USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 911 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 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot -155:sc= -0.635 USER MOD Single : A 21 LYS NZ :NH3+ -174:sc=-0.00266 (180deg=-0.0559) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 25:sc= 1.1 USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 32 GLN : amide:sc= -0.033 X(o=-0.033,f=0) USER MOD Single : A 34 SER OG : rot 32:sc= -0.751 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0311 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot -129:sc= 0.556 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 64 ASN : amide:sc= -0.623 K(o=-0.62,f=-2.4) USER MOD Single : A 66 ASN : amide:sc= -0.0139 K(o=-0.014,f=-0.99) USER MOD Single : A 70 THR OG1 : rot 44:sc= 0.754 USER MOD Single : A 75 THR OG1 : rot 96:sc= 1.22 USER MOD Single : A 85 GLN : amide:sc= 1.03 K(o=1,f=-5.4!) USER MOD Single : A 94 ASN : amide:sc= -0.0208! X(o=-0.021!,f=-0.39) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl -118:sc= -0.22 (180deg=-3.07!) USER MOD Single : A 101 GLN : amide:sc= -4.16! K(o=-4.2!,f=-1.4) USER MOD Single : A 102 THR OG1 : rot -170:sc= -1.23 USER MOD Single : A 108 THR OG1 : rot 81:sc= 1.04 USER MOD Single : A 109 TYR OH : rot 180:sc= -0.206 USER MOD Single : A 110 ASN : amide:sc= 1.23 K(o=1.2,f=-0.16) USER MOD Single : A 112 MET CE :methyl 165:sc= -0.113 (180deg=-0.495) USER MOD ----------------------------------------------------------------- ATOM 148 N PHE A 10 -17.372 9.908 -15.597 1.00 0.00 N ATOM 149 CA PHE A 10 -17.400 9.586 -14.179 1.00 0.00 C ATOM 150 C PHE A 10 -17.361 10.879 -13.372 1.00 0.00 C ATOM 151 O PHE A 10 -16.703 11.838 -13.775 1.00 0.00 O ATOM 152 CB PHE A 10 -16.216 8.687 -13.809 1.00 0.00 C ATOM 153 CG PHE A 10 -16.321 7.295 -14.365 1.00 0.00 C ATOM 154 CD1 PHE A 10 -15.966 7.027 -15.678 1.00 0.00 C ATOM 155 CD2 PHE A 10 -16.777 6.255 -13.572 1.00 0.00 C ATOM 156 CE1 PHE A 10 -16.063 5.747 -16.187 1.00 0.00 C ATOM 157 CE2 PHE A 10 -16.877 4.974 -14.076 1.00 0.00 C ATOM 158 CZ PHE A 10 -16.519 4.719 -15.385 1.00 0.00 C ATOM 0 HA PHE A 10 -18.318 9.044 -13.950 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -15.296 9.145 -14.171 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -16.139 8.631 -12.723 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -15.610 7.828 -16.309 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.058 6.449 -12.547 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -15.783 5.550 -17.211 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -17.235 4.172 -13.447 1.00 0.00 H new ATOM 0 HZ PHE A 10 -16.595 3.717 -15.781 1.00 0.00 H new ATOM 168 N PRO A 11 -18.051 10.918 -12.221 1.00 0.00 N ATOM 169 CA PRO A 11 -18.221 12.150 -11.431 1.00 0.00 C ATOM 170 C PRO A 11 -16.953 12.597 -10.701 1.00 0.00 C ATOM 171 O PRO A 11 -17.024 13.421 -9.791 1.00 0.00 O ATOM 172 CB PRO A 11 -19.304 11.766 -10.422 1.00 0.00 C ATOM 173 CG PRO A 11 -19.156 10.295 -10.253 1.00 0.00 C ATOM 174 CD PRO A 11 -18.730 9.766 -11.594 1.00 0.00 C ATOM 0 HA PRO A 11 -18.472 12.996 -12.070 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -19.167 12.289 -9.476 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -20.297 12.025 -10.789 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -18.415 10.063 -9.488 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -20.095 9.842 -9.935 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.061 8.912 -11.494 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.584 9.434 -12.184 1.00 0.00 H new ATOM 182 N ARG A 12 -15.802 12.064 -11.118 1.00 0.00 N ATOM 183 CA ARG A 12 -14.513 12.397 -10.510 1.00 0.00 C ATOM 184 C ARG A 12 -14.547 12.089 -9.013 1.00 0.00 C ATOM 185 O ARG A 12 -14.745 12.970 -8.174 1.00 0.00 O ATOM 186 CB ARG A 12 -14.165 13.866 -10.784 1.00 0.00 C ATOM 187 CG ARG A 12 -12.758 14.276 -10.385 1.00 0.00 C ATOM 188 CD ARG A 12 -12.399 15.618 -11.005 1.00 0.00 C ATOM 189 NE ARG A 12 -11.101 16.122 -10.563 1.00 0.00 N ATOM 190 CZ ARG A 12 -10.056 16.310 -11.372 1.00 0.00 C ATOM 191 NH1 ARG A 12 -10.119 15.950 -12.648 1.00 0.00 N ATOM 192 NH2 ARG A 12 -8.942 16.852 -10.904 1.00 0.00 N ATOM 0 H ARG A 12 -15.738 11.393 -11.883 1.00 0.00 H new ATOM 0 HA ARG A 12 -13.729 11.785 -10.956 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -14.297 14.063 -11.848 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -14.876 14.498 -10.252 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -12.685 14.339 -9.299 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -12.046 13.517 -10.709 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -12.394 15.521 -12.091 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -13.170 16.346 -10.753 1.00 0.00 H new ATOM 0 HE ARG A 12 -10.986 16.344 -9.574 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -10.970 15.526 -13.017 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -9.316 16.097 -13.260 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.881 17.127 -9.924 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -8.145 16.995 -11.524 1.00 0.00 H new ATOM 206 N THR A 13 -14.364 10.820 -8.695 1.00 0.00 N ATOM 207 CA THR A 13 -14.545 10.332 -7.342 1.00 0.00 C ATOM 208 C THR A 13 -13.245 10.409 -6.548 1.00 0.00 C ATOM 209 O THR A 13 -12.286 9.696 -6.836 1.00 0.00 O ATOM 210 CB THR A 13 -15.044 8.878 -7.373 1.00 0.00 C ATOM 211 OG1 THR A 13 -16.119 8.762 -8.314 1.00 0.00 O ATOM 212 CG2 THR A 13 -15.521 8.436 -6.002 1.00 0.00 C ATOM 0 H THR A 13 -14.087 10.102 -9.365 1.00 0.00 H new ATOM 0 HA THR A 13 -15.285 10.965 -6.851 1.00 0.00 H new ATOM 0 HB THR A 13 -14.216 8.236 -7.672 1.00 0.00 H new ATOM 0 HG1 THR A 13 -16.436 7.835 -8.335 1.00 0.00 H new ATOM 0 HG21 THR A 13 -15.868 7.404 -6.053 1.00 0.00 H new ATOM 0 HG22 THR A 13 -14.699 8.507 -5.290 1.00 0.00 H new ATOM 0 HG23 THR A 13 -16.339 9.079 -5.677 1.00 0.00 H new ATOM 220 N ALA A 14 -13.226 11.284 -5.550 1.00 0.00 N ATOM 221 CA ALA A 14 -12.047 11.478 -4.718 1.00 0.00 C ATOM 222 C ALA A 14 -12.115 10.624 -3.457 1.00 0.00 C ATOM 223 O ALA A 14 -11.170 10.589 -2.664 1.00 0.00 O ATOM 224 CB ALA A 14 -11.909 12.948 -4.353 1.00 0.00 C ATOM 0 H ALA A 14 -14.019 11.873 -5.297 1.00 0.00 H new ATOM 0 HA ALA A 14 -11.171 11.165 -5.286 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -11.025 13.087 -3.730 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -11.809 13.541 -5.262 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -12.794 13.271 -3.804 1.00 0.00 H new ATOM 230 N ALA A 15 -13.239 9.945 -3.268 1.00 0.00 N ATOM 231 CA ALA A 15 -13.434 9.099 -2.100 1.00 0.00 C ATOM 232 C ALA A 15 -14.385 7.952 -2.411 1.00 0.00 C ATOM 233 O ALA A 15 -15.490 8.168 -2.913 1.00 0.00 O ATOM 234 CB ALA A 15 -13.962 9.921 -0.934 1.00 0.00 C ATOM 0 H ALA A 15 -14.031 9.964 -3.911 1.00 0.00 H new ATOM 0 HA ALA A 15 -12.469 8.675 -1.823 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -14.103 9.275 -0.068 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -13.247 10.706 -0.689 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -14.915 10.372 -1.209 1.00 0.00 H new ATOM 240 N ILE A 16 -13.943 6.733 -2.125 1.00 0.00 N ATOM 241 CA ILE A 16 -14.780 5.550 -2.294 1.00 0.00 C ATOM 242 C ILE A 16 -15.972 5.631 -1.343 1.00 0.00 C ATOM 243 O ILE A 16 -15.806 5.932 -0.160 1.00 0.00 O ATOM 244 CB ILE A 16 -13.989 4.237 -2.037 1.00 0.00 C ATOM 245 CG1 ILE A 16 -12.854 4.054 -3.057 1.00 0.00 C ATOM 246 CG2 ILE A 16 -14.917 3.030 -2.077 1.00 0.00 C ATOM 247 CD1 ILE A 16 -11.632 4.914 -2.796 1.00 0.00 C ATOM 0 H ILE A 16 -13.006 6.537 -1.773 1.00 0.00 H new ATOM 0 HA ILE A 16 -15.125 5.528 -3.328 1.00 0.00 H new ATOM 0 HB ILE A 16 -13.548 4.315 -1.043 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -12.552 3.007 -3.062 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -13.236 4.280 -4.052 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -14.342 2.122 -1.895 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -15.683 3.134 -1.309 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -15.391 2.968 -3.056 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -10.881 4.722 -3.562 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -11.915 5.966 -2.822 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -11.220 4.673 -1.816 1.00 0.00 H new ATOM 259 N ASP A 17 -17.167 5.374 -1.859 1.00 0.00 N ATOM 260 CA ASP A 17 -18.381 5.544 -1.073 1.00 0.00 C ATOM 261 C ASP A 17 -18.616 4.339 -0.170 1.00 0.00 C ATOM 262 O ASP A 17 -19.005 4.490 0.988 1.00 0.00 O ATOM 263 CB ASP A 17 -19.585 5.769 -1.988 1.00 0.00 C ATOM 264 CG ASP A 17 -20.783 6.315 -1.242 1.00 0.00 C ATOM 265 OD1 ASP A 17 -20.701 7.459 -0.741 1.00 0.00 O ATOM 266 OD2 ASP A 17 -21.814 5.623 -1.163 1.00 0.00 O ATOM 0 H ASP A 17 -17.321 5.049 -2.813 1.00 0.00 H new ATOM 0 HA ASP A 17 -18.256 6.424 -0.442 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -19.309 6.462 -2.783 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -19.856 4.827 -2.465 1.00 0.00 H new ATOM 271 N ALA A 18 -18.372 3.147 -0.705 1.00 0.00 N ATOM 272 CA ALA A 18 -18.511 1.913 0.062 1.00 0.00 C ATOM 273 C ALA A 18 -17.829 0.751 -0.656 1.00 0.00 C ATOM 274 O ALA A 18 -17.353 0.898 -1.781 1.00 0.00 O ATOM 275 CB ALA A 18 -19.982 1.590 0.298 1.00 0.00 C ATOM 0 H ALA A 18 -18.076 3.009 -1.671 1.00 0.00 H new ATOM 0 HA ALA A 18 -18.026 2.059 1.027 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -20.064 0.667 0.871 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -20.449 2.404 0.852 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -20.486 1.468 -0.661 1.00 0.00 H new ATOM 281 N TYR A 19 -17.784 -0.399 0.000 1.00 0.00 N ATOM 282 CA TYR A 19 -17.230 -1.608 -0.593 1.00 0.00 C ATOM 283 C TYR A 19 -18.135 -2.786 -0.262 1.00 0.00 C ATOM 284 O TYR A 19 -18.404 -3.055 0.908 1.00 0.00 O ATOM 285 CB TYR A 19 -15.802 -1.857 -0.079 1.00 0.00 C ATOM 286 CG TYR A 19 -15.154 -3.116 -0.622 1.00 0.00 C ATOM 287 CD1 TYR A 19 -14.522 -3.117 -1.859 1.00 0.00 C ATOM 288 CD2 TYR A 19 -15.173 -4.303 0.104 1.00 0.00 C ATOM 289 CE1 TYR A 19 -13.929 -4.261 -2.358 1.00 0.00 C ATOM 290 CE2 TYR A 19 -14.582 -5.451 -0.388 1.00 0.00 C ATOM 291 CZ TYR A 19 -13.963 -5.426 -1.620 1.00 0.00 C ATOM 292 OH TYR A 19 -13.372 -6.569 -2.114 1.00 0.00 O ATOM 0 H TYR A 19 -18.128 -0.521 0.952 1.00 0.00 H new ATOM 0 HA TYR A 19 -17.177 -1.489 -1.675 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -15.180 -1.001 -0.340 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -15.825 -1.915 1.009 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -14.494 -2.208 -2.441 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -15.658 -4.327 1.069 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -13.441 -4.243 -3.321 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -14.605 -6.363 0.189 1.00 0.00 H new ATOM 0 HH TYR A 19 -13.797 -7.356 -1.714 1.00 0.00 H new ATOM 302 N GLY A 20 -18.612 -3.480 -1.284 1.00 0.00 N ATOM 303 CA GLY A 20 -19.563 -4.550 -1.060 1.00 0.00 C ATOM 304 C GLY A 20 -19.247 -5.795 -1.861 1.00 0.00 C ATOM 305 O GLY A 20 -18.941 -5.710 -3.053 1.00 0.00 O ATOM 0 H GLY A 20 -18.360 -3.323 -2.260 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -19.578 -4.800 0.001 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -20.563 -4.201 -1.319 1.00 0.00 H new ATOM 309 N LYS A 21 -19.338 -6.948 -1.197 1.00 0.00 N ATOM 310 CA LYS A 21 -19.076 -8.252 -1.811 1.00 0.00 C ATOM 311 C LYS A 21 -17.611 -8.359 -2.229 1.00 0.00 C ATOM 312 O LYS A 21 -16.754 -8.756 -1.438 1.00 0.00 O ATOM 313 CB LYS A 21 -19.989 -8.496 -3.026 1.00 0.00 C ATOM 314 CG LYS A 21 -21.470 -8.280 -2.743 1.00 0.00 C ATOM 315 CD LYS A 21 -22.323 -8.526 -3.983 1.00 0.00 C ATOM 316 CE LYS A 21 -21.882 -7.664 -5.162 1.00 0.00 C ATOM 317 NZ LYS A 21 -21.938 -6.210 -4.853 1.00 0.00 N ATOM 0 H LYS A 21 -19.597 -7.005 -0.212 1.00 0.00 H new ATOM 0 HA LYS A 21 -19.293 -9.018 -1.066 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -19.684 -7.833 -3.835 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -19.842 -9.517 -3.378 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -21.789 -8.949 -1.943 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -21.628 -7.261 -2.389 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -22.263 -9.578 -4.261 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -23.367 -8.317 -3.752 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -20.865 -7.934 -5.445 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -22.519 -7.875 -6.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -21.728 -5.664 -5.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -22.889 -5.964 -4.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -21.236 -5.984 -4.119 1.00 0.00 H new ATOM 331 N GLY A 22 -17.336 -7.967 -3.462 1.00 0.00 N ATOM 332 CA GLY A 22 -15.988 -7.986 -3.981 1.00 0.00 C ATOM 333 C GLY A 22 -15.799 -6.899 -5.009 1.00 0.00 C ATOM 334 O GLY A 22 -15.140 -7.095 -6.029 1.00 0.00 O ATOM 0 H GLY A 22 -18.037 -7.630 -4.122 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -15.277 -7.851 -3.166 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -15.779 -8.958 -4.429 1.00 0.00 H new ATOM 338 N GLY A 23 -16.415 -5.757 -4.750 1.00 0.00 N ATOM 339 CA GLY A 23 -16.327 -4.642 -5.663 1.00 0.00 C ATOM 340 C GLY A 23 -16.474 -3.321 -4.952 1.00 0.00 C ATOM 341 O GLY A 23 -17.028 -3.259 -3.851 1.00 0.00 O ATOM 0 H GLY A 23 -16.978 -5.583 -3.917 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -15.368 -4.671 -6.180 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -17.102 -4.733 -6.424 1.00 0.00 H new ATOM 345 N PHE A 24 -15.986 -2.270 -5.582 1.00 0.00 N ATOM 346 CA PHE A 24 -16.009 -0.949 -4.990 1.00 0.00 C ATOM 347 C PHE A 24 -17.277 -0.216 -5.393 1.00 0.00 C ATOM 348 O PHE A 24 -17.779 -0.381 -6.507 1.00 0.00 O ATOM 349 CB PHE A 24 -14.776 -0.151 -5.421 1.00 0.00 C ATOM 350 CG PHE A 24 -13.478 -0.796 -5.023 1.00 0.00 C ATOM 351 CD1 PHE A 24 -12.860 -1.714 -5.859 1.00 0.00 C ATOM 352 CD2 PHE A 24 -12.879 -0.487 -3.813 1.00 0.00 C ATOM 353 CE1 PHE A 24 -11.669 -2.311 -5.493 1.00 0.00 C ATOM 354 CE2 PHE A 24 -11.687 -1.080 -3.443 1.00 0.00 C ATOM 355 CZ PHE A 24 -11.083 -1.995 -4.283 1.00 0.00 C ATOM 0 H PHE A 24 -15.566 -2.308 -6.511 1.00 0.00 H new ATOM 0 HA PHE A 24 -15.994 -1.053 -3.905 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -14.794 -0.026 -6.504 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -14.827 0.846 -4.984 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -13.315 -1.965 -6.806 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -13.349 0.225 -3.151 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -11.197 -3.024 -6.152 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -11.228 -0.828 -2.498 1.00 0.00 H new ATOM 0 HZ PHE A 24 -10.154 -2.463 -3.994 1.00 0.00 H new ATOM 365 N TYR A 25 -17.802 0.572 -4.478 1.00 0.00 N ATOM 366 CA TYR A 25 -19.004 1.339 -4.729 1.00 0.00 C ATOM 367 C TYR A 25 -18.724 2.822 -4.540 1.00 0.00 C ATOM 368 O TYR A 25 -18.112 3.231 -3.552 1.00 0.00 O ATOM 369 CB TYR A 25 -20.127 0.871 -3.796 1.00 0.00 C ATOM 370 CG TYR A 25 -21.397 1.685 -3.897 1.00 0.00 C ATOM 371 CD1 TYR A 25 -22.139 1.713 -5.071 1.00 0.00 C ATOM 372 CD2 TYR A 25 -21.848 2.428 -2.816 1.00 0.00 C ATOM 373 CE1 TYR A 25 -23.298 2.460 -5.161 1.00 0.00 C ATOM 374 CE2 TYR A 25 -23.003 3.174 -2.899 1.00 0.00 C ATOM 375 CZ TYR A 25 -23.725 3.188 -4.071 1.00 0.00 C ATOM 376 OH TYR A 25 -24.876 3.936 -4.152 1.00 0.00 O ATOM 0 H TYR A 25 -17.410 0.699 -3.545 1.00 0.00 H new ATOM 0 HA TYR A 25 -19.324 1.180 -5.759 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -20.358 -0.171 -4.018 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -19.768 0.906 -2.768 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -21.805 1.143 -5.925 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -21.285 2.422 -1.895 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -23.866 2.473 -6.080 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -23.341 3.746 -2.048 1.00 0.00 H new ATOM 0 HH TYR A 25 -25.034 4.386 -3.296 1.00 0.00 H new ATOM 386 N PHE A 26 -19.150 3.618 -5.502 1.00 0.00 N ATOM 387 CA PHE A 26 -18.982 5.056 -5.434 1.00 0.00 C ATOM 388 C PHE A 26 -20.282 5.738 -5.823 1.00 0.00 C ATOM 389 O PHE A 26 -21.255 5.063 -6.164 1.00 0.00 O ATOM 390 CB PHE A 26 -17.829 5.513 -6.340 1.00 0.00 C ATOM 391 CG PHE A 26 -17.931 5.046 -7.769 1.00 0.00 C ATOM 392 CD1 PHE A 26 -18.639 5.779 -8.708 1.00 0.00 C ATOM 393 CD2 PHE A 26 -17.305 3.876 -8.175 1.00 0.00 C ATOM 394 CE1 PHE A 26 -18.726 5.354 -10.021 1.00 0.00 C ATOM 395 CE2 PHE A 26 -17.386 3.447 -9.486 1.00 0.00 C ATOM 396 CZ PHE A 26 -18.098 4.187 -10.410 1.00 0.00 C ATOM 0 H PHE A 26 -19.619 3.289 -6.346 1.00 0.00 H new ATOM 0 HA PHE A 26 -18.729 5.337 -4.412 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -17.786 6.602 -6.330 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -16.890 5.153 -5.920 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -19.129 6.694 -8.410 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -16.747 3.293 -7.457 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -19.284 5.934 -10.741 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.893 2.535 -9.788 1.00 0.00 H new ATOM 0 HZ PHE A 26 -18.163 3.853 -11.435 1.00 0.00 H new ATOM 406 N ALA A 27 -20.300 7.064 -5.752 1.00 0.00 N ATOM 407 CA ALA A 27 -21.475 7.838 -6.123 1.00 0.00 C ATOM 408 C ALA A 27 -21.862 7.579 -7.576 1.00 0.00 C ATOM 409 O ALA A 27 -21.270 8.139 -8.501 1.00 0.00 O ATOM 410 CB ALA A 27 -21.226 9.321 -5.892 1.00 0.00 C ATOM 0 H ALA A 27 -19.509 7.626 -5.439 1.00 0.00 H new ATOM 0 HA ALA A 27 -22.305 7.522 -5.492 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -22.114 9.887 -6.174 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -21.005 9.493 -4.839 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -20.380 9.647 -6.498 1.00 0.00 H new ATOM 416 N GLY A 28 -22.841 6.708 -7.767 1.00 0.00 N ATOM 417 CA GLY A 28 -23.293 6.376 -9.098 1.00 0.00 C ATOM 418 C GLY A 28 -23.539 4.891 -9.267 1.00 0.00 C ATOM 419 O GLY A 28 -24.683 4.442 -9.268 1.00 0.00 O ATOM 0 H GLY A 28 -23.333 6.223 -7.016 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -24.212 6.921 -9.314 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -22.549 6.704 -9.824 1.00 0.00 H new ATOM 423 N MET A 29 -22.464 4.124 -9.388 1.00 0.00 N ATOM 424 CA MET A 29 -22.575 2.692 -9.632 1.00 0.00 C ATOM 425 C MET A 29 -21.413 1.949 -8.975 1.00 0.00 C ATOM 426 O MET A 29 -20.373 2.541 -8.690 1.00 0.00 O ATOM 427 CB MET A 29 -22.591 2.421 -11.141 1.00 0.00 C ATOM 428 CG MET A 29 -22.942 0.988 -11.512 1.00 0.00 C ATOM 429 SD MET A 29 -22.874 0.696 -13.291 1.00 0.00 S ATOM 430 CE MET A 29 -23.407 -1.013 -13.377 1.00 0.00 C ATOM 0 H MET A 29 -21.506 4.469 -9.321 1.00 0.00 H new ATOM 0 HA MET A 29 -23.507 2.331 -9.196 1.00 0.00 H new ATOM 0 HB2 MET A 29 -23.308 3.093 -11.612 1.00 0.00 H new ATOM 0 HB3 MET A 29 -21.611 2.662 -11.553 1.00 0.00 H new ATOM 0 HG2 MET A 29 -22.255 0.308 -11.009 1.00 0.00 H new ATOM 0 HG3 MET A 29 -23.943 0.757 -11.148 1.00 0.00 H new ATOM 0 HE1 MET A 29 -23.416 -1.339 -14.417 1.00 0.00 H new ATOM 0 HE2 MET A 29 -22.719 -1.638 -12.807 1.00 0.00 H new ATOM 0 HE3 MET A 29 -24.410 -1.103 -12.959 1.00 0.00 H new ATOM 440 N SER A 30 -21.597 0.659 -8.729 1.00 0.00 N ATOM 441 CA SER A 30 -20.546 -0.173 -8.164 1.00 0.00 C ATOM 442 C SER A 30 -19.835 -0.942 -9.278 1.00 0.00 C ATOM 443 O SER A 30 -20.423 -1.209 -10.328 1.00 0.00 O ATOM 444 CB SER A 30 -21.143 -1.149 -7.141 1.00 0.00 C ATOM 445 OG SER A 30 -20.135 -1.896 -6.478 1.00 0.00 O ATOM 0 H SER A 30 -22.470 0.165 -8.914 1.00 0.00 H new ATOM 0 HA SER A 30 -19.820 0.464 -7.658 1.00 0.00 H new ATOM 0 HB2 SER A 30 -21.727 -0.594 -6.407 1.00 0.00 H new ATOM 0 HB3 SER A 30 -21.829 -1.830 -7.645 1.00 0.00 H new ATOM 0 HG SER A 30 -19.294 -1.393 -6.490 1.00 0.00 H new ATOM 451 N HIS A 31 -18.567 -1.266 -9.059 1.00 0.00 N ATOM 452 CA HIS A 31 -17.799 -2.063 -10.011 1.00 0.00 C ATOM 453 C HIS A 31 -16.845 -3.000 -9.286 1.00 0.00 C ATOM 454 O HIS A 31 -16.071 -2.575 -8.426 1.00 0.00 O ATOM 455 CB HIS A 31 -17.017 -1.175 -10.984 1.00 0.00 C ATOM 456 CG HIS A 31 -17.826 -0.703 -12.152 1.00 0.00 C ATOM 457 ND1 HIS A 31 -18.135 0.622 -12.374 1.00 0.00 N ATOM 458 CD2 HIS A 31 -18.378 -1.392 -13.181 1.00 0.00 C ATOM 459 CE1 HIS A 31 -18.840 0.727 -13.485 1.00 0.00 C ATOM 460 NE2 HIS A 31 -19.000 -0.480 -13.995 1.00 0.00 N ATOM 0 H HIS A 31 -18.046 -0.988 -8.227 1.00 0.00 H new ATOM 0 HA HIS A 31 -18.511 -2.656 -10.585 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -16.635 -0.309 -10.444 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -16.153 -1.728 -11.352 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -18.336 -2.461 -13.332 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -19.222 1.646 -13.906 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -19.504 -0.699 -14.854 1.00 0.00 H new ATOM 469 N GLN A 32 -16.911 -4.274 -9.638 1.00 0.00 N ATOM 470 CA GLN A 32 -16.059 -5.285 -9.032 1.00 0.00 C ATOM 471 C GLN A 32 -14.772 -5.456 -9.830 1.00 0.00 C ATOM 472 O GLN A 32 -14.684 -5.030 -10.982 1.00 0.00 O ATOM 473 CB GLN A 32 -16.804 -6.618 -8.936 1.00 0.00 C ATOM 474 CG GLN A 32 -17.987 -6.582 -7.984 1.00 0.00 C ATOM 475 CD GLN A 32 -18.685 -7.920 -7.864 1.00 0.00 C ATOM 476 OE1 GLN A 32 -19.633 -8.207 -8.591 1.00 0.00 O ATOM 477 NE2 GLN A 32 -18.210 -8.753 -6.953 1.00 0.00 N ATOM 0 H GLN A 32 -17.551 -4.635 -10.346 1.00 0.00 H new ATOM 0 HA GLN A 32 -15.798 -4.955 -8.027 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -17.154 -6.902 -9.928 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -16.109 -7.392 -8.610 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -17.645 -6.266 -6.998 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -18.702 -5.834 -8.328 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -17.421 -8.475 -6.370 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -18.633 -9.674 -6.834 1.00 0.00 H new ATOM 486 N GLY A 33 -13.778 -6.073 -9.210 1.00 0.00 N ATOM 487 CA GLY A 33 -12.520 -6.312 -9.885 1.00 0.00 C ATOM 488 C GLY A 33 -11.444 -5.337 -9.460 1.00 0.00 C ATOM 489 O GLY A 33 -10.836 -5.499 -8.404 1.00 0.00 O ATOM 0 H GLY A 33 -13.820 -6.413 -8.249 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.187 -7.329 -9.678 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.669 -6.238 -10.962 1.00 0.00 H new ATOM 493 N SER A 34 -11.220 -4.318 -10.276 1.00 0.00 N ATOM 494 CA SER A 34 -10.195 -3.326 -9.998 1.00 0.00 C ATOM 495 C SER A 34 -10.564 -1.995 -10.645 1.00 0.00 C ATOM 496 O SER A 34 -11.132 -1.963 -11.741 1.00 0.00 O ATOM 497 CB SER A 34 -8.841 -3.809 -10.519 1.00 0.00 C ATOM 498 OG SER A 34 -7.799 -2.917 -10.163 1.00 0.00 O ATOM 0 H SER A 34 -11.738 -4.157 -11.140 1.00 0.00 H new ATOM 0 HA SER A 34 -10.125 -3.184 -8.920 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.627 -4.799 -10.116 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.882 -3.908 -11.604 1.00 0.00 H new ATOM 0 HG SER A 34 -8.010 -2.493 -9.305 1.00 0.00 H new ATOM 504 N LEU A 35 -10.248 -0.905 -9.963 1.00 0.00 N ATOM 505 CA LEU A 35 -10.552 0.425 -10.466 1.00 0.00 C ATOM 506 C LEU A 35 -9.304 1.297 -10.477 1.00 0.00 C ATOM 507 O LEU A 35 -8.510 1.279 -9.532 1.00 0.00 O ATOM 508 CB LEU A 35 -11.646 1.087 -9.621 1.00 0.00 C ATOM 509 CG LEU A 35 -13.026 0.429 -9.705 1.00 0.00 C ATOM 510 CD1 LEU A 35 -14.009 1.139 -8.787 1.00 0.00 C ATOM 511 CD2 LEU A 35 -13.536 0.441 -11.139 1.00 0.00 C ATOM 0 H LEU A 35 -9.780 -0.916 -9.057 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.914 0.322 -11.489 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -11.326 1.089 -8.579 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.739 2.129 -9.928 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.934 -0.607 -9.380 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.985 0.659 -8.858 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -13.652 1.084 -7.759 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -14.096 2.184 -9.085 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.518 -0.031 -11.180 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.613 1.470 -11.489 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.843 -0.108 -11.776 1.00 0.00 H new ATOM 523 N LEU A 36 -9.140 2.056 -11.550 1.00 0.00 N ATOM 524 CA LEU A 36 -8.003 2.950 -11.699 1.00 0.00 C ATOM 525 C LEU A 36 -8.413 4.380 -11.394 1.00 0.00 C ATOM 526 O LEU A 36 -9.126 5.015 -12.173 1.00 0.00 O ATOM 527 CB LEU A 36 -7.430 2.874 -13.119 1.00 0.00 C ATOM 528 CG LEU A 36 -6.766 1.549 -13.489 1.00 0.00 C ATOM 529 CD1 LEU A 36 -6.313 1.570 -14.940 1.00 0.00 C ATOM 530 CD2 LEU A 36 -5.586 1.271 -12.571 1.00 0.00 C ATOM 0 H LEU A 36 -9.788 2.070 -12.338 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.234 2.636 -10.993 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -8.235 3.068 -13.828 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.699 3.673 -13.241 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.497 0.750 -13.365 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -5.842 0.619 -15.188 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -7.175 1.728 -15.588 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.597 2.379 -15.086 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.125 0.323 -12.848 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.854 2.073 -12.667 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.933 1.217 -11.539 1.00 0.00 H new ATOM 542 N PHE A 37 -7.972 4.878 -10.255 1.00 0.00 N ATOM 543 CA PHE A 37 -8.249 6.248 -9.866 1.00 0.00 C ATOM 544 C PHE A 37 -7.157 7.163 -10.403 1.00 0.00 C ATOM 545 O PHE A 37 -6.063 7.237 -9.840 1.00 0.00 O ATOM 546 CB PHE A 37 -8.343 6.369 -8.342 1.00 0.00 C ATOM 547 CG PHE A 37 -9.487 5.599 -7.742 1.00 0.00 C ATOM 548 CD1 PHE A 37 -9.370 4.242 -7.483 1.00 0.00 C ATOM 549 CD2 PHE A 37 -10.681 6.234 -7.439 1.00 0.00 C ATOM 550 CE1 PHE A 37 -10.421 3.534 -6.933 1.00 0.00 C ATOM 551 CE2 PHE A 37 -11.736 5.531 -6.888 1.00 0.00 C ATOM 552 CZ PHE A 37 -11.606 4.179 -6.635 1.00 0.00 C ATOM 0 H PHE A 37 -7.418 4.352 -9.580 1.00 0.00 H new ATOM 0 HA PHE A 37 -9.208 6.547 -10.290 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.410 6.018 -7.901 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.446 7.421 -8.076 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -8.446 3.732 -7.714 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -10.788 7.290 -7.636 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -10.316 2.477 -6.736 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -12.661 6.038 -6.656 1.00 0.00 H new ATOM 0 HZ PHE A 37 -12.429 3.627 -6.205 1.00 0.00 H new ATOM 562 N LEU A 38 -7.447 7.823 -11.512 1.00 0.00 N ATOM 563 CA LEU A 38 -6.489 8.713 -12.147 1.00 0.00 C ATOM 564 C LEU A 38 -6.771 10.161 -11.751 1.00 0.00 C ATOM 565 O LEU A 38 -7.865 10.471 -11.278 1.00 0.00 O ATOM 566 CB LEU A 38 -6.551 8.555 -13.673 1.00 0.00 C ATOM 567 CG LEU A 38 -6.209 7.157 -14.200 1.00 0.00 C ATOM 568 CD1 LEU A 38 -6.272 7.133 -15.718 1.00 0.00 C ATOM 569 CD2 LEU A 38 -4.832 6.721 -13.719 1.00 0.00 C ATOM 0 H LEU A 38 -8.344 7.758 -11.994 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.487 8.449 -11.809 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.555 8.817 -14.009 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.867 9.273 -14.124 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.946 6.455 -13.810 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.027 6.133 -16.077 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.277 7.399 -16.045 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.557 7.849 -16.123 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.610 5.726 -14.105 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.081 7.425 -14.078 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.817 6.699 -12.629 1.00 0.00 H new ATOM 581 N PRO A 39 -5.790 11.063 -11.937 1.00 0.00 N ATOM 582 CA PRO A 39 -5.939 12.487 -11.596 1.00 0.00 C ATOM 583 C PRO A 39 -7.064 13.176 -12.374 1.00 0.00 C ATOM 584 O PRO A 39 -7.489 14.276 -12.014 1.00 0.00 O ATOM 585 CB PRO A 39 -4.583 13.097 -11.972 1.00 0.00 C ATOM 586 CG PRO A 39 -3.638 11.947 -12.008 1.00 0.00 C ATOM 587 CD PRO A 39 -4.447 10.770 -12.467 1.00 0.00 C ATOM 0 HA PRO A 39 -6.206 12.615 -10.547 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -4.631 13.599 -12.938 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -4.270 13.842 -11.241 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -2.810 12.142 -12.689 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -3.205 11.765 -11.024 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -4.452 10.683 -13.554 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -4.054 9.832 -12.074 1.00 0.00 H new ATOM 595 N ASP A 40 -7.529 12.530 -13.437 1.00 0.00 N ATOM 596 CA ASP A 40 -8.623 13.065 -14.245 1.00 0.00 C ATOM 597 C ASP A 40 -9.954 12.470 -13.803 1.00 0.00 C ATOM 598 O ASP A 40 -10.875 13.192 -13.419 1.00 0.00 O ATOM 599 CB ASP A 40 -8.407 12.770 -15.735 1.00 0.00 C ATOM 600 CG ASP A 40 -7.203 13.484 -16.314 1.00 0.00 C ATOM 601 OD1 ASP A 40 -7.345 14.648 -16.749 1.00 0.00 O ATOM 602 OD2 ASP A 40 -6.113 12.878 -16.347 1.00 0.00 O ATOM 0 H ASP A 40 -7.166 11.634 -13.761 1.00 0.00 H new ATOM 0 HA ASP A 40 -8.641 14.145 -14.099 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -8.286 11.696 -15.873 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -9.298 13.064 -16.290 1.00 0.00 H new ATOM 607 N ALA A 41 -10.048 11.146 -13.858 1.00 0.00 N ATOM 608 CA ALA A 41 -11.279 10.448 -13.524 1.00 0.00 C ATOM 609 C ALA A 41 -10.990 9.003 -13.138 1.00 0.00 C ATOM 610 O ALA A 41 -9.838 8.573 -13.136 1.00 0.00 O ATOM 611 CB ALA A 41 -12.252 10.500 -14.695 1.00 0.00 C ATOM 0 H ALA A 41 -9.280 10.534 -14.133 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.735 10.947 -12.669 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -13.169 9.973 -14.430 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.485 11.539 -14.929 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.799 10.025 -15.565 1.00 0.00 H new ATOM 617 N VAL A 42 -12.042 8.263 -12.820 1.00 0.00 N ATOM 618 CA VAL A 42 -11.910 6.873 -12.418 1.00 0.00 C ATOM 619 C VAL A 42 -12.248 5.950 -13.583 1.00 0.00 C ATOM 620 O VAL A 42 -13.276 6.117 -14.235 1.00 0.00 O ATOM 621 CB VAL A 42 -12.838 6.543 -11.227 1.00 0.00 C ATOM 622 CG1 VAL A 42 -12.600 5.124 -10.726 1.00 0.00 C ATOM 623 CG2 VAL A 42 -12.648 7.551 -10.102 1.00 0.00 C ATOM 0 H VAL A 42 -13.002 8.606 -12.833 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.876 6.717 -12.112 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.869 6.608 -11.575 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -13.266 4.918 -9.888 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.799 4.416 -11.530 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.565 5.022 -10.401 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -13.310 7.301 -9.273 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.613 7.524 -9.760 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -12.884 8.551 -10.466 1.00 0.00 H new ATOM 633 N TRP A 43 -11.375 4.993 -13.850 1.00 0.00 N ATOM 634 CA TRP A 43 -11.602 4.026 -14.910 1.00 0.00 C ATOM 635 C TRP A 43 -11.551 2.609 -14.352 1.00 0.00 C ATOM 636 O TRP A 43 -11.305 2.413 -13.163 1.00 0.00 O ATOM 637 CB TRP A 43 -10.562 4.186 -16.022 1.00 0.00 C ATOM 638 CG TRP A 43 -10.604 5.522 -16.699 1.00 0.00 C ATOM 639 CD1 TRP A 43 -9.706 6.540 -16.558 1.00 0.00 C ATOM 640 CD2 TRP A 43 -11.598 5.987 -17.621 1.00 0.00 C ATOM 641 NE1 TRP A 43 -10.076 7.607 -17.342 1.00 0.00 N ATOM 642 CE2 TRP A 43 -11.234 7.294 -18.001 1.00 0.00 C ATOM 643 CE3 TRP A 43 -12.758 5.426 -18.163 1.00 0.00 C ATOM 644 CZ2 TRP A 43 -11.989 8.046 -18.898 1.00 0.00 C ATOM 645 CZ3 TRP A 43 -13.506 6.174 -19.052 1.00 0.00 C ATOM 646 CH2 TRP A 43 -13.120 7.471 -19.411 1.00 0.00 C ATOM 0 H TRP A 43 -10.498 4.865 -13.344 1.00 0.00 H new ATOM 0 HA TRP A 43 -12.591 4.208 -15.331 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -9.568 4.033 -15.602 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -10.717 3.406 -16.767 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.833 6.512 -15.923 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -9.570 8.489 -17.420 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -13.064 4.426 -17.892 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -11.693 9.046 -19.178 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -14.404 5.751 -19.477 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -13.728 8.030 -20.108 1.00 0.00 H new ATOM 657 N GLY A 44 -11.783 1.628 -15.209 1.00 0.00 N ATOM 658 CA GLY A 44 -11.738 0.246 -14.778 1.00 0.00 C ATOM 659 C GLY A 44 -10.461 -0.440 -15.214 1.00 0.00 C ATOM 660 O GLY A 44 -9.941 -0.159 -16.295 1.00 0.00 O ATOM 0 H GLY A 44 -12.002 1.763 -16.196 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -11.821 0.201 -13.692 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.595 -0.290 -15.186 1.00 0.00 H new ATOM 664 N TRP A 45 -9.949 -1.328 -14.376 1.00 0.00 N ATOM 665 CA TRP A 45 -8.730 -2.059 -14.688 1.00 0.00 C ATOM 666 C TRP A 45 -9.068 -3.530 -14.904 1.00 0.00 C ATOM 667 O TRP A 45 -9.788 -4.127 -14.104 1.00 0.00 O ATOM 668 CB TRP A 45 -7.714 -1.895 -13.554 1.00 0.00 C ATOM 669 CG TRP A 45 -6.292 -2.150 -13.963 1.00 0.00 C ATOM 670 CD1 TRP A 45 -5.769 -2.065 -15.221 1.00 0.00 C ATOM 671 CD2 TRP A 45 -5.201 -2.500 -13.100 1.00 0.00 C ATOM 672 NE1 TRP A 45 -4.427 -2.355 -15.196 1.00 0.00 N ATOM 673 CE2 TRP A 45 -4.054 -2.623 -13.907 1.00 0.00 C ATOM 674 CE3 TRP A 45 -5.083 -2.726 -11.728 1.00 0.00 C ATOM 675 CZ2 TRP A 45 -2.809 -2.957 -13.385 1.00 0.00 C ATOM 676 CZ3 TRP A 45 -3.846 -3.059 -11.210 1.00 0.00 C ATOM 677 CH2 TRP A 45 -2.723 -3.172 -12.037 1.00 0.00 C ATOM 0 H TRP A 45 -10.360 -1.561 -13.472 1.00 0.00 H new ATOM 0 HA TRP A 45 -8.286 -1.660 -15.600 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -7.790 -0.883 -13.156 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -7.976 -2.577 -12.745 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -6.329 -1.807 -16.107 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -3.808 -2.368 -16.007 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -5.944 -2.642 -11.082 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -1.941 -3.044 -14.021 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -3.744 -3.235 -10.149 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -1.770 -3.434 -11.602 1.00 0.00 H new ATOM 688 N ASP A 46 -8.547 -4.113 -15.978 1.00 0.00 N ATOM 689 CA ASP A 46 -8.913 -5.478 -16.357 1.00 0.00 C ATOM 690 C ASP A 46 -8.133 -6.507 -15.549 1.00 0.00 C ATOM 691 O ASP A 46 -8.259 -7.717 -15.741 1.00 0.00 O ATOM 692 CB ASP A 46 -8.707 -5.684 -17.862 1.00 0.00 C ATOM 693 CG ASP A 46 -9.214 -7.027 -18.357 1.00 0.00 C ATOM 694 OD1 ASP A 46 -10.442 -7.259 -18.310 1.00 0.00 O ATOM 695 OD2 ASP A 46 -8.390 -7.846 -18.814 1.00 0.00 O ATOM 0 H ASP A 46 -7.873 -3.667 -16.600 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.969 -5.623 -16.130 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.217 -4.888 -18.404 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -7.645 -5.597 -18.092 1.00 0.00 H new ATOM 700 N VAL A 47 -7.359 -6.015 -14.616 1.00 0.00 N ATOM 701 CA VAL A 47 -6.604 -6.872 -13.720 1.00 0.00 C ATOM 702 C VAL A 47 -7.407 -7.097 -12.446 1.00 0.00 C ATOM 703 O VAL A 47 -7.307 -6.340 -11.483 1.00 0.00 O ATOM 704 CB VAL A 47 -5.217 -6.281 -13.390 1.00 0.00 C ATOM 705 CG1 VAL A 47 -4.434 -7.199 -12.465 1.00 0.00 C ATOM 706 CG2 VAL A 47 -4.436 -6.028 -14.670 1.00 0.00 C ATOM 0 H VAL A 47 -7.230 -5.017 -14.451 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.432 -7.825 -14.220 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.367 -5.333 -12.873 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.461 -6.756 -12.251 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.985 -7.333 -11.534 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.294 -8.167 -12.946 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.459 -5.611 -14.424 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.305 -6.967 -15.208 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -4.983 -5.324 -15.297 1.00 0.00 H new ATOM 716 N THR A 48 -8.235 -8.131 -12.473 1.00 0.00 N ATOM 717 CA THR A 48 -9.169 -8.409 -11.392 1.00 0.00 C ATOM 718 C THR A 48 -8.508 -9.167 -10.248 1.00 0.00 C ATOM 719 O THR A 48 -9.110 -9.366 -9.194 1.00 0.00 O ATOM 720 CB THR A 48 -10.363 -9.221 -11.923 1.00 0.00 C ATOM 721 OG1 THR A 48 -9.888 -10.275 -12.777 1.00 0.00 O ATOM 722 CG2 THR A 48 -11.327 -8.333 -12.695 1.00 0.00 C ATOM 0 H THR A 48 -8.278 -8.799 -13.242 1.00 0.00 H new ATOM 0 HA THR A 48 -9.513 -7.450 -11.005 1.00 0.00 H new ATOM 0 HB THR A 48 -10.895 -9.646 -11.072 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.650 -10.792 -13.113 1.00 0.00 H new ATOM 0 HG21 THR A 48 -12.162 -8.932 -13.059 1.00 0.00 H new ATOM 0 HG22 THR A 48 -11.703 -7.548 -12.039 1.00 0.00 H new ATOM 0 HG23 THR A 48 -10.808 -7.882 -13.541 1.00 0.00 H new ATOM 730 N LYS A 49 -7.271 -9.592 -10.460 1.00 0.00 N ATOM 731 CA LYS A 49 -6.545 -10.353 -9.457 1.00 0.00 C ATOM 732 C LYS A 49 -5.117 -9.844 -9.334 1.00 0.00 C ATOM 733 O LYS A 49 -4.478 -9.526 -10.337 1.00 0.00 O ATOM 734 CB LYS A 49 -6.540 -11.841 -9.815 1.00 0.00 C ATOM 735 CG LYS A 49 -7.925 -12.463 -9.846 1.00 0.00 C ATOM 736 CD LYS A 49 -7.867 -13.943 -10.176 1.00 0.00 C ATOM 737 CE LYS A 49 -9.252 -14.562 -10.175 1.00 0.00 C ATOM 738 NZ LYS A 49 -9.210 -16.025 -10.431 1.00 0.00 N ATOM 0 H LYS A 49 -6.749 -9.422 -11.320 1.00 0.00 H new ATOM 0 HA LYS A 49 -7.048 -10.223 -8.499 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.071 -11.970 -10.790 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -5.926 -12.378 -9.092 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -8.408 -12.324 -8.879 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -8.539 -11.949 -10.586 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -7.405 -14.082 -11.153 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.237 -14.456 -9.449 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -9.731 -14.376 -9.214 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.865 -14.079 -10.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.177 -16.407 -10.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -8.777 -16.203 -11.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -8.647 -16.491 -9.691 1.00 0.00 H new ATOM 752 N PRO A 50 -4.601 -9.755 -8.099 1.00 0.00 N ATOM 753 CA PRO A 50 -3.225 -9.323 -7.842 1.00 0.00 C ATOM 754 C PRO A 50 -2.204 -10.311 -8.398 1.00 0.00 C ATOM 755 O PRO A 50 -2.577 -11.347 -8.962 1.00 0.00 O ATOM 756 CB PRO A 50 -3.134 -9.263 -6.309 1.00 0.00 C ATOM 757 CG PRO A 50 -4.545 -9.288 -5.827 1.00 0.00 C ATOM 758 CD PRO A 50 -5.318 -10.061 -6.853 1.00 0.00 C ATOM 0 HA PRO A 50 -3.003 -8.371 -8.324 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -2.569 -10.108 -5.916 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.623 -8.358 -5.981 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -4.615 -9.761 -4.848 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -4.939 -8.277 -5.721 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -5.319 -11.130 -6.639 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -6.360 -9.744 -6.898 1.00 0.00 H new ATOM 766 N GLU A 51 -0.918 -9.975 -8.249 1.00 0.00 N ATOM 767 CA GLU A 51 0.192 -10.816 -8.715 1.00 0.00 C ATOM 768 C GLU A 51 0.358 -10.748 -10.235 1.00 0.00 C ATOM 769 O GLU A 51 1.471 -10.600 -10.736 1.00 0.00 O ATOM 770 CB GLU A 51 0.007 -12.270 -8.263 1.00 0.00 C ATOM 771 CG GLU A 51 1.045 -13.227 -8.824 1.00 0.00 C ATOM 772 CD GLU A 51 0.688 -14.673 -8.567 1.00 0.00 C ATOM 773 OE1 GLU A 51 -0.399 -15.104 -9.010 1.00 0.00 O ATOM 774 OE2 GLU A 51 1.480 -15.386 -7.919 1.00 0.00 O ATOM 0 H GLU A 51 -0.616 -9.110 -7.801 1.00 0.00 H new ATOM 0 HA GLU A 51 1.103 -10.424 -8.263 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.043 -12.309 -7.174 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.985 -12.609 -8.562 1.00 0.00 H new ATOM 0 HG2 GLU A 51 1.144 -13.064 -9.897 1.00 0.00 H new ATOM 0 HG3 GLU A 51 2.016 -13.010 -8.378 1.00 0.00 H new ATOM 781 N GLN A 52 -0.754 -10.819 -10.956 1.00 0.00 N ATOM 782 CA GLN A 52 -0.744 -10.847 -12.419 1.00 0.00 C ATOM 783 C GLN A 52 -0.536 -9.449 -13.007 1.00 0.00 C ATOM 784 O GLN A 52 -1.043 -9.130 -14.085 1.00 0.00 O ATOM 785 CB GLN A 52 -2.061 -11.442 -12.922 1.00 0.00 C ATOM 786 CG GLN A 52 -2.330 -12.836 -12.382 1.00 0.00 C ATOM 787 CD GLN A 52 -3.668 -13.394 -12.820 1.00 0.00 C ATOM 788 OE1 GLN A 52 -4.163 -13.082 -13.902 1.00 0.00 O ATOM 789 NE2 GLN A 52 -4.266 -14.215 -11.974 1.00 0.00 N ATOM 0 H GLN A 52 -1.688 -10.859 -10.547 1.00 0.00 H new ATOM 0 HA GLN A 52 0.091 -11.467 -12.746 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.882 -10.784 -12.638 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -2.044 -11.478 -14.011 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -1.537 -13.507 -12.713 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -2.292 -12.811 -11.293 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -3.820 -14.447 -11.087 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.174 -14.616 -12.208 1.00 0.00 H new ATOM 798 N ILE A 53 0.244 -8.635 -12.315 1.00 0.00 N ATOM 799 CA ILE A 53 0.509 -7.272 -12.739 1.00 0.00 C ATOM 800 C ILE A 53 1.898 -7.175 -13.360 1.00 0.00 C ATOM 801 O ILE A 53 2.899 -7.470 -12.708 1.00 0.00 O ATOM 802 CB ILE A 53 0.410 -6.289 -11.554 1.00 0.00 C ATOM 803 CG1 ILE A 53 -0.952 -6.423 -10.865 1.00 0.00 C ATOM 804 CG2 ILE A 53 0.632 -4.857 -12.026 1.00 0.00 C ATOM 805 CD1 ILE A 53 -1.086 -5.579 -9.615 1.00 0.00 C ATOM 0 H ILE A 53 0.709 -8.900 -11.447 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.244 -7.002 -13.479 1.00 0.00 H new ATOM 0 HB ILE A 53 1.189 -6.536 -10.833 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.735 -6.141 -11.569 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.117 -7.469 -10.606 1.00 0.00 H new ATOM 0 HG21 ILE A 53 0.558 -4.178 -11.176 1.00 0.00 H new ATOM 0 HG22 ILE A 53 1.622 -4.771 -12.474 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -0.125 -4.596 -12.765 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.075 -5.725 -9.182 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.326 -5.876 -8.892 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.953 -4.528 -9.870 1.00 0.00 H new ATOM 817 N ASP A 54 1.950 -6.791 -14.624 1.00 0.00 N ATOM 818 CA ASP A 54 3.216 -6.635 -15.329 1.00 0.00 C ATOM 819 C ASP A 54 3.173 -5.358 -16.167 1.00 0.00 C ATOM 820 O ASP A 54 2.234 -4.570 -16.050 1.00 0.00 O ATOM 821 CB ASP A 54 3.476 -7.863 -16.219 1.00 0.00 C ATOM 822 CG ASP A 54 4.925 -7.987 -16.670 1.00 0.00 C ATOM 823 OD1 ASP A 54 5.280 -7.423 -17.728 1.00 0.00 O ATOM 824 OD2 ASP A 54 5.717 -8.652 -15.976 1.00 0.00 O ATOM 0 H ASP A 54 1.127 -6.580 -15.188 1.00 0.00 H new ATOM 0 HA ASP A 54 4.031 -6.557 -14.609 1.00 0.00 H new ATOM 0 HB2 ASP A 54 3.195 -8.764 -15.674 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.833 -7.808 -17.098 1.00 0.00 H new ATOM 829 N ARG A 55 4.175 -5.168 -17.011 1.00 0.00 N ATOM 830 CA ARG A 55 4.251 -4.016 -17.904 1.00 0.00 C ATOM 831 C ARG A 55 3.013 -3.927 -18.776 1.00 0.00 C ATOM 832 O ARG A 55 2.480 -2.848 -19.013 1.00 0.00 O ATOM 833 CB ARG A 55 5.485 -4.146 -18.791 1.00 0.00 C ATOM 834 CG ARG A 55 6.781 -3.874 -18.063 1.00 0.00 C ATOM 835 CD ARG A 55 7.870 -4.857 -18.459 1.00 0.00 C ATOM 836 NE ARG A 55 7.653 -6.176 -17.862 1.00 0.00 N ATOM 837 CZ ARG A 55 8.623 -6.930 -17.352 1.00 0.00 C ATOM 838 NH1 ARG A 55 9.890 -6.549 -17.466 1.00 0.00 N ATOM 839 NH2 ARG A 55 8.328 -8.071 -16.741 1.00 0.00 N ATOM 0 H ARG A 55 4.963 -5.810 -17.098 1.00 0.00 H new ATOM 0 HA ARG A 55 4.317 -3.111 -17.300 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.517 -5.152 -19.210 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.396 -3.454 -19.628 1.00 0.00 H new ATOM 0 HG2 ARG A 55 7.113 -2.858 -18.279 1.00 0.00 H new ATOM 0 HG3 ARG A 55 6.613 -3.932 -16.988 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.899 -4.949 -19.545 1.00 0.00 H new ATOM 0 HD3 ARG A 55 8.840 -4.471 -18.146 1.00 0.00 H new ATOM 0 HE ARG A 55 6.700 -6.539 -17.836 1.00 0.00 H new ATOM 0 HH11 ARG A 55 10.120 -5.678 -17.945 1.00 0.00 H new ATOM 0 HH12 ARG A 55 10.634 -7.127 -17.075 1.00 0.00 H new ATOM 0 HH21 ARG A 55 7.356 -8.371 -16.662 1.00 0.00 H new ATOM 0 HH22 ARG A 55 9.073 -8.648 -16.351 1.00 0.00 H new ATOM 853 N TYR A 56 2.573 -5.080 -19.243 1.00 0.00 N ATOM 854 CA TYR A 56 1.387 -5.178 -20.090 1.00 0.00 C ATOM 855 C TYR A 56 0.141 -4.725 -19.335 1.00 0.00 C ATOM 856 O TYR A 56 -0.749 -4.093 -19.903 1.00 0.00 O ATOM 857 CB TYR A 56 1.207 -6.617 -20.574 1.00 0.00 C ATOM 858 CG TYR A 56 2.478 -7.232 -21.110 1.00 0.00 C ATOM 859 CD1 TYR A 56 3.096 -6.722 -22.245 1.00 0.00 C ATOM 860 CD2 TYR A 56 3.067 -8.316 -20.474 1.00 0.00 C ATOM 861 CE1 TYR A 56 4.262 -7.278 -22.731 1.00 0.00 C ATOM 862 CE2 TYR A 56 4.234 -8.876 -20.953 1.00 0.00 C ATOM 863 CZ TYR A 56 4.827 -8.353 -22.081 1.00 0.00 C ATOM 864 OH TYR A 56 5.989 -8.908 -22.561 1.00 0.00 O ATOM 0 H TYR A 56 3.022 -5.975 -19.050 1.00 0.00 H new ATOM 0 HA TYR A 56 1.526 -4.523 -20.950 1.00 0.00 H new ATOM 0 HB2 TYR A 56 0.837 -7.226 -19.750 1.00 0.00 H new ATOM 0 HB3 TYR A 56 0.445 -6.638 -21.353 1.00 0.00 H new ATOM 0 HD1 TYR A 56 2.657 -5.877 -22.755 1.00 0.00 H new ATOM 0 HD2 TYR A 56 2.604 -8.728 -19.589 1.00 0.00 H new ATOM 0 HE1 TYR A 56 4.729 -6.872 -23.616 1.00 0.00 H new ATOM 0 HE2 TYR A 56 4.680 -9.719 -20.446 1.00 0.00 H new ATOM 0 HH TYR A 56 6.255 -9.657 -21.987 1.00 0.00 H new ATOM 874 N SER A 57 0.086 -5.050 -18.051 1.00 0.00 N ATOM 875 CA SER A 57 -1.032 -4.657 -17.206 1.00 0.00 C ATOM 876 C SER A 57 -0.983 -3.157 -16.940 1.00 0.00 C ATOM 877 O SER A 57 -2.014 -2.487 -16.849 1.00 0.00 O ATOM 878 CB SER A 57 -0.967 -5.419 -15.884 1.00 0.00 C ATOM 879 OG SER A 57 -0.602 -6.775 -16.096 1.00 0.00 O ATOM 0 H SER A 57 0.807 -5.588 -17.570 1.00 0.00 H new ATOM 0 HA SER A 57 -1.966 -4.895 -17.715 1.00 0.00 H new ATOM 0 HB2 SER A 57 -0.244 -4.943 -15.221 1.00 0.00 H new ATOM 0 HB3 SER A 57 -1.935 -5.373 -15.385 1.00 0.00 H new ATOM 0 HG SER A 57 -1.241 -7.361 -15.639 1.00 0.00 H new ATOM 885 N LEU A 58 0.233 -2.640 -16.833 1.00 0.00 N ATOM 886 CA LEU A 58 0.453 -1.233 -16.541 1.00 0.00 C ATOM 887 C LEU A 58 0.648 -0.431 -17.823 1.00 0.00 C ATOM 888 O LEU A 58 1.109 0.707 -17.778 1.00 0.00 O ATOM 889 CB LEU A 58 1.681 -1.070 -15.640 1.00 0.00 C ATOM 890 CG LEU A 58 1.593 -1.757 -14.277 1.00 0.00 C ATOM 891 CD1 LEU A 58 2.914 -1.635 -13.534 1.00 0.00 C ATOM 892 CD2 LEU A 58 0.463 -1.163 -13.451 1.00 0.00 C ATOM 0 H LEU A 58 1.090 -3.182 -16.946 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.430 -0.853 -16.027 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.552 -1.459 -16.168 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.854 -0.006 -15.480 1.00 0.00 H new ATOM 0 HG LEU A 58 1.383 -2.814 -14.438 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.834 -2.129 -12.566 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.705 -2.106 -14.118 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.152 -0.582 -13.385 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.416 -1.665 -12.484 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.644 -0.099 -13.299 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.482 -1.299 -13.977 1.00 0.00 H new ATOM 904 N GLN A 59 0.284 -1.017 -18.961 1.00 0.00 N ATOM 905 CA GLN A 59 0.437 -0.349 -20.252 1.00 0.00 C ATOM 906 C GLN A 59 -0.326 0.971 -20.265 1.00 0.00 C ATOM 907 O GLN A 59 0.163 1.983 -20.771 1.00 0.00 O ATOM 908 CB GLN A 59 -0.049 -1.248 -21.392 1.00 0.00 C ATOM 909 CG GLN A 59 0.050 -0.595 -22.762 1.00 0.00 C ATOM 910 CD GLN A 59 -0.430 -1.489 -23.889 1.00 0.00 C ATOM 911 OE1 GLN A 59 -0.312 -2.715 -23.827 1.00 0.00 O ATOM 912 NE2 GLN A 59 -0.990 -0.876 -24.921 1.00 0.00 N ATOM 0 H GLN A 59 -0.119 -1.952 -19.016 1.00 0.00 H new ATOM 0 HA GLN A 59 1.497 -0.144 -20.402 1.00 0.00 H new ATOM 0 HB2 GLN A 59 0.536 -2.168 -21.393 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.086 -1.529 -21.206 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -0.536 0.324 -22.762 1.00 0.00 H new ATOM 0 HG3 GLN A 59 1.086 -0.312 -22.948 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.067 0.141 -24.930 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -1.345 -1.421 -25.707 1.00 0.00 H new ATOM 921 N ARG A 60 -1.516 0.958 -19.678 1.00 0.00 N ATOM 922 CA ARG A 60 -2.344 2.154 -19.597 1.00 0.00 C ATOM 923 C ARG A 60 -1.679 3.196 -18.698 1.00 0.00 C ATOM 924 O ARG A 60 -1.869 4.400 -18.871 1.00 0.00 O ATOM 925 CB ARG A 60 -3.730 1.791 -19.060 1.00 0.00 C ATOM 926 CG ARG A 60 -4.757 2.903 -19.198 1.00 0.00 C ATOM 927 CD ARG A 60 -6.120 2.463 -18.694 1.00 0.00 C ATOM 928 NE ARG A 60 -7.167 3.429 -19.019 1.00 0.00 N ATOM 929 CZ ARG A 60 -8.450 3.107 -19.176 1.00 0.00 C ATOM 930 NH1 ARG A 60 -8.857 1.856 -18.990 1.00 0.00 N ATOM 931 NH2 ARG A 60 -9.332 4.038 -19.511 1.00 0.00 N ATOM 0 H ARG A 60 -1.930 0.130 -19.250 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.454 2.579 -20.595 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.093 0.908 -19.586 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.641 1.521 -18.008 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.426 3.778 -18.639 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -4.833 3.203 -20.243 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.372 1.496 -19.130 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -6.079 2.324 -17.614 1.00 0.00 H new ATOM 0 HE ARG A 60 -6.900 4.407 -19.132 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -8.186 1.135 -18.725 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.841 1.616 -19.112 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -9.029 5.002 -19.649 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -10.314 3.790 -19.631 1.00 0.00 H new ATOM 945 N VAL A 61 -0.879 2.715 -17.753 1.00 0.00 N ATOM 946 CA VAL A 61 -0.178 3.582 -16.817 1.00 0.00 C ATOM 947 C VAL A 61 1.067 4.178 -17.469 1.00 0.00 C ATOM 948 O VAL A 61 1.335 5.365 -17.325 1.00 0.00 O ATOM 949 CB VAL A 61 0.226 2.819 -15.536 1.00 0.00 C ATOM 950 CG1 VAL A 61 0.932 3.740 -14.549 1.00 0.00 C ATOM 951 CG2 VAL A 61 -0.993 2.175 -14.889 1.00 0.00 C ATOM 0 H VAL A 61 -0.700 1.720 -17.616 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.862 4.385 -16.541 1.00 0.00 H new ATOM 0 HB VAL A 61 0.924 2.031 -15.820 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.205 3.176 -13.657 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.832 4.147 -15.011 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.265 4.557 -14.272 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.688 1.642 -13.988 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.716 2.947 -14.627 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.448 1.474 -15.588 1.00 0.00 H new ATOM 961 N PHE A 62 1.812 3.346 -18.199 1.00 0.00 N ATOM 962 CA PHE A 62 3.026 3.793 -18.885 1.00 0.00 C ATOM 963 C PHE A 62 2.735 4.931 -19.855 1.00 0.00 C ATOM 964 O PHE A 62 3.559 5.828 -20.034 1.00 0.00 O ATOM 965 CB PHE A 62 3.690 2.637 -19.641 1.00 0.00 C ATOM 966 CG PHE A 62 4.549 1.754 -18.781 1.00 0.00 C ATOM 967 CD1 PHE A 62 5.777 2.202 -18.320 1.00 0.00 C ATOM 968 CD2 PHE A 62 4.140 0.474 -18.445 1.00 0.00 C ATOM 969 CE1 PHE A 62 6.579 1.393 -17.540 1.00 0.00 C ATOM 970 CE2 PHE A 62 4.937 -0.340 -17.662 1.00 0.00 C ATOM 971 CZ PHE A 62 6.158 0.119 -17.209 1.00 0.00 C ATOM 0 H PHE A 62 1.596 2.358 -18.331 1.00 0.00 H new ATOM 0 HA PHE A 62 3.708 4.156 -18.116 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.915 2.029 -20.107 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.300 3.047 -20.446 1.00 0.00 H new ATOM 0 HD1 PHE A 62 6.111 3.197 -18.574 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.188 0.108 -18.799 1.00 0.00 H new ATOM 0 HE1 PHE A 62 7.534 1.755 -17.189 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.605 -1.335 -17.405 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.782 -0.516 -16.598 1.00 0.00 H new ATOM 981 N ASP A 63 1.567 4.891 -20.482 1.00 0.00 N ATOM 982 CA ASP A 63 1.170 5.936 -21.420 1.00 0.00 C ATOM 983 C ASP A 63 1.028 7.283 -20.715 1.00 0.00 C ATOM 984 O ASP A 63 1.479 8.312 -21.223 1.00 0.00 O ATOM 985 CB ASP A 63 -0.142 5.568 -22.112 1.00 0.00 C ATOM 986 CG ASP A 63 -0.684 6.703 -22.959 1.00 0.00 C ATOM 987 OD1 ASP A 63 -0.099 6.993 -24.025 1.00 0.00 O ATOM 988 OD2 ASP A 63 -1.693 7.318 -22.556 1.00 0.00 O ATOM 0 H ASP A 63 0.878 4.149 -20.360 1.00 0.00 H new ATOM 0 HA ASP A 63 1.954 6.022 -22.172 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.015 4.691 -22.741 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -0.882 5.293 -21.360 1.00 0.00 H new ATOM 993 N ASN A 64 0.432 7.266 -19.533 1.00 0.00 N ATOM 994 CA ASN A 64 0.182 8.491 -18.783 1.00 0.00 C ATOM 995 C ASN A 64 1.195 8.630 -17.645 1.00 0.00 C ATOM 996 O ASN A 64 0.969 9.343 -16.668 1.00 0.00 O ATOM 997 CB ASN A 64 -1.250 8.477 -18.229 1.00 0.00 C ATOM 998 CG ASN A 64 -1.704 9.838 -17.732 1.00 0.00 C ATOM 999 OD1 ASN A 64 -1.281 10.872 -18.247 1.00 0.00 O ATOM 1000 ND2 ASN A 64 -2.572 9.845 -16.730 1.00 0.00 N ATOM 0 H ASN A 64 0.111 6.416 -19.070 1.00 0.00 H new ATOM 0 HA ASN A 64 0.294 9.347 -19.449 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.932 8.134 -19.007 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -1.311 7.758 -17.412 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -2.914 10.731 -16.358 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.898 8.964 -16.331 1.00 0.00 H new ATOM 1007 N ALA A 65 2.334 7.965 -17.802 1.00 0.00 N ATOM 1008 CA ALA A 65 3.355 7.912 -16.759 1.00 0.00 C ATOM 1009 C ALA A 65 3.994 9.274 -16.511 1.00 0.00 C ATOM 1010 O ALA A 65 4.618 9.494 -15.476 1.00 0.00 O ATOM 1011 CB ALA A 65 4.421 6.890 -17.122 1.00 0.00 C ATOM 0 H ALA A 65 2.576 7.451 -18.649 1.00 0.00 H new ATOM 0 HA ALA A 65 2.862 7.611 -15.834 1.00 0.00 H new ATOM 0 HB1 ALA A 65 5.177 6.859 -16.338 1.00 0.00 H new ATOM 0 HB2 ALA A 65 3.962 5.906 -17.223 1.00 0.00 H new ATOM 0 HB3 ALA A 65 4.889 7.171 -18.066 1.00 0.00 H new ATOM 1017 N ASN A 66 3.826 10.191 -17.452 1.00 0.00 N ATOM 1018 CA ASN A 66 4.400 11.526 -17.321 1.00 0.00 C ATOM 1019 C ASN A 66 3.471 12.446 -16.537 1.00 0.00 C ATOM 1020 O ASN A 66 3.789 13.613 -16.305 1.00 0.00 O ATOM 1021 CB ASN A 66 4.696 12.127 -18.695 1.00 0.00 C ATOM 1022 CG ASN A 66 5.846 11.434 -19.399 1.00 0.00 C ATOM 1023 OD1 ASN A 66 6.782 10.953 -18.761 1.00 0.00 O ATOM 1024 ND2 ASN A 66 5.786 11.381 -20.722 1.00 0.00 N ATOM 0 H ASN A 66 3.299 10.038 -18.312 1.00 0.00 H new ATOM 0 HA ASN A 66 5.337 11.431 -16.772 1.00 0.00 H new ATOM 0 HB2 ASN A 66 3.803 12.062 -19.316 1.00 0.00 H new ATOM 0 HB3 ASN A 66 4.929 13.186 -18.582 1.00 0.00 H new ATOM 0 HD21 ASN A 66 6.533 10.929 -21.249 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.992 11.792 -21.213 1.00 0.00 H new ATOM 1031 N ALA A 67 2.319 11.918 -16.141 1.00 0.00 N ATOM 1032 CA ALA A 67 1.371 12.674 -15.335 1.00 0.00 C ATOM 1033 C ALA A 67 1.141 11.988 -13.994 1.00 0.00 C ATOM 1034 O ALA A 67 0.456 12.518 -13.118 1.00 0.00 O ATOM 1035 CB ALA A 67 0.056 12.840 -16.077 1.00 0.00 C ATOM 0 H ALA A 67 2.020 10.969 -16.365 1.00 0.00 H new ATOM 0 HA ALA A 67 1.791 13.662 -15.149 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.641 13.407 -15.460 1.00 0.00 H new ATOM 0 HB2 ALA A 67 0.230 13.373 -17.012 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.366 11.859 -16.293 1.00 0.00 H new ATOM 1041 N ILE A 68 1.728 10.809 -13.837 1.00 0.00 N ATOM 1042 CA ILE A 68 1.568 10.032 -12.619 1.00 0.00 C ATOM 1043 C ILE A 68 2.870 10.009 -11.826 1.00 0.00 C ATOM 1044 O ILE A 68 3.844 9.370 -12.227 1.00 0.00 O ATOM 1045 CB ILE A 68 1.125 8.585 -12.925 1.00 0.00 C ATOM 1046 CG1 ILE A 68 -0.195 8.587 -13.705 1.00 0.00 C ATOM 1047 CG2 ILE A 68 0.981 7.788 -11.634 1.00 0.00 C ATOM 1048 CD1 ILE A 68 -0.659 7.207 -14.124 1.00 0.00 C ATOM 0 H ILE A 68 2.321 10.370 -14.542 1.00 0.00 H new ATOM 0 HA ILE A 68 0.790 10.512 -12.026 1.00 0.00 H new ATOM 0 HB ILE A 68 1.890 8.109 -13.539 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.968 9.049 -13.091 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.080 9.207 -14.594 1.00 0.00 H new ATOM 0 HG21 ILE A 68 0.668 6.770 -11.868 1.00 0.00 H new ATOM 0 HG22 ILE A 68 1.938 7.763 -11.113 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.233 8.260 -10.996 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.598 7.289 -14.671 1.00 0.00 H new ATOM 0 HD12 ILE A 68 0.095 6.749 -14.765 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -0.807 6.589 -13.239 1.00 0.00 H new ATOM 1060 N ASP A 69 2.884 10.735 -10.718 1.00 0.00 N ATOM 1061 CA ASP A 69 4.051 10.783 -9.846 1.00 0.00 C ATOM 1062 C ASP A 69 4.106 9.544 -8.960 1.00 0.00 C ATOM 1063 O ASP A 69 4.977 8.688 -9.116 1.00 0.00 O ATOM 1064 CB ASP A 69 4.010 12.050 -8.988 1.00 0.00 C ATOM 1065 CG ASP A 69 5.157 12.138 -8.005 1.00 0.00 C ATOM 1066 OD1 ASP A 69 5.010 11.644 -6.870 1.00 0.00 O ATOM 1067 OD2 ASP A 69 6.198 12.733 -8.355 1.00 0.00 O ATOM 0 H ASP A 69 2.098 11.301 -10.400 1.00 0.00 H new ATOM 0 HA ASP A 69 4.949 10.804 -10.463 1.00 0.00 H new ATOM 0 HB2 ASP A 69 4.030 12.924 -9.639 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.068 12.081 -8.441 1.00 0.00 H new ATOM 1072 N THR A 70 3.157 9.444 -8.045 1.00 0.00 N ATOM 1073 CA THR A 70 3.078 8.301 -7.156 1.00 0.00 C ATOM 1074 C THR A 70 1.943 7.375 -7.596 1.00 0.00 C ATOM 1075 O THR A 70 0.878 7.836 -8.012 1.00 0.00 O ATOM 1076 CB THR A 70 2.850 8.753 -5.695 1.00 0.00 C ATOM 1077 OG1 THR A 70 3.841 9.722 -5.317 1.00 0.00 O ATOM 1078 CG2 THR A 70 2.912 7.571 -4.737 1.00 0.00 C ATOM 0 H THR A 70 2.429 10.144 -7.899 1.00 0.00 H new ATOM 0 HA THR A 70 4.024 7.763 -7.206 1.00 0.00 H new ATOM 0 HB THR A 70 1.857 9.199 -5.635 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.952 10.375 -6.039 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.748 7.920 -3.717 1.00 0.00 H new ATOM 0 HG22 THR A 70 2.141 6.848 -5.001 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.892 7.098 -4.806 1.00 0.00 H new ATOM 1086 N LEU A 71 2.182 6.074 -7.531 1.00 0.00 N ATOM 1087 CA LEU A 71 1.176 5.089 -7.901 1.00 0.00 C ATOM 1088 C LEU A 71 0.959 4.105 -6.761 1.00 0.00 C ATOM 1089 O LEU A 71 1.795 3.239 -6.510 1.00 0.00 O ATOM 1090 CB LEU A 71 1.607 4.341 -9.169 1.00 0.00 C ATOM 1091 CG LEU A 71 0.636 3.262 -9.660 1.00 0.00 C ATOM 1092 CD1 LEU A 71 -0.672 3.886 -10.119 1.00 0.00 C ATOM 1093 CD2 LEU A 71 1.264 2.451 -10.784 1.00 0.00 C ATOM 0 H LEU A 71 3.069 5.674 -7.224 1.00 0.00 H new ATOM 0 HA LEU A 71 0.238 5.607 -8.101 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.749 5.068 -9.968 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.576 3.877 -8.984 1.00 0.00 H new ATOM 0 HG LEU A 71 0.421 2.591 -8.829 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.347 3.103 -10.464 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.131 4.421 -9.288 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.477 4.582 -10.935 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.560 1.689 -11.120 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.509 3.111 -11.616 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.173 1.971 -10.422 1.00 0.00 H new ATOM 1105 N ILE A 72 -0.157 4.246 -6.064 1.00 0.00 N ATOM 1106 CA ILE A 72 -0.477 3.355 -4.962 1.00 0.00 C ATOM 1107 C ILE A 72 -1.315 2.187 -5.459 1.00 0.00 C ATOM 1108 O ILE A 72 -2.424 2.368 -5.968 1.00 0.00 O ATOM 1109 CB ILE A 72 -1.224 4.084 -3.822 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -0.337 5.180 -3.222 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -1.652 3.097 -2.742 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -1.005 5.973 -2.116 1.00 0.00 C ATOM 0 H ILE A 72 -0.855 4.968 -6.242 1.00 0.00 H new ATOM 0 HA ILE A 72 0.467 2.987 -4.559 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.119 4.547 -4.237 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.573 4.724 -2.831 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.035 5.864 -4.015 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.176 3.630 -1.949 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.315 2.348 -3.175 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.771 2.606 -2.328 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.314 6.729 -1.742 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.899 6.459 -2.506 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.282 5.302 -1.303 1.00 0.00 H new ATOM 1124 N VAL A 73 -0.768 0.992 -5.331 1.00 0.00 N ATOM 1125 CA VAL A 73 -1.450 -0.210 -5.774 1.00 0.00 C ATOM 1126 C VAL A 73 -1.959 -1.001 -4.578 1.00 0.00 C ATOM 1127 O VAL A 73 -1.185 -1.390 -3.702 1.00 0.00 O ATOM 1128 CB VAL A 73 -0.524 -1.106 -6.626 1.00 0.00 C ATOM 1129 CG1 VAL A 73 -1.262 -2.347 -7.108 1.00 0.00 C ATOM 1130 CG2 VAL A 73 0.035 -0.324 -7.805 1.00 0.00 C ATOM 0 H VAL A 73 0.152 0.828 -4.922 1.00 0.00 H new ATOM 0 HA VAL A 73 -2.292 0.101 -6.392 1.00 0.00 H new ATOM 0 HB VAL A 73 0.307 -1.429 -6.000 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.589 -2.962 -7.706 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.610 -2.920 -6.249 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.117 -2.049 -7.715 1.00 0.00 H new ATOM 0 HG21 VAL A 73 0.685 -0.970 -8.395 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.786 0.031 -8.428 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.607 0.528 -7.438 1.00 0.00 H new ATOM 1140 N GLY A 74 -3.265 -1.213 -4.540 1.00 0.00 N ATOM 1141 CA GLY A 74 -3.865 -1.989 -3.480 1.00 0.00 C ATOM 1142 C GLY A 74 -4.078 -3.422 -3.909 1.00 0.00 C ATOM 1143 O GLY A 74 -4.943 -3.701 -4.737 1.00 0.00 O ATOM 0 H GLY A 74 -3.924 -0.857 -5.232 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.225 -1.961 -2.598 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.819 -1.546 -3.196 1.00 0.00 H new ATOM 1147 N THR A 75 -3.288 -4.329 -3.354 1.00 0.00 N ATOM 1148 CA THR A 75 -3.329 -5.729 -3.757 1.00 0.00 C ATOM 1149 C THR A 75 -4.393 -6.512 -2.990 1.00 0.00 C ATOM 1150 O THR A 75 -4.410 -7.741 -3.003 1.00 0.00 O ATOM 1151 CB THR A 75 -1.951 -6.389 -3.569 1.00 0.00 C ATOM 1152 OG1 THR A 75 -1.470 -6.163 -2.236 1.00 0.00 O ATOM 1153 CG2 THR A 75 -0.952 -5.834 -4.572 1.00 0.00 C ATOM 0 H THR A 75 -2.609 -4.121 -2.622 1.00 0.00 H new ATOM 0 HA THR A 75 -3.595 -5.752 -4.814 1.00 0.00 H new ATOM 0 HB THR A 75 -2.060 -7.461 -3.735 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.688 -6.936 -1.674 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.016 -6.312 -4.424 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.304 -6.033 -5.584 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.851 -4.758 -4.428 1.00 0.00 H new ATOM 1161 N GLY A 76 -5.284 -5.789 -2.330 1.00 0.00 N ATOM 1162 CA GLY A 76 -6.383 -6.424 -1.640 1.00 0.00 C ATOM 1163 C GLY A 76 -6.010 -6.898 -0.252 1.00 0.00 C ATOM 1164 O GLY A 76 -5.774 -6.089 0.648 1.00 0.00 O ATOM 0 H GLY A 76 -5.264 -4.772 -2.261 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -7.214 -5.723 -1.568 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.732 -7.273 -2.227 1.00 0.00 H new ATOM 1168 N ALA A 77 -5.943 -8.213 -0.084 1.00 0.00 N ATOM 1169 CA ALA A 77 -5.700 -8.809 1.222 1.00 0.00 C ATOM 1170 C ALA A 77 -4.211 -9.017 1.468 1.00 0.00 C ATOM 1171 O ALA A 77 -3.632 -8.419 2.377 1.00 0.00 O ATOM 1172 CB ALA A 77 -6.448 -10.130 1.343 1.00 0.00 C ATOM 0 H ALA A 77 -6.054 -8.889 -0.840 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.070 -8.120 1.982 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.259 -10.567 2.324 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.517 -9.955 1.224 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.104 -10.815 0.568 1.00 0.00 H new ATOM 1178 N ASP A 78 -3.593 -9.858 0.652 1.00 0.00 N ATOM 1179 CA ASP A 78 -2.177 -10.157 0.802 1.00 0.00 C ATOM 1180 C ASP A 78 -1.345 -9.142 0.033 1.00 0.00 C ATOM 1181 O ASP A 78 -1.862 -8.428 -0.827 1.00 0.00 O ATOM 1182 CB ASP A 78 -1.865 -11.581 0.329 1.00 0.00 C ATOM 1183 CG ASP A 78 -2.140 -11.802 -1.147 1.00 0.00 C ATOM 1184 OD1 ASP A 78 -3.327 -11.906 -1.526 1.00 0.00 O ATOM 1185 OD2 ASP A 78 -1.169 -11.895 -1.928 1.00 0.00 O ATOM 0 H ASP A 78 -4.049 -10.345 -0.120 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.920 -10.092 1.859 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.817 -11.802 0.532 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.458 -12.287 0.911 1.00 0.00 H new ATOM 1190 N VAL A 79 -0.067 -9.059 0.357 1.00 0.00 N ATOM 1191 CA VAL A 79 0.804 -8.081 -0.273 1.00 0.00 C ATOM 1192 C VAL A 79 1.628 -8.709 -1.394 1.00 0.00 C ATOM 1193 O VAL A 79 2.361 -9.677 -1.186 1.00 0.00 O ATOM 1194 CB VAL A 79 1.733 -7.393 0.760 1.00 0.00 C ATOM 1195 CG1 VAL A 79 2.585 -8.409 1.509 1.00 0.00 C ATOM 1196 CG2 VAL A 79 2.609 -6.343 0.088 1.00 0.00 C ATOM 0 H VAL A 79 0.390 -9.653 1.049 1.00 0.00 H new ATOM 0 HA VAL A 79 0.160 -7.317 -0.709 1.00 0.00 H new ATOM 0 HB VAL A 79 1.098 -6.892 1.491 1.00 0.00 H new ATOM 0 HG11 VAL A 79 3.224 -7.891 2.225 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.937 -9.107 2.039 1.00 0.00 H new ATOM 0 HG13 VAL A 79 3.205 -8.957 0.800 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.252 -5.874 0.833 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.225 -6.818 -0.676 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.978 -5.585 -0.375 1.00 0.00 H new ATOM 1206 N TRP A 80 1.474 -8.169 -2.590 1.00 0.00 N ATOM 1207 CA TRP A 80 2.275 -8.588 -3.724 1.00 0.00 C ATOM 1208 C TRP A 80 3.472 -7.661 -3.863 1.00 0.00 C ATOM 1209 O TRP A 80 3.319 -6.451 -3.995 1.00 0.00 O ATOM 1210 CB TRP A 80 1.432 -8.585 -5.003 1.00 0.00 C ATOM 1211 CG TRP A 80 2.221 -8.836 -6.255 1.00 0.00 C ATOM 1212 CD1 TRP A 80 2.772 -10.019 -6.660 1.00 0.00 C ATOM 1213 CD2 TRP A 80 2.541 -7.877 -7.269 1.00 0.00 C ATOM 1214 NE1 TRP A 80 3.413 -9.851 -7.863 1.00 0.00 N ATOM 1215 CE2 TRP A 80 3.288 -8.544 -8.256 1.00 0.00 C ATOM 1216 CE3 TRP A 80 2.269 -6.515 -7.435 1.00 0.00 C ATOM 1217 CZ2 TRP A 80 3.762 -7.898 -9.394 1.00 0.00 C ATOM 1218 CZ3 TRP A 80 2.742 -5.876 -8.564 1.00 0.00 C ATOM 1219 CH2 TRP A 80 3.482 -6.567 -9.531 1.00 0.00 C ATOM 0 H TRP A 80 0.797 -7.435 -2.800 1.00 0.00 H new ATOM 0 HA TRP A 80 2.631 -9.605 -3.561 1.00 0.00 H new ATOM 0 HB2 TRP A 80 0.656 -9.346 -4.916 1.00 0.00 H new ATOM 0 HB3 TRP A 80 0.927 -7.623 -5.091 1.00 0.00 H new ATOM 0 HD1 TRP A 80 2.712 -10.949 -6.114 1.00 0.00 H new ATOM 0 HE1 TRP A 80 3.903 -10.581 -8.380 1.00 0.00 H new ATOM 0 HE3 TRP A 80 1.700 -5.973 -6.694 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 4.331 -8.430 -10.142 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 2.538 -4.825 -8.704 1.00 0.00 H new ATOM 0 HH2 TRP A 80 3.839 -6.038 -10.402 1.00 0.00 H new ATOM 1230 N ILE A 81 4.664 -8.233 -3.832 1.00 0.00 N ATOM 1231 CA ILE A 81 5.876 -7.439 -3.901 1.00 0.00 C ATOM 1232 C ILE A 81 6.265 -7.208 -5.353 1.00 0.00 C ATOM 1233 O ILE A 81 6.717 -8.124 -6.041 1.00 0.00 O ATOM 1234 CB ILE A 81 7.046 -8.121 -3.159 1.00 0.00 C ATOM 1235 CG1 ILE A 81 6.669 -8.372 -1.695 1.00 0.00 C ATOM 1236 CG2 ILE A 81 8.304 -7.265 -3.249 1.00 0.00 C ATOM 1237 CD1 ILE A 81 7.735 -9.099 -0.905 1.00 0.00 C ATOM 0 H ILE A 81 4.817 -9.239 -3.760 1.00 0.00 H new ATOM 0 HA ILE A 81 5.673 -6.485 -3.415 1.00 0.00 H new ATOM 0 HB ILE A 81 7.250 -9.081 -3.634 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.462 -7.416 -1.214 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.747 -8.952 -1.662 1.00 0.00 H new ATOM 0 HG21 ILE A 81 9.119 -7.760 -2.721 1.00 0.00 H new ATOM 0 HG22 ILE A 81 8.578 -7.130 -4.295 1.00 0.00 H new ATOM 0 HG23 ILE A 81 8.115 -6.292 -2.795 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.395 -9.240 0.121 1.00 0.00 H new ATOM 0 HD12 ILE A 81 7.926 -10.071 -1.360 1.00 0.00 H new ATOM 0 HD13 ILE A 81 8.653 -8.511 -0.906 1.00 0.00 H new ATOM 1249 N ALA A 82 6.053 -5.980 -5.814 1.00 0.00 N ATOM 1250 CA ALA A 82 6.414 -5.591 -7.169 1.00 0.00 C ATOM 1251 C ALA A 82 7.899 -5.830 -7.420 1.00 0.00 C ATOM 1252 O ALA A 82 8.748 -5.361 -6.655 1.00 0.00 O ATOM 1253 CB ALA A 82 6.062 -4.130 -7.408 1.00 0.00 C ATOM 0 H ALA A 82 5.630 -5.233 -5.263 1.00 0.00 H new ATOM 0 HA ALA A 82 5.847 -6.206 -7.868 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.337 -3.851 -8.425 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.990 -3.987 -7.270 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.606 -3.504 -6.701 1.00 0.00 H new ATOM 1259 N PRO A 83 8.223 -6.579 -8.487 1.00 0.00 N ATOM 1260 CA PRO A 83 9.605 -6.938 -8.824 1.00 0.00 C ATOM 1261 C PRO A 83 10.495 -5.717 -9.009 1.00 0.00 C ATOM 1262 O PRO A 83 10.037 -4.668 -9.471 1.00 0.00 O ATOM 1263 CB PRO A 83 9.469 -7.701 -10.146 1.00 0.00 C ATOM 1264 CG PRO A 83 8.063 -8.187 -10.165 1.00 0.00 C ATOM 1265 CD PRO A 83 7.260 -7.140 -9.451 1.00 0.00 C ATOM 0 HA PRO A 83 10.075 -7.517 -8.029 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.675 -7.054 -10.999 1.00 0.00 H new ATOM 0 HB3 PRO A 83 10.174 -8.530 -10.198 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.709 -8.322 -11.187 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.976 -9.153 -9.668 1.00 0.00 H new ATOM 0 HD2 PRO A 83 6.888 -6.380 -10.138 1.00 0.00 H new ATOM 0 HD3 PRO A 83 6.392 -7.569 -8.950 1.00 0.00 H new ATOM 1273 N ARG A 84 11.768 -5.861 -8.646 1.00 0.00 N ATOM 1274 CA ARG A 84 12.741 -4.781 -8.777 1.00 0.00 C ATOM 1275 C ARG A 84 12.782 -4.286 -10.216 1.00 0.00 C ATOM 1276 O ARG A 84 12.783 -3.084 -10.469 1.00 0.00 O ATOM 1277 CB ARG A 84 14.142 -5.247 -8.374 1.00 0.00 C ATOM 1278 CG ARG A 84 14.200 -6.014 -7.063 1.00 0.00 C ATOM 1279 CD ARG A 84 15.636 -6.339 -6.677 1.00 0.00 C ATOM 1280 NE ARG A 84 16.400 -6.881 -7.802 1.00 0.00 N ATOM 1281 CZ ARG A 84 17.367 -7.794 -7.691 1.00 0.00 C ATOM 1282 NH1 ARG A 84 17.685 -8.295 -6.506 1.00 0.00 N ATOM 1283 NH2 ARG A 84 18.023 -8.201 -8.770 1.00 0.00 N ATOM 0 H ARG A 84 12.151 -6.722 -8.256 1.00 0.00 H new ATOM 0 HA ARG A 84 12.432 -3.974 -8.113 1.00 0.00 H new ATOM 0 HB2 ARG A 84 14.543 -5.878 -9.167 1.00 0.00 H new ATOM 0 HB3 ARG A 84 14.793 -4.376 -8.300 1.00 0.00 H new ATOM 0 HG2 ARG A 84 13.733 -5.425 -6.273 1.00 0.00 H new ATOM 0 HG3 ARG A 84 13.627 -6.937 -7.153 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.125 -5.437 -6.309 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.637 -7.059 -5.859 1.00 0.00 H new ATOM 0 HE ARG A 84 16.178 -6.537 -8.736 1.00 0.00 H new ATOM 0 HH11 ARG A 84 17.189 -7.983 -5.671 1.00 0.00 H new ATOM 0 HH12 ARG A 84 18.425 -8.993 -6.429 1.00 0.00 H new ATOM 0 HH21 ARG A 84 17.788 -7.816 -9.685 1.00 0.00 H new ATOM 0 HH22 ARG A 84 18.762 -8.899 -8.685 1.00 0.00 H new ATOM 1297 N GLN A 85 12.788 -5.236 -11.146 1.00 0.00 N ATOM 1298 CA GLN A 85 12.850 -4.937 -12.573 1.00 0.00 C ATOM 1299 C GLN A 85 11.693 -4.030 -12.994 1.00 0.00 C ATOM 1300 O GLN A 85 11.899 -2.989 -13.617 1.00 0.00 O ATOM 1301 CB GLN A 85 12.803 -6.243 -13.365 1.00 0.00 C ATOM 1302 CG GLN A 85 13.047 -6.079 -14.853 1.00 0.00 C ATOM 1303 CD GLN A 85 12.901 -7.387 -15.602 1.00 0.00 C ATOM 1304 OE1 GLN A 85 11.816 -7.731 -16.069 1.00 0.00 O ATOM 1305 NE2 GLN A 85 13.985 -8.136 -15.709 1.00 0.00 N ATOM 0 H GLN A 85 12.750 -6.233 -10.933 1.00 0.00 H new ATOM 0 HA GLN A 85 13.783 -4.413 -12.780 1.00 0.00 H new ATOM 0 HB2 GLN A 85 13.548 -6.927 -12.960 1.00 0.00 H new ATOM 0 HB3 GLN A 85 11.829 -6.709 -13.218 1.00 0.00 H new ATOM 0 HG2 GLN A 85 12.344 -5.350 -15.257 1.00 0.00 H new ATOM 0 HG3 GLN A 85 14.048 -5.680 -15.014 1.00 0.00 H new ATOM 0 HE21 GLN A 85 14.867 -7.817 -15.309 1.00 0.00 H new ATOM 0 HE22 GLN A 85 13.939 -9.033 -16.192 1.00 0.00 H new ATOM 1314 N LEU A 86 10.479 -4.429 -12.634 1.00 0.00 N ATOM 1315 CA LEU A 86 9.286 -3.666 -12.982 1.00 0.00 C ATOM 1316 C LEU A 86 9.291 -2.312 -12.280 1.00 0.00 C ATOM 1317 O LEU A 86 8.935 -1.293 -12.868 1.00 0.00 O ATOM 1318 CB LEU A 86 8.027 -4.456 -12.601 1.00 0.00 C ATOM 1319 CG LEU A 86 6.696 -3.771 -12.926 1.00 0.00 C ATOM 1320 CD1 LEU A 86 6.558 -3.544 -14.424 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.532 -4.599 -12.403 1.00 0.00 C ATOM 0 H LEU A 86 10.294 -5.278 -12.100 1.00 0.00 H new ATOM 0 HA LEU A 86 9.285 -3.495 -14.059 1.00 0.00 H new ATOM 0 HB2 LEU A 86 8.055 -5.419 -13.112 1.00 0.00 H new ATOM 0 HB3 LEU A 86 8.058 -4.662 -11.531 1.00 0.00 H new ATOM 0 HG LEU A 86 6.681 -2.800 -12.432 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.606 -3.056 -14.632 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.374 -2.911 -14.773 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.596 -4.502 -14.942 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.593 -4.099 -12.642 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.547 -5.584 -12.870 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.620 -4.708 -11.322 1.00 0.00 H new ATOM 1333 N ARG A 87 9.717 -2.312 -11.023 1.00 0.00 N ATOM 1334 CA ARG A 87 9.740 -1.100 -10.216 1.00 0.00 C ATOM 1335 C ARG A 87 10.743 -0.097 -10.783 1.00 0.00 C ATOM 1336 O ARG A 87 10.479 1.106 -10.836 1.00 0.00 O ATOM 1337 CB ARG A 87 10.098 -1.449 -8.771 1.00 0.00 C ATOM 1338 CG ARG A 87 9.763 -0.357 -7.769 1.00 0.00 C ATOM 1339 CD ARG A 87 10.203 -0.740 -6.365 1.00 0.00 C ATOM 1340 NE ARG A 87 9.717 -2.067 -5.973 1.00 0.00 N ATOM 1341 CZ ARG A 87 9.543 -2.450 -4.707 1.00 0.00 C ATOM 1342 NH1 ARG A 87 9.732 -1.589 -3.716 1.00 0.00 N ATOM 1343 NH2 ARG A 87 9.163 -3.692 -4.434 1.00 0.00 N ATOM 0 H ARG A 87 10.053 -3.144 -10.538 1.00 0.00 H new ATOM 0 HA ARG A 87 8.751 -0.643 -10.238 1.00 0.00 H new ATOM 0 HB2 ARG A 87 9.573 -2.361 -8.488 1.00 0.00 H new ATOM 0 HB3 ARG A 87 11.165 -1.665 -8.714 1.00 0.00 H new ATOM 0 HG2 ARG A 87 10.251 0.572 -8.064 1.00 0.00 H new ATOM 0 HG3 ARG A 87 8.689 -0.170 -7.777 1.00 0.00 H new ATOM 0 HD2 ARG A 87 11.291 -0.723 -6.310 1.00 0.00 H new ATOM 0 HD3 ARG A 87 9.837 0.003 -5.656 1.00 0.00 H new ATOM 0 HE ARG A 87 9.499 -2.736 -6.711 1.00 0.00 H new ATOM 0 HH11 ARG A 87 10.012 -0.630 -3.920 1.00 0.00 H new ATOM 0 HH12 ARG A 87 9.598 -1.886 -2.750 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.004 -4.355 -5.193 1.00 0.00 H new ATOM 0 HH22 ARG A 87 9.030 -3.984 -3.466 1.00 0.00 H new ATOM 1357 N GLU A 88 11.889 -0.610 -11.215 1.00 0.00 N ATOM 1358 CA GLU A 88 12.942 0.214 -11.797 1.00 0.00 C ATOM 1359 C GLU A 88 12.473 0.840 -13.105 1.00 0.00 C ATOM 1360 O GLU A 88 12.709 2.023 -13.359 1.00 0.00 O ATOM 1361 CB GLU A 88 14.189 -0.634 -12.040 1.00 0.00 C ATOM 1362 CG GLU A 88 15.374 0.152 -12.571 1.00 0.00 C ATOM 1363 CD GLU A 88 16.548 -0.739 -12.906 1.00 0.00 C ATOM 1364 OE1 GLU A 88 17.271 -1.149 -11.979 1.00 0.00 O ATOM 1365 OE2 GLU A 88 16.750 -1.039 -14.104 1.00 0.00 O ATOM 0 H GLU A 88 12.114 -1.604 -11.172 1.00 0.00 H new ATOM 0 HA GLU A 88 13.183 1.015 -11.099 1.00 0.00 H new ATOM 0 HB2 GLU A 88 14.475 -1.117 -11.106 1.00 0.00 H new ATOM 0 HB3 GLU A 88 13.945 -1.427 -12.747 1.00 0.00 H new ATOM 0 HG2 GLU A 88 15.072 0.703 -13.462 1.00 0.00 H new ATOM 0 HG3 GLU A 88 15.680 0.889 -11.829 1.00 0.00 H new ATOM 1372 N ALA A 89 11.801 0.039 -13.926 1.00 0.00 N ATOM 1373 CA ALA A 89 11.284 0.503 -15.207 1.00 0.00 C ATOM 1374 C ALA A 89 10.290 1.647 -15.016 1.00 0.00 C ATOM 1375 O ALA A 89 10.239 2.583 -15.817 1.00 0.00 O ATOM 1376 CB ALA A 89 10.634 -0.651 -15.957 1.00 0.00 C ATOM 0 H ALA A 89 11.601 -0.941 -13.724 1.00 0.00 H new ATOM 0 HA ALA A 89 12.119 0.881 -15.797 1.00 0.00 H new ATOM 0 HB1 ALA A 89 10.251 -0.294 -16.913 1.00 0.00 H new ATOM 0 HB2 ALA A 89 11.373 -1.433 -16.132 1.00 0.00 H new ATOM 0 HB3 ALA A 89 9.812 -1.053 -15.364 1.00 0.00 H new ATOM 1382 N LEU A 90 9.512 1.568 -13.945 1.00 0.00 N ATOM 1383 CA LEU A 90 8.534 2.601 -13.623 1.00 0.00 C ATOM 1384 C LEU A 90 9.224 3.896 -13.208 1.00 0.00 C ATOM 1385 O LEU A 90 8.902 4.974 -13.718 1.00 0.00 O ATOM 1386 CB LEU A 90 7.609 2.117 -12.506 1.00 0.00 C ATOM 1387 CG LEU A 90 6.694 0.954 -12.884 1.00 0.00 C ATOM 1388 CD1 LEU A 90 6.001 0.403 -11.651 1.00 0.00 C ATOM 1389 CD2 LEU A 90 5.668 1.398 -13.914 1.00 0.00 C ATOM 0 H LEU A 90 9.539 0.795 -13.280 1.00 0.00 H new ATOM 0 HA LEU A 90 7.942 2.802 -14.516 1.00 0.00 H new ATOM 0 HB2 LEU A 90 8.219 1.817 -11.654 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.992 2.953 -12.178 1.00 0.00 H new ATOM 0 HG LEU A 90 7.304 0.163 -13.322 1.00 0.00 H new ATOM 0 HD11 LEU A 90 5.353 -0.425 -11.938 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.749 0.050 -10.941 1.00 0.00 H new ATOM 0 HD13 LEU A 90 5.403 1.188 -11.188 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.024 0.557 -14.172 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.063 2.205 -13.500 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.180 1.751 -14.809 1.00 0.00 H new ATOM 1401 N ARG A 91 10.188 3.786 -12.299 1.00 0.00 N ATOM 1402 CA ARG A 91 10.907 4.957 -11.802 1.00 0.00 C ATOM 1403 C ARG A 91 11.830 5.524 -12.872 1.00 0.00 C ATOM 1404 O ARG A 91 12.278 6.667 -12.773 1.00 0.00 O ATOM 1405 CB ARG A 91 11.723 4.618 -10.556 1.00 0.00 C ATOM 1406 CG ARG A 91 10.887 4.236 -9.348 1.00 0.00 C ATOM 1407 CD ARG A 91 11.763 4.024 -8.124 1.00 0.00 C ATOM 1408 NE ARG A 91 12.484 5.242 -7.747 1.00 0.00 N ATOM 1409 CZ ARG A 91 13.741 5.264 -7.303 1.00 0.00 C ATOM 1410 NH1 ARG A 91 14.455 4.145 -7.254 1.00 0.00 N ATOM 1411 NH2 ARG A 91 14.290 6.417 -6.943 1.00 0.00 N ATOM 0 H ARG A 91 10.490 2.901 -11.892 1.00 0.00 H new ATOM 0 HA ARG A 91 10.160 5.707 -11.540 1.00 0.00 H new ATOM 0 HB2 ARG A 91 12.398 3.795 -10.791 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.343 5.476 -10.297 1.00 0.00 H new ATOM 0 HG2 ARG A 91 10.156 5.019 -9.145 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.328 3.325 -9.562 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.145 3.695 -7.288 1.00 0.00 H new ATOM 0 HD3 ARG A 91 12.479 3.226 -8.324 1.00 0.00 H new ATOM 0 HE ARG A 91 11.992 6.132 -7.830 1.00 0.00 H new ATOM 0 HH11 ARG A 91 14.042 3.263 -7.557 1.00 0.00 H new ATOM 0 HH12 ARG A 91 15.416 4.168 -6.913 1.00 0.00 H new ATOM 0 HH21 ARG A 91 13.751 7.280 -7.007 1.00 0.00 H new ATOM 0 HH22 ARG A 91 15.251 6.440 -6.603 1.00 0.00 H new ATOM 1425 N GLY A 92 12.129 4.715 -13.881 1.00 0.00 N ATOM 1426 CA GLY A 92 12.901 5.190 -15.010 1.00 0.00 C ATOM 1427 C GLY A 92 12.155 6.263 -15.768 1.00 0.00 C ATOM 1428 O GLY A 92 12.757 7.116 -16.419 1.00 0.00 O ATOM 0 H GLY A 92 11.849 3.736 -13.936 1.00 0.00 H new ATOM 0 HA2 GLY A 92 13.856 5.584 -14.661 1.00 0.00 H new ATOM 0 HA3 GLY A 92 13.124 4.358 -15.677 1.00 0.00 H new ATOM 1432 N VAL A 93 10.833 6.219 -15.674 1.00 0.00 N ATOM 1433 CA VAL A 93 9.988 7.224 -16.292 1.00 0.00 C ATOM 1434 C VAL A 93 9.654 8.319 -15.285 1.00 0.00 C ATOM 1435 O VAL A 93 9.941 9.494 -15.518 1.00 0.00 O ATOM 1436 CB VAL A 93 8.679 6.612 -16.834 1.00 0.00 C ATOM 1437 CG1 VAL A 93 7.866 7.656 -17.582 1.00 0.00 C ATOM 1438 CG2 VAL A 93 8.972 5.417 -17.729 1.00 0.00 C ATOM 0 H VAL A 93 10.323 5.492 -15.172 1.00 0.00 H new ATOM 0 HA VAL A 93 10.541 7.647 -17.131 1.00 0.00 H new ATOM 0 HB VAL A 93 8.090 6.265 -15.985 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.948 7.203 -17.955 1.00 0.00 H new ATOM 0 HG12 VAL A 93 7.618 8.476 -16.908 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.448 8.039 -18.420 1.00 0.00 H new ATOM 0 HG21 VAL A 93 8.035 5.002 -18.100 1.00 0.00 H new ATOM 0 HG22 VAL A 93 9.586 5.735 -18.571 1.00 0.00 H new ATOM 0 HG23 VAL A 93 9.505 4.657 -17.158 1.00 0.00 H new ATOM 1448 N ASN A 94 9.072 7.907 -14.158 1.00 0.00 N ATOM 1449 CA ASN A 94 8.635 8.835 -13.105 1.00 0.00 C ATOM 1450 C ASN A 94 7.812 8.090 -12.055 1.00 0.00 C ATOM 1451 O ASN A 94 7.817 8.450 -10.879 1.00 0.00 O ATOM 1452 CB ASN A 94 7.787 9.977 -13.701 1.00 0.00 C ATOM 1453 CG ASN A 94 7.643 11.200 -12.794 1.00 0.00 C ATOM 1454 OD1 ASN A 94 7.637 12.335 -13.276 1.00 0.00 O ATOM 1455 ND2 ASN A 94 7.496 10.999 -11.491 1.00 0.00 N ATOM 0 H ASN A 94 8.889 6.926 -13.946 1.00 0.00 H new ATOM 0 HA ASN A 94 9.524 9.260 -12.638 1.00 0.00 H new ATOM 0 HB2 ASN A 94 8.234 10.291 -14.644 1.00 0.00 H new ATOM 0 HB3 ASN A 94 6.793 9.593 -13.932 1.00 0.00 H new ATOM 0 HD21 ASN A 94 7.374 11.793 -10.863 1.00 0.00 H new ATOM 0 HD22 ASN A 94 7.505 10.050 -11.117 1.00 0.00 H new ATOM 1462 N VAL A 95 7.134 7.035 -12.487 1.00 0.00 N ATOM 1463 CA VAL A 95 6.147 6.354 -11.658 1.00 0.00 C ATOM 1464 C VAL A 95 6.768 5.720 -10.416 1.00 0.00 C ATOM 1465 O VAL A 95 7.538 4.763 -10.506 1.00 0.00 O ATOM 1466 CB VAL A 95 5.401 5.268 -12.460 1.00 0.00 C ATOM 1467 CG1 VAL A 95 4.363 4.569 -11.594 1.00 0.00 C ATOM 1468 CG2 VAL A 95 4.750 5.867 -13.696 1.00 0.00 C ATOM 0 H VAL A 95 7.251 6.629 -13.415 1.00 0.00 H new ATOM 0 HA VAL A 95 5.442 7.120 -11.335 1.00 0.00 H new ATOM 0 HB VAL A 95 6.130 4.524 -12.781 1.00 0.00 H new ATOM 0 HG11 VAL A 95 3.851 3.808 -12.183 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.856 4.099 -10.743 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.638 5.299 -11.235 1.00 0.00 H new ATOM 0 HG21 VAL A 95 4.229 5.085 -14.248 1.00 0.00 H new ATOM 0 HG22 VAL A 95 4.038 6.635 -13.396 1.00 0.00 H new ATOM 0 HG23 VAL A 95 5.516 6.311 -14.332 1.00 0.00 H new ATOM 1478 N VAL A 96 6.434 6.267 -9.258 1.00 0.00 N ATOM 1479 CA VAL A 96 6.832 5.677 -7.995 1.00 0.00 C ATOM 1480 C VAL A 96 5.716 4.769 -7.489 1.00 0.00 C ATOM 1481 O VAL A 96 4.741 5.235 -6.898 1.00 0.00 O ATOM 1482 CB VAL A 96 7.145 6.752 -6.930 1.00 0.00 C ATOM 1483 CG1 VAL A 96 7.636 6.110 -5.639 1.00 0.00 C ATOM 1484 CG2 VAL A 96 8.170 7.747 -7.455 1.00 0.00 C ATOM 0 H VAL A 96 5.886 7.123 -9.169 1.00 0.00 H new ATOM 0 HA VAL A 96 7.743 5.102 -8.165 1.00 0.00 H new ATOM 0 HB VAL A 96 6.223 7.291 -6.713 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.850 6.887 -4.905 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.867 5.443 -5.249 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.543 5.540 -5.838 1.00 0.00 H new ATOM 0 HG21 VAL A 96 8.376 8.495 -6.690 1.00 0.00 H new ATOM 0 HG22 VAL A 96 9.091 7.222 -7.706 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.778 8.238 -8.346 1.00 0.00 H new ATOM 1494 N LEU A 97 5.845 3.480 -7.763 1.00 0.00 N ATOM 1495 CA LEU A 97 4.828 2.518 -7.366 1.00 0.00 C ATOM 1496 C LEU A 97 4.989 2.150 -5.897 1.00 0.00 C ATOM 1497 O LEU A 97 6.087 1.827 -5.438 1.00 0.00 O ATOM 1498 CB LEU A 97 4.895 1.265 -8.257 1.00 0.00 C ATOM 1499 CG LEU A 97 3.777 0.229 -8.047 1.00 0.00 C ATOM 1500 CD1 LEU A 97 3.551 -0.574 -9.318 1.00 0.00 C ATOM 1501 CD2 LEU A 97 4.113 -0.718 -6.903 1.00 0.00 C ATOM 0 H LEU A 97 6.641 3.077 -8.257 1.00 0.00 H new ATOM 0 HA LEU A 97 3.847 2.975 -7.496 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.878 1.583 -9.299 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.854 0.775 -8.089 1.00 0.00 H new ATOM 0 HG LEU A 97 2.866 0.773 -7.795 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.757 -1.302 -9.152 1.00 0.00 H new ATOM 0 HD12 LEU A 97 3.264 0.098 -10.127 1.00 0.00 H new ATOM 0 HD13 LEU A 97 4.470 -1.094 -9.588 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.305 -1.439 -6.778 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.039 -1.247 -7.128 1.00 0.00 H new ATOM 0 HD23 LEU A 97 4.236 -0.147 -5.982 1.00 0.00 H new ATOM 1513 N ASP A 98 3.890 2.214 -5.168 1.00 0.00 N ATOM 1514 CA ASP A 98 3.873 1.841 -3.767 1.00 0.00 C ATOM 1515 C ASP A 98 2.769 0.821 -3.527 1.00 0.00 C ATOM 1516 O ASP A 98 1.622 1.038 -3.914 1.00 0.00 O ATOM 1517 CB ASP A 98 3.666 3.075 -2.890 1.00 0.00 C ATOM 1518 CG ASP A 98 3.838 2.770 -1.419 1.00 0.00 C ATOM 1519 OD1 ASP A 98 4.850 2.132 -1.058 1.00 0.00 O ATOM 1520 OD2 ASP A 98 2.985 3.190 -0.615 1.00 0.00 O ATOM 0 H ASP A 98 2.988 2.525 -5.529 1.00 0.00 H new ATOM 0 HA ASP A 98 4.832 1.395 -3.502 1.00 0.00 H new ATOM 0 HB2 ASP A 98 4.375 3.849 -3.183 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.667 3.476 -3.061 1.00 0.00 H new ATOM 1525 N THR A 99 3.121 -0.297 -2.914 1.00 0.00 N ATOM 1526 CA THR A 99 2.178 -1.383 -2.718 1.00 0.00 C ATOM 1527 C THR A 99 1.566 -1.328 -1.323 1.00 0.00 C ATOM 1528 O THR A 99 2.283 -1.318 -0.321 1.00 0.00 O ATOM 1529 CB THR A 99 2.867 -2.741 -2.925 1.00 0.00 C ATOM 1530 OG1 THR A 99 3.691 -2.689 -4.098 1.00 0.00 O ATOM 1531 CG2 THR A 99 1.840 -3.850 -3.077 1.00 0.00 C ATOM 0 H THR A 99 4.054 -0.475 -2.543 1.00 0.00 H new ATOM 0 HA THR A 99 1.383 -1.269 -3.455 1.00 0.00 H new ATOM 0 HB THR A 99 3.481 -2.953 -2.050 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.131 -3.555 -4.227 1.00 0.00 H new ATOM 0 HG21 THR A 99 2.351 -4.802 -3.222 1.00 0.00 H new ATOM 0 HG22 THR A 99 1.225 -3.902 -2.179 1.00 0.00 H new ATOM 0 HG23 THR A 99 1.206 -3.643 -3.939 1.00 0.00 H new ATOM 1539 N MET A 100 0.241 -1.287 -1.266 1.00 0.00 N ATOM 1540 CA MET A 100 -0.477 -1.183 -0.003 1.00 0.00 C ATOM 1541 C MET A 100 -1.699 -2.092 -0.014 1.00 0.00 C ATOM 1542 O MET A 100 -2.083 -2.618 -1.059 1.00 0.00 O ATOM 1543 CB MET A 100 -0.916 0.269 0.240 1.00 0.00 C ATOM 1544 CG MET A 100 0.240 1.251 0.370 1.00 0.00 C ATOM 1545 SD MET A 100 1.139 1.077 1.926 1.00 0.00 S ATOM 1546 CE MET A 100 -0.032 1.798 3.073 1.00 0.00 C ATOM 0 H MET A 100 -0.362 -1.325 -2.088 1.00 0.00 H new ATOM 0 HA MET A 100 0.191 -1.494 0.801 1.00 0.00 H new ATOM 0 HB2 MET A 100 -1.558 0.586 -0.582 1.00 0.00 H new ATOM 0 HB3 MET A 100 -1.517 0.309 1.148 1.00 0.00 H new ATOM 0 HG2 MET A 100 0.930 1.104 -0.461 1.00 0.00 H new ATOM 0 HG3 MET A 100 -0.143 2.268 0.290 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.412 2.675 3.543 1.00 0.00 H new ATOM 0 HE2 MET A 100 -0.934 2.092 2.536 1.00 0.00 H new ATOM 0 HE3 MET A 100 -0.288 1.066 3.839 1.00 0.00 H new ATOM 1556 N GLN A 101 -2.297 -2.287 1.150 1.00 0.00 N ATOM 1557 CA GLN A 101 -3.556 -3.010 1.247 1.00 0.00 C ATOM 1558 C GLN A 101 -4.706 -2.049 0.993 1.00 0.00 C ATOM 1559 O GLN A 101 -4.545 -0.841 1.161 1.00 0.00 O ATOM 1560 CB GLN A 101 -3.708 -3.674 2.621 1.00 0.00 C ATOM 1561 CG GLN A 101 -3.056 -5.048 2.720 1.00 0.00 C ATOM 1562 CD GLN A 101 -1.543 -5.018 2.607 1.00 0.00 C ATOM 1563 OE1 GLN A 101 -0.884 -4.064 3.020 1.00 0.00 O ATOM 1564 NE2 GLN A 101 -0.981 -6.072 2.042 1.00 0.00 N ATOM 0 H GLN A 101 -1.931 -1.955 2.042 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.567 -3.800 0.496 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.274 -3.022 3.379 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.769 -3.769 2.852 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.331 -5.502 3.672 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.457 -5.688 1.934 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.561 -6.844 1.712 1.00 0.00 H new ATOM 0 HE22 GLN A 101 0.033 -6.114 1.936 1.00 0.00 H new ATOM 1573 N THR A 102 -5.857 -2.583 0.595 1.00 0.00 N ATOM 1574 CA THR A 102 -7.007 -1.763 0.219 1.00 0.00 C ATOM 1575 C THR A 102 -7.339 -0.712 1.285 1.00 0.00 C ATOM 1576 O THR A 102 -7.555 0.457 0.964 1.00 0.00 O ATOM 1577 CB THR A 102 -8.243 -2.648 -0.033 1.00 0.00 C ATOM 1578 OG1 THR A 102 -7.880 -3.751 -0.874 1.00 0.00 O ATOM 1579 CG2 THR A 102 -9.359 -1.852 -0.695 1.00 0.00 C ATOM 0 H THR A 102 -6.020 -3.587 0.524 1.00 0.00 H new ATOM 0 HA THR A 102 -6.737 -1.240 -0.698 1.00 0.00 H new ATOM 0 HB THR A 102 -8.604 -3.015 0.928 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.689 -4.222 -1.163 1.00 0.00 H new ATOM 0 HG21 THR A 102 -10.219 -2.501 -0.861 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.649 -1.024 -0.048 1.00 0.00 H new ATOM 0 HG23 THR A 102 -9.009 -1.461 -1.650 1.00 0.00 H new ATOM 1587 N GLY A 103 -7.346 -1.130 2.548 1.00 0.00 N ATOM 1588 CA GLY A 103 -7.667 -0.222 3.641 1.00 0.00 C ATOM 1589 C GLY A 103 -6.715 0.963 3.731 1.00 0.00 C ATOM 1590 O GLY A 103 -7.121 2.103 3.495 1.00 0.00 O ATOM 0 H GLY A 103 -7.134 -2.085 2.837 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.685 0.146 3.513 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -7.643 -0.772 4.582 1.00 0.00 H new ATOM 1594 N PRO A 104 -5.438 0.724 4.081 1.00 0.00 N ATOM 1595 CA PRO A 104 -4.428 1.789 4.186 1.00 0.00 C ATOM 1596 C PRO A 104 -4.255 2.579 2.887 1.00 0.00 C ATOM 1597 O PRO A 104 -3.870 3.753 2.913 1.00 0.00 O ATOM 1598 CB PRO A 104 -3.141 1.033 4.527 1.00 0.00 C ATOM 1599 CG PRO A 104 -3.598 -0.246 5.136 1.00 0.00 C ATOM 1600 CD PRO A 104 -4.880 -0.594 4.437 1.00 0.00 C ATOM 0 HA PRO A 104 -4.712 2.535 4.928 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -2.540 0.854 3.635 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -2.521 1.601 5.220 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.854 -1.031 5.002 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -3.755 -0.135 6.209 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -4.703 -1.208 3.554 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -5.553 -1.154 5.086 1.00 0.00 H new ATOM 1608 N ALA A 105 -4.538 1.940 1.756 1.00 0.00 N ATOM 1609 CA ALA A 105 -4.466 2.610 0.464 1.00 0.00 C ATOM 1610 C ALA A 105 -5.520 3.706 0.365 1.00 0.00 C ATOM 1611 O ALA A 105 -5.205 4.845 0.030 1.00 0.00 O ATOM 1612 CB ALA A 105 -4.630 1.614 -0.673 1.00 0.00 C ATOM 0 H ALA A 105 -4.819 0.961 1.709 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.481 3.069 0.378 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -4.573 2.138 -1.627 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.837 0.868 -0.621 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.598 1.121 -0.588 1.00 0.00 H new ATOM 1618 N ILE A 106 -6.766 3.358 0.681 1.00 0.00 N ATOM 1619 CA ILE A 106 -7.864 4.320 0.651 1.00 0.00 C ATOM 1620 C ILE A 106 -7.610 5.449 1.651 1.00 0.00 C ATOM 1621 O ILE A 106 -7.916 6.615 1.384 1.00 0.00 O ATOM 1622 CB ILE A 106 -9.222 3.642 0.962 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -9.545 2.584 -0.099 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -10.340 4.676 1.038 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -10.828 1.821 0.165 1.00 0.00 C ATOM 0 H ILE A 106 -7.040 2.416 0.961 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.912 4.733 -0.357 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.144 3.152 1.933 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -9.616 3.070 -1.072 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -8.718 1.876 -0.156 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -11.284 4.176 1.257 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.118 5.395 1.827 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.419 5.197 0.084 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -10.987 1.091 -0.629 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -10.754 1.305 1.122 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.666 2.517 0.192 1.00 0.00 H new ATOM 1637 N ARG A 107 -7.032 5.092 2.791 1.00 0.00 N ATOM 1638 CA ARG A 107 -6.693 6.065 3.825 1.00 0.00 C ATOM 1639 C ARG A 107 -5.717 7.108 3.279 1.00 0.00 C ATOM 1640 O ARG A 107 -6.012 8.308 3.263 1.00 0.00 O ATOM 1641 CB ARG A 107 -6.076 5.349 5.030 1.00 0.00 C ATOM 1642 CG ARG A 107 -5.893 6.235 6.249 1.00 0.00 C ATOM 1643 CD ARG A 107 -5.237 5.472 7.388 1.00 0.00 C ATOM 1644 NE ARG A 107 -5.293 6.209 8.648 1.00 0.00 N ATOM 1645 CZ ARG A 107 -4.523 5.945 9.701 1.00 0.00 C ATOM 1646 NH1 ARG A 107 -3.576 5.016 9.626 1.00 0.00 N ATOM 1647 NH2 ARG A 107 -4.695 6.626 10.828 1.00 0.00 N ATOM 0 H ARG A 107 -6.786 4.130 3.025 1.00 0.00 H new ATOM 0 HA ARG A 107 -7.604 6.574 4.139 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -6.709 4.504 5.300 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.107 4.942 4.741 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -5.282 7.098 5.986 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -6.861 6.617 6.573 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.731 4.508 7.510 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -4.197 5.267 7.135 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.964 6.973 8.726 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -3.435 4.500 8.757 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -2.990 4.819 10.437 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -5.414 7.347 10.883 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -4.108 6.428 11.638 1.00 0.00 H new ATOM 1661 N THR A 108 -4.569 6.634 2.806 1.00 0.00 N ATOM 1662 CA THR A 108 -3.536 7.504 2.260 1.00 0.00 C ATOM 1663 C THR A 108 -4.063 8.279 1.053 1.00 0.00 C ATOM 1664 O THR A 108 -3.741 9.455 0.863 1.00 0.00 O ATOM 1665 CB THR A 108 -2.298 6.687 1.845 1.00 0.00 C ATOM 1666 OG1 THR A 108 -1.946 5.776 2.895 1.00 0.00 O ATOM 1667 CG2 THR A 108 -1.114 7.598 1.545 1.00 0.00 C ATOM 0 H THR A 108 -4.330 5.642 2.791 1.00 0.00 H new ATOM 0 HA THR A 108 -3.251 8.211 3.039 1.00 0.00 H new ATOM 0 HB THR A 108 -2.544 6.132 0.940 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.515 4.980 2.842 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.254 6.994 1.255 1.00 0.00 H new ATOM 0 HG22 THR A 108 -1.373 8.275 0.731 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.866 8.178 2.434 1.00 0.00 H new ATOM 1675 N TYR A 109 -4.889 7.609 0.253 1.00 0.00 N ATOM 1676 CA TYR A 109 -5.501 8.217 -0.922 1.00 0.00 C ATOM 1677 C TYR A 109 -6.260 9.483 -0.537 1.00 0.00 C ATOM 1678 O TYR A 109 -5.978 10.561 -1.055 1.00 0.00 O ATOM 1679 CB TYR A 109 -6.443 7.215 -1.600 1.00 0.00 C ATOM 1680 CG TYR A 109 -7.083 7.720 -2.874 1.00 0.00 C ATOM 1681 CD1 TYR A 109 -6.355 7.801 -4.055 1.00 0.00 C ATOM 1682 CD2 TYR A 109 -8.417 8.109 -2.897 1.00 0.00 C ATOM 1683 CE1 TYR A 109 -6.939 8.257 -5.222 1.00 0.00 C ATOM 1684 CE2 TYR A 109 -9.006 8.566 -4.061 1.00 0.00 C ATOM 1685 CZ TYR A 109 -8.263 8.638 -5.219 1.00 0.00 C ATOM 1686 OH TYR A 109 -8.845 9.097 -6.376 1.00 0.00 O ATOM 0 H TYR A 109 -5.151 6.634 0.401 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.713 8.491 -1.624 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -5.885 6.306 -1.824 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -7.230 6.942 -0.897 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -5.317 7.503 -4.061 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -9.003 8.053 -1.991 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -6.360 8.314 -6.132 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -10.044 8.865 -4.063 1.00 0.00 H new ATOM 0 HH TYR A 109 -9.783 9.323 -6.203 1.00 0.00 H new ATOM 1696 N ASN A 110 -7.193 9.351 0.402 1.00 0.00 N ATOM 1697 CA ASN A 110 -8.013 10.481 0.844 1.00 0.00 C ATOM 1698 C ASN A 110 -7.157 11.645 1.328 1.00 0.00 C ATOM 1699 O ASN A 110 -7.477 12.808 1.073 1.00 0.00 O ATOM 1700 CB ASN A 110 -8.974 10.057 1.958 1.00 0.00 C ATOM 1701 CG ASN A 110 -10.242 9.414 1.428 1.00 0.00 C ATOM 1702 OD1 ASN A 110 -11.229 10.097 1.152 1.00 0.00 O ATOM 1703 ND2 ASN A 110 -10.233 8.098 1.290 1.00 0.00 N ATOM 0 H ASN A 110 -7.402 8.471 0.874 1.00 0.00 H new ATOM 0 HA ASN A 110 -8.588 10.812 -0.021 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -8.467 9.357 2.622 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -9.237 10.929 2.556 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -11.063 7.616 0.945 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -9.396 7.566 1.529 1.00 0.00 H new ATOM 1710 N ILE A 111 -6.070 11.329 2.020 1.00 0.00 N ATOM 1711 CA ILE A 111 -5.166 12.353 2.533 1.00 0.00 C ATOM 1712 C ILE A 111 -4.488 13.118 1.393 1.00 0.00 C ATOM 1713 O ILE A 111 -4.520 14.349 1.352 1.00 0.00 O ATOM 1714 CB ILE A 111 -4.085 11.737 3.449 1.00 0.00 C ATOM 1715 CG1 ILE A 111 -4.740 10.994 4.619 1.00 0.00 C ATOM 1716 CG2 ILE A 111 -3.143 12.818 3.965 1.00 0.00 C ATOM 1717 CD1 ILE A 111 -3.755 10.270 5.512 1.00 0.00 C ATOM 0 H ILE A 111 -5.792 10.372 2.239 1.00 0.00 H new ATOM 0 HA ILE A 111 -5.771 13.048 3.115 1.00 0.00 H new ATOM 0 HB ILE A 111 -3.503 11.023 2.866 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -5.304 11.707 5.220 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -5.456 10.273 4.224 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.388 12.366 4.608 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.655 13.308 3.122 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.711 13.554 4.534 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -4.293 9.769 6.316 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -3.208 9.532 4.926 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -3.054 10.988 5.937 1.00 0.00 H new ATOM 1729 N MET A 112 -3.896 12.383 0.456 1.00 0.00 N ATOM 1730 CA MET A 112 -3.126 12.996 -0.628 1.00 0.00 C ATOM 1731 C MET A 112 -4.036 13.682 -1.646 1.00 0.00 C ATOM 1732 O MET A 112 -3.658 14.689 -2.255 1.00 0.00 O ATOM 1733 CB MET A 112 -2.257 11.947 -1.327 1.00 0.00 C ATOM 1734 CG MET A 112 -1.254 11.275 -0.402 1.00 0.00 C ATOM 1735 SD MET A 112 -0.209 10.075 -1.252 1.00 0.00 S ATOM 1736 CE MET A 112 0.727 11.143 -2.342 1.00 0.00 C ATOM 0 H MET A 112 -3.933 11.364 0.423 1.00 0.00 H new ATOM 0 HA MET A 112 -2.483 13.756 -0.184 1.00 0.00 H new ATOM 0 HB2 MET A 112 -2.902 11.185 -1.765 1.00 0.00 H new ATOM 0 HB3 MET A 112 -1.720 12.421 -2.149 1.00 0.00 H new ATOM 0 HG2 MET A 112 -0.624 12.037 0.057 1.00 0.00 H new ATOM 0 HG3 MET A 112 -1.790 10.775 0.405 1.00 0.00 H new ATOM 0 HE1 MET A 112 1.587 10.600 -2.733 1.00 0.00 H new ATOM 0 HE2 MET A 112 0.094 11.464 -3.169 1.00 0.00 H new ATOM 0 HE3 MET A 112 1.071 12.017 -1.788 1.00 0.00 H new ATOM 1746 N ILE A 113 -5.231 13.136 -1.828 1.00 0.00 N ATOM 1747 CA ILE A 113 -6.206 13.710 -2.750 1.00 0.00 C ATOM 1748 C ILE A 113 -6.780 15.007 -2.181 1.00 0.00 C ATOM 1749 O ILE A 113 -7.227 15.882 -2.922 1.00 0.00 O ATOM 1750 CB ILE A 113 -7.349 12.709 -3.052 1.00 0.00 C ATOM 1751 CG1 ILE A 113 -6.791 11.459 -3.741 1.00 0.00 C ATOM 1752 CG2 ILE A 113 -8.435 13.344 -3.907 1.00 0.00 C ATOM 1753 CD1 ILE A 113 -6.055 11.742 -5.034 1.00 0.00 C ATOM 0 H ILE A 113 -5.550 12.294 -1.349 1.00 0.00 H new ATOM 0 HA ILE A 113 -5.691 13.930 -3.685 1.00 0.00 H new ATOM 0 HB ILE A 113 -7.800 12.421 -2.103 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -6.115 10.950 -3.054 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.613 10.773 -3.946 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -9.221 12.613 -4.099 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -8.857 14.201 -3.382 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -8.007 13.674 -4.854 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -5.692 10.806 -5.458 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -6.732 12.222 -5.741 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.211 12.402 -4.835 1.00 0.00 H new ATOM 1765 N GLY A 114 -6.722 15.136 -0.860 1.00 0.00 N ATOM 1766 CA GLY A 114 -7.256 16.312 -0.197 1.00 0.00 C ATOM 1767 C GLY A 114 -6.464 17.576 -0.489 1.00 0.00 C ATOM 1768 O GLY A 114 -6.888 18.675 -0.126 1.00 0.00 O ATOM 0 H GLY A 114 -6.312 14.443 -0.233 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -8.290 16.459 -0.509 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.269 16.140 0.879 1.00 0.00 H new ATOM 1772 N GLU A 115 -5.311 17.431 -1.134 1.00 0.00 N ATOM 1773 CA GLU A 115 -4.508 18.588 -1.497 1.00 0.00 C ATOM 1774 C GLU A 115 -4.261 18.678 -3.001 1.00 0.00 C ATOM 1775 O GLU A 115 -5.054 19.268 -3.732 1.00 0.00 O ATOM 1776 CB GLU A 115 -3.169 18.596 -0.760 1.00 0.00 C ATOM 1777 CG GLU A 115 -3.248 19.127 0.659 1.00 0.00 C ATOM 1778 CD GLU A 115 -1.920 19.680 1.127 1.00 0.00 C ATOM 1779 OE1 GLU A 115 -1.400 20.608 0.466 1.00 0.00 O ATOM 1780 OE2 GLU A 115 -1.386 19.197 2.144 1.00 0.00 O ATOM 0 H GLU A 115 -4.917 16.533 -1.413 1.00 0.00 H new ATOM 0 HA GLU A 115 -5.087 19.460 -1.195 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.774 17.581 -0.735 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.459 19.201 -1.324 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -4.006 19.908 0.713 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -3.565 18.328 1.329 1.00 0.00 H new ATOM 1787 N ARG A 116 -3.169 18.076 -3.460 1.00 0.00 N ATOM 1788 CA ARG A 116 -2.686 18.321 -4.814 1.00 0.00 C ATOM 1789 C ARG A 116 -3.021 17.176 -5.765 1.00 0.00 C ATOM 1790 O ARG A 116 -3.143 17.388 -6.971 1.00 0.00 O ATOM 1791 CB ARG A 116 -1.174 18.547 -4.793 1.00 0.00 C ATOM 1792 CG ARG A 116 -0.667 19.347 -5.978 1.00 0.00 C ATOM 1793 CD ARG A 116 -1.304 20.725 -6.003 1.00 0.00 C ATOM 1794 NE ARG A 116 -0.845 21.534 -7.126 1.00 0.00 N ATOM 1795 CZ ARG A 116 -1.121 22.828 -7.264 1.00 0.00 C ATOM 1796 NH1 ARG A 116 -1.841 23.458 -6.341 1.00 0.00 N ATOM 1797 NH2 ARG A 116 -0.673 23.495 -8.317 1.00 0.00 N ATOM 0 H ARG A 116 -2.605 17.420 -2.919 1.00 0.00 H new ATOM 0 HA ARG A 116 -3.193 19.213 -5.183 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -0.904 19.065 -3.873 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -0.670 17.581 -4.774 1.00 0.00 H new ATOM 0 HG2 ARG A 116 0.417 19.442 -5.922 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -0.893 18.819 -6.904 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -2.388 20.620 -6.055 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -1.078 21.243 -5.071 1.00 0.00 H new ATOM 0 HE ARG A 116 -0.281 21.083 -7.846 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -2.183 22.949 -5.526 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -2.052 24.450 -6.448 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -0.115 23.016 -9.024 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -0.886 24.487 -8.421 1.00 0.00 H new ATOM 1811 N ARG A 117 -3.165 15.973 -5.215 1.00 0.00 N ATOM 1812 CA ARG A 117 -3.422 14.772 -6.014 1.00 0.00 C ATOM 1813 C ARG A 117 -2.271 14.488 -6.979 1.00 0.00 C ATOM 1814 O ARG A 117 -2.361 14.765 -8.174 1.00 0.00 O ATOM 1815 CB ARG A 117 -4.736 14.893 -6.796 1.00 0.00 C ATOM 1816 CG ARG A 117 -5.954 15.106 -5.918 1.00 0.00 C ATOM 1817 CD ARG A 117 -7.216 15.276 -6.746 1.00 0.00 C ATOM 1818 NE ARG A 117 -7.137 16.444 -7.615 1.00 0.00 N ATOM 1819 CZ ARG A 117 -7.966 17.480 -7.545 1.00 0.00 C ATOM 1820 NH1 ARG A 117 -8.972 17.473 -6.679 1.00 0.00 N ATOM 1821 NH2 ARG A 117 -7.789 18.521 -8.347 1.00 0.00 N ATOM 0 H ARG A 117 -3.108 15.801 -4.211 1.00 0.00 H new ATOM 0 HA ARG A 117 -3.506 13.938 -5.317 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -4.655 15.724 -7.497 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -4.880 13.989 -7.388 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -6.071 14.257 -5.245 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -5.805 15.988 -5.295 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -7.378 14.383 -7.350 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -8.076 15.373 -6.083 1.00 0.00 H new ATOM 0 HE ARG A 117 -6.400 16.467 -8.320 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -9.110 16.671 -6.065 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -9.606 18.270 -6.628 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -7.018 18.525 -9.015 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -8.424 19.318 -8.296 1.00 0.00 H new ATOM 1835 N ARG A 118 -1.180 13.956 -6.446 1.00 0.00 N ATOM 1836 CA ARG A 118 -0.040 13.561 -7.269 1.00 0.00 C ATOM 1837 C ARG A 118 0.098 12.050 -7.265 1.00 0.00 C ATOM 1838 O ARG A 118 1.174 11.504 -7.510 1.00 0.00 O ATOM 1839 CB ARG A 118 1.255 14.197 -6.755 1.00 0.00 C ATOM 1840 CG ARG A 118 1.378 15.680 -7.057 1.00 0.00 C ATOM 1841 CD ARG A 118 2.700 16.239 -6.554 1.00 0.00 C ATOM 1842 NE ARG A 118 3.852 15.521 -7.104 1.00 0.00 N ATOM 1843 CZ ARG A 118 5.041 16.083 -7.330 1.00 0.00 C ATOM 1844 NH1 ARG A 118 5.228 17.371 -7.083 1.00 0.00 N ATOM 1845 NH2 ARG A 118 6.047 15.360 -7.809 1.00 0.00 N ATOM 0 H ARG A 118 -1.058 13.787 -5.448 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.216 13.911 -8.286 1.00 0.00 H new ATOM 0 HB2 ARG A 118 1.317 14.050 -5.677 1.00 0.00 H new ATOM 0 HB3 ARG A 118 2.104 13.675 -7.197 1.00 0.00 H new ATOM 0 HG2 ARG A 118 1.298 15.842 -8.132 1.00 0.00 H new ATOM 0 HG3 ARG A 118 0.552 16.218 -6.591 1.00 0.00 H new ATOM 0 HD2 ARG A 118 2.771 17.294 -6.820 1.00 0.00 H new ATOM 0 HD3 ARG A 118 2.725 16.183 -5.466 1.00 0.00 H new ATOM 0 HE ARG A 118 3.739 14.532 -7.328 1.00 0.00 H new ATOM 0 HH11 ARG A 118 4.462 17.937 -6.719 1.00 0.00 H new ATOM 0 HH12 ARG A 118 6.138 17.797 -7.257 1.00 0.00 H new ATOM 0 HH21 ARG A 118 5.914 14.368 -8.007 1.00 0.00 H new ATOM 0 HH22 ARG A 118 6.953 15.797 -7.979 1.00 0.00 H new ATOM 1859 N VAL A 119 -1.008 11.381 -7.006 1.00 0.00 N ATOM 1860 CA VAL A 119 -1.002 9.942 -6.847 1.00 0.00 C ATOM 1861 C VAL A 119 -2.178 9.305 -7.577 1.00 0.00 C ATOM 1862 O VAL A 119 -3.305 9.800 -7.519 1.00 0.00 O ATOM 1863 CB VAL A 119 -1.031 9.548 -5.351 1.00 0.00 C ATOM 1864 CG1 VAL A 119 -2.256 10.122 -4.652 1.00 0.00 C ATOM 1865 CG2 VAL A 119 -0.979 8.037 -5.187 1.00 0.00 C ATOM 0 H VAL A 119 -1.926 11.814 -6.901 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.077 9.568 -7.287 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.146 9.975 -4.880 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -2.247 9.828 -3.603 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.240 11.210 -4.724 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.159 9.740 -5.129 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.001 7.785 -4.127 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.838 7.587 -5.684 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.061 7.654 -5.632 1.00 0.00 H new ATOM 1875 N ALA A 120 -1.896 8.229 -8.290 1.00 0.00 N ATOM 1876 CA ALA A 120 -2.931 7.427 -8.910 1.00 0.00 C ATOM 1877 C ALA A 120 -3.122 6.155 -8.101 1.00 0.00 C ATOM 1878 O ALA A 120 -2.153 5.599 -7.580 1.00 0.00 O ATOM 1879 CB ALA A 120 -2.569 7.105 -10.352 1.00 0.00 C ATOM 0 H ALA A 120 -0.948 7.890 -8.454 1.00 0.00 H new ATOM 0 HA ALA A 120 -3.866 7.987 -8.924 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.359 6.502 -10.800 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.457 8.032 -10.915 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.631 6.550 -10.376 1.00 0.00 H new ATOM 1885 N ALA A 121 -4.356 5.702 -7.980 1.00 0.00 N ATOM 1886 CA ALA A 121 -4.649 4.546 -7.150 1.00 0.00 C ATOM 1887 C ALA A 121 -5.184 3.388 -7.974 1.00 0.00 C ATOM 1888 O ALA A 121 -6.169 3.529 -8.700 1.00 0.00 O ATOM 1889 CB ALA A 121 -5.636 4.915 -6.053 1.00 0.00 C ATOM 0 H ALA A 121 -5.167 6.113 -8.442 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.714 4.224 -6.691 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.844 4.038 -5.441 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.209 5.700 -5.429 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.563 5.272 -6.502 1.00 0.00 H new ATOM 1895 N ALA A 122 -4.522 2.249 -7.864 1.00 0.00 N ATOM 1896 CA ALA A 122 -4.986 1.027 -8.498 1.00 0.00 C ATOM 1897 C ALA A 122 -5.498 0.073 -7.431 1.00 0.00 C ATOM 1898 O ALA A 122 -4.718 -0.627 -6.786 1.00 0.00 O ATOM 1899 CB ALA A 122 -3.870 0.386 -9.310 1.00 0.00 C ATOM 0 H ALA A 122 -3.655 2.145 -7.337 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.799 1.263 -9.185 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.238 -0.528 -9.777 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -3.538 1.079 -10.083 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -3.034 0.146 -8.653 1.00 0.00 H new ATOM 1905 N LEU A 123 -6.803 0.070 -7.223 1.00 0.00 N ATOM 1906 CA LEU A 123 -7.391 -0.705 -6.142 1.00 0.00 C ATOM 1907 C LEU A 123 -8.015 -1.991 -6.659 1.00 0.00 C ATOM 1908 O LEU A 123 -8.988 -1.961 -7.412 1.00 0.00 O ATOM 1909 CB LEU A 123 -8.438 0.124 -5.396 1.00 0.00 C ATOM 1910 CG LEU A 123 -7.892 1.351 -4.660 1.00 0.00 C ATOM 1911 CD1 LEU A 123 -9.017 2.091 -3.955 1.00 0.00 C ATOM 1912 CD2 LEU A 123 -6.819 0.942 -3.662 1.00 0.00 C ATOM 0 H LEU A 123 -7.474 0.593 -7.785 1.00 0.00 H new ATOM 0 HA LEU A 123 -6.590 -0.970 -5.451 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.193 0.454 -6.109 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.941 -0.519 -4.674 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.443 2.020 -5.394 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -8.612 2.960 -3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.754 2.417 -4.689 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -9.493 1.427 -3.233 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.443 1.827 -3.149 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -7.244 0.253 -2.932 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -6.000 0.453 -4.189 1.00 0.00 H new ATOM 1924 N ILE A 124 -7.440 -3.114 -6.252 1.00 0.00 N ATOM 1925 CA ILE A 124 -7.962 -4.423 -6.613 1.00 0.00 C ATOM 1926 C ILE A 124 -8.775 -4.991 -5.451 1.00 0.00 C ATOM 1927 O ILE A 124 -8.469 -4.728 -4.283 1.00 0.00 O ATOM 1928 CB ILE A 124 -6.818 -5.402 -6.975 1.00 0.00 C ATOM 1929 CG1 ILE A 124 -5.897 -4.777 -8.028 1.00 0.00 C ATOM 1930 CG2 ILE A 124 -7.382 -6.723 -7.486 1.00 0.00 C ATOM 1931 CD1 ILE A 124 -4.705 -5.641 -8.387 1.00 0.00 C ATOM 0 H ILE A 124 -6.605 -3.143 -5.667 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.601 -4.305 -7.488 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.238 -5.600 -6.074 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.475 -4.578 -8.931 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.539 -3.815 -7.660 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.562 -7.397 -7.735 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -8.003 -7.177 -6.713 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.985 -6.541 -8.376 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -4.100 -5.132 -9.138 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -4.103 -5.819 -7.496 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -5.053 -6.594 -8.786 1.00 0.00 H new ATOM 1943 N ALA A 125 -9.820 -5.739 -5.775 1.00 0.00 N ATOM 1944 CA ALA A 125 -10.665 -6.362 -4.765 1.00 0.00 C ATOM 1945 C ALA A 125 -9.954 -7.540 -4.101 1.00 0.00 C ATOM 1946 O ALA A 125 -8.941 -8.032 -4.600 1.00 0.00 O ATOM 1947 CB ALA A 125 -11.976 -6.814 -5.390 1.00 0.00 C ATOM 0 H ALA A 125 -10.105 -5.930 -6.736 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.877 -5.623 -3.992 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -12.601 -7.279 -4.628 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -12.495 -5.952 -5.810 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -11.772 -7.535 -6.181 1.00 0.00 H new ATOM 1953 N VAL A 126 -10.490 -7.991 -2.974 1.00 0.00 N ATOM 1954 CA VAL A 126 -9.890 -9.088 -2.231 1.00 0.00 C ATOM 1955 C VAL A 126 -10.368 -10.441 -2.760 1.00 0.00 C ATOM 1956 O VAL A 126 -11.515 -10.579 -3.187 1.00 0.00 O ATOM 1957 CB VAL A 126 -10.196 -8.985 -0.718 1.00 0.00 C ATOM 1958 CG1 VAL A 126 -9.613 -7.703 -0.141 1.00 0.00 C ATOM 1959 CG2 VAL A 126 -11.694 -9.055 -0.455 1.00 0.00 C ATOM 0 H VAL A 126 -11.340 -7.613 -2.555 1.00 0.00 H new ATOM 0 HA VAL A 126 -8.812 -9.013 -2.373 1.00 0.00 H new ATOM 0 HB VAL A 126 -9.727 -9.835 -0.222 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -9.838 -7.648 0.924 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -8.532 -7.698 -0.284 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -10.050 -6.844 -0.649 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -11.879 -8.980 0.617 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -12.192 -8.232 -0.968 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -12.085 -10.003 -0.825 1.00 0.00 H new