.235 1.00 0.00 C ATOM 681 CG2 VAL A 406 5.271 5.649 -2.179 1.00 0.00 C ATOM 0 H VAL A 406 6.545 3.697 -3.708 1.00 0.00 H new ATOM 0 HA VAL A 406 4.020 4.379 -5.004 1.00 0.00 H new ATOM 0 HB VAL A 406 4.767 6.807 -3.898 1.00 0.00 H new ATOM 0 HG11 VAL A 406 2.742 6.554 -2.512 1.00 0.00 H new ATOM 0 HG12 VAL A 406 2.483 5.962 -4.170 1.00 0.00 H new ATOM 0 HG13 VAL A 406 2.741 4.806 -2.843 1.00 0.00 H new ATOM 0 HG21 VAL A 406 4.970 6.422 -1.472 1.00 0.00 H new ATOM 0 HG22 VAL A 406 5.046 4.668 -1.761 1.00 0.00 H new ATOM 0 HG23 VAL A 406 6.342 5.726 -2.367 1.00 0.00 H new ATOM 691 N GLY A 407 5.249 6.076 -6.509 1.00 0.00 N ATOM 692 CA GLY A 407 6.021 6.694 -7.574 1.00 0.00 C ATOM 693 C GLY A 407 7.339 7.272 -7.098 1.00 0.00 C ATOM 694 O GLY A 407 8.289 7.382 -7.874 1.00 0.00 O ATOM 0 H GLY A 407 4.244 6.245 -6.559 1.00 0.00 H new ATOM 0 HA2 GLY A 407 6.215 5.953 -8.350 1.00 0.00 H new ATOM 0 HA3 GLY A 407 5.428 7.486 -8.031 1.00 0.00 H new ATOM 698 N ASP A 408 7.400 7.649 -5.825 1.00 0.00 N ATOM 699 CA ASP A 408 8.615 8.224 -5.258 1.00 0.00 C ATOM 700 C ASP A 408 9.664 7.149 -4.985 1.00 0.00 C ATOM 701 O ASP A 408 10.728 7.435 -4.435 1.00 0.00 O ATOM 702 CB ASP A 408 8.293 8.974 -3.963 1.00 0.00 C ATOM 703 CG ASP A 408 9.070 10.270 -3.839 1.00 0.00 C ATOM 704 OD1 ASP A 408 10.315 10.226 -3.920 1.00 0.00 O ATOM 705 OD2 ASP A 408 8.433 11.329 -3.658 1.00 0.00 O ATOM 0 H ASP A 408 6.624 7.567 -5.168 1.00 0.00 H new ATOM 0 HA ASP A 408 9.024 8.922 -5.988 1.00 0.00 H new ATOM 0 HB2 ASP A 408 7.225 9.189 -3.926 1.00 0.00 H new ATOM 0 HB3 ASP A 408 8.519 8.335 -3.110 1.00 0.00 H new ATOM 710 N GLY A 409 9.362 5.912 -5.372 1.00 0.00 N ATOM 711 CA GLY A 409 10.294 4.822 -5.154 1.00 0.00 C ATOM 712 C GLY A 409 10.403 4.443 -3.692 1.00 0.00 C ATOM 713 O GLY A 409 11.236 3.618 -3.316 1.00 0.00 O ATOM 0 H GLY A 409 8.491 5.647 -5.831 1.00 0.00 H new ATOM 0 HA2 GLY A 409 9.975 3.953 -5.729 1.00 0.00 H new ATOM 0 HA3 GLY A 409 11.277 5.108 -5.527 1.00 0.00 H new ATOM 717 N THR A 410 9.560 5.051 -2.864 1.00 0.00 N ATOM 718 CA THR A 410 9.558 4.782 -1.434 1.00 0.00 C ATOM 719 C THR A 410 8.423 3.839 -1.055 1.00 0.00 C ATOM 720 O THR A 410 7.382 3.804 -1.711 1.00 0.00 O ATOM 721 CB THR A 410 9.425 6.081 -0.619 1.00 0.00 C ATOM 722 OG1 THR A 410 9.602 7.237 -1.448 1.00 0.00 O ATOM 723 CG2 THR A 410 10.456 6.128 0.499 1.00 0.00 C ATOM 0 H THR A 410 8.867 5.737 -3.163 1.00 0.00 H new ATOM 0 HA THR A 410 10.512 4.311 -1.199 1.00 0.00 H new ATOM 0 HB THR A 410 8.420 6.088 -0.197 1.00 0.00 H new ATOM 0 HG1 THR A 410 9.511 8.047 -0.904 1.00 0.00 H new ATOM 0 HG21 THR A 410 10.342 7.055 1.060 1.00 0.00 H new ATOM 0 HG22 THR A 410 10.308 5.279 1.166 1.00 0.00 H new ATOM 0 HG23 THR A 410 11.458 6.083 0.072 1.00 0.00 H new ATOM 731 N VAL A 411 8.634 3.072 0.007 1.00 0.00 N ATOM 732 CA VAL A 411 7.632 2.123 0.478 1.00 0.00 C ATOM 733 C VAL A 411 6.832 2.702 1.639 1.00 0.00 C ATOM 734 O VAL A 411 7.370 2.919 2.724 1.00 0.00 O ATOM 735 CB VAL A 411 8.282 0.800 0.922 1.00 0.00 C ATOM 736 CG1 VAL A 411 7.220 -0.220 1.301 1.00 0.00 C ATOM 737 CG2 VAL A 411 9.185 0.258 -0.177 1.00 0.00 C ATOM 0 H VAL A 411 9.491 3.088 0.560 1.00 0.00 H new ATOM 0 HA VAL A 411 6.960 1.926 -0.358 1.00 0.00 H new ATOM 0 HB VAL A 411 8.893 0.994 1.804 1.00 0.00 H new ATOM 0 HG11 VAL A 411 7.701 -1.148 1.612 1.00 0.00 H new ATOM 0 HG12 VAL A 411 6.618 0.169 2.122 1.00 0.00 H new ATOM 0 HG13 VAL A 411 6.579 -0.414 0.441 1.00 0.00 H new ATOM 0 HG21 VAL A 411 9.637 -0.678 0.152 1.00 0.00 H new ATOM 0 HG22 VAL A 411 8.596 0.080 -1.077 1.00 0.00 H new ATOM 0 HG23 VAL A 411 9.969 0.983 -0.394 1.00 0.00 H new ATOM 747 N LEU A 412 5.541 2.945 1.412 1.00 0.00 N ATOM 748 CA LEU A 412 4.687 3.492 2.458 1.00 0.00 C ATOM 749 C LEU A 412 4.129 2.383 3.336 1.00 0.00 C ATOM 750 O LEU A 412 3.925 2.577 4.534 1.00 0.00 O ATOM 751 CB LEU A 412 3.542 4.344 1.879 1.00 0.00 C ATOM 752 CG LEU A 412 2.814 3.792 0.651 1.00 0.00 C ATOM 753 CD1 LEU A 412 1.740 2.800 1.067 1.00 0.00 C ATOM 754 CD2 LEU A 412 2.191 4.937 -0.134 1.00 0.00 C ATOM 0 H LEU A 412 5.071 2.773 0.523 1.00 0.00 H new ATOM 0 HA LEU A 412 5.308 4.146 3.070 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.805 4.501 2.667 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.946 5.323 1.621 1.00 0.00 H new ATOM 0 HG LEU A 412 3.536 3.273 0.020 1.00 0.00 H new ATOM 0 HD11 LEU A 412 1.234 2.419 0.180 1.00 0.00 H new ATOM 0 HD12 LEU A 412 2.199 1.972 1.607 1.00 0.00 H new ATOM 0 HD13 LEU A 412 1.016 3.297 1.713 1.00 0.00 H new ATOM 0 HD21 LEU A 412 1.674 4.540 -1.007 1.00 0.00 H new ATOM 0 HD22 LEU A 412 1.480 5.468 0.499 1.00 0.00 H new ATOM 0 HD23 LEU A 412 2.973 5.625 -0.457 1.00 0.00 H new ATOM 766 N GLY A 413 3.873 1.220 2.742 1.00 0.00 N ATOM 767 CA GLY A 413 3.329 0.114 3.507 1.00 0.00 C ATOM 768 C GLY A 413 4.039 -1.200 3.253 1.00 0.00 C ATOM 769 O GLY A 413 4.841 -1.318 2.329 1.00 0.00 O ATOM 0 H GLY A 413 4.031 1.026 1.753 1.00 0.00 H new ATOM 0 HA2 GLY A 413 3.390 0.352 4.569 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.272 0.000 3.266 1.00 0.00 H new ATOM 773 N THR A 414 3.737 -2.185 4.089 1.00 0.00 N ATOM 774 CA THR A 414 4.337 -3.507 3.973 1.00 0.00 C ATOM 775 C THR A 414 3.520 -4.541 4.739 1.00 0.00 C ATOM 776 O THR A 414 3.404 -4.468 5.963 1.00 0.00 O ATOM 777 CB THR A 414 5.785 -3.518 4.499 1.00 0.00 C ATOM 778 OG1 THR A 414 6.630 -2.665 3.717 1.00 0.00 O ATOM 779 CG2 THR A 414 6.361 -4.925 4.472 1.00 0.00 C ATOM 0 H THR A 414 3.075 -2.092 4.860 1.00 0.00 H new ATOM 0 HA THR A 414 4.346 -3.762 2.913 1.00 0.00 H new ATOM 0 HB THR A 414 5.753 -3.152 5.525 1.00 0.00 H new ATOM 0 HG1 THR A 414 6.145 -2.365 2.920 1.00 0.00 H new ATOM 0 HG21 THR A 414 7.384 -4.907 4.848 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.755 -5.578 5.100 1.00 0.00 H new ATOM 0 HG23 THR A 414 6.357 -5.300 3.449 1.00 0.00 H new ATOM 787 N GLY A 415 2.950 -5.500 4.018 1.00 0.00 N ATOM 788 CA GLY A 415 2.148 -6.522 4.662 1.00 0.00 C ATOM 789 C GLY A 415 2.469 -7.919 4.173 1.00 0.00 C ATOM 790 O GLY A 415 2.903 -8.105 3.037 1.00 0.00 O ATOM 0 H GLY A 415 3.028 -5.588 3.005 1.00 0.00 H new ATOM 0 HA2 GLY A 415 2.305 -6.475 5.740 1.00 0.00 H new ATOM 0 HA3 GLY A 415 1.093 -6.314 4.485 1.00 0.00 H new ATOM 794 N VAL A 416 2.251 -8.900 5.040 1.00 0.00 N ATOM 795 CA VAL A 416 2.509 -10.291 4.710 1.00 0.00 C ATOM 796 C VAL A 416 1.214 -11.097 4.766 1.00 0.00 C ATOM 797 O VAL A 416 0.331 -10.812 5.576 1.00 0.00 O ATOM 798 CB VAL A 416 3.554 -10.899 5.676 1.00 0.00 C ATOM 799 CG1 VAL A 416 3.355 -12.397 5.844 1.00 0.00 C ATOM 800 CG2 VAL A 416 4.963 -10.598 5.191 1.00 0.00 C ATOM 0 H VAL A 416 1.893 -8.753 5.984 1.00 0.00 H new ATOM 0 HA VAL A 416 2.909 -10.333 3.697 1.00 0.00 H new ATOM 0 HB VAL A 416 3.412 -10.436 6.653 1.00 0.00 H new ATOM 0 HG11 VAL A 416 4.107 -12.789 6.529 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.361 -12.589 6.248 1.00 0.00 H new ATOM 0 HG13 VAL A 416 3.455 -12.888 4.876 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.686 -11.032 5.881 1.00 0.00 H new ATOM 0 HG22 VAL A 416 5.106 -11.027 4.199 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.109 -9.519 5.144 1.00 0.00 H new ATOM 810 N GLY A 417 1.104 -12.103 3.905 1.00 0.00 N ATOM 811 CA GLY A 417 -0.089 -12.926 3.886 1.00 0.00 C ATOM 812 C GLY A 417 0.117 -14.228 3.140 1.00 0.00 C ATOM 813 O GLY A 417 1.110 -14.395 2.432 1.00 0.00 O ATOM 0 H GLY A 417 1.817 -12.362 3.223 1.00 0.00 H new ATOM 0 HA2 GLY A 417 -0.394 -13.142 4.910 1.00 0.00 H new ATOM 0 HA3 GLY A 417 -0.903 -12.370 3.422 1.00 0.00 H new ATOM 817 N ARG A 418 -0.825 -15.153 3.293 1.00 0.00 N ATOM 818 CA ARG A 418 -0.736 -16.442 2.621 1.00 0.00 C ATOM 819 C ARG A 418 -0.269 -16.255 1.185 1.00 0.00 C ATOM 820 O ARG A 418 0.598 -16.982 0.698 1.00 0.00 O ATOM 821 CB ARG A 418 -2.092 -17.141 2.636 1.00 0.00 C ATOM 822 CG ARG A 418 -3.218 -16.271 2.116 1.00 0.00 C ATOM 823 CD ARG A 418 -4.550 -16.648 2.744 1.00 0.00 C ATOM 824 NE ARG A 418 -5.034 -17.939 2.264 1.00 0.00 N ATOM 825 CZ ARG A 418 -5.591 -18.119 1.070 1.00 0.00 C ATOM 826 NH1 ARG A 418 -5.738 -17.093 0.243 1.00 0.00 N ATOM 827 NH2 ARG A 418 -6.000 -19.325 0.703 1.00 0.00 N ATOM 0 H ARG A 418 -1.655 -15.034 3.874 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.013 -17.060 3.153 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -2.033 -18.047 2.033 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -2.322 -17.451 3.655 1.00 0.00 H new ATOM 0 HG2 ARG A 418 -2.998 -15.225 2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -3.285 -16.370 1.033 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -4.443 -16.681 3.828 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -5.288 -15.878 2.519 1.00 0.00 H new ATOM 0 HE ARG A 418 -4.940 -18.748 2.878 1.00 0.00 H new ATOM 0 HH11 ARG A 418 -5.424 -16.164 0.522 1.00 0.00 H new ATOM 0 HH12 ARG A 418 -6.165 -17.233 -0.672 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -5.888 -20.116 1.337 1.00 0.00 H new ATOM 0 HH22 ARG A 418 -6.427 -19.462 -0.213 1.00 0.00 H new ATOM 841 N ASN A 419 -0.849 -15.267 0.518 1.00 0.00 N ATOM 842 CA ASN A 419 -0.500 -14.961 -0.861 1.00 0.00 C ATOM 843 C ASN A 419 -0.132 -13.489 -1.001 1.00 0.00 C ATOM 844 O ASN A 419 0.010 -12.777 -0.007 1.00 0.00 O ATOM 845 CB ASN A 419 -1.665 -15.301 -1.791 1.00 0.00 C ATOM 846 CG ASN A 419 -1.196 -15.813 -3.138 1.00 0.00 C ATOM 847 OD1 ASN A 419 -0.055 -16.250 -3.286 1.00 0.00 O ATOM 848 ND2 ASN A 419 -2.077 -15.761 -4.130 1.00 0.00 N ATOM 0 H ASN A 419 -1.568 -14.661 0.913 1.00 0.00 H new ATOM 0 HA ASN A 419 0.362 -15.566 -1.142 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -2.296 -16.054 -1.319 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -2.281 -14.414 -1.937 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -1.818 -16.091 -5.060 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -3.013 -15.391 -3.962 1.00 0.00 H new ATOM 855 N ILE A 420 0.021 -13.038 -2.239 1.00 0.00 N ATOM 856 CA ILE A 420 0.373 -11.649 -2.503 1.00 0.00 C ATOM 857 C ILE A 420 -0.796 -10.719 -2.202 1.00 0.00 C ATOM 858 O ILE A 420 -0.628 -9.502 -2.118 1.00 0.00 O ATOM 859 CB ILE A 420 0.819 -11.456 -3.963 1.00 0.00 C ATOM 860 CG1 ILE A 420 2.230 -12.011 -4.155 1.00 0.00 C ATOM 861 CG2 ILE A 420 0.761 -9.985 -4.348 1.00 0.00 C ATOM 862 CD1 ILE A 420 2.255 -13.432 -4.673 1.00 0.00 C ATOM 0 H ILE A 420 -0.093 -13.612 -3.074 1.00 0.00 H new ATOM 0 HA ILE A 420 1.204 -11.397 -1.844 1.00 0.00 H new ATOM 0 HB ILE A 420 0.138 -12.003 -4.615 1.00 0.00 H new ATOM 0 HG12 ILE A 420 2.772 -11.370 -4.850 1.00 0.00 H new ATOM 0 HG13 ILE A 420 2.760 -11.970 -3.204 1.00 0.00 H new ATOM 0 HG21 ILE A 420 1.080 -9.867 -5.384 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -0.260 -9.620 -4.239 1.00 0.00 H new ATOM 0 HG23 ILE A 420 1.422 -9.412 -3.698 1.00 0.00 H new ATOM 0 HD11 ILE A 420 3.288 -13.760 -4.785 1.00 0.00 H new ATOM 0 HD12 ILE A 420 1.741 -14.085 -3.968 1.00 0.00 H new ATOM 0 HD13 ILE A 420 1.754 -13.476 -5.640 1.00 0.00 H new ATOM 874 N LYS A 421 -1.976 -11.297 -2.036 1.00 0.00 N ATOM 875 CA LYS A 421 -3.160 -10.516 -1.738 1.00 0.00 C ATOM 876 C LYS A 421 -3.243 -10.213 -0.255 1.00 0.00 C ATOM 877 O LYS A 421 -3.271 -9.054 0.149 1.00 0.00 O ATOM 878 CB LYS A 421 -4.409 -11.258 -2.183 1.00 0.00 C ATOM 879 CG LYS A 421 -5.686 -10.576 -1.753 1.00 0.00 C ATOM 880 CD LYS A 421 -5.566 -9.068 -1.863 1.00 0.00 C ATOM 881 CE LYS A 421 -5.373 -8.637 -3.305 1.00 0.00 C ATOM 882 NZ LYS A 421 -6.647 -8.188 -3.930 1.00 0.00 N ATOM 0 H LYS A 421 -2.136 -12.302 -2.103 1.00 0.00 H new ATOM 0 HA LYS A 421 -3.092 -9.575 -2.284 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.402 -11.352 -3.269 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.389 -12.269 -1.776 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -6.513 -10.924 -2.372 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.920 -10.851 -0.724 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -6.462 -8.599 -1.457 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -4.725 -8.723 -1.262 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -4.644 -7.828 -3.347 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -4.961 -9.467 -3.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -6.536 -8.163 -4.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.409 -8.850 -3.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -6.887 -7.237 -3.584 1.00 0.00 H new ATOM 896 N ILE A 422 -3.268 -11.254 0.557 1.00 0.00 N ATOM 897 CA ILE A 422 -3.333 -11.068 1.995 1.00 0.00 C ATOM 898 C ILE A 422 -2.198 -10.180 2.448 1.00 0.00 C ATOM 899 O ILE A 422 -2.361 -9.339 3.331 1.00 0.00 O ATOM 900 CB ILE A 422 -3.285 -12.405 2.740 1.00 0.00 C ATOM 901 CG1 ILE A 422 -4.492 -13.266 2.359 1.00 0.00 C ATOM 902 CG2 ILE A 422 -3.246 -12.173 4.243 1.00 0.00 C ATOM 903 CD1 ILE A 422 -5.685 -12.479 1.833 1.00 0.00 C ATOM 0 H ILE A 422 -3.245 -12.226 0.250 1.00 0.00 H new ATOM 0 HA ILE A 422 -4.285 -10.592 2.230 1.00 0.00 H new ATOM 0 HB ILE A 422 -2.377 -12.934 2.451 1.00 0.00 H new ATOM 0 HG12 ILE A 422 -4.184 -13.986 1.601 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -4.806 -13.837 3.233 1.00 0.00 H new ATOM 0 HG21 ILE A 422 -3.212 -13.133 4.759 1.00 0.00 H new ATOM 0 HG22 ILE A 422 -2.360 -11.592 4.499 1.00 0.00 H new ATOM 0 HG23 ILE A 422 -4.138 -11.627 4.550 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -6.495 -13.166 1.587 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -6.023 -11.778 2.596 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -5.392 -11.929 0.939 1.00 0.00 H new ATOM 915 N ALA A 423 -1.051 -10.342 1.802 1.00 0.00 N ATOM 916 CA ALA A 423 0.094 -9.519 2.109 1.00 0.00 C ATOM 917 C ALA A 423 -0.215 -8.098 1.665 1.00 0.00 C ATOM 918 O ALA A 423 -0.159 -7.155 2.453 1.00 0.00 O ATOM 919 CB ALA A 423 1.352 -10.038 1.427 1.00 0.00 C ATOM 0 H ALA A 423 -0.896 -11.033 1.068 1.00 0.00 H new ATOM 0 HA ALA A 423 0.286 -9.545 3.182 1.00 0.00 H new ATOM 0 HB1 ALA A 423 2.195 -9.395 1.680 1.00 0.00 H new ATOM 0 HB2 ALA A 423 1.557 -11.054 1.765 1.00 0.00 H new ATOM 0 HB3 ALA A 423 1.207 -10.038 0.347 1.00 0.00 H new ATOM 925 N GLY A 424 -0.576 -7.968 0.388 1.00 0.00 N ATOM 926 CA GLY A 424 -0.931 -6.674 -0.158 1.00 0.00 C ATOM 927 C GLY A 424 -2.015 -6.015 0.668 1.00 0.00 C ATOM 928 O GLY A 424 -1.919 -4.836 1.008 1.00 0.00 O ATOM 0 H GLY A 424 -0.628 -8.740 -0.276 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -0.050 -6.033 -0.186 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -1.273 -6.791 -1.186 1.00 0.00 H new ATOM 932 N ILE A 425 -3.036 -6.793 1.024 1.00 0.00 N ATOM 933 CA ILE A 425 -4.117 -6.284 1.854 1.00 0.00 C ATOM 934 C ILE A 425 -3.528 -5.707 3.134 1.00 0.00 C ATOM 935 O ILE A 425 -3.656 -4.517 3.425 1.00 0.00 O ATOM 936 CB ILE A 425 -5.122 -7.391 2.239 1.00 0.00 C ATOM 937 CG1 ILE A 425 -5.869 -7.901 1.007 1.00 0.00 C ATOM 938 CG2 ILE A 425 -6.103 -6.877 3.281 1.00 0.00 C ATOM 939 CD1 ILE A 425 -6.175 -9.379 1.060 1.00 0.00 C ATOM 0 H ILE A 425 -3.134 -7.771 0.751 1.00 0.00 H new ATOM 0 HA ILE A 425 -4.646 -5.524 1.280 1.00 0.00 H new ATOM 0 HB ILE A 425 -4.564 -8.224 2.667 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -6.802 -7.348 0.902 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -5.274 -7.692 0.118 1.00 0.00 H new ATOM 0 HG21 ILE A 425 -6.805 -7.669 3.542 1.00 0.00 H new ATOM 0 HG22 ILE A 425 -5.558 -6.567 4.172 1.00 0.00 H new ATOM 0 HG23 ILE A 425 -6.651 -6.026 2.877 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -6.706 -9.673 0.155 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -5.244 -9.941 1.134 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -6.796 -9.591 1.930 1.00 0.00 H new ATOM 951 N ARG A 426 -2.878 -6.586 3.889 1.00 0.00 N ATOM 952 CA ARG A 426 -2.242 -6.226 5.150 1.00 0.00 C ATOM 953 C ARG A 426 -1.340 -5.004 5.000 1.00 0.00 C ATOM 954 O ARG A 426 -1.284 -4.156 5.887 1.00 0.00 O ATOM 955 CB ARG A 426 -1.424 -7.408 5.667 1.00 0.00 C ATOM 956 CG ARG A 426 -1.486 -7.581 7.175 1.00 0.00 C ATOM 957 CD ARG A 426 -0.338 -6.860 7.864 1.00 0.00 C ATOM 958 NE ARG A 426 0.492 -7.772 8.647 1.00 0.00 N ATOM 959 CZ ARG A 426 0.246 -8.087 9.914 1.00 0.00 C ATOM 960 NH1 ARG A 426 -0.804 -7.570 10.538 1.00 0.00 N ATOM 961 NH2 ARG A 426 1.050 -8.920 10.560 1.00 0.00 N ATOM 0 H ARG A 426 -2.777 -7.571 3.643 1.00 0.00 H new ATOM 0 HA ARG A 426 -3.028 -5.975 5.862 1.00 0.00 H new ATOM 0 HB2 ARG A 426 -1.781 -8.321 5.191 1.00 0.00 H new ATOM 0 HB3 ARG A 426 -0.384 -7.277 5.368 1.00 0.00 H new ATOM 0 HG2 ARG A 426 -2.435 -7.197 7.548 1.00 0.00 H new ATOM 0 HG3 ARG A 426 -1.452 -8.642 7.423 1.00 0.00 H new ATOM 0 HD2 ARG A 426 0.278 -6.362 7.115 1.00 0.00 H new ATOM 0 HD3 ARG A 426 -0.737 -6.083 8.516 1.00 0.00 H new ATOM 0 HE ARG A 426 1.306 -8.190 8.196 1.00 0.00 H new ATOM 0 HH11 ARG A 426 -1.425 -6.929 10.045 1.00 0.00 H new ATOM 0 HH12 ARG A 426 -0.990 -7.814 11.511 1.00 0.00 H new ATOM 0 HH21 ARG A 426 1.859 -9.320 10.084 1.00 0.00 H new ATOM 0 HH22 ARG A 426 0.860 -9.161 11.533 1.00 0.00 H new ATOM 975 N ALA A 427 -0.629 -4.928 3.882 1.00 0.00 N ATOM 976 CA ALA A 427 0.277 -3.811 3.628 1.00 0.00 C ATOM 977 C ALA A 427 -0.497 -2.529 3.353 1.00 0.00 C ATOM 978 O ALA A 427 -0.389 -1.554 4.092 1.00 0.00 O ATOM 979 CB ALA A 427 1.204 -4.119 2.462 1.00 0.00 C ATOM 0 H ALA A 427 -0.661 -5.624 3.137 1.00 0.00 H new ATOM 0 HA ALA A 427 0.879 -3.666 4.525 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.869 -3.272 2.292 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.796 -5.005 2.692 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.612 -4.301 1.565 1.00 0.00 H new ATOM 985 N ALA A 428 -1.274 -2.541 2.279 1.00 0.00 N ATOM 986 CA ALA A 428 -2.063 -1.377 1.902 1.00 0.00 C ATOM 987 C ALA A 428 -2.689 -0.792 3.150 1.00 0.00 C ATOM 988 O ALA A 428 -2.569 0.400 3.436 1.00 0.00 O ATOM 989 CB ALA A 428 -3.135 -1.745 0.894 1.00 0.00 C ATOM 0 H ALA A 428 -1.375 -3.342 1.655 1.00 0.00 H new ATOM 0 HA ALA A 428 -1.413 -0.640 1.431 1.00 0.00 H new ATOM 0 HB1 ALA A 428 -3.708 -0.856 0.631 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -2.667 -2.153 -0.002 1.00 0.00 H new ATOM 0 HB3 ALA A 428 -3.801 -2.491 1.327 1.00 0.00 H new ATOM 995 N GLU A 429 -3.328 -1.668 3.901 1.00 0.00 N ATOM 996 CA GLU A 429 -3.959 -1.308 5.152 1.00 0.00 C ATOM 997 C GLU A 429 -2.909 -0.804 6.135 1.00 0.00 C ATOM 998 O GLU A 429 -3.019 0.286 6.686 1.00 0.00 O ATOM 999 CB GLU A 429 -4.650 -2.540 5.716 1.00 0.00 C ATOM 1000 CG GLU A 429 -6.093 -2.297 6.126 1.00 0.00 C ATOM 1001 CD GLU A 429 -6.270 -2.222 7.631 1.00 0.00 C ATOM 1002 OE1 GLU A 429 -5.366 -2.684 8.359 1.00 0.00 O ATOM 1003 OE2 GLU A 429 -7.312 -1.700 8.079 1.00 0.00 O ATOM 0 H GLU A 429 -3.423 -2.654 3.658 1.00 0.00 H new ATOM 0 HA GLU A 429 -4.689 -0.516 4.988 1.00 0.00 H new ATOM 0 HB2 GLU A 429 -4.622 -3.335 4.970 1.00 0.00 H new ATOM 0 HB3 GLU A 429 -4.091 -2.895 6.581 1.00 0.00 H new ATOM 0 HG2 GLU A 429 -6.442 -1.367 5.677 1.00 0.00 H new ATOM 0 HG3 GLU A 429 -6.718 -3.097 5.730 1.00 0.00 H new ATOM 1010 N ASN A 430 -1.894 -1.634 6.336 1.00 0.00 N ATOM 1011 CA ASN A 430 -0.806 -1.317 7.253 1.00 0.00 C ATOM 1012 C ASN A 430 -0.355 0.117 7.036 1.00 0.00 C ATOM 1013 O ASN A 430 -0.365 0.930 7.962 1.00 0.00 O ATOM 1014 CB ASN A 430 0.365 -2.273 7.042 1.00 0.00 C ATOM 1015 CG ASN A 430 1.583 -1.881 7.855 1.00 0.00 C ATOM 1016 OD1 ASN A 430 1.969 -0.713 7.890 1.00 0.00 O ATOM 1017 ND2 ASN A 430 2.195 -2.858 8.511 1.00 0.00 N ATOM 0 H ASN A 430 -1.801 -2.538 5.873 1.00 0.00 H new ATOM 0 HA ASN A 430 -1.163 -1.430 8.277 1.00 0.00 H new ATOM 0 HB2 ASN A 430 0.060 -3.283 7.314 1.00 0.00 H new ATOM 0 HB3 ASN A 430 0.628 -2.293 5.984 1.00 0.00 H new ATOM 0 HD21 ASN A 430 3.021 -2.655 9.074 1.00 0.00 H new ATOM 0 HD22 ASN A 430 1.839 -3.812 8.453 1.00 0.00 H new ATOM 1024 N ALA A 431 0.006 0.429 5.804 1.00 0.00 N ATOM 1025 CA ALA A 431 0.422 1.774 5.452 1.00 0.00 C ATOM 1026 C ALA A 431 -0.750 2.719 5.626 1.00 0.00 C ATOM 1027 O ALA A 431 -0.596 3.871 6.031 1.00 0.00 O ATOM 1028 CB ALA A 431 0.922 1.830 4.021 1.00 0.00 C ATOM 0 H ALA A 431 0.019 -0.234 5.029 1.00 0.00 H new ATOM 0 HA ALA A 431 1.240 2.072 6.108 1.00 0.00 H new ATOM 0 HB1 ALA A 431 1.228 2.849 3.782 1.00 0.00 H new ATOM 0 HB2 ALA A 431 1.774 1.159 3.907 1.00 0.00 H new ATOM 0 HB3 ALA A 431 0.125 1.522 3.345 1.00 0.00 H new ATOM 1034 N LEU A 432 -1.927 2.201 5.312 1.00 0.00 N ATOM 1035 CA LEU A 432 -3.158 2.959 5.418 1.00 0.00 C ATOM 1036 C LEU A 432 -3.463 3.306 6.873 1.00 0.00 C ATOM 1037 O LEU A 432 -4.031 4.360 7.160 1.00 0.00 O ATOM 1038 CB LEU A 432 -4.288 2.144 4.793 1.00 0.00 C ATOM 1039 CG LEU A 432 -5.662 2.287 5.437 1.00 0.00 C ATOM 1040 CD1 LEU A 432 -6.720 1.734 4.502 1.00 0.00 C ATOM 1041 CD2 LEU A 432 -5.715 1.570 6.777 1.00 0.00 C ATOM 0 H LEU A 432 -2.053 1.246 4.978 1.00 0.00 H new ATOM 0 HA LEU A 432 -3.055 3.903 4.882 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -4.372 2.425 3.743 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -4.006 1.092 4.820 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.854 3.345 5.617 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -7.702 1.836 4.963 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -6.700 2.287 3.563 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -6.519 0.681 4.307 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -6.706 1.688 7.214 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -5.507 0.510 6.631 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -4.969 1.997 7.448 1.00 0.00 H new ATOM 1053 N ARG A 433 -3.071 2.425 7.793 1.00 0.00 N ATOM 1054 CA ARG A 433 -3.295 2.662 9.215 1.00 0.00 C ATOM 1055 C ARG A 433 -2.636 3.968 9.642 1.00 0.00 C ATOM 1056 O ARG A 433 -3.143 4.684 10.507 1.00 0.00 O ATOM 1057 CB ARG A 433 -2.732 1.513 10.056 1.00 0.00 C ATOM 1058 CG ARG A 433 -2.873 0.144 9.415 1.00 0.00 C ATOM 1059 CD ARG A 433 -4.305 -0.115 8.982 1.00 0.00 C ATOM 1060 NE ARG A 433 -5.068 -0.807 10.019 1.00 0.00 N ATOM 1061 CZ ARG A 433 -6.361 -0.599 10.256 1.00 0.00 C ATOM 1062 NH1 ARG A 433 -7.051 0.266 9.524 1.00 0.00 N ATOM 1063 NH2 ARG A 433 -6.969 -1.263 11.230 1.00 0.00 N ATOM 0 H ARG A 433 -2.600 1.546 7.579 1.00 0.00 H new ATOM 0 HA ARG A 433 -4.371 2.725 9.379 1.00 0.00 H new ATOM 0 HB2 ARG A 433 -1.677 1.704 10.250 1.00 0.00 H new ATOM 0 HB3 ARG A 433 -3.237 1.503 11.022 1.00 0.00 H new ATOM 0 HG2 ARG A 433 -2.211 0.074 8.552 1.00 0.00 H new ATOM 0 HG3 ARG A 433 -2.559 -0.625 10.121 1.00 0.00 H new ATOM 0 HD2 ARG A 433 -4.790 0.832 8.744 1.00 0.00 H new ATOM 0 HD3 ARG A 433 -4.307 -0.712 8.070 1.00 0.00 H new ATOM 0 HE ARG A 433 -4.580 -1.491 10.596 1.00 0.00 H new ATOM 0 HH11 ARG A 433 -6.591 0.779 8.772 1.00 0.00 H new ATOM 0 HH12 ARG A 433 -8.042 0.418 9.713 1.00 0.00 H new ATOM 0 HH21 ARG A 433 -6.446 -1.931 11.796 1.00 0.00 H new ATOM 0 HH22 ARG A 433 -7.960 -1.105 11.414 1.00 0.00 H new ATOM 1077 N ASP A 434 -1.494 4.260 9.031 1.00 0.00 N ATOM 1078 CA ASP A 434 -0.738 5.464 9.335 1.00 0.00 C ATOM 1079 C ASP A 434 -1.394 6.707 8.739 1.00 0.00 C ATOM 1080 O ASP A 434 -1.377 6.910 7.525 1.00 0.00 O ATOM 1081 CB ASP A 434 0.687 5.327 8.805 1.00 0.00 C ATOM 1082 CG ASP A 434 1.391 4.098 9.345 1.00 0.00 C ATOM 1083 OD1 ASP A 434 0.695 3.168 9.803 1.00 0.00 O ATOM 1084 OD2 ASP A 434 2.638 4.067 9.309 1.00 0.00 O ATOM 0 H ASP A 434 -1.070 3.671 8.315 1.00 0.00 H new ATOM 0 HA ASP A 434 -0.719 5.583 10.418 1.00 0.00 H new ATOM 0 HB2 ASP A 434 0.663 5.279 7.716 1.00 0.00 H new ATOM 0 HB3 ASP A 434 1.258 6.216 9.073 1.00 0.00 H new ATOM 1089 N LYS A 435 -1.958 7.542 9.605 1.00 0.00 N ATOM 1090 CA LYS A 435 -2.603 8.776 9.171 1.00 0.00 C ATOM 1091 C LYS A 435 -1.564 9.764 8.663 1.00 0.00 C ATOM 1092 O LYS A 435 -1.636 10.226 7.528 1.00 0.00 O ATOM 1093 CB LYS A 435 -3.392 9.398 10.322 1.00 0.00 C ATOM 1094 CG LYS A 435 -4.405 10.436 9.873 1.00 0.00 C ATOM 1095 CD LYS A 435 -5.828 9.944 10.073 1.00 0.00 C ATOM 1096 CE LYS A 435 -6.373 9.289 8.815 1.00 0.00 C ATOM 1097 NZ LYS A 435 -7.811 8.932 8.953 1.00 0.00 N ATOM 0 H LYS A 435 -1.982 7.386 10.613 1.00 0.00 H new ATOM 0 HA LYS A 435 -3.292 8.538 8.360 1.00 0.00 H new ATOM 0 HB2 LYS A 435 -3.910 8.608 10.865 1.00 0.00 H new ATOM 0 HB3 LYS A 435 -2.695 9.861 11.021 1.00 0.00 H new ATOM 0 HG2 LYS A 435 -4.255 11.359 10.433 1.00 0.00 H new ATOM 0 HG3 LYS A 435 -4.244 10.672 8.821 1.00 0.00 H new ATOM 0 HD2 LYS A 435 -5.855 9.231 10.897 1.00 0.00 H new ATOM 0 HD3 LYS A 435 -6.467 10.781 10.355 1.00 0.00 H new ATOM 0 HE2 LYS A 435 -6.246 9.965 7.970 1.00 0.00 H new ATOM 0 HE3 LYS A 435 -5.796 8.391 8.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 -8.144 8.488 8.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 -7.929 8.267 9.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 -8.366 9.792 9.138 1.00 0.00 H new ATOM 1111 N LYS A 436 -0.613 10.096 9.525 1.00 0.00 N ATOM 1112 CA LYS A 436 0.427 11.051 9.178 1.00 0.00 C ATOM 1113 C LYS A 436 0.834 10.879 7.720 1.00 0.00 C ATOM 1114 O LYS A 436 0.827 11.839 6.953 1.00 0.00 O ATOM 1115 CB LYS A 436 1.636 10.866 10.092 1.00 0.00 C ATOM 1116 CG LYS A 436 1.597 11.737 11.338 1.00 0.00 C ATOM 1117 CD LYS A 436 2.972 11.866 11.976 1.00 0.00 C ATOM 1118 CE LYS A 436 3.558 13.252 11.761 1.00 0.00 C ATOM 1119 NZ LYS A 436 4.010 13.871 13.039 1.00 0.00 N ATOM 0 H LYS A 436 -0.541 9.717 10.469 1.00 0.00 H new ATOM 0 HA LYS A 436 0.038 12.060 9.314 1.00 0.00 H new ATOM 0 HB2 LYS A 436 1.697 9.820 10.392 1.00 0.00 H new ATOM 0 HB3 LYS A 436 2.543 11.090 9.531 1.00 0.00 H new ATOM 0 HG2 LYS A 436 1.222 12.727 11.079 1.00 0.00 H new ATOM 0 HG3 LYS A 436 0.900 11.310 12.059 1.00 0.00 H new ATOM 0 HD2 LYS A 436 2.899 11.662 13.044 1.00 0.00 H new ATOM 0 HD3 LYS A 436 3.642 11.117 11.554 1.00 0.00 H new ATOM 0 HE2 LYS A 436 4.400 13.187 11.072 1.00 0.00 H new ATOM 0 HE3 LYS A 436 2.811 13.893 11.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 4.403 14.815 12.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 3.202 13.957 13.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 4.741 13.273 13.475 1.00 0.00 H new ATOM 1133 N MET A 437 1.161 9.654 7.333 1.00 0.00 N ATOM 1134 CA MET A 437 1.533 9.390 5.945 1.00 0.00 C ATOM 1135 C MET A 437 0.344 9.695 5.049 1.00 0.00 C ATOM 1136 O MET A 437 0.477 10.369 4.033 1.00 0.00 O ATOM 1137 CB MET A 437 2.003 7.943 5.722 1.00 0.00 C ATOM 1138 CG MET A 437 1.938 7.062 6.959 1.00 0.00 C ATOM 1139 SD MET A 437 3.190 7.500 8.183 1.00 0.00 S ATOM 1140 CE MET A 437 4.532 6.418 7.700 1.00 0.00 C ATOM 0 H MET A 437 1.177 8.839 7.946 1.00 0.00 H new ATOM 0 HA MET A 437 2.376 10.035 5.697 1.00 0.00 H new ATOM 0 HB2 MET A 437 1.393 7.493 4.938 1.00 0.00 H new ATOM 0 HB3 MET A 437 3.030 7.960 5.357 1.00 0.00 H new ATOM 0 HG2 MET A 437 0.949 7.145 7.409 1.00 0.00 H new ATOM 0 HG3 MET A 437 2.068 6.020 6.667 1.00 0.00 H new ATOM 0 HE1 MET A 437 5.375 6.560 8.376 1.00 0.00 H new ATOM 0 HE2 MET A 437 4.199 5.381 7.748 1.00 0.00 H new ATOM 0 HE3 MET A 437 4.841 6.653 6.681 1.00 0.00 H new ATOM 1150 N LEU A 438 -0.830 9.221 5.454 1.00 0.00 N ATOM 1151 CA LEU A 438 -2.052 9.478 4.704 1.00 0.00 C ATOM 1152 C LEU A 438 -2.135 10.967 4.386 1.00 0.00 C ATOM 1153 O LEU A 438 -2.090 11.384 3.229 1.00 0.00 O ATOM 1154 CB LEU A 438 -3.257 9.085 5.557 1.00 0.00 C ATOM 1155 CG LEU A 438 -4.068 7.895 5.061 1.00 0.00 C ATOM 1156 CD1 LEU A 438 -3.157 6.726 4.714 1.00 0.00 C ATOM 1157 CD2 LEU A 438 -5.079 7.490 6.122 1.00 0.00 C ATOM 0 H LEU A 438 -0.960 8.659 6.295 1.00 0.00 H new ATOM 0 HA LEU A 438 -2.047 8.898 3.781 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -2.907 8.865 6.566 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -3.921 9.946 5.631 1.00 0.00 H new ATOM 0 HG LEU A 438 -4.599 8.184 4.154 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -3.759 5.888 4.362 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -2.461 7.027 3.931 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -2.598 6.425 5.600 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -5.659 6.638 5.766 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -4.555 7.215 7.038 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -5.749 8.326 6.324 1.00 0.00 H new ATOM 1169 N ASP A 439 -2.242 11.749 5.452 1.00 0.00 N ATOM 1170 CA ASP A 439 -2.318 13.203 5.371 1.00 0.00 C ATOM 1171 C ASP A 439 -1.075 13.775 4.707 1.00 0.00 C ATOM 1172 O ASP A 439 -1.077 14.901 4.227 1.00 0.00 O ATOM 1173 CB ASP A 439 -2.457 13.782 6.780 1.00 0.00 C ATOM 1174 CG ASP A 439 -3.584 14.791 6.884 1.00 0.00 C ATOM 1175 OD1 ASP A 439 -4.294 14.994 5.878 1.00 0.00 O ATOM 1176 OD2 ASP A 439 -3.754 15.380 7.973 1.00 0.00 O ATOM 0 H ASP A 439 -2.279 11.390 6.406 1.00 0.00 H new ATOM 0 HA ASP A 439 -3.186 13.473 4.769 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.633 12.971 7.487 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -1.520 14.258 7.068 1.00 0.00 H new ATOM 1181 N PHE A 440 -0.023 12.978 4.678 1.00 0.00 N ATOM 1182 CA PHE A 440 1.223 13.396 4.063 1.00 0.00 C ATOM 1183 C PHE A 440 1.102 13.297 2.553 1.00 0.00 C ATOM 1184 O PHE A 440 1.304 14.275 1.834 1.00 0.00 O ATOM 1185 CB PHE A 440 2.388 12.543 4.566 1.00 0.00 C ATOM 1186 CG PHE A 440 3.730 13.026 4.095 1.00 0.00 C ATOM 1187 CD1 PHE A 440 4.068 12.973 2.753 1.00 0.00 C ATOM 1188 CD2 PHE A 440 4.654 13.533 4.996 1.00 0.00 C ATOM 1189 CE1 PHE A 440 5.302 13.417 2.316 1.00 0.00 C ATOM 1190 CE2 PHE A 440 5.890 13.978 4.565 1.00 0.00 C ATOM 1191 CZ PHE A 440 6.214 13.920 3.223 1.00 0.00 C ATOM 0 H PHE A 440 -0.006 12.038 5.073 1.00 0.00 H new ATOM 0 HA PHE A 440 1.424 14.432 4.338 1.00 0.00 H new ATOM 0 HB2 PHE A 440 2.376 12.532 5.656 1.00 0.00 H new ATOM 0 HB3 PHE A 440 2.244 11.514 4.236 1.00 0.00 H new ATOM 0 HD1 PHE A 440 3.359 12.580 2.039 1.00 0.00 H new ATOM 0 HD2 PHE A 440 4.405 13.581 6.046 1.00 0.00 H new ATOM 0 HE1 PHE A 440 5.553 13.371 1.267 1.00 0.00 H new ATOM 0 HE2 PHE A 440 6.601 14.371 5.276 1.00 0.00 H new ATOM 0 HZ PHE A 440 7.179 14.267 2.884 1.00 0.00 H new ATOM 1201 N TYR A 441 0.751 12.108 2.079 1.00 0.00 N ATOM 1202 CA TYR A 441 0.581 11.877 0.662 1.00 0.00 C ATOM 1203 C TYR A 441 -0.517 12.771 0.118 1.00 0.00 C ATOM 1204 O TYR A 441 -0.324 13.466 -0.880 1.00 0.00 O ATOM 1205 CB TYR A 441 0.266 10.411 0.405 1.00 0.00 C ATOM 1206 CG TYR A 441 1.474 9.521 0.551 1.00 0.00 C ATOM 1207 CD1 TYR A 441 2.725 9.945 0.123 1.00 0.00 C ATOM 1208 CD2 TYR A 441 1.365 8.256 1.110 1.00 0.00 C ATOM 1209 CE1 TYR A 441 3.836 9.134 0.249 1.00 0.00 C ATOM 1210 CE2 TYR A 441 2.473 7.438 1.239 1.00 0.00 C ATOM 1211 CZ TYR A 441 3.705 7.882 0.808 1.00 0.00 C ATOM 1212 OH TYR A 441 4.810 7.072 0.933 1.00 0.00 O ATOM 0 H TYR A 441 0.579 11.290 2.663 1.00 0.00 H new ATOM 0 HA TYR A 441 1.509 12.122 0.146 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -0.508 10.083 1.099 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -0.141 10.302 -0.600 1.00 0.00 H new ATOM 0 HD1 TYR A 441 2.831 10.926 -0.316 1.00 0.00 H new ATOM 0 HD2 TYR A 441 0.402 7.905 1.449 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.802 9.480 -0.089 1.00 0.00 H new ATOM 0 HE2 TYR A 441 2.373 6.455 1.676 1.00 0.00 H new ATOM 0 HH TYR A 441 5.079 7.029 1.874 1.00 0.00 H new ATOM 1222 N ALA A 442 -1.661 12.781 0.793 1.00 0.00 N ATOM 1223 CA ALA A 442 -2.755 13.633 0.368 1.00 0.00 C ATOM 1224 C ALA A 442 -2.241 15.063 0.299 1.00 0.00 C ATOM 1225 O ALA A 442 -2.190 15.671 -0.770 1.00 0.00 O ATOM 1226 CB ALA A 442 -3.940 13.530 1.316 1.00 0.00 C ATOM 0 H ALA A 442 -1.850 12.218 1.622 1.00 0.00 H new ATOM 0 HA ALA A 442 -3.107 13.312 -0.612 1.00 0.00 H new ATOM 0 HB1 ALA A 442 -4.742 14.181 0.968 1.00 0.00 H new ATOM 0 HB2 ALA A 442 -4.295 12.500 1.344 1.00 0.00 H new ATOM 0 HB3 ALA A 442 -3.633 13.835 2.316 1.00 0.00 H new ATOM 1232 N LYS A 443 -1.852 15.588 1.458 1.00 0.00 N ATOM 1233 CA LYS A 443 -1.327 16.942 1.544 1.00 0.00 C ATOM 1234 C LYS A 443 -0.360 17.181 0.404 1.00 0.00 C ATOM 1235 O LYS A 443 -0.258 18.287 -0.124 1.00 0.00 O ATOM 1236 CB LYS A 443 -0.591 17.141 2.863 1.00 0.00 C ATOM 1237 CG LYS A 443 -1.496 17.379 4.051 1.00 0.00 C ATOM 1238 CD LYS A 443 -1.815 18.856 4.217 1.00 0.00 C ATOM 1239 CE LYS A 443 -2.253 19.487 2.905 1.00 0.00 C ATOM 1240 NZ LYS A 443 -2.503 20.949 3.049 1.00 0.00 N ATOM 0 H LYS A 443 -1.892 15.094 2.349 1.00 0.00 H new ATOM 0 HA LYS A 443 -2.159 17.644 1.485 1.00 0.00 H new ATOM 0 HB2 LYS A 443 0.023 16.262 3.059 1.00 0.00 H new ATOM 0 HB3 LYS A 443 0.088 17.988 2.763 1.00 0.00 H new ATOM 0 HG2 LYS A 443 -2.421 16.817 3.924 1.00 0.00 H new ATOM 0 HG3 LYS A 443 -1.017 17.004 4.956 1.00 0.00 H new ATOM 0 HD2 LYS A 443 -2.603 18.977 4.960 1.00 0.00 H new ATOM 0 HD3 LYS A 443 -0.936 19.378 4.596 1.00 0.00 H new ATOM 0 HE2 LYS A 443 -1.485 19.322 2.149 1.00 0.00 H new ATOM 0 HE3 LYS A 443 -3.160 18.997 2.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 -2.800 21.342 2.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 -3.253 21.105 3.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 -1.631 21.421 3.362 1.00 0.00 H new ATOM 1254 N GLN A 444 0.323 16.118 0.011 1.00 0.00 N ATOM 1255 CA GLN A 444 1.257 16.191 -1.098 1.00 0.00 C ATOM 1256 C GLN A 444 0.476 16.461 -2.378 1.00 0.00 C ATOM 1257 O GLN A 444 0.731 17.428 -3.094 1.00 0.00 O ATOM 1258 CB GLN A 444 2.045 14.886 -1.221 1.00 0.00 C ATOM 1259 CG GLN A 444 3.436 15.066 -1.804 1.00 0.00 C ATOM 1260 CD GLN A 444 3.514 14.652 -3.261 1.00 0.00 C ATOM 1261 OE1 GLN A 444 4.065 15.371 -4.095 1.00 0.00 O ATOM 1262 NE2 GLN A 444 2.960 13.486 -3.575 1.00 0.00 N ATOM 0 H GLN A 444 0.248 15.197 0.443 1.00 0.00 H new ATOM 0 HA GLN A 444 1.969 16.998 -0.924 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.130 14.429 -0.235 1.00 0.00 H new ATOM 0 HB3 GLN A 444 1.485 14.191 -1.847 1.00 0.00 H new ATOM 0 HG2 GLN A 444 3.733 16.110 -1.710 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.148 14.479 -1.224 1.00 0.00 H new ATOM 0 HE21 GLN A 444 2.514 12.922 -2.852 1.00 0.00 H new ATOM 0 HE22 GLN A 444 2.981 13.155 -4.539 1.00 0.00 H new ATOM 1271 N ARG A 445 -0.474 15.574 -2.654 1.00 0.00 N ATOM 1272 CA ARG A 445 -1.305 15.683 -3.848 1.00 0.00 C ATOM 1273 C ARG A 445 -1.658 17.145 -4.093 1.00 0.00 C ATOM 1274 O ARG A 445 -1.476 17.665 -5.194 1.00 0.00 O ATOM 1275 CB ARG A 445 -2.579 14.852 -3.689 1.00 0.00 C ATOM 1276 CG ARG A 445 -3.215 14.449 -5.008 1.00 0.00 C ATOM 1277 CD ARG A 445 -3.028 15.524 -6.065 1.00 0.00 C ATOM 1278 NE ARG A 445 -3.498 15.090 -7.378 1.00 0.00 N ATOM 1279 CZ ARG A 445 -3.597 15.899 -8.428 1.00 0.00 C ATOM 1280 NH1 ARG A 445 -3.265 17.177 -8.317 1.00 0.00 N ATOM 1281 NH2 ARG A 445 -4.030 15.429 -9.589 1.00 0.00 N ATOM 0 H ARG A 445 -0.688 14.769 -2.065 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.749 15.300 -4.704 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -2.347 13.953 -3.118 1.00 0.00 H new ATOM 0 HB3 ARG A 445 -3.303 15.421 -3.106 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -2.775 13.514 -5.355 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -4.279 14.264 -4.859 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -3.567 16.423 -5.766 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -1.973 15.791 -6.128 1.00 0.00 H new ATOM 0 HE ARG A 445 -3.765 14.113 -7.496 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -2.933 17.542 -7.424 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -3.342 17.796 -9.124 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -4.288 14.446 -9.677 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -4.106 16.050 -10.394 1.00 0.00 H new ATOM 1295 N ALA A 446 -2.135 17.808 -3.046 1.00 0.00 N ATOM 1296 CA ALA A 446 -2.485 19.219 -3.126 1.00 0.00 C ATOM 1297 C ALA A 446 -1.212 20.058 -3.163 1.00 0.00 C ATOM 1298 O ALA A 446 -1.147 21.107 -3.804 1.00 0.00 O ATOM 1299 CB ALA A 446 -3.350 19.615 -1.942 1.00 0.00 C ATOM 0 H ALA A 446 -2.288 17.388 -2.129 1.00 0.00 H new ATOM 0 HA ALA A 446 -3.054 19.397 -4.038 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -3.604 20.672 -2.015 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -4.264 19.021 -1.944 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -2.803 19.436 -1.016 1.00 0.00 H new ATOM 1305 N ALA A 447 -0.201 19.557 -2.466 1.00 0.00 N ATOM 1306 CA ALA A 447 1.108 20.198 -2.384 1.00 0.00 C ATOM 1307 C ALA A 447 2.003 19.744 -3.535 1.00 0.00 C ATOM 1308 O ALA A 447 3.220 19.641 -3.384 1.00 0.00 O ATOM 1309 CB ALA A 447 1.776 19.906 -1.049 1.00 0.00 C ATOM 0 H ALA A 447 -0.265 18.687 -1.937 1.00 0.00 H new ATOM 0 HA ALA A 447 0.959 21.275 -2.463 1.00 0.00 H new ATOM 0 HB1 ALA A 447 2.749 20.395 -1.014 1.00 0.00 H new ATOM 0 HB2 ALA A 447 1.151 20.283 -0.239 1.00 0.00 H new ATOM 0 HB3 ALA A 447 1.907 18.830 -0.935 1.00 0.00 H new ATOM 1315 N ILE A 448 1.392 19.478 -4.686 1.00 0.00 N ATOM 1316 CA ILE A 448 2.132 19.043 -5.864 1.00 0.00 C ATOM 1317 C ILE A 448 2.557 20.239 -6.711 1.00 0.00 C ATOM 1318 O ILE A 448 1.727 21.058 -7.106 1.00 0.00 O ATOM 1319 CB ILE A 448 1.294 18.082 -6.732 1.00 0.00 C ATOM 1320 CG1 ILE A 448 1.116 16.741 -6.017 1.00 0.00 C ATOM 1321 CG2 ILE A 448 1.949 17.880 -8.091 1.00 0.00 C ATOM 1322 CD1 ILE A 448 0.427 15.692 -6.862 1.00 0.00 C ATOM 0 H ILE A 448 0.385 19.557 -4.827 1.00 0.00 H new ATOM 0 HA ILE A 448 3.018 18.516 -5.509 1.00 0.00 H new ATOM 0 HB ILE A 448 0.311 18.525 -6.889 1.00 0.00 H new ATOM 0 HG12 ILE A 448 2.094 16.367 -5.715 1.00 0.00 H new ATOM 0 HG13 ILE A 448 0.539 16.898 -5.106 1.00 0.00 H new ATOM 0 HG21 ILE A 448 1.343 17.199 -8.689 1.00 0.00 H new ATOM 0 HG22 ILE A 448 2.029 18.839 -8.603 1.00 0.00 H new ATOM 0 HG23 ILE A 448 2.944 17.457 -7.956 1.00 0.00 H new ATOM 0 HD11 ILE A 448 0.335 14.768 -6.291 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -0.565 16.045 -7.143 1.00 0.00 H new ATOM 0 HD13 ILE A 448 1.014 15.506 -7.761 1.00 0.00 H new ATOM 1334 N PRO A 449 3.861 20.354 -7.000 1.00 0.00 N ATOM 1335 CA PRO A 449 4.401 21.456 -7.804 1.00 0.00 C ATOM 1336 C PRO A 449 3.914 21.411 -9.248 1.00 0.00 C ATOM 1337 O PRO A 449 3.473 22.422 -9.796 1.00 0.00 O ATOM 1338 CB PRO A 449 5.916 21.238 -7.743 1.00 0.00 C ATOM 1339 CG PRO A 449 6.082 19.791 -7.433 1.00 0.00 C ATOM 1340 CD PRO A 449 4.913 19.419 -6.567 1.00 0.00 C ATOM 0 HA PRO A 449 4.084 22.428 -7.426 1.00 0.00 H new ATOM 0 HB2 PRO A 449 6.391 21.496 -8.689 1.00 0.00 H new ATOM 0 HB3 PRO A 449 6.374 21.862 -6.976 1.00 0.00 H new ATOM 0 HG2 PRO A 449 6.097 19.195 -8.346 1.00 0.00 H new ATOM 0 HG3 PRO A 449 7.024 19.608 -6.917 1.00 0.00 H new ATOM 0 HD2 PRO A 449 4.615 18.381 -6.717 1.00 0.00 H new ATOM 0 HD3 PRO A 449 5.144 19.535 -5.508 1.00 0.00 H new ATOM 1348 N ARG A 450 3.997 20.235 -9.861 1.00 0.00 N ATOM 1349 CA ARG A 450 3.566 20.061 -11.243 1.00 0.00 C ATOM 1350 C ARG A 450 2.652 18.848 -11.381 1.00 0.00 C ATOM 1351 O ARG A 450 3.048 17.721 -11.082 1.00 0.00 O ATOM 1352 CB ARG A 450 4.779 19.909 -12.161 1.00 0.00 C ATOM 1353 CG ARG A 450 5.117 21.171 -12.937 1.00 0.00 C ATOM 1354 CD ARG A 450 5.777 22.212 -12.045 1.00 0.00 C ATOM 1355 NE ARG A 450 4.942 23.398 -11.879 1.00 0.00 N ATOM 1356 CZ ARG A 450 4.778 24.321 -12.821 1.00 0.00 C ATOM 1357 NH1 ARG A 450 5.390 24.194 -13.991 1.00 0.00 N ATOM 1358 NH2 ARG A 450 4.002 25.373 -12.595 1.00 0.00 N ATOM 0 H ARG A 450 4.359 19.388 -9.422 1.00 0.00 H new ATOM 0 HA ARG A 450 3.006 20.948 -11.537 1.00 0.00 H new ATOM 0 HB2 ARG A 450 5.643 19.618 -11.563 1.00 0.00 H new ATOM 0 HB3 ARG A 450 4.592 19.099 -12.865 1.00 0.00 H new ATOM 0 HG2 ARG A 450 5.783 20.924 -13.764 1.00 0.00 H new ATOM 0 HG3 ARG A 450 4.208 21.586 -13.372 1.00 0.00 H new ATOM 0 HD2 ARG A 450 5.983 21.774 -11.068 1.00 0.00 H new ATOM 0 HD3 ARG A 450 6.736 22.501 -12.474 1.00 0.00 H new ATOM 0 HE ARG A 450 4.457 23.525 -10.991 1.00 0.00 H new ATOM 0 HH11 ARG A 450 5.988 23.387 -14.169 1.00 0.00 H new ATOM 0 HH12 ARG A 450 5.263 24.903 -14.713 1.00 0.00 H new ATOM 0 HH21 ARG A 450 3.530 25.475 -11.697 1.00 0.00 H new ATOM 0 HH22 ARG A 450 3.878 26.080 -13.320 1.00 0.00 H new ATOM 1372 N SER A 451 1.425 19.086 -11.837 1.00 0.00 N ATOM 1373 CA SER A 451 0.454 18.012 -12.016 1.00 0.00 C ATOM 1374 C SER A 451 -0.196 18.090 -13.394 1.00 0.00 C ATOM 1375 O SER A 451 -0.704 19.137 -13.793 1.00 0.00 O ATOM 1376 CB SER A 451 -0.620 18.081 -10.929 1.00 0.00 C ATOM 1377 OG SER A 451 -1.718 17.242 -11.244 1.00 0.00 O ATOM 0 H SER A 451 1.080 20.012 -12.089 1.00 0.00 H new ATOM 0 HA SER A 451 0.982 17.062 -11.936 1.00 0.00 H new ATOM 0 HB2 SER A 451 -0.193 17.782 -9.972 1.00 0.00 H new ATOM 0 HB3 SER A 451 -0.964 19.109 -10.818 1.00 0.00 H new ATOM 0 HG SER A 451 -2.554 17.693 -11.003 1.00 0.00 H new ATOM 1383 N GLU A 452 -0.175 16.974 -14.115 1.00 0.00 N ATOM 1384 CA GLU A 452 -0.764 16.916 -15.449 1.00 0.00 C ATOM 1385 C GLU A 452 -2.091 16.163 -15.427 1.00 0.00 C ATOM 1386 O GLU A 452 -2.963 16.398 -16.263 1.00 0.00 O ATOM 1387 CB GLU A 452 0.200 16.242 -16.427 1.00 0.00 C ATOM 1388 CG GLU A 452 0.614 17.135 -17.586 1.00 0.00 C ATOM 1389 CD GLU A 452 1.762 18.059 -17.228 1.00 0.00 C ATOM 1390 OE1 GLU A 452 1.663 18.757 -16.198 1.00 0.00 O ATOM 1391 OE2 GLU A 452 2.760 18.084 -17.980 1.00 0.00 O ATOM 0 H GLU A 452 0.243 16.099 -13.799 1.00 0.00 H new ATOM 0 HA GLU A 452 -0.951 17.938 -15.779 1.00 0.00 H new ATOM 0 HB2 GLU A 452 1.092 15.926 -15.886 1.00 0.00 H new ATOM 0 HB3 GLU A 452 -0.268 15.341 -16.823 1.00 0.00 H new ATOM 0 HG2 GLU A 452 0.903 16.514 -18.434 1.00 0.00 H new ATOM 0 HG3 GLU A 452 -0.241 17.731 -17.905 1.00 0.00 H new ATOM 1398 N SER A 453 -2.235 15.257 -14.465 1.00 0.00 N ATOM 1399 CA SER A 453 -3.455 14.470 -14.334 1.00 0.00 C ATOM 1400 C SER A 453 -4.431 15.133 -13.367 1.00 0.00 C ATOM 1401 O SER A 453 -5.426 14.479 -12.990 1.00 0.00 O ATOM 1402 CB SER A 453 -3.126 13.056 -13.853 1.00 0.00 C ATOM 1403 OG SER A 453 -2.547 13.078 -12.559 1.00 0.00 O ATOM 1404 OXT SER A 453 -4.191 16.301 -12.995 1.00 0.00 O ATOM 0 H SER A 453 -1.522 15.050 -13.765 1.00 0.00 H new ATOM 0 HA SER A 453 -3.926 14.413 -15.315 1.00 0.00 H new ATOM 0 HB2 SER A 453 -4.034 12.453 -13.838 1.00 0.00 H new ATOM 0 HB3 SER A 453 -2.440 12.581 -14.554 1.00 0.00 H new ATOM 0 HG SER A 453 -2.348 12.162 -12.274 1.00 0.00 H new TER 1410 SER A 453