USER MOD reduce.3.24.130724 H: found=0, std=0, add=550, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 550 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 NoAdj-H: A 346 HIS HD1 : A 346 HIS ND1 : A 402 ZNZN :(H bumps) USER MOD Set 1.1: A 355 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 356 SER OG : rot 180:sc= 0 USER MOD Single : A 303 SER OG : rot 180:sc= 0 USER MOD Single : A 306 SER OG : rot 180:sc= 0 USER MOD Single : A 311 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 315 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 316 LYS NZ :NH3+ 164:sc= -0.513 (180deg=-1.09) USER MOD Single : A 320 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 324 HIS : no HE2:sc= 0.714 K(o=0.71,f=-2.5!) USER MOD Single : A 334 LYS NZ :NH3+ -172:sc= 0.17 (180deg=0.149) USER MOD Single : A 335 GLN : amide:sc= -2.39! C(o=-2.4!,f=-3.8!) USER MOD Single : A 343 MET CE :methyl 180:sc=-0.00248 (180deg=-0.00248) USER MOD Single : A 348 TYR OH : rot 180:sc= -0.277 USER MOD Single : A 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 364 TYR OH : rot 176:sc= 0.676 USER MOD Single : A 367 SER OG : rot 180:sc= 0.0254 USER MOD Single : A 370 THR OG1 : rot 60:sc= 1.1 USER MOD Single : A 372 SER OG : rot 180:sc= 0 USER MOD Single : A 373 SER OG : rot 124:sc= 0.287 USER MOD Single : A 377 GLN : amide:sc= -0.0312 X(o=-0.031,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 303 13.533 11.144 -1.010 1.00 0.00 N ATOM 2 CA SER A 303 12.827 12.157 -1.805 1.00 0.00 C ATOM 3 C SER A 303 12.167 13.202 -0.871 1.00 0.00 C ATOM 4 O SER A 303 12.140 14.404 -1.182 1.00 0.00 O ATOM 5 CB SER A 303 11.778 11.462 -2.704 1.00 0.00 C ATOM 6 OG SER A 303 11.160 12.376 -3.593 1.00 0.00 O ATOM 0 HA SER A 303 13.535 12.685 -2.444 1.00 0.00 H new ATOM 0 HB2 SER A 303 12.258 10.667 -3.275 1.00 0.00 H new ATOM 0 HB3 SER A 303 11.018 10.992 -2.080 1.00 0.00 H new ATOM 0 HG SER A 303 10.505 11.902 -4.146 1.00 0.00 H new ATOM 12 N GLY A 304 11.638 12.724 0.280 1.00 0.00 N ATOM 13 CA GLY A 304 11.102 13.604 1.332 1.00 0.00 C ATOM 14 C GLY A 304 12.177 13.964 2.366 1.00 0.00 C ATOM 15 O GLY A 304 13.093 13.158 2.578 1.00 0.00 O ATOM 0 H GLY A 304 11.573 11.730 0.499 1.00 0.00 H new ATOM 0 HA2 GLY A 304 10.710 14.515 0.881 1.00 0.00 H new ATOM 0 HA3 GLY A 304 10.267 13.111 1.830 1.00 0.00 H new ATOM 19 N PRO A 305 12.103 15.164 3.037 1.00 0.00 N ATOM 20 CA PRO A 305 13.105 15.583 4.062 1.00 0.00 C ATOM 21 C PRO A 305 13.123 14.642 5.290 1.00 0.00 C ATOM 22 O PRO A 305 12.062 14.261 5.813 1.00 0.00 O ATOM 23 CB PRO A 305 12.661 17.025 4.435 1.00 0.00 C ATOM 24 CG PRO A 305 11.209 17.090 4.065 1.00 0.00 C ATOM 25 CD PRO A 305 11.051 16.205 2.847 1.00 0.00 C ATOM 0 HA PRO A 305 14.127 15.541 3.686 1.00 0.00 H new ATOM 0 HB2 PRO A 305 12.807 17.221 5.497 1.00 0.00 H new ATOM 0 HB3 PRO A 305 13.241 17.770 3.891 1.00 0.00 H new ATOM 0 HG2 PRO A 305 10.581 16.742 4.885 1.00 0.00 H new ATOM 0 HG3 PRO A 305 10.907 18.114 3.845 1.00 0.00 H new ATOM 0 HD2 PRO A 305 10.055 15.765 2.796 1.00 0.00 H new ATOM 0 HD3 PRO A 305 11.200 16.763 1.923 1.00 0.00 H new ATOM 33 N SER A 306 14.345 14.273 5.729 1.00 0.00 N ATOM 34 CA SER A 306 14.561 13.340 6.847 1.00 0.00 C ATOM 35 C SER A 306 14.086 13.936 8.193 1.00 0.00 C ATOM 36 O SER A 306 13.921 15.161 8.329 1.00 0.00 O ATOM 37 CB SER A 306 16.049 12.933 6.912 1.00 0.00 C ATOM 38 OG SER A 306 16.483 12.389 5.674 1.00 0.00 O ATOM 0 H SER A 306 15.211 14.617 5.314 1.00 0.00 H new ATOM 0 HA SER A 306 13.960 12.449 6.667 1.00 0.00 H new ATOM 0 HB2 SER A 306 16.657 13.802 7.164 1.00 0.00 H new ATOM 0 HB3 SER A 306 16.195 12.201 7.706 1.00 0.00 H new ATOM 0 HG SER A 306 17.429 12.140 5.739 1.00 0.00 H new ATOM 44 N CYS A 307 13.894 13.056 9.185 1.00 0.00 N ATOM 45 CA CYS A 307 13.250 13.407 10.460 1.00 0.00 C ATOM 46 C CYS A 307 13.905 12.699 11.658 1.00 0.00 C ATOM 47 O CYS A 307 13.711 11.498 11.855 1.00 0.00 O ATOM 48 CB CYS A 307 11.738 13.064 10.388 1.00 0.00 C ATOM 49 SG CYS A 307 10.713 14.318 9.569 1.00 0.00 S ATOM 0 H CYS A 307 14.181 12.079 9.127 1.00 0.00 H new ATOM 0 HA CYS A 307 13.379 14.478 10.616 1.00 0.00 H new ATOM 0 HB2 CYS A 307 11.619 12.117 9.862 1.00 0.00 H new ATOM 0 HB3 CYS A 307 11.365 12.915 11.401 1.00 0.00 H new ATOM 54 N ARG A 308 14.689 13.461 12.451 1.00 0.00 N ATOM 55 CA ARG A 308 15.159 13.002 13.773 1.00 0.00 C ATOM 56 C ARG A 308 13.962 13.046 14.749 1.00 0.00 C ATOM 57 O ARG A 308 13.726 12.116 15.526 1.00 0.00 O ATOM 58 CB ARG A 308 16.333 13.871 14.357 1.00 0.00 C ATOM 59 CG ARG A 308 17.397 14.394 13.354 1.00 0.00 C ATOM 60 CD ARG A 308 17.012 15.757 12.742 1.00 0.00 C ATOM 61 NE ARG A 308 18.094 16.330 11.918 1.00 0.00 N ATOM 62 CZ ARG A 308 18.474 17.623 11.909 1.00 0.00 C ATOM 63 NH1 ARG A 308 17.908 18.504 12.721 1.00 0.00 N ATOM 64 NH2 ARG A 308 19.444 18.016 11.107 1.00 0.00 N ATOM 0 H ARG A 308 15.009 14.396 12.197 1.00 0.00 H new ATOM 0 HA ARG A 308 15.552 11.992 13.651 1.00 0.00 H new ATOM 0 HB2 ARG A 308 15.896 14.731 14.865 1.00 0.00 H new ATOM 0 HB3 ARG A 308 16.846 13.280 15.115 1.00 0.00 H new ATOM 0 HG2 ARG A 308 18.357 14.486 13.862 1.00 0.00 H new ATOM 0 HG3 ARG A 308 17.528 13.664 12.555 1.00 0.00 H new ATOM 0 HD2 ARG A 308 16.118 15.638 12.130 1.00 0.00 H new ATOM 0 HD3 ARG A 308 16.761 16.453 13.542 1.00 0.00 H new ATOM 0 HE ARG A 308 18.598 15.692 11.302 1.00 0.00 H new ATOM 0 HH11 ARG A 308 17.174 18.207 13.364 1.00 0.00 H new ATOM 0 HH12 ARG A 308 18.206 19.479 12.703 1.00 0.00 H new ATOM 0 HH21 ARG A 308 19.905 17.342 10.495 1.00 0.00 H new ATOM 0 HH22 ARG A 308 19.734 18.994 11.098 1.00 0.00 H new ATOM 78 N PHE A 309 13.187 14.148 14.634 1.00 0.00 N ATOM 79 CA PHE A 309 12.020 14.449 15.494 1.00 0.00 C ATOM 80 C PHE A 309 10.819 13.501 15.245 1.00 0.00 C ATOM 81 O PHE A 309 9.798 13.604 15.928 1.00 0.00 O ATOM 82 CB PHE A 309 11.566 15.922 15.269 1.00 0.00 C ATOM 83 CG PHE A 309 12.606 16.985 15.648 1.00 0.00 C ATOM 84 CD1 PHE A 309 12.741 17.406 16.978 1.00 0.00 C ATOM 85 CD2 PHE A 309 13.440 17.569 14.689 1.00 0.00 C ATOM 86 CE1 PHE A 309 13.663 18.380 17.327 1.00 0.00 C ATOM 87 CE2 PHE A 309 14.362 18.542 15.046 1.00 0.00 C ATOM 88 CZ PHE A 309 14.475 18.940 16.364 1.00 0.00 C ATOM 0 H PHE A 309 13.358 14.865 13.929 1.00 0.00 H new ATOM 0 HA PHE A 309 12.343 14.297 16.524 1.00 0.00 H new ATOM 0 HB2 PHE A 309 11.304 16.049 14.219 1.00 0.00 H new ATOM 0 HB3 PHE A 309 10.659 16.100 15.847 1.00 0.00 H new ATOM 0 HD1 PHE A 309 12.118 16.965 17.742 1.00 0.00 H new ATOM 0 HD2 PHE A 309 13.365 17.258 13.657 1.00 0.00 H new ATOM 0 HE1 PHE A 309 13.745 18.701 18.355 1.00 0.00 H new ATOM 0 HE2 PHE A 309 14.993 18.989 14.292 1.00 0.00 H new ATOM 0 HZ PHE A 309 15.200 19.691 16.640 1.00 0.00 H new ATOM 98 N CYS A 310 10.918 12.598 14.253 1.00 0.00 N ATOM 99 CA CYS A 310 9.809 11.671 13.912 1.00 0.00 C ATOM 100 C CYS A 310 10.332 10.246 13.653 1.00 0.00 C ATOM 101 O CYS A 310 9.531 9.345 13.389 1.00 0.00 O ATOM 102 CB CYS A 310 9.037 12.197 12.676 1.00 0.00 C ATOM 103 SG CYS A 310 8.554 13.954 12.789 1.00 0.00 S ATOM 0 H CYS A 310 11.749 12.486 13.672 1.00 0.00 H new ATOM 0 HA CYS A 310 9.129 11.627 14.763 1.00 0.00 H new ATOM 0 HB2 CYS A 310 9.655 12.058 11.789 1.00 0.00 H new ATOM 0 HB3 CYS A 310 8.140 11.593 12.538 1.00 0.00 H new ATOM 108 N LYS A 311 11.684 10.062 13.713 1.00 0.00 N ATOM 109 CA LYS A 311 12.380 8.773 13.422 1.00 0.00 C ATOM 110 C LYS A 311 12.127 8.272 11.975 1.00 0.00 C ATOM 111 O LYS A 311 12.440 7.116 11.654 1.00 0.00 O ATOM 112 CB LYS A 311 11.980 7.676 14.450 1.00 0.00 C ATOM 113 CG LYS A 311 12.294 8.018 15.924 1.00 0.00 C ATOM 114 CD LYS A 311 11.785 6.934 16.906 1.00 0.00 C ATOM 115 CE LYS A 311 10.259 6.725 16.823 1.00 0.00 C ATOM 116 NZ LYS A 311 9.787 5.643 17.717 1.00 0.00 N ATOM 0 H LYS A 311 12.326 10.812 13.967 1.00 0.00 H new ATOM 0 HA LYS A 311 13.448 8.972 13.514 1.00 0.00 H new ATOM 0 HB2 LYS A 311 10.911 7.484 14.357 1.00 0.00 H new ATOM 0 HB3 LYS A 311 12.494 6.751 14.190 1.00 0.00 H new ATOM 0 HG2 LYS A 311 13.371 8.136 16.045 1.00 0.00 H new ATOM 0 HG3 LYS A 311 11.838 8.975 16.177 1.00 0.00 H new ATOM 0 HD2 LYS A 311 12.289 5.991 16.693 1.00 0.00 H new ATOM 0 HD3 LYS A 311 12.054 7.216 17.924 1.00 0.00 H new ATOM 0 HE2 LYS A 311 9.753 7.655 17.084 1.00 0.00 H new ATOM 0 HE3 LYS A 311 9.983 6.490 15.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 8.756 5.542 17.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 10.248 4.749 17.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 10.025 5.878 18.702 1.00 0.00 H new ATOM 130 N ASP A 312 11.588 9.173 11.117 1.00 0.00 N ATOM 131 CA ASP A 312 11.130 8.858 9.738 1.00 0.00 C ATOM 132 C ASP A 312 10.074 7.734 9.723 1.00 0.00 C ATOM 133 O ASP A 312 9.962 6.985 8.744 1.00 0.00 O ATOM 134 CB ASP A 312 12.338 8.530 8.817 1.00 0.00 C ATOM 135 CG ASP A 312 13.276 9.733 8.665 1.00 0.00 C ATOM 136 OD1 ASP A 312 14.334 9.786 9.332 1.00 0.00 O ATOM 137 OD2 ASP A 312 12.933 10.661 7.915 1.00 0.00 O ATOM 0 H ASP A 312 11.457 10.153 11.366 1.00 0.00 H new ATOM 0 HA ASP A 312 10.641 9.747 9.341 1.00 0.00 H new ATOM 0 HB2 ASP A 312 12.892 7.686 9.229 1.00 0.00 H new ATOM 0 HB3 ASP A 312 11.975 8.225 7.836 1.00 0.00 H new ATOM 142 N ASP A 313 9.274 7.651 10.809 1.00 0.00 N ATOM 143 CA ASP A 313 8.217 6.630 10.960 1.00 0.00 C ATOM 144 C ASP A 313 7.085 6.901 9.949 1.00 0.00 C ATOM 145 O ASP A 313 6.665 8.046 9.777 1.00 0.00 O ATOM 146 CB ASP A 313 7.666 6.618 12.413 1.00 0.00 C ATOM 147 CG ASP A 313 6.884 5.335 12.764 1.00 0.00 C ATOM 148 OD1 ASP A 313 7.448 4.443 13.439 1.00 0.00 O ATOM 149 OD2 ASP A 313 5.705 5.212 12.369 1.00 0.00 O ATOM 0 H ASP A 313 9.343 8.288 11.602 1.00 0.00 H new ATOM 0 HA ASP A 313 8.644 5.648 10.758 1.00 0.00 H new ATOM 0 HB2 ASP A 313 8.497 6.729 13.109 1.00 0.00 H new ATOM 0 HB3 ASP A 313 7.015 7.481 12.553 1.00 0.00 H new ATOM 154 N GLU A 314 6.617 5.841 9.300 1.00 0.00 N ATOM 155 CA GLU A 314 5.637 5.926 8.201 1.00 0.00 C ATOM 156 C GLU A 314 4.202 6.102 8.737 1.00 0.00 C ATOM 157 O GLU A 314 3.346 6.697 8.071 1.00 0.00 O ATOM 158 CB GLU A 314 5.724 4.631 7.366 1.00 0.00 C ATOM 159 CG GLU A 314 7.150 4.254 6.912 1.00 0.00 C ATOM 160 CD GLU A 314 7.219 2.832 6.342 1.00 0.00 C ATOM 161 OE1 GLU A 314 7.013 1.875 7.115 1.00 0.00 O ATOM 162 OE2 GLU A 314 7.481 2.661 5.132 1.00 0.00 O ATOM 0 H GLU A 314 6.904 4.886 9.517 1.00 0.00 H new ATOM 0 HA GLU A 314 5.870 6.796 7.588 1.00 0.00 H new ATOM 0 HB2 GLU A 314 5.314 3.808 7.952 1.00 0.00 H new ATOM 0 HB3 GLU A 314 5.093 4.740 6.484 1.00 0.00 H new ATOM 0 HG2 GLU A 314 7.488 4.963 6.157 1.00 0.00 H new ATOM 0 HG3 GLU A 314 7.833 4.338 7.757 1.00 0.00 H new ATOM 169 N ASN A 315 3.962 5.566 9.948 1.00 0.00 N ATOM 170 CA ASN A 315 2.617 5.500 10.553 1.00 0.00 C ATOM 171 C ASN A 315 2.332 6.748 11.396 1.00 0.00 C ATOM 172 O ASN A 315 1.187 7.217 11.445 1.00 0.00 O ATOM 173 CB ASN A 315 2.468 4.222 11.425 1.00 0.00 C ATOM 174 CG ASN A 315 2.530 2.920 10.618 1.00 0.00 C ATOM 175 OD1 ASN A 315 1.510 2.413 10.146 1.00 0.00 O ATOM 176 ND2 ASN A 315 3.724 2.379 10.446 1.00 0.00 N ATOM 0 H ASN A 315 4.694 5.166 10.535 1.00 0.00 H new ATOM 0 HA ASN A 315 1.890 5.458 9.742 1.00 0.00 H new ATOM 0 HB2 ASN A 315 3.256 4.211 12.178 1.00 0.00 H new ATOM 0 HB3 ASN A 315 1.518 4.265 11.959 1.00 0.00 H new ATOM 0 HD21 ASN A 315 3.821 1.517 9.909 1.00 0.00 H new ATOM 0 HD22 ASN A 315 4.548 2.824 10.850 1.00 0.00 H new ATOM 183 N LYS A 316 3.364 7.259 12.095 1.00 0.00 N ATOM 184 CA LYS A 316 3.220 8.459 12.938 1.00 0.00 C ATOM 185 C LYS A 316 3.294 9.726 12.050 1.00 0.00 C ATOM 186 O LYS A 316 4.183 9.814 11.197 1.00 0.00 O ATOM 187 CB LYS A 316 4.304 8.518 14.065 1.00 0.00 C ATOM 188 CG LYS A 316 4.541 7.201 14.864 1.00 0.00 C ATOM 189 CD LYS A 316 3.264 6.498 15.415 1.00 0.00 C ATOM 190 CE LYS A 316 2.507 7.280 16.518 1.00 0.00 C ATOM 191 NZ LYS A 316 1.681 8.387 15.981 1.00 0.00 N ATOM 0 H LYS A 316 4.303 6.860 12.092 1.00 0.00 H new ATOM 0 HA LYS A 316 2.249 8.411 13.431 1.00 0.00 H new ATOM 0 HB2 LYS A 316 5.250 8.820 13.615 1.00 0.00 H new ATOM 0 HB3 LYS A 316 4.022 9.300 14.770 1.00 0.00 H new ATOM 0 HG2 LYS A 316 5.069 6.498 14.220 1.00 0.00 H new ATOM 0 HG3 LYS A 316 5.201 7.422 15.703 1.00 0.00 H new ATOM 0 HD2 LYS A 316 2.581 6.318 14.585 1.00 0.00 H new ATOM 0 HD3 LYS A 316 3.547 5.523 15.812 1.00 0.00 H new ATOM 0 HE2 LYS A 316 1.867 6.591 17.070 1.00 0.00 H new ATOM 0 HE3 LYS A 316 3.228 7.684 17.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 1.001 8.695 16.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 2.296 9.185 15.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 1.166 8.059 15.139 1.00 0.00 H new ATOM 205 N PRO A 317 2.356 10.719 12.221 1.00 0.00 N ATOM 206 CA PRO A 317 2.366 11.986 11.437 1.00 0.00 C ATOM 207 C PRO A 317 3.572 12.901 11.771 1.00 0.00 C ATOM 208 O PRO A 317 4.320 12.667 12.730 1.00 0.00 O ATOM 209 CB PRO A 317 1.017 12.653 11.823 1.00 0.00 C ATOM 210 CG PRO A 317 0.703 12.104 13.180 1.00 0.00 C ATOM 211 CD PRO A 317 1.199 10.673 13.155 1.00 0.00 C ATOM 0 HA PRO A 317 2.471 11.803 10.368 1.00 0.00 H new ATOM 0 HB2 PRO A 317 1.103 13.739 11.844 1.00 0.00 H new ATOM 0 HB3 PRO A 317 0.234 12.409 11.105 1.00 0.00 H new ATOM 0 HG2 PRO A 317 1.199 12.679 13.962 1.00 0.00 H new ATOM 0 HG3 PRO A 317 -0.367 12.146 13.384 1.00 0.00 H new ATOM 0 HD2 PRO A 317 1.498 10.335 14.147 1.00 0.00 H new ATOM 0 HD3 PRO A 317 0.428 9.988 12.804 1.00 0.00 H new ATOM 219 N CYS A 318 3.729 13.959 10.961 1.00 0.00 N ATOM 220 CA CYS A 318 4.844 14.910 11.051 1.00 0.00 C ATOM 221 C CYS A 318 4.281 16.347 11.024 1.00 0.00 C ATOM 222 O CYS A 318 3.818 16.817 9.987 1.00 0.00 O ATOM 223 CB CYS A 318 5.812 14.659 9.870 1.00 0.00 C ATOM 224 SG CYS A 318 7.188 15.842 9.742 1.00 0.00 S ATOM 0 H CYS A 318 3.072 14.180 10.212 1.00 0.00 H new ATOM 0 HA CYS A 318 5.395 14.776 11.982 1.00 0.00 H new ATOM 0 HB2 CYS A 318 6.224 13.654 9.964 1.00 0.00 H new ATOM 0 HB3 CYS A 318 5.243 14.685 8.941 1.00 0.00 H new ATOM 229 N ARG A 319 4.310 17.028 12.189 1.00 0.00 N ATOM 230 CA ARG A 319 3.722 18.381 12.369 1.00 0.00 C ATOM 231 C ARG A 319 4.805 19.424 12.694 1.00 0.00 C ATOM 232 O ARG A 319 4.725 20.573 12.256 1.00 0.00 O ATOM 233 CB ARG A 319 2.666 18.329 13.506 1.00 0.00 C ATOM 234 CG ARG A 319 1.843 19.626 13.709 1.00 0.00 C ATOM 235 CD ARG A 319 0.703 19.439 14.730 1.00 0.00 C ATOM 236 NE ARG A 319 1.197 18.940 16.037 1.00 0.00 N ATOM 237 CZ ARG A 319 0.792 17.815 16.659 1.00 0.00 C ATOM 238 NH1 ARG A 319 -0.086 17.001 16.089 1.00 0.00 N ATOM 239 NH2 ARG A 319 1.288 17.505 17.840 1.00 0.00 N ATOM 0 H ARG A 319 4.742 16.658 13.036 1.00 0.00 H new ATOM 0 HA ARG A 319 3.246 18.683 11.436 1.00 0.00 H new ATOM 0 HB2 ARG A 319 1.977 17.510 13.301 1.00 0.00 H new ATOM 0 HB3 ARG A 319 3.175 18.092 14.440 1.00 0.00 H new ATOM 0 HG2 ARG A 319 2.504 20.424 14.047 1.00 0.00 H new ATOM 0 HG3 ARG A 319 1.424 19.942 12.753 1.00 0.00 H new ATOM 0 HD2 ARG A 319 0.189 20.389 14.876 1.00 0.00 H new ATOM 0 HD3 ARG A 319 -0.030 18.739 14.329 1.00 0.00 H new ATOM 0 HE ARG A 319 1.908 19.499 16.508 1.00 0.00 H new ATOM 0 HH11 ARG A 319 -0.464 17.223 15.168 1.00 0.00 H new ATOM 0 HH12 ARG A 319 -0.383 16.153 16.572 1.00 0.00 H new ATOM 0 HH21 ARG A 319 1.976 18.116 18.280 1.00 0.00 H new ATOM 0 HH22 ARG A 319 0.984 16.654 18.314 1.00 0.00 H new ATOM 253 N LYS A 320 5.819 18.985 13.465 1.00 0.00 N ATOM 254 CA LYS A 320 6.897 19.857 13.977 1.00 0.00 C ATOM 255 C LYS A 320 7.789 20.405 12.847 1.00 0.00 C ATOM 256 O LYS A 320 8.104 21.593 12.808 1.00 0.00 O ATOM 257 CB LYS A 320 7.751 19.082 15.015 1.00 0.00 C ATOM 258 CG LYS A 320 8.873 19.917 15.679 1.00 0.00 C ATOM 259 CD LYS A 320 9.611 19.157 16.801 1.00 0.00 C ATOM 260 CE LYS A 320 8.679 18.736 17.957 1.00 0.00 C ATOM 261 NZ LYS A 320 9.434 18.085 19.055 1.00 0.00 N ATOM 0 H LYS A 320 5.915 18.011 13.752 1.00 0.00 H new ATOM 0 HA LYS A 320 6.429 20.716 14.458 1.00 0.00 H new ATOM 0 HB2 LYS A 320 7.092 18.698 15.794 1.00 0.00 H new ATOM 0 HB3 LYS A 320 8.201 18.219 14.524 1.00 0.00 H new ATOM 0 HG2 LYS A 320 9.593 20.217 14.918 1.00 0.00 H new ATOM 0 HG3 LYS A 320 8.443 20.831 16.089 1.00 0.00 H new ATOM 0 HD2 LYS A 320 10.084 18.269 16.381 1.00 0.00 H new ATOM 0 HD3 LYS A 320 10.409 19.787 17.195 1.00 0.00 H new ATOM 0 HE2 LYS A 320 8.157 19.612 18.342 1.00 0.00 H new ATOM 0 HE3 LYS A 320 7.918 18.052 17.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 320 8.778 17.815 19.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 320 9.912 17.236 18.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 320 10.143 18.747 19.429 1.00 0.00 H new ATOM 275 N CYS A 321 8.154 19.525 11.906 1.00 0.00 N ATOM 276 CA CYS A 321 9.051 19.876 10.782 1.00 0.00 C ATOM 277 C CYS A 321 8.213 20.229 9.536 1.00 0.00 C ATOM 278 O CYS A 321 8.754 20.463 8.450 1.00 0.00 O ATOM 279 CB CYS A 321 10.032 18.701 10.494 1.00 0.00 C ATOM 280 SG CYS A 321 10.011 17.369 11.744 1.00 0.00 S ATOM 0 H CYS A 321 7.842 18.554 11.896 1.00 0.00 H new ATOM 0 HA CYS A 321 9.646 20.749 11.049 1.00 0.00 H new ATOM 0 HB2 CYS A 321 9.789 18.273 9.522 1.00 0.00 H new ATOM 0 HB3 CYS A 321 11.044 19.099 10.423 1.00 0.00 H new ATOM 285 N ALA A 322 6.884 20.241 9.716 1.00 0.00 N ATOM 286 CA ALA A 322 5.936 20.794 8.754 1.00 0.00 C ATOM 287 C ALA A 322 5.477 22.166 9.263 1.00 0.00 C ATOM 288 O ALA A 322 5.842 22.581 10.377 1.00 0.00 O ATOM 289 CB ALA A 322 4.734 19.841 8.597 1.00 0.00 C ATOM 0 H ALA A 322 6.437 19.859 10.549 1.00 0.00 H new ATOM 0 HA ALA A 322 6.407 20.906 7.778 1.00 0.00 H new ATOM 0 HB1 ALA A 322 4.030 20.259 7.878 1.00 0.00 H new ATOM 0 HB2 ALA A 322 5.083 18.871 8.242 1.00 0.00 H new ATOM 0 HB3 ALA A 322 4.239 19.718 9.560 1.00 0.00 H new ATOM 295 N CYS A 323 4.660 22.853 8.467 1.00 0.00 N ATOM 296 CA CYS A 323 4.035 24.111 8.884 1.00 0.00 C ATOM 297 C CYS A 323 2.862 23.808 9.815 1.00 0.00 C ATOM 298 O CYS A 323 1.800 23.374 9.358 1.00 0.00 O ATOM 299 CB CYS A 323 3.600 24.942 7.673 1.00 0.00 C ATOM 300 SG CYS A 323 2.582 26.382 8.064 1.00 0.00 S ATOM 0 H CYS A 323 4.413 22.558 7.522 1.00 0.00 H new ATOM 0 HA CYS A 323 4.765 24.711 9.428 1.00 0.00 H new ATOM 0 HB2 CYS A 323 4.491 25.278 7.143 1.00 0.00 H new ATOM 0 HB3 CYS A 323 3.046 24.299 6.989 1.00 0.00 H new ATOM 305 N HIS A 324 3.088 24.058 11.117 1.00 0.00 N ATOM 306 CA HIS A 324 2.209 23.635 12.215 1.00 0.00 C ATOM 307 C HIS A 324 0.805 24.258 12.082 1.00 0.00 C ATOM 308 O HIS A 324 -0.204 23.602 12.358 1.00 0.00 O ATOM 309 CB HIS A 324 2.882 24.043 13.556 1.00 0.00 C ATOM 310 CG HIS A 324 2.263 23.465 14.810 1.00 0.00 C ATOM 311 ND1 HIS A 324 2.922 22.594 15.649 1.00 0.00 N ATOM 312 CD2 HIS A 324 1.046 23.681 15.390 1.00 0.00 C ATOM 313 CE1 HIS A 324 2.112 22.319 16.678 1.00 0.00 C ATOM 314 NE2 HIS A 324 0.965 22.951 16.567 1.00 0.00 N ATOM 0 H HIS A 324 3.908 24.572 11.440 1.00 0.00 H new ATOM 0 HA HIS A 324 2.072 22.554 12.183 1.00 0.00 H new ATOM 0 HB2 HIS A 324 3.929 23.744 13.520 1.00 0.00 H new ATOM 0 HB3 HIS A 324 2.864 25.130 13.633 1.00 0.00 H new ATOM 0 HD1 HIS A 324 3.862 22.224 15.510 1.00 0.00 H new ATOM 0 HD2 HIS A 324 0.269 24.319 14.995 1.00 0.00 H new ATOM 0 HE1 HIS A 324 2.368 21.661 17.496 1.00 0.00 H new ATOM 322 N VAL A 325 0.777 25.515 11.609 1.00 0.00 N ATOM 323 CA VAL A 325 -0.441 26.340 11.552 1.00 0.00 C ATOM 324 C VAL A 325 -1.536 25.698 10.666 1.00 0.00 C ATOM 325 O VAL A 325 -2.689 25.590 11.083 1.00 0.00 O ATOM 326 CB VAL A 325 -0.108 27.796 11.052 1.00 0.00 C ATOM 327 CG1 VAL A 325 -1.369 28.694 10.974 1.00 0.00 C ATOM 328 CG2 VAL A 325 0.965 28.454 11.951 1.00 0.00 C ATOM 0 H VAL A 325 1.606 25.991 11.253 1.00 0.00 H new ATOM 0 HA VAL A 325 -0.836 26.400 12.566 1.00 0.00 H new ATOM 0 HB VAL A 325 0.287 27.700 10.041 1.00 0.00 H new ATOM 0 HG11 VAL A 325 -1.087 29.687 10.624 1.00 0.00 H new ATOM 0 HG12 VAL A 325 -2.086 28.255 10.280 1.00 0.00 H new ATOM 0 HG13 VAL A 325 -1.822 28.772 11.962 1.00 0.00 H new ATOM 0 HG21 VAL A 325 1.179 29.459 11.586 1.00 0.00 H new ATOM 0 HG22 VAL A 325 0.597 28.510 12.975 1.00 0.00 H new ATOM 0 HG23 VAL A 325 1.877 27.857 11.926 1.00 0.00 H new ATOM 338 N CYS A 326 -1.164 25.256 9.453 1.00 0.00 N ATOM 339 CA CYS A 326 -2.122 24.630 8.502 1.00 0.00 C ATOM 340 C CYS A 326 -1.875 23.110 8.369 1.00 0.00 C ATOM 341 O CYS A 326 -2.528 22.443 7.554 1.00 0.00 O ATOM 342 CB CYS A 326 -2.038 25.328 7.122 1.00 0.00 C ATOM 343 SG CYS A 326 -0.461 25.099 6.239 1.00 0.00 S ATOM 0 H CYS A 326 -0.209 25.317 9.100 1.00 0.00 H new ATOM 0 HA CYS A 326 -3.129 24.761 8.899 1.00 0.00 H new ATOM 0 HB2 CYS A 326 -2.847 24.955 6.493 1.00 0.00 H new ATOM 0 HB3 CYS A 326 -2.208 26.396 7.261 1.00 0.00 H new ATOM 348 N GLY A 327 -0.941 22.578 9.196 1.00 0.00 N ATOM 349 CA GLY A 327 -0.622 21.137 9.241 1.00 0.00 C ATOM 350 C GLY A 327 -0.162 20.551 7.903 1.00 0.00 C ATOM 351 O GLY A 327 -0.575 19.443 7.532 1.00 0.00 O ATOM 0 H GLY A 327 -0.391 23.138 9.847 1.00 0.00 H new ATOM 0 HA2 GLY A 327 0.159 20.973 9.984 1.00 0.00 H new ATOM 0 HA3 GLY A 327 -1.503 20.592 9.579 1.00 0.00 H new ATOM 355 N GLY A 328 0.704 21.296 7.187 1.00 0.00 N ATOM 356 CA GLY A 328 1.150 20.909 5.837 1.00 0.00 C ATOM 357 C GLY A 328 2.610 21.257 5.586 1.00 0.00 C ATOM 358 O GLY A 328 3.076 22.308 6.024 1.00 0.00 O ATOM 0 H GLY A 328 1.108 22.170 7.523 1.00 0.00 H new ATOM 0 HA2 GLY A 328 1.007 19.837 5.704 1.00 0.00 H new ATOM 0 HA3 GLY A 328 0.528 21.408 5.095 1.00 0.00 H new ATOM 362 N ARG A 329 3.332 20.383 4.851 1.00 0.00 N ATOM 363 CA ARG A 329 4.790 20.540 4.602 1.00 0.00 C ATOM 364 C ARG A 329 5.059 20.967 3.130 1.00 0.00 C ATOM 365 O ARG A 329 6.151 20.775 2.585 1.00 0.00 O ATOM 366 CB ARG A 329 5.519 19.219 4.968 1.00 0.00 C ATOM 367 CG ARG A 329 7.050 19.347 5.168 1.00 0.00 C ATOM 368 CD ARG A 329 7.715 17.983 5.395 1.00 0.00 C ATOM 369 NE ARG A 329 7.423 17.063 4.280 1.00 0.00 N ATOM 370 CZ ARG A 329 7.598 15.736 4.291 1.00 0.00 C ATOM 371 NH1 ARG A 329 8.055 15.116 5.369 1.00 0.00 N ATOM 372 NH2 ARG A 329 7.309 15.032 3.218 1.00 0.00 N ATOM 0 H ARG A 329 2.929 19.554 4.415 1.00 0.00 H new ATOM 0 HA ARG A 329 5.184 21.335 5.235 1.00 0.00 H new ATOM 0 HB2 ARG A 329 5.081 18.822 5.884 1.00 0.00 H new ATOM 0 HB3 ARG A 329 5.331 18.488 4.181 1.00 0.00 H new ATOM 0 HG2 ARG A 329 7.491 19.825 4.293 1.00 0.00 H new ATOM 0 HG3 ARG A 329 7.251 19.995 6.021 1.00 0.00 H new ATOM 0 HD2 ARG A 329 8.793 18.111 5.493 1.00 0.00 H new ATOM 0 HD3 ARG A 329 7.359 17.552 6.331 1.00 0.00 H new ATOM 0 HE ARG A 329 7.054 17.475 3.423 1.00 0.00 H new ATOM 0 HH11 ARG A 329 8.280 15.651 6.208 1.00 0.00 H new ATOM 0 HH12 ARG A 329 8.182 14.104 5.360 1.00 0.00 H new ATOM 0 HH21 ARG A 329 6.953 15.498 2.383 1.00 0.00 H new ATOM 0 HH22 ARG A 329 7.441 14.021 3.221 1.00 0.00 H new ATOM 386 N GLU A 330 4.048 21.608 2.519 1.00 0.00 N ATOM 387 CA GLU A 330 4.113 22.077 1.117 1.00 0.00 C ATOM 388 C GLU A 330 4.832 23.436 1.027 1.00 0.00 C ATOM 389 O GLU A 330 4.972 24.128 2.039 1.00 0.00 O ATOM 390 CB GLU A 330 2.683 22.186 0.540 1.00 0.00 C ATOM 391 CG GLU A 330 1.843 20.906 0.706 1.00 0.00 C ATOM 392 CD GLU A 330 0.440 21.018 0.083 1.00 0.00 C ATOM 393 OE1 GLU A 330 0.195 20.424 -0.992 1.00 0.00 O ATOM 394 OE2 GLU A 330 -0.425 21.705 0.671 1.00 0.00 O ATOM 0 H GLU A 330 3.162 21.817 2.979 1.00 0.00 H new ATOM 0 HA GLU A 330 4.683 21.355 0.532 1.00 0.00 H new ATOM 0 HB2 GLU A 330 2.167 23.013 1.028 1.00 0.00 H new ATOM 0 HB3 GLU A 330 2.747 22.431 -0.520 1.00 0.00 H new ATOM 0 HG2 GLU A 330 2.372 20.070 0.248 1.00 0.00 H new ATOM 0 HG3 GLU A 330 1.745 20.678 1.767 1.00 0.00 H new ATOM 401 N ALA A 331 5.267 23.796 -0.199 1.00 0.00 N ATOM 402 CA ALA A 331 5.965 25.067 -0.499 1.00 0.00 C ATOM 403 C ALA A 331 7.181 25.294 0.431 1.00 0.00 C ATOM 404 O ALA A 331 7.105 26.094 1.379 1.00 0.00 O ATOM 405 CB ALA A 331 4.987 26.254 -0.476 1.00 0.00 C ATOM 0 H ALA A 331 5.142 23.205 -1.021 1.00 0.00 H new ATOM 0 HA ALA A 331 6.363 24.993 -1.511 1.00 0.00 H new ATOM 0 HB1 ALA A 331 5.527 27.174 -0.700 1.00 0.00 H new ATOM 0 HB2 ALA A 331 4.209 26.099 -1.223 1.00 0.00 H new ATOM 0 HB3 ALA A 331 4.532 26.331 0.511 1.00 0.00 H new ATOM 411 N PRO A 332 8.319 24.572 0.179 1.00 0.00 N ATOM 412 CA PRO A 332 9.495 24.587 1.089 1.00 0.00 C ATOM 413 C PRO A 332 10.191 25.964 1.129 1.00 0.00 C ATOM 414 O PRO A 332 10.754 26.349 2.155 1.00 0.00 O ATOM 415 CB PRO A 332 10.417 23.483 0.502 1.00 0.00 C ATOM 416 CG PRO A 332 10.048 23.422 -0.954 1.00 0.00 C ATOM 417 CD PRO A 332 8.560 23.700 -1.012 1.00 0.00 C ATOM 0 HA PRO A 332 9.222 24.402 2.128 1.00 0.00 H new ATOM 0 HB2 PRO A 332 11.470 23.733 0.635 1.00 0.00 H new ATOM 0 HB3 PRO A 332 10.252 22.525 0.994 1.00 0.00 H new ATOM 0 HG2 PRO A 332 10.607 24.159 -1.531 1.00 0.00 H new ATOM 0 HG3 PRO A 332 10.280 22.444 -1.376 1.00 0.00 H new ATOM 0 HD2 PRO A 332 8.282 24.201 -1.939 1.00 0.00 H new ATOM 0 HD3 PRO A 332 7.978 22.780 -0.960 1.00 0.00 H new ATOM 425 N GLU A 333 10.113 26.699 -0.001 1.00 0.00 N ATOM 426 CA GLU A 333 10.694 28.050 -0.145 1.00 0.00 C ATOM 427 C GLU A 333 9.871 29.109 0.620 1.00 0.00 C ATOM 428 O GLU A 333 10.397 30.168 0.978 1.00 0.00 O ATOM 429 CB GLU A 333 10.787 28.428 -1.648 1.00 0.00 C ATOM 430 CG GLU A 333 9.428 28.441 -2.387 1.00 0.00 C ATOM 431 CD GLU A 333 9.545 28.883 -3.850 1.00 0.00 C ATOM 432 OE1 GLU A 333 9.820 28.032 -4.723 1.00 0.00 O ATOM 433 OE2 GLU A 333 9.367 30.090 -4.137 1.00 0.00 O ATOM 0 H GLU A 333 9.642 26.369 -0.844 1.00 0.00 H new ATOM 0 HA GLU A 333 11.694 28.033 0.288 1.00 0.00 H new ATOM 0 HB2 GLU A 333 11.244 29.414 -1.735 1.00 0.00 H new ATOM 0 HB3 GLU A 333 11.452 27.723 -2.147 1.00 0.00 H new ATOM 0 HG2 GLU A 333 8.990 27.443 -2.349 1.00 0.00 H new ATOM 0 HG3 GLU A 333 8.743 29.110 -1.865 1.00 0.00 H new ATOM 440 N LYS A 334 8.573 28.822 0.850 1.00 0.00 N ATOM 441 CA LYS A 334 7.668 29.727 1.586 1.00 0.00 C ATOM 442 C LYS A 334 7.643 29.393 3.089 1.00 0.00 C ATOM 443 O LYS A 334 7.135 30.187 3.885 1.00 0.00 O ATOM 444 CB LYS A 334 6.232 29.673 0.996 1.00 0.00 C ATOM 445 CG LYS A 334 6.126 30.141 -0.472 1.00 0.00 C ATOM 446 CD LYS A 334 6.611 31.599 -0.668 1.00 0.00 C ATOM 447 CE LYS A 334 6.347 32.147 -2.074 1.00 0.00 C ATOM 448 NZ LYS A 334 6.996 31.332 -3.127 1.00 0.00 N ATOM 0 H LYS A 334 8.126 27.962 0.533 1.00 0.00 H new ATOM 0 HA LYS A 334 8.052 30.741 1.471 1.00 0.00 H new ATOM 0 HB2 LYS A 334 5.862 28.650 1.066 1.00 0.00 H new ATOM 0 HB3 LYS A 334 5.577 30.291 1.610 1.00 0.00 H new ATOM 0 HG2 LYS A 334 6.716 29.478 -1.105 1.00 0.00 H new ATOM 0 HG3 LYS A 334 5.090 30.059 -0.802 1.00 0.00 H new ATOM 0 HD2 LYS A 334 6.116 32.239 0.062 1.00 0.00 H new ATOM 0 HD3 LYS A 334 7.680 31.649 -0.462 1.00 0.00 H new ATOM 0 HE2 LYS A 334 5.272 32.179 -2.253 1.00 0.00 H new ATOM 0 HE3 LYS A 334 6.711 33.173 -2.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 334 6.905 31.813 -4.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 334 8.003 31.209 -2.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 334 6.536 30.400 -3.178 1.00 0.00 H new ATOM 462 N GLN A 335 8.172 28.213 3.473 1.00 0.00 N ATOM 463 CA GLN A 335 8.263 27.819 4.890 1.00 0.00 C ATOM 464 C GLN A 335 9.567 28.326 5.520 1.00 0.00 C ATOM 465 O GLN A 335 10.618 28.347 4.883 1.00 0.00 O ATOM 466 CB GLN A 335 8.120 26.286 5.079 1.00 0.00 C ATOM 467 CG GLN A 335 6.712 25.752 4.733 1.00 0.00 C ATOM 468 CD GLN A 335 6.340 24.446 5.427 1.00 0.00 C ATOM 469 OE1 GLN A 335 6.823 24.135 6.505 1.00 0.00 O ATOM 470 NE2 GLN A 335 5.404 23.726 4.859 1.00 0.00 N ATOM 0 H GLN A 335 8.541 27.520 2.822 1.00 0.00 H new ATOM 0 HA GLN A 335 7.426 28.289 5.406 1.00 0.00 H new ATOM 0 HB2 GLN A 335 8.856 25.780 4.453 1.00 0.00 H new ATOM 0 HB3 GLN A 335 8.352 26.032 6.113 1.00 0.00 H new ATOM 0 HG2 GLN A 335 5.975 26.511 4.996 1.00 0.00 H new ATOM 0 HG3 GLN A 335 6.648 25.606 3.655 1.00 0.00 H new ATOM 0 HE21 GLN A 335 5.019 24.010 3.958 1.00 0.00 H new ATOM 0 HE22 GLN A 335 5.061 22.882 5.318 1.00 0.00 H new ATOM 479 N LEU A 336 9.447 28.742 6.781 1.00 0.00 N ATOM 480 CA LEU A 336 10.534 29.284 7.591 1.00 0.00 C ATOM 481 C LEU A 336 10.481 28.613 8.967 1.00 0.00 C ATOM 482 O LEU A 336 9.457 28.668 9.663 1.00 0.00 O ATOM 483 CB LEU A 336 10.402 30.828 7.720 1.00 0.00 C ATOM 484 CG LEU A 336 10.709 31.653 6.433 1.00 0.00 C ATOM 485 CD1 LEU A 336 10.465 33.161 6.653 1.00 0.00 C ATOM 486 CD2 LEU A 336 12.157 31.401 5.953 1.00 0.00 C ATOM 0 H LEU A 336 8.559 28.709 7.282 1.00 0.00 H new ATOM 0 HA LEU A 336 11.494 29.080 7.117 1.00 0.00 H new ATOM 0 HB2 LEU A 336 9.387 31.060 8.042 1.00 0.00 H new ATOM 0 HB3 LEU A 336 11.072 31.165 8.511 1.00 0.00 H new ATOM 0 HG LEU A 336 10.022 31.316 5.656 1.00 0.00 H new ATOM 0 HD11 LEU A 336 10.689 33.704 5.735 1.00 0.00 H new ATOM 0 HD12 LEU A 336 9.422 33.325 6.926 1.00 0.00 H new ATOM 0 HD13 LEU A 336 11.111 33.521 7.454 1.00 0.00 H new ATOM 0 HD21 LEU A 336 12.349 31.987 5.054 1.00 0.00 H new ATOM 0 HD22 LEU A 336 12.856 31.697 6.735 1.00 0.00 H new ATOM 0 HD23 LEU A 336 12.288 30.342 5.731 1.00 0.00 H new ATOM 498 N LEU A 337 11.593 27.979 9.338 1.00 0.00 N ATOM 499 CA LEU A 337 11.718 27.226 10.591 1.00 0.00 C ATOM 500 C LEU A 337 12.194 28.165 11.709 1.00 0.00 C ATOM 501 O LEU A 337 13.306 28.695 11.653 1.00 0.00 O ATOM 502 CB LEU A 337 12.700 26.018 10.426 1.00 0.00 C ATOM 503 CG LEU A 337 12.194 24.820 9.542 1.00 0.00 C ATOM 504 CD1 LEU A 337 12.078 25.194 8.040 1.00 0.00 C ATOM 505 CD2 LEU A 337 13.087 23.569 9.735 1.00 0.00 C ATOM 0 H LEU A 337 12.442 27.972 8.773 1.00 0.00 H new ATOM 0 HA LEU A 337 10.741 26.821 10.856 1.00 0.00 H new ATOM 0 HB2 LEU A 337 13.630 26.390 9.996 1.00 0.00 H new ATOM 0 HB3 LEU A 337 12.938 25.634 11.418 1.00 0.00 H new ATOM 0 HG LEU A 337 11.187 24.581 9.885 1.00 0.00 H new ATOM 0 HD11 LEU A 337 11.725 24.331 7.476 1.00 0.00 H new ATOM 0 HD12 LEU A 337 11.373 26.017 7.923 1.00 0.00 H new ATOM 0 HD13 LEU A 337 13.055 25.498 7.664 1.00 0.00 H new ATOM 0 HD21 LEU A 337 12.714 22.756 9.112 1.00 0.00 H new ATOM 0 HD22 LEU A 337 14.112 23.806 9.448 1.00 0.00 H new ATOM 0 HD23 LEU A 337 13.065 23.264 10.781 1.00 0.00 H new ATOM 517 N CYS A 338 11.313 28.406 12.693 1.00 0.00 N ATOM 518 CA CYS A 338 11.648 29.199 13.884 1.00 0.00 C ATOM 519 C CYS A 338 12.587 28.406 14.795 1.00 0.00 C ATOM 520 O CYS A 338 12.176 27.385 15.352 1.00 0.00 O ATOM 521 CB CYS A 338 10.380 29.576 14.663 1.00 0.00 C ATOM 522 SG CYS A 338 10.705 30.605 16.134 1.00 0.00 S ATOM 0 H CYS A 338 10.354 28.058 12.685 1.00 0.00 H new ATOM 0 HA CYS A 338 12.143 30.113 13.555 1.00 0.00 H new ATOM 0 HB2 CYS A 338 9.701 30.111 13.999 1.00 0.00 H new ATOM 0 HB3 CYS A 338 9.870 28.664 14.973 1.00 0.00 H new ATOM 527 N ASP A 339 13.828 28.900 14.941 1.00 0.00 N ATOM 528 CA ASP A 339 14.878 28.254 15.760 1.00 0.00 C ATOM 529 C ASP A 339 14.419 28.044 17.229 1.00 0.00 C ATOM 530 O ASP A 339 14.681 26.999 17.829 1.00 0.00 O ATOM 531 CB ASP A 339 16.168 29.112 15.705 1.00 0.00 C ATOM 532 CG ASP A 339 17.364 28.475 16.439 1.00 0.00 C ATOM 533 OD1 ASP A 339 17.619 28.830 17.609 1.00 0.00 O ATOM 534 OD2 ASP A 339 18.065 27.629 15.837 1.00 0.00 O ATOM 0 H ASP A 339 14.137 29.763 14.493 1.00 0.00 H new ATOM 0 HA ASP A 339 15.078 27.265 15.347 1.00 0.00 H new ATOM 0 HB2 ASP A 339 16.439 29.279 14.663 1.00 0.00 H new ATOM 0 HB3 ASP A 339 15.963 30.090 16.142 1.00 0.00 H new ATOM 539 N GLU A 340 13.713 29.052 17.767 1.00 0.00 N ATOM 540 CA GLU A 340 13.183 29.047 19.149 1.00 0.00 C ATOM 541 C GLU A 340 12.121 27.932 19.372 1.00 0.00 C ATOM 542 O GLU A 340 12.019 27.360 20.459 1.00 0.00 O ATOM 543 CB GLU A 340 12.550 30.432 19.441 1.00 0.00 C ATOM 544 CG GLU A 340 12.045 30.650 20.884 1.00 0.00 C ATOM 545 CD GLU A 340 13.178 30.740 21.919 1.00 0.00 C ATOM 546 OE1 GLU A 340 13.777 31.830 22.054 1.00 0.00 O ATOM 547 OE2 GLU A 340 13.464 29.737 22.605 1.00 0.00 O ATOM 0 H GLU A 340 13.489 29.904 17.253 1.00 0.00 H new ATOM 0 HA GLU A 340 14.010 28.844 19.829 1.00 0.00 H new ATOM 0 HB2 GLU A 340 13.287 31.202 19.214 1.00 0.00 H new ATOM 0 HB3 GLU A 340 11.714 30.580 18.757 1.00 0.00 H new ATOM 0 HG2 GLU A 340 11.456 31.566 20.920 1.00 0.00 H new ATOM 0 HG3 GLU A 340 11.379 29.831 21.156 1.00 0.00 H new ATOM 554 N CYS A 341 11.320 27.639 18.334 1.00 0.00 N ATOM 555 CA CYS A 341 10.151 26.734 18.454 1.00 0.00 C ATOM 556 C CYS A 341 10.409 25.348 17.837 1.00 0.00 C ATOM 557 O CYS A 341 9.663 24.403 18.122 1.00 0.00 O ATOM 558 CB CYS A 341 8.912 27.378 17.779 1.00 0.00 C ATOM 559 SG CYS A 341 8.321 28.886 18.600 1.00 0.00 S ATOM 0 H CYS A 341 11.457 28.015 17.396 1.00 0.00 H new ATOM 0 HA CYS A 341 9.969 26.589 19.519 1.00 0.00 H new ATOM 0 HB2 CYS A 341 9.157 27.613 16.743 1.00 0.00 H new ATOM 0 HB3 CYS A 341 8.103 26.648 17.757 1.00 0.00 H new ATOM 564 N ASP A 342 11.446 25.250 16.970 1.00 0.00 N ATOM 565 CA ASP A 342 11.717 24.064 16.105 1.00 0.00 C ATOM 566 C ASP A 342 10.524 23.752 15.164 1.00 0.00 C ATOM 567 O ASP A 342 10.445 22.672 14.578 1.00 0.00 O ATOM 568 CB ASP A 342 12.119 22.811 16.956 1.00 0.00 C ATOM 569 CG ASP A 342 13.472 22.984 17.687 1.00 0.00 C ATOM 570 OD1 ASP A 342 14.478 22.360 17.285 1.00 0.00 O ATOM 571 OD2 ASP A 342 13.535 23.764 18.663 1.00 0.00 O ATOM 0 H ASP A 342 12.128 25.998 16.846 1.00 0.00 H new ATOM 0 HA ASP A 342 12.568 24.317 15.473 1.00 0.00 H new ATOM 0 HB2 ASP A 342 11.339 22.612 17.690 1.00 0.00 H new ATOM 0 HB3 ASP A 342 12.173 21.939 16.305 1.00 0.00 H new ATOM 576 N MET A 343 9.633 24.742 14.996 1.00 0.00 N ATOM 577 CA MET A 343 8.411 24.630 14.179 1.00 0.00 C ATOM 578 C MET A 343 8.578 25.422 12.892 1.00 0.00 C ATOM 579 O MET A 343 9.148 26.522 12.904 1.00 0.00 O ATOM 580 CB MET A 343 7.187 25.177 14.953 1.00 0.00 C ATOM 581 CG MET A 343 6.760 24.331 16.147 1.00 0.00 C ATOM 582 SD MET A 343 6.170 22.705 15.653 1.00 0.00 S ATOM 583 CE MET A 343 6.048 21.884 17.235 1.00 0.00 C ATOM 0 H MET A 343 9.742 25.658 15.431 1.00 0.00 H new ATOM 0 HA MET A 343 8.247 23.577 13.949 1.00 0.00 H new ATOM 0 HB2 MET A 343 7.415 26.184 15.301 1.00 0.00 H new ATOM 0 HB3 MET A 343 6.346 25.260 14.264 1.00 0.00 H new ATOM 0 HG2 MET A 343 7.602 24.218 16.829 1.00 0.00 H new ATOM 0 HG3 MET A 343 5.973 24.850 16.695 1.00 0.00 H new ATOM 0 HE1 MET A 343 5.694 20.864 17.089 1.00 0.00 H new ATOM 0 HE2 MET A 343 7.029 21.863 17.711 1.00 0.00 H new ATOM 0 HE3 MET A 343 5.347 22.424 17.872 1.00 0.00 H new ATOM 593 N ALA A 344 8.048 24.871 11.803 1.00 0.00 N ATOM 594 CA ALA A 344 8.056 25.539 10.482 1.00 0.00 C ATOM 595 C ALA A 344 6.741 26.306 10.271 1.00 0.00 C ATOM 596 O ALA A 344 5.701 25.928 10.829 1.00 0.00 O ATOM 597 CB ALA A 344 8.308 24.524 9.358 1.00 0.00 C ATOM 0 H ALA A 344 7.601 23.954 11.799 1.00 0.00 H new ATOM 0 HA ALA A 344 8.874 26.259 10.455 1.00 0.00 H new ATOM 0 HB1 ALA A 344 8.309 25.038 8.397 1.00 0.00 H new ATOM 0 HB2 ALA A 344 9.273 24.042 9.513 1.00 0.00 H new ATOM 0 HB3 ALA A 344 7.521 23.770 9.365 1.00 0.00 H new ATOM 603 N PHE A 345 6.791 27.415 9.505 1.00 0.00 N ATOM 604 CA PHE A 345 5.621 28.290 9.257 1.00 0.00 C ATOM 605 C PHE A 345 5.697 28.877 7.841 1.00 0.00 C ATOM 606 O PHE A 345 6.746 29.376 7.450 1.00 0.00 O ATOM 607 CB PHE A 345 5.575 29.476 10.267 1.00 0.00 C ATOM 608 CG PHE A 345 5.624 29.090 11.743 1.00 0.00 C ATOM 609 CD1 PHE A 345 4.481 28.662 12.404 1.00 0.00 C ATOM 610 CD2 PHE A 345 6.819 29.147 12.464 1.00 0.00 C ATOM 611 CE1 PHE A 345 4.517 28.315 13.742 1.00 0.00 C ATOM 612 CE2 PHE A 345 6.851 28.799 13.802 1.00 0.00 C ATOM 613 CZ PHE A 345 5.703 28.381 14.436 1.00 0.00 C ATOM 0 H PHE A 345 7.642 27.731 9.040 1.00 0.00 H new ATOM 0 HA PHE A 345 4.726 27.679 9.375 1.00 0.00 H new ATOM 0 HB2 PHE A 345 6.412 30.141 10.056 1.00 0.00 H new ATOM 0 HB3 PHE A 345 4.663 30.045 10.089 1.00 0.00 H new ATOM 0 HD1 PHE A 345 3.548 28.599 11.864 1.00 0.00 H new ATOM 0 HD2 PHE A 345 7.726 29.466 11.972 1.00 0.00 H new ATOM 0 HE1 PHE A 345 3.615 27.993 14.242 1.00 0.00 H new ATOM 0 HE2 PHE A 345 7.779 28.855 14.351 1.00 0.00 H new ATOM 0 HZ PHE A 345 5.733 28.104 15.480 1.00 0.00 H new ATOM 623 N HIS A 346 4.581 28.828 7.080 1.00 0.00 N ATOM 624 CA HIS A 346 4.467 29.573 5.804 1.00 0.00 C ATOM 625 C HIS A 346 4.476 31.083 6.070 1.00 0.00 C ATOM 626 O HIS A 346 3.972 31.530 7.106 1.00 0.00 O ATOM 627 CB HIS A 346 3.170 29.220 5.025 1.00 0.00 C ATOM 628 CG HIS A 346 3.176 27.887 4.327 1.00 0.00 C ATOM 629 ND1 HIS A 346 2.246 26.923 4.624 1.00 0.00 N ATOM 630 CD2 HIS A 346 3.965 27.446 3.318 1.00 0.00 C ATOM 631 CE1 HIS A 346 2.491 25.926 3.795 1.00 0.00 C ATOM 632 NE2 HIS A 346 3.519 26.199 2.985 1.00 0.00 N ATOM 0 H HIS A 346 3.752 28.285 7.324 1.00 0.00 H new ATOM 0 HA HIS A 346 5.324 29.283 5.196 1.00 0.00 H new ATOM 0 HB2 HIS A 346 2.332 29.242 5.721 1.00 0.00 H new ATOM 0 HB3 HIS A 346 2.989 29.998 4.283 1.00 0.00 H new ATOM 0 HD2 HIS A 346 4.788 27.978 2.864 1.00 0.00 H new ATOM 0 HE1 HIS A 346 1.930 25.003 3.773 1.00 0.00 H new ATOM 0 HE2 HIS A 346 3.898 25.592 2.258 1.00 0.00 H new ATOM 640 N LEU A 347 5.012 31.834 5.098 1.00 0.00 N ATOM 641 CA LEU A 347 4.955 33.308 5.059 1.00 0.00 C ATOM 642 C LEU A 347 3.510 33.819 5.220 1.00 0.00 C ATOM 643 O LEU A 347 3.258 34.808 5.904 1.00 0.00 O ATOM 644 CB LEU A 347 5.549 33.790 3.715 1.00 0.00 C ATOM 645 CG LEU A 347 7.071 33.511 3.514 1.00 0.00 C ATOM 646 CD1 LEU A 347 7.515 33.834 2.078 1.00 0.00 C ATOM 647 CD2 LEU A 347 7.918 34.282 4.548 1.00 0.00 C ATOM 0 H LEU A 347 5.506 31.431 4.302 1.00 0.00 H new ATOM 0 HA LEU A 347 5.535 33.709 5.890 1.00 0.00 H new ATOM 0 HB2 LEU A 347 5.000 33.313 2.903 1.00 0.00 H new ATOM 0 HB3 LEU A 347 5.380 34.863 3.627 1.00 0.00 H new ATOM 0 HG LEU A 347 7.236 32.446 3.676 1.00 0.00 H new ATOM 0 HD11 LEU A 347 8.580 33.629 1.972 1.00 0.00 H new ATOM 0 HD12 LEU A 347 6.955 33.216 1.376 1.00 0.00 H new ATOM 0 HD13 LEU A 347 7.325 34.886 1.867 1.00 0.00 H new ATOM 0 HD21 LEU A 347 8.974 34.069 4.385 1.00 0.00 H new ATOM 0 HD22 LEU A 347 7.742 35.352 4.437 1.00 0.00 H new ATOM 0 HD23 LEU A 347 7.637 33.970 5.554 1.00 0.00 H new ATOM 659 N TYR A 348 2.577 33.079 4.604 1.00 0.00 N ATOM 660 CA TYR A 348 1.140 33.396 4.589 1.00 0.00 C ATOM 661 C TYR A 348 0.473 33.015 5.932 1.00 0.00 C ATOM 662 O TYR A 348 -0.533 33.604 6.324 1.00 0.00 O ATOM 663 CB TYR A 348 0.459 32.626 3.428 1.00 0.00 C ATOM 664 CG TYR A 348 1.189 32.745 2.071 1.00 0.00 C ATOM 665 CD1 TYR A 348 2.186 31.829 1.700 1.00 0.00 C ATOM 666 CD2 TYR A 348 0.882 33.765 1.170 1.00 0.00 C ATOM 667 CE1 TYR A 348 2.835 31.932 0.484 1.00 0.00 C ATOM 668 CE2 TYR A 348 1.533 33.865 -0.042 1.00 0.00 C ATOM 669 CZ TYR A 348 2.502 32.950 -0.381 1.00 0.00 C ATOM 670 OH TYR A 348 3.140 33.056 -1.596 1.00 0.00 O ATOM 0 H TYR A 348 2.804 32.226 4.092 1.00 0.00 H new ATOM 0 HA TYR A 348 1.021 34.470 4.444 1.00 0.00 H new ATOM 0 HB2 TYR A 348 0.389 31.572 3.698 1.00 0.00 H new ATOM 0 HB3 TYR A 348 -0.560 32.994 3.312 1.00 0.00 H new ATOM 0 HD1 TYR A 348 2.451 31.030 2.377 1.00 0.00 H new ATOM 0 HD2 TYR A 348 0.122 34.488 1.426 1.00 0.00 H new ATOM 0 HE1 TYR A 348 3.599 31.218 0.214 1.00 0.00 H new ATOM 0 HE2 TYR A 348 1.281 34.663 -0.725 1.00 0.00 H new ATOM 0 HH TYR A 348 2.786 33.828 -2.085 1.00 0.00 H new ATOM 680 N CYS A 349 1.051 32.009 6.622 1.00 0.00 N ATOM 681 CA CYS A 349 0.506 31.473 7.896 1.00 0.00 C ATOM 682 C CYS A 349 1.046 32.229 9.127 1.00 0.00 C ATOM 683 O CYS A 349 0.734 31.865 10.267 1.00 0.00 O ATOM 684 CB CYS A 349 0.828 29.971 8.009 1.00 0.00 C ATOM 685 SG CYS A 349 0.110 28.949 6.691 1.00 0.00 S ATOM 0 H CYS A 349 1.906 31.544 6.316 1.00 0.00 H new ATOM 0 HA CYS A 349 -0.574 31.618 7.880 1.00 0.00 H new ATOM 0 HB2 CYS A 349 1.910 29.842 8.003 1.00 0.00 H new ATOM 0 HB3 CYS A 349 0.469 29.606 8.971 1.00 0.00 H new ATOM 690 N LEU A 350 1.879 33.254 8.886 1.00 0.00 N ATOM 691 CA LEU A 350 2.384 34.157 9.938 1.00 0.00 C ATOM 692 C LEU A 350 1.331 35.235 10.267 1.00 0.00 C ATOM 693 O LEU A 350 0.409 35.470 9.474 1.00 0.00 O ATOM 694 CB LEU A 350 3.712 34.809 9.471 1.00 0.00 C ATOM 695 CG LEU A 350 4.888 33.812 9.230 1.00 0.00 C ATOM 696 CD1 LEU A 350 6.105 34.519 8.607 1.00 0.00 C ATOM 697 CD2 LEU A 350 5.265 33.083 10.543 1.00 0.00 C ATOM 0 H LEU A 350 2.224 33.482 7.954 1.00 0.00 H new ATOM 0 HA LEU A 350 2.575 33.583 10.845 1.00 0.00 H new ATOM 0 HB2 LEU A 350 3.525 35.357 8.547 1.00 0.00 H new ATOM 0 HB3 LEU A 350 4.023 35.540 10.218 1.00 0.00 H new ATOM 0 HG LEU A 350 4.552 33.061 8.515 1.00 0.00 H new ATOM 0 HD11 LEU A 350 6.906 33.796 8.452 1.00 0.00 H new ATOM 0 HD12 LEU A 350 5.821 34.956 7.650 1.00 0.00 H new ATOM 0 HD13 LEU A 350 6.451 35.306 9.277 1.00 0.00 H new ATOM 0 HD21 LEU A 350 6.087 32.393 10.353 1.00 0.00 H new ATOM 0 HD22 LEU A 350 5.571 33.815 11.290 1.00 0.00 H new ATOM 0 HD23 LEU A 350 4.402 32.528 10.911 1.00 0.00 H new ATOM 709 N LYS A 351 1.483 35.889 11.430 1.00 0.00 N ATOM 710 CA LYS A 351 0.565 36.954 11.881 1.00 0.00 C ATOM 711 C LYS A 351 1.389 38.028 12.626 1.00 0.00 C ATOM 712 O LYS A 351 1.715 37.826 13.804 1.00 0.00 O ATOM 713 CB LYS A 351 -0.554 36.354 12.789 1.00 0.00 C ATOM 714 CG LYS A 351 -1.800 37.252 12.959 1.00 0.00 C ATOM 715 CD LYS A 351 -2.586 37.431 11.630 1.00 0.00 C ATOM 716 CE LYS A 351 -3.892 38.232 11.805 1.00 0.00 C ATOM 717 NZ LYS A 351 -3.644 39.632 12.232 1.00 0.00 N ATOM 0 H LYS A 351 2.242 35.697 12.084 1.00 0.00 H new ATOM 0 HA LYS A 351 0.071 37.417 11.026 1.00 0.00 H new ATOM 0 HB2 LYS A 351 -0.867 35.397 12.372 1.00 0.00 H new ATOM 0 HB3 LYS A 351 -0.133 36.150 13.774 1.00 0.00 H new ATOM 0 HG2 LYS A 351 -2.458 36.817 13.712 1.00 0.00 H new ATOM 0 HG3 LYS A 351 -1.492 38.229 13.331 1.00 0.00 H new ATOM 0 HD2 LYS A 351 -1.950 37.938 10.904 1.00 0.00 H new ATOM 0 HD3 LYS A 351 -2.821 36.449 11.218 1.00 0.00 H new ATOM 0 HE2 LYS A 351 -4.443 38.234 10.864 1.00 0.00 H new ATOM 0 HE3 LYS A 351 -4.523 37.736 12.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 -4.552 40.129 12.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 -3.142 39.633 13.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 -3.064 40.116 11.517 1.00 0.00 H new ATOM 731 N PRO A 352 1.787 39.181 11.976 1.00 0.00 N ATOM 732 CA PRO A 352 1.427 39.560 10.574 1.00 0.00 C ATOM 733 C PRO A 352 2.164 38.713 9.498 1.00 0.00 C ATOM 734 O PRO A 352 3.326 38.339 9.705 1.00 0.00 O ATOM 735 CB PRO A 352 1.845 41.070 10.486 1.00 0.00 C ATOM 736 CG PRO A 352 2.164 41.478 11.899 1.00 0.00 C ATOM 737 CD PRO A 352 2.643 40.223 12.586 1.00 0.00 C ATOM 0 HA PRO A 352 0.371 39.383 10.371 1.00 0.00 H new ATOM 0 HB2 PRO A 352 2.709 41.201 9.834 1.00 0.00 H new ATOM 0 HB3 PRO A 352 1.039 41.678 10.074 1.00 0.00 H new ATOM 0 HG2 PRO A 352 2.930 42.253 11.920 1.00 0.00 H new ATOM 0 HG3 PRO A 352 1.285 41.886 12.397 1.00 0.00 H new ATOM 0 HD2 PRO A 352 3.701 40.038 12.403 1.00 0.00 H new ATOM 0 HD3 PRO A 352 2.511 40.276 13.667 1.00 0.00 H new ATOM 745 N PRO A 353 1.492 38.381 8.343 1.00 0.00 N ATOM 746 CA PRO A 353 2.112 37.575 7.266 1.00 0.00 C ATOM 747 C PRO A 353 3.191 38.359 6.492 1.00 0.00 C ATOM 748 O PRO A 353 3.072 39.578 6.294 1.00 0.00 O ATOM 749 CB PRO A 353 0.910 37.206 6.357 1.00 0.00 C ATOM 750 CG PRO A 353 -0.057 38.335 6.547 1.00 0.00 C ATOM 751 CD PRO A 353 0.084 38.749 8.003 1.00 0.00 C ATOM 0 HA PRO A 353 2.640 36.703 7.652 1.00 0.00 H new ATOM 0 HB2 PRO A 353 1.213 37.113 5.314 1.00 0.00 H new ATOM 0 HB3 PRO A 353 0.470 36.252 6.647 1.00 0.00 H new ATOM 0 HG2 PRO A 353 0.173 39.165 5.879 1.00 0.00 H new ATOM 0 HG3 PRO A 353 -1.077 38.020 6.325 1.00 0.00 H new ATOM 0 HD2 PRO A 353 -0.093 39.816 8.134 1.00 0.00 H new ATOM 0 HD3 PRO A 353 -0.631 38.226 8.639 1.00 0.00 H new ATOM 759 N LEU A 354 4.248 37.647 6.078 1.00 0.00 N ATOM 760 CA LEU A 354 5.341 38.212 5.275 1.00 0.00 C ATOM 761 C LEU A 354 5.098 37.912 3.787 1.00 0.00 C ATOM 762 O LEU A 354 4.457 36.911 3.446 1.00 0.00 O ATOM 763 CB LEU A 354 6.704 37.625 5.739 1.00 0.00 C ATOM 764 CG LEU A 354 7.090 37.904 7.230 1.00 0.00 C ATOM 765 CD1 LEU A 354 8.415 37.209 7.612 1.00 0.00 C ATOM 766 CD2 LEU A 354 7.155 39.423 7.528 1.00 0.00 C ATOM 0 H LEU A 354 4.369 36.657 6.292 1.00 0.00 H new ATOM 0 HA LEU A 354 5.370 39.293 5.414 1.00 0.00 H new ATOM 0 HB2 LEU A 354 6.686 36.546 5.583 1.00 0.00 H new ATOM 0 HB3 LEU A 354 7.489 38.027 5.098 1.00 0.00 H new ATOM 0 HG LEU A 354 6.301 37.479 7.850 1.00 0.00 H new ATOM 0 HD11 LEU A 354 8.652 37.425 8.654 1.00 0.00 H new ATOM 0 HD12 LEU A 354 8.313 36.132 7.478 1.00 0.00 H new ATOM 0 HD13 LEU A 354 9.217 37.579 6.974 1.00 0.00 H new ATOM 0 HD21 LEU A 354 7.426 39.578 8.572 1.00 0.00 H new ATOM 0 HD22 LEU A 354 7.904 39.888 6.886 1.00 0.00 H new ATOM 0 HD23 LEU A 354 6.181 39.874 7.335 1.00 0.00 H new ATOM 778 N THR A 355 5.587 38.805 2.921 1.00 0.00 N ATOM 779 CA THR A 355 5.526 38.641 1.458 1.00 0.00 C ATOM 780 C THR A 355 6.626 37.675 0.982 1.00 0.00 C ATOM 781 O THR A 355 6.384 36.786 0.153 1.00 0.00 O ATOM 782 CB THR A 355 5.673 40.026 0.744 1.00 0.00 C ATOM 783 OG1 THR A 355 6.865 40.688 1.206 1.00 0.00 O ATOM 784 CG2 THR A 355 4.457 40.937 0.992 1.00 0.00 C ATOM 0 H THR A 355 6.041 39.670 3.214 1.00 0.00 H new ATOM 0 HA THR A 355 4.555 38.220 1.198 1.00 0.00 H new ATOM 0 HB THR A 355 5.737 39.836 -0.327 1.00 0.00 H new ATOM 0 HG1 THR A 355 6.954 41.554 0.755 1.00 0.00 H new ATOM 0 HG21 THR A 355 4.603 41.887 0.478 1.00 0.00 H new ATOM 0 HG22 THR A 355 3.557 40.454 0.613 1.00 0.00 H new ATOM 0 HG23 THR A 355 4.349 41.117 2.062 1.00 0.00 H new ATOM 792 N SER A 356 7.828 37.852 1.546 1.00 0.00 N ATOM 793 CA SER A 356 9.013 37.041 1.236 1.00 0.00 C ATOM 794 C SER A 356 9.819 36.793 2.524 1.00 0.00 C ATOM 795 O SER A 356 9.451 37.297 3.599 1.00 0.00 O ATOM 796 CB SER A 356 9.863 37.761 0.168 1.00 0.00 C ATOM 797 OG SER A 356 10.221 39.074 0.586 1.00 0.00 O ATOM 0 H SER A 356 8.007 38.575 2.243 1.00 0.00 H new ATOM 0 HA SER A 356 8.711 36.074 0.835 1.00 0.00 H new ATOM 0 HB2 SER A 356 10.765 37.183 -0.032 1.00 0.00 H new ATOM 0 HB3 SER A 356 9.305 37.815 -0.767 1.00 0.00 H new ATOM 0 HG SER A 356 10.760 39.503 -0.111 1.00 0.00 H new ATOM 803 N VAL A 357 10.898 35.993 2.415 1.00 0.00 N ATOM 804 CA VAL A 357 11.836 35.757 3.524 1.00 0.00 C ATOM 805 C VAL A 357 12.562 37.080 3.889 1.00 0.00 C ATOM 806 O VAL A 357 13.029 37.782 2.987 1.00 0.00 O ATOM 807 CB VAL A 357 12.892 34.625 3.173 1.00 0.00 C ATOM 808 CG1 VAL A 357 13.685 34.943 1.876 1.00 0.00 C ATOM 809 CG2 VAL A 357 13.853 34.350 4.368 1.00 0.00 C ATOM 0 H VAL A 357 11.141 35.495 1.558 1.00 0.00 H new ATOM 0 HA VAL A 357 11.261 35.410 4.382 1.00 0.00 H new ATOM 0 HB VAL A 357 12.324 33.714 2.985 1.00 0.00 H new ATOM 0 HG11 VAL A 357 14.395 34.140 1.677 1.00 0.00 H new ATOM 0 HG12 VAL A 357 12.993 35.031 1.039 1.00 0.00 H new ATOM 0 HG13 VAL A 357 14.225 35.882 2.000 1.00 0.00 H new ATOM 0 HG21 VAL A 357 14.562 33.570 4.092 1.00 0.00 H new ATOM 0 HG22 VAL A 357 14.395 35.262 4.616 1.00 0.00 H new ATOM 0 HG23 VAL A 357 13.274 34.025 5.233 1.00 0.00 H new ATOM 819 N PRO A 358 12.612 37.480 5.197 1.00 0.00 N ATOM 820 CA PRO A 358 13.377 38.669 5.632 1.00 0.00 C ATOM 821 C PRO A 358 14.903 38.385 5.648 1.00 0.00 C ATOM 822 O PRO A 358 15.317 37.218 5.671 1.00 0.00 O ATOM 823 CB PRO A 358 12.797 38.954 7.042 1.00 0.00 C ATOM 824 CG PRO A 358 12.370 37.618 7.551 1.00 0.00 C ATOM 825 CD PRO A 358 11.909 36.830 6.338 1.00 0.00 C ATOM 0 HA PRO A 358 13.279 39.526 4.965 1.00 0.00 H new ATOM 0 HB2 PRO A 358 13.544 39.406 7.694 1.00 0.00 H new ATOM 0 HB3 PRO A 358 11.957 39.646 6.992 1.00 0.00 H new ATOM 0 HG2 PRO A 358 13.194 37.112 8.054 1.00 0.00 H new ATOM 0 HG3 PRO A 358 11.565 37.718 8.279 1.00 0.00 H new ATOM 0 HD2 PRO A 358 12.175 35.776 6.422 1.00 0.00 H new ATOM 0 HD3 PRO A 358 10.827 36.877 6.219 1.00 0.00 H new ATOM 833 N PRO A 359 15.773 39.444 5.630 1.00 0.00 N ATOM 834 CA PRO A 359 17.256 39.270 5.571 1.00 0.00 C ATOM 835 C PRO A 359 17.912 38.966 6.943 1.00 0.00 C ATOM 836 O PRO A 359 19.138 39.067 7.078 1.00 0.00 O ATOM 837 CB PRO A 359 17.704 40.643 5.027 1.00 0.00 C ATOM 838 CG PRO A 359 16.741 41.603 5.661 1.00 0.00 C ATOM 839 CD PRO A 359 15.401 40.897 5.641 1.00 0.00 C ATOM 0 HA PRO A 359 17.551 38.413 4.966 1.00 0.00 H new ATOM 0 HB2 PRO A 359 18.734 40.867 5.303 1.00 0.00 H new ATOM 0 HB3 PRO A 359 17.650 40.680 3.939 1.00 0.00 H new ATOM 0 HG2 PRO A 359 17.042 41.847 6.680 1.00 0.00 H new ATOM 0 HG3 PRO A 359 16.699 42.541 5.108 1.00 0.00 H new ATOM 0 HD2 PRO A 359 14.800 41.151 6.514 1.00 0.00 H new ATOM 0 HD3 PRO A 359 14.817 41.169 4.762 1.00 0.00 H new ATOM 847 N GLU A 360 17.083 38.594 7.942 1.00 0.00 N ATOM 848 CA GLU A 360 17.533 38.338 9.326 1.00 0.00 C ATOM 849 C GLU A 360 18.500 37.122 9.393 1.00 0.00 C ATOM 850 O GLU A 360 18.223 36.086 8.768 1.00 0.00 O ATOM 851 CB GLU A 360 16.302 38.108 10.258 1.00 0.00 C ATOM 852 CG GLU A 360 15.174 39.153 10.104 1.00 0.00 C ATOM 853 CD GLU A 360 15.658 40.607 10.242 1.00 0.00 C ATOM 854 OE1 GLU A 360 15.824 41.084 11.385 1.00 0.00 O ATOM 855 OE2 GLU A 360 15.897 41.280 9.207 1.00 0.00 O ATOM 0 H GLU A 360 16.080 38.463 7.810 1.00 0.00 H new ATOM 0 HA GLU A 360 18.080 39.216 9.670 1.00 0.00 H new ATOM 0 HB2 GLU A 360 15.892 37.118 10.058 1.00 0.00 H new ATOM 0 HB3 GLU A 360 16.642 38.109 11.294 1.00 0.00 H new ATOM 0 HG2 GLU A 360 14.704 39.027 9.129 1.00 0.00 H new ATOM 0 HG3 GLU A 360 14.408 38.961 10.855 1.00 0.00 H new ATOM 862 N PRO A 361 19.649 37.236 10.151 1.00 0.00 N ATOM 863 CA PRO A 361 20.644 36.131 10.295 1.00 0.00 C ATOM 864 C PRO A 361 20.073 34.930 11.088 1.00 0.00 C ATOM 865 O PRO A 361 20.428 33.771 10.831 1.00 0.00 O ATOM 866 CB PRO A 361 21.826 36.814 11.041 1.00 0.00 C ATOM 867 CG PRO A 361 21.190 37.946 11.797 1.00 0.00 C ATOM 868 CD PRO A 361 20.068 38.450 10.912 1.00 0.00 C ATOM 0 HA PRO A 361 20.938 35.700 9.338 1.00 0.00 H new ATOM 0 HB2 PRO A 361 22.325 36.118 11.715 1.00 0.00 H new ATOM 0 HB3 PRO A 361 22.580 37.177 10.342 1.00 0.00 H new ATOM 0 HG2 PRO A 361 20.807 37.608 12.760 1.00 0.00 H new ATOM 0 HG3 PRO A 361 21.913 38.736 12.001 1.00 0.00 H new ATOM 0 HD2 PRO A 361 19.246 38.858 11.500 1.00 0.00 H new ATOM 0 HD3 PRO A 361 20.408 39.243 10.246 1.00 0.00 H new ATOM 876 N GLU A 362 19.173 35.234 12.039 1.00 0.00 N ATOM 877 CA GLU A 362 18.451 34.237 12.847 1.00 0.00 C ATOM 878 C GLU A 362 16.959 34.602 12.829 1.00 0.00 C ATOM 879 O GLU A 362 16.573 35.712 13.229 1.00 0.00 O ATOM 880 CB GLU A 362 19.029 34.183 14.291 1.00 0.00 C ATOM 881 CG GLU A 362 19.132 35.552 14.993 1.00 0.00 C ATOM 882 CD GLU A 362 19.846 35.485 16.355 1.00 0.00 C ATOM 883 OE1 GLU A 362 19.168 35.437 17.401 1.00 0.00 O ATOM 884 OE2 GLU A 362 21.095 35.464 16.379 1.00 0.00 O ATOM 0 H GLU A 362 18.923 36.195 12.271 1.00 0.00 H new ATOM 0 HA GLU A 362 18.575 33.238 12.430 1.00 0.00 H new ATOM 0 HB2 GLU A 362 18.403 33.526 14.895 1.00 0.00 H new ATOM 0 HB3 GLU A 362 20.021 33.733 14.255 1.00 0.00 H new ATOM 0 HG2 GLU A 362 19.666 36.246 14.344 1.00 0.00 H new ATOM 0 HG3 GLU A 362 18.130 35.956 15.135 1.00 0.00 H new ATOM 891 N TRP A 363 16.137 33.687 12.309 1.00 0.00 N ATOM 892 CA TRP A 363 14.700 33.926 12.110 1.00 0.00 C ATOM 893 C TRP A 363 13.876 33.322 13.254 1.00 0.00 C ATOM 894 O TRP A 363 14.120 32.189 13.698 1.00 0.00 O ATOM 895 CB TRP A 363 14.221 33.354 10.754 1.00 0.00 C ATOM 896 CG TRP A 363 12.801 33.746 10.393 1.00 0.00 C ATOM 897 CD1 TRP A 363 12.411 34.888 9.753 1.00 0.00 C ATOM 898 CD2 TRP A 363 11.586 33.018 10.667 1.00 0.00 C ATOM 899 NE1 TRP A 363 11.051 34.909 9.605 1.00 0.00 N ATOM 900 CE2 TRP A 363 10.523 33.781 10.164 1.00 0.00 C ATOM 901 CE3 TRP A 363 11.296 31.803 11.295 1.00 0.00 C ATOM 902 CZ2 TRP A 363 9.203 33.368 10.250 1.00 0.00 C ATOM 903 CZ3 TRP A 363 9.976 31.395 11.387 1.00 0.00 C ATOM 904 CH2 TRP A 363 8.945 32.176 10.868 1.00 0.00 C ATOM 0 H TRP A 363 16.445 32.761 12.014 1.00 0.00 H new ATOM 0 HA TRP A 363 14.548 35.005 12.104 1.00 0.00 H new ATOM 0 HB2 TRP A 363 14.894 33.696 9.968 1.00 0.00 H new ATOM 0 HB3 TRP A 363 14.292 32.267 10.783 1.00 0.00 H new ATOM 0 HD1 TRP A 363 13.081 35.664 9.412 1.00 0.00 H new ATOM 0 HE1 TRP A 363 10.517 35.649 9.150 1.00 0.00 H new ATOM 0 HE3 TRP A 363 12.089 31.193 11.702 1.00 0.00 H new ATOM 0 HZ2 TRP A 363 8.404 33.969 9.842 1.00 0.00 H new ATOM 0 HZ3 TRP A 363 9.742 30.457 11.868 1.00 0.00 H new ATOM 0 HH2 TRP A 363 7.924 31.834 10.955 1.00 0.00 H new ATOM 915 N TYR A 364 12.878 34.097 13.703 1.00 0.00 N ATOM 916 CA TYR A 364 11.909 33.690 14.724 1.00 0.00 C ATOM 917 C TYR A 364 10.497 34.053 14.255 1.00 0.00 C ATOM 918 O TYR A 364 10.306 35.010 13.499 1.00 0.00 O ATOM 919 CB TYR A 364 12.220 34.376 16.078 1.00 0.00 C ATOM 920 CG TYR A 364 13.625 34.065 16.613 1.00 0.00 C ATOM 921 CD1 TYR A 364 13.918 32.816 17.152 1.00 0.00 C ATOM 922 CD2 TYR A 364 14.656 35.007 16.547 1.00 0.00 C ATOM 923 CE1 TYR A 364 15.181 32.515 17.613 1.00 0.00 C ATOM 924 CE2 TYR A 364 15.922 34.708 17.012 1.00 0.00 C ATOM 925 CZ TYR A 364 16.177 33.460 17.541 1.00 0.00 C ATOM 926 OH TYR A 364 17.438 33.150 18.003 1.00 0.00 O ATOM 0 H TYR A 364 12.721 35.044 13.357 1.00 0.00 H new ATOM 0 HA TYR A 364 11.976 32.612 14.869 1.00 0.00 H new ATOM 0 HB2 TYR A 364 12.114 35.455 15.963 1.00 0.00 H new ATOM 0 HB3 TYR A 364 11.481 34.060 16.815 1.00 0.00 H new ATOM 0 HD1 TYR A 364 13.141 32.068 17.210 1.00 0.00 H new ATOM 0 HD2 TYR A 364 14.460 35.982 16.127 1.00 0.00 H new ATOM 0 HE1 TYR A 364 15.388 31.540 18.029 1.00 0.00 H new ATOM 0 HE2 TYR A 364 16.708 35.447 16.962 1.00 0.00 H new ATOM 0 HH TYR A 364 18.045 33.898 17.824 1.00 0.00 H new ATOM 936 N CYS A 365 9.515 33.258 14.691 1.00 0.00 N ATOM 937 CA CYS A 365 8.097 33.511 14.408 1.00 0.00 C ATOM 938 C CYS A 365 7.609 34.691 15.258 1.00 0.00 C ATOM 939 O CYS A 365 8.097 34.857 16.390 1.00 0.00 O ATOM 940 CB CYS A 365 7.255 32.257 14.733 1.00 0.00 C ATOM 941 SG CYS A 365 7.091 31.892 16.519 1.00 0.00 S ATOM 0 H CYS A 365 9.680 32.421 15.250 1.00 0.00 H new ATOM 0 HA CYS A 365 7.983 33.748 13.350 1.00 0.00 H new ATOM 0 HB2 CYS A 365 6.259 32.384 14.308 1.00 0.00 H new ATOM 0 HB3 CYS A 365 7.705 31.396 14.239 1.00 0.00 H new ATOM 946 N PRO A 366 6.633 35.522 14.757 1.00 0.00 N ATOM 947 CA PRO A 366 5.997 36.585 15.582 1.00 0.00 C ATOM 948 C PRO A 366 5.346 36.001 16.858 1.00 0.00 C ATOM 949 O PRO A 366 5.311 36.658 17.895 1.00 0.00 O ATOM 950 CB PRO A 366 4.947 37.218 14.621 1.00 0.00 C ATOM 951 CG PRO A 366 4.745 36.188 13.541 1.00 0.00 C ATOM 952 CD PRO A 366 6.090 35.528 13.364 1.00 0.00 C ATOM 0 HA PRO A 366 6.712 37.319 15.953 1.00 0.00 H new ATOM 0 HB2 PRO A 366 4.014 37.434 15.141 1.00 0.00 H new ATOM 0 HB3 PRO A 366 5.307 38.160 14.207 1.00 0.00 H new ATOM 0 HG2 PRO A 366 3.985 35.461 13.828 1.00 0.00 H new ATOM 0 HG3 PRO A 366 4.409 36.651 12.613 1.00 0.00 H new ATOM 0 HD2 PRO A 366 5.997 34.520 12.960 1.00 0.00 H new ATOM 0 HD3 PRO A 366 6.730 36.087 12.681 1.00 0.00 H new ATOM 960 N SER A 367 4.910 34.725 16.759 1.00 0.00 N ATOM 961 CA SER A 367 4.284 33.949 17.851 1.00 0.00 C ATOM 962 C SER A 367 5.222 33.755 19.084 1.00 0.00 C ATOM 963 O SER A 367 4.787 33.291 20.134 1.00 0.00 O ATOM 964 CB SER A 367 3.856 32.571 17.285 1.00 0.00 C ATOM 965 OG SER A 367 3.320 32.689 15.970 1.00 0.00 O ATOM 0 H SER A 367 4.987 34.193 15.892 1.00 0.00 H new ATOM 0 HA SER A 367 3.423 34.511 18.212 1.00 0.00 H new ATOM 0 HB2 SER A 367 4.715 31.900 17.270 1.00 0.00 H new ATOM 0 HB3 SER A 367 3.112 32.122 17.943 1.00 0.00 H new ATOM 0 HG SER A 367 3.061 31.803 15.641 1.00 0.00 H new ATOM 971 N CYS A 368 6.521 34.078 18.929 1.00 0.00 N ATOM 972 CA CYS A 368 7.498 34.053 20.042 1.00 0.00 C ATOM 973 C CYS A 368 7.308 35.250 20.997 1.00 0.00 C ATOM 974 O CYS A 368 7.670 35.168 22.180 1.00 0.00 O ATOM 975 CB CYS A 368 8.946 34.015 19.492 1.00 0.00 C ATOM 976 SG CYS A 368 9.652 32.345 19.362 1.00 0.00 S ATOM 0 H CYS A 368 6.923 34.362 18.036 1.00 0.00 H new ATOM 0 HA CYS A 368 7.319 33.145 20.618 1.00 0.00 H new ATOM 0 HB2 CYS A 368 8.960 34.481 18.507 1.00 0.00 H new ATOM 0 HB3 CYS A 368 9.584 34.617 20.139 1.00 0.00 H new ATOM 981 N ARG A 369 6.747 36.359 20.475 1.00 0.00 N ATOM 982 CA ARG A 369 6.602 37.621 21.231 1.00 0.00 C ATOM 983 C ARG A 369 5.145 38.131 21.225 1.00 0.00 C ATOM 984 O ARG A 369 4.834 39.118 21.902 1.00 0.00 O ATOM 985 CB ARG A 369 7.584 38.682 20.652 1.00 0.00 C ATOM 986 CG ARG A 369 7.308 39.101 19.187 1.00 0.00 C ATOM 987 CD ARG A 369 8.430 39.983 18.592 1.00 0.00 C ATOM 988 NE ARG A 369 8.773 41.128 19.464 1.00 0.00 N ATOM 989 CZ ARG A 369 8.365 42.401 19.304 1.00 0.00 C ATOM 990 NH1 ARG A 369 7.555 42.742 18.305 1.00 0.00 N ATOM 991 NH2 ARG A 369 8.778 43.328 20.156 1.00 0.00 N ATOM 0 H ARG A 369 6.383 36.406 19.523 1.00 0.00 H new ATOM 0 HA ARG A 369 6.855 37.435 22.275 1.00 0.00 H new ATOM 0 HB2 ARG A 369 7.546 39.571 21.281 1.00 0.00 H new ATOM 0 HB3 ARG A 369 8.599 38.289 20.716 1.00 0.00 H new ATOM 0 HG2 ARG A 369 7.192 38.207 18.574 1.00 0.00 H new ATOM 0 HG3 ARG A 369 6.364 39.643 19.141 1.00 0.00 H new ATOM 0 HD2 ARG A 369 9.320 39.374 18.431 1.00 0.00 H new ATOM 0 HD3 ARG A 369 8.117 40.355 17.616 1.00 0.00 H new ATOM 0 HE ARG A 369 9.377 40.934 20.263 1.00 0.00 H new ATOM 0 HH11 ARG A 369 7.233 42.034 17.645 1.00 0.00 H new ATOM 0 HH12 ARG A 369 7.256 43.711 18.199 1.00 0.00 H new ATOM 0 HH21 ARG A 369 9.399 43.074 20.924 1.00 0.00 H new ATOM 0 HH22 ARG A 369 8.475 44.295 20.044 1.00 0.00 H new ATOM 1005 N THR A 370 4.260 37.455 20.463 1.00 0.00 N ATOM 1006 CA THR A 370 2.822 37.776 20.427 1.00 0.00 C ATOM 1007 C THR A 370 2.130 37.279 21.715 1.00 0.00 C ATOM 1008 O THR A 370 2.396 36.168 22.182 1.00 0.00 O ATOM 1009 CB THR A 370 2.148 37.153 19.153 1.00 0.00 C ATOM 1010 OG1 THR A 370 2.781 37.659 17.964 1.00 0.00 O ATOM 1011 CG2 THR A 370 0.640 37.436 19.062 1.00 0.00 C ATOM 0 H THR A 370 4.522 36.676 19.859 1.00 0.00 H new ATOM 0 HA THR A 370 2.708 38.859 20.373 1.00 0.00 H new ATOM 0 HB THR A 370 2.278 36.074 19.239 1.00 0.00 H new ATOM 0 HG1 THR A 370 3.732 37.423 17.974 1.00 0.00 H new ATOM 0 HG21 THR A 370 0.238 36.977 18.159 1.00 0.00 H new ATOM 0 HG22 THR A 370 0.138 37.019 19.935 1.00 0.00 H new ATOM 0 HG23 THR A 370 0.473 38.513 19.027 1.00 0.00 H new ATOM 1019 N ASP A 371 1.244 38.118 22.277 1.00 0.00 N ATOM 1020 CA ASP A 371 0.527 37.822 23.537 1.00 0.00 C ATOM 1021 C ASP A 371 -0.614 36.816 23.305 1.00 0.00 C ATOM 1022 O ASP A 371 -1.046 36.145 24.243 1.00 0.00 O ATOM 1023 CB ASP A 371 -0.030 39.126 24.159 1.00 0.00 C ATOM 1024 CG ASP A 371 1.073 40.158 24.451 1.00 0.00 C ATOM 1025 OD1 ASP A 371 1.455 40.918 23.526 1.00 0.00 O ATOM 1026 OD2 ASP A 371 1.558 40.225 25.600 1.00 0.00 O ATOM 0 H ASP A 371 1.002 39.023 21.873 1.00 0.00 H new ATOM 0 HA ASP A 371 1.239 37.374 24.230 1.00 0.00 H new ATOM 0 HB2 ASP A 371 -0.762 39.564 23.481 1.00 0.00 H new ATOM 0 HB3 ASP A 371 -0.555 38.888 25.084 1.00 0.00 H new ATOM 1031 N SER A 372 -1.108 36.736 22.048 1.00 0.00 N ATOM 1032 CA SER A 372 -2.146 35.755 21.637 1.00 0.00 C ATOM 1033 C SER A 372 -1.576 34.319 21.556 1.00 0.00 C ATOM 1034 O SER A 372 -2.332 33.346 21.433 1.00 0.00 O ATOM 1035 CB SER A 372 -2.751 36.172 20.277 1.00 0.00 C ATOM 1036 OG SER A 372 -3.272 37.491 20.343 1.00 0.00 O ATOM 0 H SER A 372 -0.801 37.346 21.290 1.00 0.00 H new ATOM 0 HA SER A 372 -2.928 35.753 22.396 1.00 0.00 H new ATOM 0 HB2 SER A 372 -1.988 36.116 19.501 1.00 0.00 H new ATOM 0 HB3 SER A 372 -3.542 35.477 19.997 1.00 0.00 H new ATOM 0 HG SER A 372 -3.649 37.738 19.473 1.00 0.00 H new ATOM 1042 N SER A 373 -0.242 34.211 21.602 1.00 0.00 N ATOM 1043 CA SER A 373 0.493 32.942 21.676 1.00 0.00 C ATOM 1044 C SER A 373 1.206 32.832 23.044 1.00 0.00 C ATOM 1045 O SER A 373 1.228 33.794 23.828 1.00 0.00 O ATOM 1046 CB SER A 373 1.489 32.876 20.499 1.00 0.00 C ATOM 1047 OG SER A 373 2.181 34.097 20.345 1.00 0.00 O ATOM 0 H SER A 373 0.372 35.025 21.588 1.00 0.00 H new ATOM 0 HA SER A 373 -0.190 32.096 21.595 1.00 0.00 H new ATOM 0 HB2 SER A 373 2.203 32.070 20.668 1.00 0.00 H new ATOM 0 HB3 SER A 373 0.954 32.640 19.579 1.00 0.00 H new ATOM 0 HG SER A 373 3.146 33.934 20.389 1.00 0.00 H new ATOM 1053 N GLU A 374 1.776 31.644 23.320 1.00 0.00 N ATOM 1054 CA GLU A 374 2.410 31.321 24.613 1.00 0.00 C ATOM 1055 C GLU A 374 3.746 32.080 24.787 1.00 0.00 C ATOM 1056 O GLU A 374 4.577 32.120 23.870 1.00 0.00 O ATOM 1057 CB GLU A 374 2.613 29.775 24.734 1.00 0.00 C ATOM 1058 CG GLU A 374 3.551 29.145 23.672 1.00 0.00 C ATOM 1059 CD GLU A 374 3.454 27.613 23.613 1.00 0.00 C ATOM 1060 OE1 GLU A 374 4.064 26.930 24.468 1.00 0.00 O ATOM 1061 OE2 GLU A 374 2.746 27.079 22.725 1.00 0.00 O ATOM 0 H GLU A 374 1.810 30.877 22.649 1.00 0.00 H new ATOM 0 HA GLU A 374 1.750 31.647 25.416 1.00 0.00 H new ATOM 0 HB2 GLU A 374 3.012 29.554 25.724 1.00 0.00 H new ATOM 0 HB3 GLU A 374 1.639 29.291 24.667 1.00 0.00 H new ATOM 0 HG2 GLU A 374 3.308 29.556 22.692 1.00 0.00 H new ATOM 0 HG3 GLU A 374 4.580 29.429 23.891 1.00 0.00 H new ATOM 1068 N VAL A 375 3.907 32.721 25.959 1.00 0.00 N ATOM 1069 CA VAL A 375 5.164 33.369 26.368 1.00 0.00 C ATOM 1070 C VAL A 375 5.999 32.383 27.209 1.00 0.00 C ATOM 1071 O VAL A 375 5.456 31.662 28.058 1.00 0.00 O ATOM 1072 CB VAL A 375 4.912 34.717 27.164 1.00 0.00 C ATOM 1073 CG1 VAL A 375 4.041 34.504 28.437 1.00 0.00 C ATOM 1074 CG2 VAL A 375 6.253 35.433 27.510 1.00 0.00 C ATOM 0 H VAL A 375 3.163 32.804 26.652 1.00 0.00 H new ATOM 0 HA VAL A 375 5.715 33.638 25.467 1.00 0.00 H new ATOM 0 HB VAL A 375 4.344 35.369 26.500 1.00 0.00 H new ATOM 0 HG11 VAL A 375 3.899 35.458 28.945 1.00 0.00 H new ATOM 0 HG12 VAL A 375 3.071 34.098 28.150 1.00 0.00 H new ATOM 0 HG13 VAL A 375 4.542 33.807 29.108 1.00 0.00 H new ATOM 0 HG21 VAL A 375 6.044 36.353 28.055 1.00 0.00 H new ATOM 0 HG22 VAL A 375 6.867 34.777 28.127 1.00 0.00 H new ATOM 0 HG23 VAL A 375 6.787 35.670 26.590 1.00 0.00 H new ATOM 1084 N VAL A 376 7.311 32.329 26.932 1.00 0.00 N ATOM 1085 CA VAL A 376 8.261 31.500 27.696 1.00 0.00 C ATOM 1086 C VAL A 376 8.538 32.142 29.075 1.00 0.00 C ATOM 1087 O VAL A 376 8.681 33.368 29.172 1.00 0.00 O ATOM 1088 CB VAL A 376 9.603 31.283 26.888 1.00 0.00 C ATOM 1089 CG1 VAL A 376 10.259 32.635 26.491 1.00 0.00 C ATOM 1090 CG2 VAL A 376 10.605 30.375 27.662 1.00 0.00 C ATOM 0 H VAL A 376 7.744 32.857 26.174 1.00 0.00 H new ATOM 0 HA VAL A 376 7.814 30.519 27.856 1.00 0.00 H new ATOM 0 HB VAL A 376 9.338 30.764 25.967 1.00 0.00 H new ATOM 0 HG11 VAL A 376 11.178 32.445 25.937 1.00 0.00 H new ATOM 0 HG12 VAL A 376 9.570 33.204 25.866 1.00 0.00 H new ATOM 0 HG13 VAL A 376 10.489 33.206 27.391 1.00 0.00 H new ATOM 0 HG21 VAL A 376 11.514 30.251 27.073 1.00 0.00 H new ATOM 0 HG22 VAL A 376 10.852 30.838 28.617 1.00 0.00 H new ATOM 0 HG23 VAL A 376 10.151 29.400 27.838 1.00 0.00 H new ATOM 1100 N GLN A 377 8.564 31.313 30.139 1.00 0.00 N ATOM 1101 CA GLN A 377 8.916 31.765 31.497 1.00 0.00 C ATOM 1102 C GLN A 377 10.436 32.037 31.567 1.00 0.00 C ATOM 1103 O GLN A 377 11.239 31.140 31.855 1.00 0.00 O ATOM 1104 CB GLN A 377 8.460 30.724 32.567 1.00 0.00 C ATOM 1105 CG GLN A 377 8.757 31.125 34.035 1.00 0.00 C ATOM 1106 CD GLN A 377 8.112 32.448 34.472 1.00 0.00 C ATOM 1107 OE1 GLN A 377 7.029 32.826 34.015 1.00 0.00 O ATOM 1108 NE2 GLN A 377 8.781 33.174 35.353 1.00 0.00 N ATOM 0 H GLN A 377 8.343 30.319 30.080 1.00 0.00 H new ATOM 0 HA GLN A 377 8.389 32.693 31.719 1.00 0.00 H new ATOM 0 HB2 GLN A 377 7.388 30.561 32.460 1.00 0.00 H new ATOM 0 HB3 GLN A 377 8.950 29.773 32.359 1.00 0.00 H new ATOM 0 HG2 GLN A 377 8.409 30.330 34.694 1.00 0.00 H new ATOM 0 HG3 GLN A 377 9.836 31.199 34.168 1.00 0.00 H new ATOM 0 HE21 GLN A 377 9.674 32.840 35.716 1.00 0.00 H new ATOM 0 HE22 GLN A 377 8.404 34.067 35.669 1.00 0.00 H new ATOM 1117 N ALA A 378 10.805 33.277 31.206 1.00 0.00 N ATOM 1118 CA ALA A 378 12.193 33.760 31.224 1.00 0.00 C ATOM 1119 C ALA A 378 12.467 34.532 32.528 1.00 0.00 C ATOM 1120 O ALA A 378 11.534 34.837 33.289 1.00 0.00 O ATOM 1121 CB ALA A 378 12.450 34.640 29.984 1.00 0.00 C ATOM 0 H ALA A 378 10.138 33.980 30.889 1.00 0.00 H new ATOM 0 HA ALA A 378 12.877 32.912 31.189 1.00 0.00 H new ATOM 0 HB1 ALA A 378 13.480 34.998 29.999 1.00 0.00 H new ATOM 0 HB2 ALA A 378 12.282 34.054 29.081 1.00 0.00 H new ATOM 0 HB3 ALA A 378 11.770 35.492 29.995 1.00 0.00 H new ATOM 1127 N GLY A 379 13.756 34.841 32.773 1.00 0.00 N ATOM 1128 CA GLY A 379 14.188 35.547 33.987 1.00 0.00 C ATOM 1129 C GLY A 379 14.239 34.645 35.222 1.00 0.00 C ATOM 1130 O GLY A 379 14.391 35.136 36.345 1.00 0.00 O ATOM 0 H GLY A 379 14.519 34.608 32.137 1.00 0.00 H new ATOM 0 HA2 GLY A 379 15.175 35.977 33.818 1.00 0.00 H new ATOM 0 HA3 GLY A 379 13.508 36.377 34.179 1.00 0.00 H new ATOM 1134 N GLU A 380 14.104 33.323 35.010 1.00 0.00 N ATOM 1135 CA GLU A 380 14.144 32.319 36.076 1.00 0.00 C ATOM 1136 C GLU A 380 14.763 31.025 35.501 1.00 0.00 C ATOM 1137 CB GLU A 380 12.719 32.061 36.652 1.00 0.00 C ATOM 1138 CG GLU A 380 12.676 31.082 37.851 1.00 0.00 C ATOM 1139 CD GLU A 380 13.461 31.584 39.085 1.00 0.00 C ATOM 1140 OE1 GLU A 380 14.669 31.267 39.222 1.00 0.00 O ATOM 1141 OE2 GLU A 380 12.879 32.317 39.912 1.00 0.00 O ATOM 0 H GLU A 380 13.963 32.923 34.082 1.00 0.00 H new ATOM 0 HA GLU A 380 14.757 32.679 36.903 1.00 0.00 H new ATOM 0 HB2 GLU A 380 12.289 33.013 36.962 1.00 0.00 H new ATOM 0 HB3 GLU A 380 12.085 31.669 35.857 1.00 0.00 H new ATOM 0 HG2 GLU A 380 11.637 30.913 38.135 1.00 0.00 H new ATOM 0 HG3 GLU A 380 13.082 30.120 37.539 1.00 0.00 H new TER 1148 GLU A 380 HETATM 1149 ZN ZN A 401 9.121 15.347 10.964 1.00 0.00 ZN HETATM 1150 ZN ZN A 402 1.094 26.853 6.373 1.00 0.00 ZN HETATM 1151 ZN ZN A 403 8.930 30.932 17.637 1.00 0.00 ZN