USER MOD reduce.3.24.130724 H: found=0, std=0, add=989, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 991 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 Set 1.1: A 76 TYR OH : rot 17:sc= 1.16 USER MOD Set 1.2: A 96 HIS : no HD1:sc= 2.13 K(o=3.3,f=-13!) USER MOD Set 2.1: A 46 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 47 GLN : amide:sc= 0.214 K(o=0.85,f=-1.4) USER MOD Set 2.3: A 48 SER OG : rot 26:sc= 0.639 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 MET CE :methyl -111:sc= -0.232 (180deg=-3.54!) USER MOD Single : A 17 LYS NZ :NH3+ -152:sc= 1.16 (180deg=0.995) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 158:sc= 0.295 (180deg=0.139) USER MOD Single : A 26 ASN : amide:sc=-0.00979 K(o=-0.0098,f=-1.7) USER MOD Single : A 30 LYS NZ :NH3+ 130:sc= -0.0858 (180deg=-0.498) USER MOD Single : A 33 TYR OH : rot 60:sc= -0.625 USER MOD Single : A 35 GLN : amide:sc= -0.0477 X(o=-0.048,f=-0.12) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -0.445 X(o=-0.44,f=-0.89) USER MOD Single : A 58 ASN : amide:sc= 1.17 K(o=1.2,f=-0.079) USER MOD Single : A 62 SER OG : rot 86:sc= 1.2 USER MOD Single : A 63 MET CE :methyl 163:sc= -0.0863 (180deg=-0.501) USER MOD Single : A 64 LYS NZ :NH3+ -116:sc= -0.229 (180deg=-2.69!) USER MOD Single : A 72 LYS NZ :NH3+ 162:sc= 1.22 (180deg=0.952) USER MOD Single : A 73 SER OG : rot 54:sc= 1.2 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -1.27! K(o=-1.3!,f=-0.32) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 87 SER OG : rot 180:sc= 0.0426 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 109 GLN : amide:sc= -0.724 K(o=-0.72,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0304) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 68:sc= 1.19 USER MOD Single : A 116 SER OG : rot -102:sc= 1.2 USER MOD Single : A 117 SER OG : rot 92:sc= 0.987 USER MOD Single : A 130 SER OG : rot -79:sc= 1.22 USER MOD Single : A 131 GLN : amide:sc= -0.243 X(o=-0.24,f=-0.098) USER MOD Single : A 133 TYR OH : rot 180:sc= -1.64! USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 215 N TYR A 14 -5.083 -10.836 -7.395 1.00 0.00 N ATOM 216 CA TYR A 14 -6.389 -10.240 -7.617 1.00 0.00 C ATOM 217 C TYR A 14 -6.224 -8.848 -8.203 1.00 0.00 C ATOM 218 O TYR A 14 -5.421 -8.055 -7.715 1.00 0.00 O ATOM 219 CB TYR A 14 -7.182 -10.185 -6.311 1.00 0.00 C ATOM 220 CG TYR A 14 -7.592 -11.545 -5.799 1.00 0.00 C ATOM 221 CD1 TYR A 14 -8.795 -12.115 -6.190 1.00 0.00 C ATOM 222 CD2 TYR A 14 -6.778 -12.262 -4.929 1.00 0.00 C ATOM 223 CE1 TYR A 14 -9.178 -13.359 -5.729 1.00 0.00 C ATOM 224 CE2 TYR A 14 -7.155 -13.507 -4.463 1.00 0.00 C ATOM 225 CZ TYR A 14 -8.359 -14.051 -4.866 1.00 0.00 C ATOM 226 OH TYR A 14 -8.742 -15.293 -4.410 1.00 0.00 O ATOM 0 HA TYR A 14 -6.945 -10.856 -8.324 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.581 -9.685 -5.551 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -8.075 -9.578 -6.462 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.443 -11.577 -6.866 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -5.836 -11.839 -4.612 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -10.118 -13.788 -6.045 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -6.512 -14.052 -3.788 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.053 -15.648 -3.810 1.00 0.00 H new ATOM 236 N ALA A 15 -6.968 -8.554 -9.257 1.00 0.00 N ATOM 237 CA ALA A 15 -6.816 -7.289 -9.954 1.00 0.00 C ATOM 238 C ALA A 15 -8.145 -6.570 -10.111 1.00 0.00 C ATOM 239 O ALA A 15 -9.154 -7.184 -10.474 1.00 0.00 O ATOM 240 CB ALA A 15 -6.185 -7.516 -11.319 1.00 0.00 C ATOM 0 H ALA A 15 -7.680 -9.172 -9.647 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.163 -6.657 -9.352 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.076 -6.561 -11.833 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.204 -7.975 -11.195 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -6.822 -8.175 -11.909 1.00 0.00 H new ATOM 246 N MET A 16 -8.134 -5.266 -9.854 1.00 0.00 N ATOM 247 CA MET A 16 -9.297 -4.416 -10.090 1.00 0.00 C ATOM 248 C MET A 16 -9.315 -4.007 -11.562 1.00 0.00 C ATOM 249 O MET A 16 -9.519 -2.846 -11.914 1.00 0.00 O ATOM 250 CB MET A 16 -9.258 -3.180 -9.179 1.00 0.00 C ATOM 251 CG MET A 16 -10.543 -2.358 -9.201 1.00 0.00 C ATOM 252 SD MET A 16 -11.978 -3.291 -8.630 1.00 0.00 S ATOM 253 CE MET A 16 -11.550 -3.568 -6.913 1.00 0.00 C ATOM 0 H MET A 16 -7.325 -4.771 -9.479 1.00 0.00 H new ATOM 0 HA MET A 16 -10.208 -4.967 -9.855 1.00 0.00 H new ATOM 0 HB2 MET A 16 -9.060 -3.500 -8.156 1.00 0.00 H new ATOM 0 HB3 MET A 16 -8.426 -2.544 -9.481 1.00 0.00 H new ATOM 0 HG2 MET A 16 -10.416 -1.476 -8.574 1.00 0.00 H new ATOM 0 HG3 MET A 16 -10.725 -2.004 -10.216 1.00 0.00 H new ATOM 0 HE1 MET A 16 -11.342 -4.626 -6.756 1.00 0.00 H new ATOM 0 HE2 MET A 16 -10.666 -2.983 -6.659 1.00 0.00 H new ATOM 0 HE3 MET A 16 -12.381 -3.263 -6.277 1.00 0.00 H new ATOM 263 N LYS A 17 -9.084 -5.004 -12.403 1.00 0.00 N ATOM 264 CA LYS A 17 -9.013 -4.844 -13.850 1.00 0.00 C ATOM 265 C LYS A 17 -10.241 -4.118 -14.394 1.00 0.00 C ATOM 266 O LYS A 17 -11.362 -4.371 -13.957 1.00 0.00 O ATOM 267 CB LYS A 17 -8.863 -6.230 -14.490 1.00 0.00 C ATOM 268 CG LYS A 17 -9.825 -7.268 -13.927 1.00 0.00 C ATOM 269 CD LYS A 17 -9.364 -8.683 -14.224 1.00 0.00 C ATOM 270 CE LYS A 17 -10.310 -9.724 -13.643 1.00 0.00 C ATOM 271 NZ LYS A 17 -10.317 -9.714 -12.152 1.00 0.00 N ATOM 0 H LYS A 17 -8.938 -5.965 -12.094 1.00 0.00 H new ATOM 0 HA LYS A 17 -8.149 -4.229 -14.101 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -9.022 -6.144 -15.565 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.840 -6.579 -14.346 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -9.915 -7.134 -12.849 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -10.817 -7.112 -14.351 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.291 -8.822 -15.303 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -8.365 -8.832 -13.815 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -11.320 -9.539 -14.010 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -10.019 -10.713 -13.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -10.557 -10.663 -11.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.376 -9.443 -11.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -11.023 -9.030 -11.813 1.00 0.00 H new ATOM 285 N PRO A 18 -10.034 -3.196 -15.346 1.00 0.00 N ATOM 286 CA PRO A 18 -11.108 -2.365 -15.904 1.00 0.00 C ATOM 287 C PRO A 18 -12.292 -3.185 -16.405 1.00 0.00 C ATOM 288 O PRO A 18 -12.171 -3.956 -17.362 1.00 0.00 O ATOM 289 CB PRO A 18 -10.432 -1.637 -17.067 1.00 0.00 C ATOM 290 CG PRO A 18 -8.988 -1.614 -16.711 1.00 0.00 C ATOM 291 CD PRO A 18 -8.727 -2.883 -15.953 1.00 0.00 C ATOM 0 HA PRO A 18 -11.530 -1.699 -15.152 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -10.599 -2.157 -18.010 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -10.827 -0.628 -17.185 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.367 -1.559 -17.605 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.750 -0.741 -16.103 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -8.389 -3.682 -16.613 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -7.955 -2.747 -15.196 1.00 0.00 H new ATOM 299 N GLY A 19 -13.429 -3.024 -15.743 1.00 0.00 N ATOM 300 CA GLY A 19 -14.637 -3.711 -16.154 1.00 0.00 C ATOM 301 C GLY A 19 -14.676 -5.153 -15.693 1.00 0.00 C ATOM 302 O GLY A 19 -14.967 -6.058 -16.479 1.00 0.00 O ATOM 0 H GLY A 19 -13.537 -2.426 -14.924 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -15.503 -3.183 -15.756 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -14.716 -3.679 -17.241 1.00 0.00 H new ATOM 306 N LEU A 20 -14.394 -5.372 -14.420 1.00 0.00 N ATOM 307 CA LEU A 20 -14.358 -6.718 -13.879 1.00 0.00 C ATOM 308 C LEU A 20 -15.601 -7.020 -13.037 1.00 0.00 C ATOM 309 O LEU A 20 -16.260 -6.111 -12.532 1.00 0.00 O ATOM 310 CB LEU A 20 -13.028 -6.954 -13.141 1.00 0.00 C ATOM 311 CG LEU A 20 -12.814 -6.322 -11.765 1.00 0.00 C ATOM 312 CD1 LEU A 20 -13.365 -4.917 -11.657 1.00 0.00 C ATOM 313 CD2 LEU A 20 -13.399 -7.222 -10.723 1.00 0.00 C ATOM 0 H LEU A 20 -14.187 -4.637 -13.744 1.00 0.00 H new ATOM 0 HA LEU A 20 -14.392 -7.437 -14.697 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -12.901 -8.031 -13.030 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -12.226 -6.604 -13.791 1.00 0.00 H new ATOM 0 HG LEU A 20 -11.741 -6.219 -11.607 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -13.179 -4.529 -10.655 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -12.875 -4.277 -12.391 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -14.438 -4.931 -11.847 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -13.252 -6.781 -9.737 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -14.466 -7.348 -10.909 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -12.906 -8.193 -10.763 1.00 0.00 H new ATOM 325 N SER A 21 -15.918 -8.306 -12.921 1.00 0.00 N ATOM 326 CA SER A 21 -17.192 -8.766 -12.364 1.00 0.00 C ATOM 327 C SER A 21 -17.318 -8.486 -10.865 1.00 0.00 C ATOM 328 O SER A 21 -16.325 -8.246 -10.180 1.00 0.00 O ATOM 329 CB SER A 21 -17.336 -10.264 -12.624 1.00 0.00 C ATOM 330 OG SER A 21 -17.020 -10.574 -13.972 1.00 0.00 O ATOM 0 H SER A 21 -15.299 -9.063 -13.211 1.00 0.00 H new ATOM 0 HA SER A 21 -17.989 -8.210 -12.857 1.00 0.00 H new ATOM 0 HB2 SER A 21 -16.678 -10.819 -11.955 1.00 0.00 H new ATOM 0 HB3 SER A 21 -18.356 -10.580 -12.403 1.00 0.00 H new ATOM 0 HG SER A 21 -17.117 -11.538 -14.117 1.00 0.00 H new ATOM 336 N ALA A 22 -18.550 -8.545 -10.360 1.00 0.00 N ATOM 337 CA ALA A 22 -18.832 -8.266 -8.954 1.00 0.00 C ATOM 338 C ALA A 22 -18.171 -9.285 -8.030 1.00 0.00 C ATOM 339 O ALA A 22 -17.490 -8.911 -7.078 1.00 0.00 O ATOM 340 CB ALA A 22 -20.333 -8.233 -8.712 1.00 0.00 C ATOM 0 H ALA A 22 -19.375 -8.786 -10.910 1.00 0.00 H new ATOM 0 HA ALA A 22 -18.410 -7.288 -8.723 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -20.527 -8.024 -7.660 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -20.783 -7.453 -9.326 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -20.765 -9.198 -8.976 1.00 0.00 H new ATOM 346 N LEU A 23 -18.372 -10.571 -8.312 1.00 0.00 N ATOM 347 CA LEU A 23 -17.754 -11.637 -7.528 1.00 0.00 C ATOM 348 C LEU A 23 -16.238 -11.497 -7.537 1.00 0.00 C ATOM 349 O LEU A 23 -15.580 -11.693 -6.512 1.00 0.00 O ATOM 350 CB LEU A 23 -18.157 -13.006 -8.078 1.00 0.00 C ATOM 351 CG LEU A 23 -19.497 -13.558 -7.576 1.00 0.00 C ATOM 352 CD1 LEU A 23 -19.404 -13.927 -6.104 1.00 0.00 C ATOM 353 CD2 LEU A 23 -20.624 -12.562 -7.793 1.00 0.00 C ATOM 0 H LEU A 23 -18.959 -10.900 -9.079 1.00 0.00 H new ATOM 0 HA LEU A 23 -18.106 -11.554 -6.500 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -18.196 -12.943 -9.165 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -17.374 -13.722 -7.828 1.00 0.00 H new ATOM 0 HG LEU A 23 -19.721 -14.455 -8.154 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -20.364 -14.317 -5.765 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -18.635 -14.687 -5.967 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -19.146 -13.042 -5.523 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -21.559 -12.985 -7.426 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -20.405 -11.641 -7.252 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -20.717 -12.344 -8.857 1.00 0.00 H new ATOM 365 N GLU A 24 -15.704 -11.158 -8.704 1.00 0.00 N ATOM 366 CA GLU A 24 -14.286 -10.852 -8.854 1.00 0.00 C ATOM 367 C GLU A 24 -13.889 -9.702 -7.938 1.00 0.00 C ATOM 368 O GLU A 24 -12.940 -9.802 -7.165 1.00 0.00 O ATOM 369 CB GLU A 24 -13.991 -10.460 -10.303 1.00 0.00 C ATOM 370 CG GLU A 24 -13.938 -11.627 -11.268 1.00 0.00 C ATOM 371 CD GLU A 24 -12.670 -12.433 -11.115 1.00 0.00 C ATOM 372 OE1 GLU A 24 -11.580 -11.877 -11.370 1.00 0.00 O ATOM 373 OE2 GLU A 24 -12.752 -13.618 -10.744 1.00 0.00 O ATOM 0 H GLU A 24 -16.239 -11.088 -9.570 1.00 0.00 H new ATOM 0 HA GLU A 24 -13.712 -11.739 -8.585 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -14.755 -9.760 -10.640 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -13.038 -9.932 -10.337 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -14.800 -12.273 -11.103 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -14.010 -11.255 -12.290 1.00 0.00 H new ATOM 380 N LYS A 25 -14.645 -8.619 -8.038 1.00 0.00 N ATOM 381 CA LYS A 25 -14.359 -7.384 -7.324 1.00 0.00 C ATOM 382 C LYS A 25 -14.401 -7.594 -5.815 1.00 0.00 C ATOM 383 O LYS A 25 -13.531 -7.108 -5.091 1.00 0.00 O ATOM 384 CB LYS A 25 -15.371 -6.326 -7.755 1.00 0.00 C ATOM 385 CG LYS A 25 -15.048 -4.912 -7.305 1.00 0.00 C ATOM 386 CD LYS A 25 -15.918 -3.902 -8.039 1.00 0.00 C ATOM 387 CE LYS A 25 -15.623 -3.888 -9.535 1.00 0.00 C ATOM 388 NZ LYS A 25 -16.576 -3.025 -10.284 1.00 0.00 N ATOM 0 H LYS A 25 -15.480 -8.572 -8.621 1.00 0.00 H new ATOM 0 HA LYS A 25 -13.351 -7.051 -7.570 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -15.446 -6.338 -8.842 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -16.351 -6.601 -7.365 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -15.206 -4.822 -6.230 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -13.996 -4.697 -7.492 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -16.969 -4.141 -7.877 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -15.750 -2.908 -7.625 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.606 -3.533 -9.700 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -15.673 -4.905 -9.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -16.149 -2.741 -11.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -17.453 -3.553 -10.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -16.792 -2.177 -9.722 1.00 0.00 H new ATOM 402 N ASN A 26 -15.405 -8.331 -5.351 1.00 0.00 N ATOM 403 CA ASN A 26 -15.536 -8.652 -3.933 1.00 0.00 C ATOM 404 C ASN A 26 -14.305 -9.397 -3.432 1.00 0.00 C ATOM 405 O ASN A 26 -13.823 -9.148 -2.327 1.00 0.00 O ATOM 406 CB ASN A 26 -16.790 -9.497 -3.681 1.00 0.00 C ATOM 407 CG ASN A 26 -18.080 -8.717 -3.863 1.00 0.00 C ATOM 408 OD1 ASN A 26 -18.136 -7.512 -3.625 1.00 0.00 O ATOM 409 ND2 ASN A 26 -19.130 -9.404 -4.290 1.00 0.00 N ATOM 0 H ASN A 26 -16.143 -8.719 -5.939 1.00 0.00 H new ATOM 0 HA ASN A 26 -15.627 -7.714 -3.386 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -16.789 -10.350 -4.360 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -16.754 -9.897 -2.668 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -20.024 -8.934 -4.432 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -19.044 -10.403 -4.477 1.00 0.00 H new ATOM 416 N ALA A 27 -13.791 -10.306 -4.255 1.00 0.00 N ATOM 417 CA ALA A 27 -12.610 -11.082 -3.897 1.00 0.00 C ATOM 418 C ALA A 27 -11.361 -10.207 -3.893 1.00 0.00 C ATOM 419 O ALA A 27 -10.486 -10.358 -3.038 1.00 0.00 O ATOM 420 CB ALA A 27 -12.438 -12.254 -4.851 1.00 0.00 C ATOM 0 H ALA A 27 -14.175 -10.523 -5.175 1.00 0.00 H new ATOM 0 HA ALA A 27 -12.751 -11.471 -2.889 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.552 -12.824 -4.571 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -13.316 -12.898 -4.798 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -12.323 -11.881 -5.869 1.00 0.00 H new ATOM 426 N VAL A 28 -11.290 -9.286 -4.851 1.00 0.00 N ATOM 427 CA VAL A 28 -10.179 -8.346 -4.939 1.00 0.00 C ATOM 428 C VAL A 28 -10.130 -7.458 -3.699 1.00 0.00 C ATOM 429 O VAL A 28 -9.079 -7.301 -3.073 1.00 0.00 O ATOM 430 CB VAL A 28 -10.290 -7.463 -6.206 1.00 0.00 C ATOM 431 CG1 VAL A 28 -9.163 -6.445 -6.260 1.00 0.00 C ATOM 432 CG2 VAL A 28 -10.287 -8.322 -7.460 1.00 0.00 C ATOM 0 H VAL A 28 -11.994 -9.172 -5.580 1.00 0.00 H new ATOM 0 HA VAL A 28 -9.260 -8.928 -5.002 1.00 0.00 H new ATOM 0 HB VAL A 28 -11.236 -6.923 -6.157 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -9.264 -5.838 -7.159 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -9.211 -5.802 -5.381 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -8.205 -6.964 -6.279 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -10.366 -7.683 -8.339 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -9.359 -8.892 -7.508 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -11.134 -9.008 -7.433 1.00 0.00 H new ATOM 442 N ILE A 29 -11.278 -6.897 -3.342 1.00 0.00 N ATOM 443 CA ILE A 29 -11.385 -6.039 -2.168 1.00 0.00 C ATOM 444 C ILE A 29 -11.088 -6.828 -0.891 1.00 0.00 C ATOM 445 O ILE A 29 -10.468 -6.313 0.044 1.00 0.00 O ATOM 446 CB ILE A 29 -12.791 -5.401 -2.070 1.00 0.00 C ATOM 447 CG1 ILE A 29 -13.074 -4.550 -3.311 1.00 0.00 C ATOM 448 CG2 ILE A 29 -12.916 -4.557 -0.811 1.00 0.00 C ATOM 449 CD1 ILE A 29 -14.467 -3.951 -3.341 1.00 0.00 C ATOM 0 H ILE A 29 -12.153 -7.021 -3.851 1.00 0.00 H new ATOM 0 HA ILE A 29 -10.647 -5.244 -2.275 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.528 -6.203 -2.017 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -12.342 -3.744 -3.362 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -12.934 -5.164 -4.200 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -13.913 -4.119 -0.764 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -12.754 -5.185 0.065 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -12.171 -3.762 -0.831 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -14.591 -3.363 -4.250 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -15.207 -4.751 -3.323 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -14.606 -3.309 -2.471 1.00 0.00 H new ATOM 461 N LYS A 30 -11.521 -8.083 -0.865 1.00 0.00 N ATOM 462 CA LYS A 30 -11.298 -8.952 0.285 1.00 0.00 C ATOM 463 C LYS A 30 -9.802 -9.168 0.509 1.00 0.00 C ATOM 464 O LYS A 30 -9.307 -9.067 1.636 1.00 0.00 O ATOM 465 CB LYS A 30 -12.000 -10.294 0.073 1.00 0.00 C ATOM 466 CG LYS A 30 -12.028 -11.170 1.313 1.00 0.00 C ATOM 467 CD LYS A 30 -12.766 -12.474 1.062 1.00 0.00 C ATOM 468 CE LYS A 30 -13.015 -13.225 2.360 1.00 0.00 C ATOM 469 NZ LYS A 30 -13.897 -12.459 3.276 1.00 0.00 N ATOM 0 H LYS A 30 -12.031 -8.523 -1.631 1.00 0.00 H new ATOM 0 HA LYS A 30 -11.715 -8.472 1.171 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -13.023 -10.111 -0.255 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -11.499 -10.833 -0.731 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.008 -11.384 1.630 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -12.509 -10.631 2.129 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -13.717 -12.268 0.570 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -12.185 -13.099 0.383 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -13.469 -14.191 2.140 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -12.064 -13.425 2.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.668 -13.072 3.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -13.344 -12.124 4.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.298 -11.643 2.771 1.00 0.00 H new ATOM 483 N ALA A 31 -9.090 -9.448 -0.576 1.00 0.00 N ATOM 484 CA ALA A 31 -7.654 -9.688 -0.514 1.00 0.00 C ATOM 485 C ALA A 31 -6.902 -8.431 -0.097 1.00 0.00 C ATOM 486 O ALA A 31 -5.931 -8.502 0.654 1.00 0.00 O ATOM 487 CB ALA A 31 -7.142 -10.188 -1.858 1.00 0.00 C ATOM 0 H ALA A 31 -9.486 -9.515 -1.513 1.00 0.00 H new ATOM 0 HA ALA A 31 -7.474 -10.454 0.240 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -6.068 -10.363 -1.796 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -7.647 -11.119 -2.116 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -7.344 -9.441 -2.625 1.00 0.00 H new ATOM 493 N ALA A 32 -7.365 -7.282 -0.577 1.00 0.00 N ATOM 494 CA ALA A 32 -6.728 -6.006 -0.272 1.00 0.00 C ATOM 495 C ALA A 32 -6.654 -5.770 1.234 1.00 0.00 C ATOM 496 O ALA A 32 -5.574 -5.548 1.785 1.00 0.00 O ATOM 497 CB ALA A 32 -7.473 -4.869 -0.949 1.00 0.00 C ATOM 0 H ALA A 32 -8.183 -7.208 -1.182 1.00 0.00 H new ATOM 0 HA ALA A 32 -5.709 -6.039 -0.657 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -6.986 -3.923 -0.712 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -7.466 -5.021 -2.028 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -8.503 -4.846 -0.593 1.00 0.00 H new ATOM 503 N TYR A 33 -7.800 -5.836 1.901 1.00 0.00 N ATOM 504 CA TYR A 33 -7.858 -5.613 3.343 1.00 0.00 C ATOM 505 C TYR A 33 -7.115 -6.706 4.105 1.00 0.00 C ATOM 506 O TYR A 33 -6.576 -6.463 5.185 1.00 0.00 O ATOM 507 CB TYR A 33 -9.304 -5.547 3.832 1.00 0.00 C ATOM 508 CG TYR A 33 -10.033 -4.275 3.460 1.00 0.00 C ATOM 509 CD1 TYR A 33 -9.736 -3.073 4.090 1.00 0.00 C ATOM 510 CD2 TYR A 33 -11.036 -4.282 2.502 1.00 0.00 C ATOM 511 CE1 TYR A 33 -10.417 -1.913 3.770 1.00 0.00 C ATOM 512 CE2 TYR A 33 -11.717 -3.126 2.175 1.00 0.00 C ATOM 513 CZ TYR A 33 -11.408 -1.947 2.813 1.00 0.00 C ATOM 514 OH TYR A 33 -12.097 -0.798 2.497 1.00 0.00 O ATOM 0 H TYR A 33 -8.701 -6.042 1.469 1.00 0.00 H new ATOM 0 HA TYR A 33 -7.372 -4.657 3.537 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -9.851 -6.397 3.425 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -9.313 -5.652 4.917 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -8.961 -3.044 4.842 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -11.288 -5.206 2.004 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -10.174 -0.986 4.267 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -12.490 -3.147 1.421 1.00 0.00 H new ATOM 0 HH TYR A 33 -11.470 -0.121 2.166 1.00 0.00 H new ATOM 524 N ARG A 34 -7.086 -7.904 3.534 1.00 0.00 N ATOM 525 CA ARG A 34 -6.458 -9.050 4.184 1.00 0.00 C ATOM 526 C ARG A 34 -4.938 -9.018 4.014 1.00 0.00 C ATOM 527 O ARG A 34 -4.218 -9.770 4.667 1.00 0.00 O ATOM 528 CB ARG A 34 -7.028 -10.352 3.613 1.00 0.00 C ATOM 529 CG ARG A 34 -6.672 -11.589 4.424 1.00 0.00 C ATOM 530 CD ARG A 34 -7.229 -12.847 3.780 1.00 0.00 C ATOM 531 NE ARG A 34 -7.022 -14.033 4.610 1.00 0.00 N ATOM 532 CZ ARG A 34 -6.540 -15.191 4.152 1.00 0.00 C ATOM 533 NH1 ARG A 34 -6.094 -15.292 2.904 1.00 0.00 N ATOM 534 NH2 ARG A 34 -6.477 -16.245 4.951 1.00 0.00 N ATOM 0 H ARG A 34 -7.491 -8.108 2.620 1.00 0.00 H new ATOM 0 HA ARG A 34 -6.677 -9.000 5.250 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -8.113 -10.267 3.555 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -6.664 -10.480 2.594 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -5.589 -11.671 4.511 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -7.066 -11.490 5.435 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -8.295 -12.717 3.596 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -6.754 -12.997 2.810 1.00 0.00 H new ATOM 0 HE ARG A 34 -7.261 -13.972 5.600 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -6.118 -14.480 2.287 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -5.728 -16.181 2.564 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -6.797 -16.173 5.917 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -6.109 -17.129 4.601 1.00 0.00 H new ATOM 548 N GLN A 35 -4.455 -8.152 3.132 1.00 0.00 N ATOM 549 CA GLN A 35 -3.019 -8.034 2.899 1.00 0.00 C ATOM 550 C GLN A 35 -2.455 -6.749 3.505 1.00 0.00 C ATOM 551 O GLN A 35 -1.416 -6.770 4.161 1.00 0.00 O ATOM 552 CB GLN A 35 -2.720 -8.064 1.398 1.00 0.00 C ATOM 553 CG GLN A 35 -1.235 -8.078 1.077 1.00 0.00 C ATOM 554 CD GLN A 35 -0.553 -9.346 1.546 1.00 0.00 C ATOM 555 OE1 GLN A 35 -0.072 -9.433 2.676 1.00 0.00 O ATOM 556 NE2 GLN A 35 -0.502 -10.341 0.676 1.00 0.00 N ATOM 0 H GLN A 35 -5.030 -7.525 2.570 1.00 0.00 H new ATOM 0 HA GLN A 35 -2.538 -8.883 3.386 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -3.187 -8.946 0.960 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -3.178 -7.194 0.927 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -1.098 -7.972 0.001 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -0.757 -7.218 1.545 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -0.913 -10.229 -0.251 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -0.052 -11.220 0.932 1.00 0.00 H new ATOM 565 N ILE A 36 -3.148 -5.634 3.292 1.00 0.00 N ATOM 566 CA ILE A 36 -2.654 -4.334 3.742 1.00 0.00 C ATOM 567 C ILE A 36 -2.706 -4.223 5.263 1.00 0.00 C ATOM 568 O ILE A 36 -1.689 -3.982 5.913 1.00 0.00 O ATOM 569 CB ILE A 36 -3.449 -3.170 3.106 1.00 0.00 C ATOM 570 CG1 ILE A 36 -3.371 -3.246 1.577 1.00 0.00 C ATOM 571 CG2 ILE A 36 -2.930 -1.825 3.598 1.00 0.00 C ATOM 572 CD1 ILE A 36 -1.956 -3.253 1.034 1.00 0.00 C ATOM 0 H ILE A 36 -4.048 -5.603 2.814 1.00 0.00 H new ATOM 0 HA ILE A 36 -1.616 -4.259 3.417 1.00 0.00 H new ATOM 0 HB ILE A 36 -4.492 -3.263 3.409 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.883 -4.148 1.241 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -3.908 -2.398 1.153 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.505 -1.022 3.137 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -3.034 -1.769 4.682 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -1.879 -1.720 3.328 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -1.984 -3.308 -0.054 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.445 -2.339 1.338 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -1.420 -4.116 1.427 1.00 0.00 H new ATOM 584 N PHE A 37 -3.892 -4.405 5.826 1.00 0.00 N ATOM 585 CA PHE A 37 -4.060 -4.373 7.273 1.00 0.00 C ATOM 586 C PHE A 37 -4.109 -5.789 7.824 1.00 0.00 C ATOM 587 O PHE A 37 -4.292 -5.992 9.024 1.00 0.00 O ATOM 588 CB PHE A 37 -5.337 -3.627 7.657 1.00 0.00 C ATOM 589 CG PHE A 37 -5.303 -2.159 7.339 1.00 0.00 C ATOM 590 CD1 PHE A 37 -4.511 -1.296 8.082 1.00 0.00 C ATOM 591 CD2 PHE A 37 -6.066 -1.641 6.306 1.00 0.00 C ATOM 592 CE1 PHE A 37 -4.480 0.055 7.798 1.00 0.00 C ATOM 593 CE2 PHE A 37 -6.039 -0.290 6.018 1.00 0.00 C ATOM 594 CZ PHE A 37 -5.246 0.558 6.764 1.00 0.00 C ATOM 0 H PHE A 37 -4.752 -4.576 5.304 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.208 -3.846 7.702 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -6.181 -4.082 7.139 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -5.513 -3.753 8.725 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -3.912 -1.685 8.892 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -6.689 -2.300 5.719 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.858 0.717 8.383 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -6.638 0.102 5.210 1.00 0.00 H new ATOM 0 HZ PHE A 37 -5.224 1.614 6.540 1.00 0.00 H new ATOM 604 N GLU A 38 -3.974 -6.759 6.922 1.00 0.00 N ATOM 605 CA GLU A 38 -3.985 -8.176 7.276 1.00 0.00 C ATOM 606 C GLU A 38 -5.274 -8.564 8.006 1.00 0.00 C ATOM 607 O GLU A 38 -5.322 -9.567 8.717 1.00 0.00 O ATOM 608 CB GLU A 38 -2.745 -8.524 8.108 1.00 0.00 C ATOM 609 CG GLU A 38 -1.448 -8.351 7.330 1.00 0.00 C ATOM 610 CD GLU A 38 -0.213 -8.715 8.128 1.00 0.00 C ATOM 611 OE1 GLU A 38 -0.155 -9.837 8.672 1.00 0.00 O ATOM 612 OE2 GLU A 38 0.726 -7.893 8.185 1.00 0.00 O ATOM 0 H GLU A 38 -3.854 -6.584 5.924 1.00 0.00 H new ATOM 0 HA GLU A 38 -3.955 -8.757 6.354 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.719 -7.892 8.995 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.822 -9.555 8.453 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.486 -8.969 6.433 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.366 -7.315 7.001 1.00 0.00 H new ATOM 720 N TYR A 45 -15.749 -0.941 12.005 1.00 0.00 N ATOM 721 CA TYR A 45 -14.676 0.054 12.040 1.00 0.00 C ATOM 722 C TYR A 45 -15.134 1.376 11.403 1.00 0.00 C ATOM 723 O TYR A 45 -16.257 1.478 10.901 1.00 0.00 O ATOM 724 CB TYR A 45 -13.432 -0.475 11.319 1.00 0.00 C ATOM 725 CG TYR A 45 -12.200 -0.545 12.196 1.00 0.00 C ATOM 726 CD1 TYR A 45 -12.063 -1.540 13.154 1.00 0.00 C ATOM 727 CD2 TYR A 45 -11.170 0.378 12.063 1.00 0.00 C ATOM 728 CE1 TYR A 45 -10.941 -1.615 13.956 1.00 0.00 C ATOM 729 CE2 TYR A 45 -10.044 0.312 12.861 1.00 0.00 C ATOM 730 CZ TYR A 45 -9.935 -0.688 13.805 1.00 0.00 C ATOM 731 OH TYR A 45 -8.814 -0.763 14.600 1.00 0.00 O ATOM 0 HA TYR A 45 -14.425 0.244 13.084 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -13.646 -1.470 10.929 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -13.221 0.165 10.462 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -12.850 -2.270 13.275 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -11.251 1.161 11.323 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -10.854 -2.396 14.697 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -9.254 1.039 12.746 1.00 0.00 H new ATOM 0 HH TYR A 45 -8.199 -0.037 14.367 1.00 0.00 H new ATOM 741 N SER A 46 -14.256 2.375 11.425 1.00 0.00 N ATOM 742 CA SER A 46 -14.583 3.716 10.937 1.00 0.00 C ATOM 743 C SER A 46 -15.190 3.680 9.534 1.00 0.00 C ATOM 744 O SER A 46 -14.696 2.981 8.644 1.00 0.00 O ATOM 745 CB SER A 46 -13.335 4.604 10.942 1.00 0.00 C ATOM 746 OG SER A 46 -13.647 5.925 10.533 1.00 0.00 O ATOM 0 H SER A 46 -13.304 2.282 11.778 1.00 0.00 H new ATOM 0 HA SER A 46 -15.329 4.134 11.613 1.00 0.00 H new ATOM 0 HB2 SER A 46 -12.902 4.622 11.942 1.00 0.00 H new ATOM 0 HB3 SER A 46 -12.582 4.182 10.276 1.00 0.00 H new ATOM 0 HG SER A 46 -12.834 6.472 10.546 1.00 0.00 H new ATOM 752 N GLN A 47 -16.256 4.455 9.346 1.00 0.00 N ATOM 753 CA GLN A 47 -16.981 4.492 8.080 1.00 0.00 C ATOM 754 C GLN A 47 -16.124 5.042 6.940 1.00 0.00 C ATOM 755 O GLN A 47 -16.456 4.864 5.767 1.00 0.00 O ATOM 756 CB GLN A 47 -18.289 5.290 8.226 1.00 0.00 C ATOM 757 CG GLN A 47 -18.207 6.504 9.148 1.00 0.00 C ATOM 758 CD GLN A 47 -17.326 7.618 8.612 1.00 0.00 C ATOM 759 OE1 GLN A 47 -16.125 7.661 8.881 1.00 0.00 O ATOM 760 NE2 GLN A 47 -17.915 8.536 7.860 1.00 0.00 N ATOM 0 H GLN A 47 -16.639 5.071 10.063 1.00 0.00 H new ATOM 0 HA GLN A 47 -17.231 3.464 7.819 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -18.605 5.624 7.238 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -19.065 4.621 8.599 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -19.212 6.894 9.311 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -17.826 6.187 10.119 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -18.913 8.467 7.659 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -17.371 9.312 7.482 1.00 0.00 H new ATOM 769 N SER A 48 -15.018 5.692 7.286 1.00 0.00 N ATOM 770 CA SER A 48 -14.086 6.199 6.288 1.00 0.00 C ATOM 771 C SER A 48 -13.487 5.045 5.489 1.00 0.00 C ATOM 772 O SER A 48 -13.200 5.178 4.299 1.00 0.00 O ATOM 773 CB SER A 48 -12.980 7.007 6.969 1.00 0.00 C ATOM 774 OG SER A 48 -13.520 8.089 7.716 1.00 0.00 O ATOM 0 H SER A 48 -14.746 5.880 8.251 1.00 0.00 H new ATOM 0 HA SER A 48 -14.625 6.851 5.601 1.00 0.00 H new ATOM 0 HB2 SER A 48 -12.405 6.357 7.629 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.290 7.389 6.217 1.00 0.00 H new ATOM 0 HG SER A 48 -14.439 7.877 7.982 1.00 0.00 H new ATOM 780 N ILE A 49 -13.329 3.902 6.148 1.00 0.00 N ATOM 781 CA ILE A 49 -12.802 2.711 5.501 1.00 0.00 C ATOM 782 C ILE A 49 -13.815 2.166 4.500 1.00 0.00 C ATOM 783 O ILE A 49 -13.461 1.791 3.383 1.00 0.00 O ATOM 784 CB ILE A 49 -12.452 1.622 6.537 1.00 0.00 C ATOM 785 CG1 ILE A 49 -11.412 2.158 7.524 1.00 0.00 C ATOM 786 CG2 ILE A 49 -11.940 0.363 5.849 1.00 0.00 C ATOM 787 CD1 ILE A 49 -10.983 1.148 8.562 1.00 0.00 C ATOM 0 H ILE A 49 -13.560 3.778 7.134 1.00 0.00 H new ATOM 0 HA ILE A 49 -11.888 2.990 4.976 1.00 0.00 H new ATOM 0 HB ILE A 49 -13.357 1.359 7.085 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -10.535 2.490 6.969 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -11.820 3.034 8.029 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -11.700 -0.390 6.600 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -12.708 -0.024 5.180 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -11.045 0.601 5.274 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -10.245 1.599 9.226 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -11.850 0.833 9.143 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -10.544 0.282 8.067 1.00 0.00 H new ATOM 799 N SER A 50 -15.081 2.158 4.899 1.00 0.00 N ATOM 800 CA SER A 50 -16.151 1.687 4.033 1.00 0.00 C ATOM 801 C SER A 50 -16.327 2.639 2.850 1.00 0.00 C ATOM 802 O SER A 50 -16.635 2.212 1.734 1.00 0.00 O ATOM 803 CB SER A 50 -17.455 1.561 4.829 1.00 0.00 C ATOM 804 OG SER A 50 -18.471 0.928 4.069 1.00 0.00 O ATOM 0 H SER A 50 -15.391 2.473 5.818 1.00 0.00 H new ATOM 0 HA SER A 50 -15.889 0.703 3.645 1.00 0.00 H new ATOM 0 HB2 SER A 50 -17.272 0.991 5.740 1.00 0.00 H new ATOM 0 HB3 SER A 50 -17.792 2.551 5.135 1.00 0.00 H new ATOM 0 HG SER A 50 -19.288 0.862 4.606 1.00 0.00 H new ATOM 810 N TYR A 51 -16.116 3.930 3.099 1.00 0.00 N ATOM 811 CA TYR A 51 -16.148 4.934 2.044 1.00 0.00 C ATOM 812 C TYR A 51 -15.121 4.600 0.965 1.00 0.00 C ATOM 813 O TYR A 51 -15.400 4.704 -0.230 1.00 0.00 O ATOM 814 CB TYR A 51 -15.874 6.329 2.626 1.00 0.00 C ATOM 815 CG TYR A 51 -15.695 7.408 1.578 1.00 0.00 C ATOM 816 CD1 TYR A 51 -16.791 8.063 1.030 1.00 0.00 C ATOM 817 CD2 TYR A 51 -14.427 7.765 1.128 1.00 0.00 C ATOM 818 CE1 TYR A 51 -16.630 9.042 0.066 1.00 0.00 C ATOM 819 CE2 TYR A 51 -14.259 8.740 0.164 1.00 0.00 C ATOM 820 CZ TYR A 51 -15.362 9.374 -0.365 1.00 0.00 C ATOM 821 OH TYR A 51 -15.197 10.339 -1.329 1.00 0.00 O ATOM 0 H TYR A 51 -15.920 4.304 4.028 1.00 0.00 H new ATOM 0 HA TYR A 51 -17.141 4.934 1.593 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -16.699 6.607 3.282 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -14.977 6.284 3.244 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -17.785 7.803 1.362 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -13.559 7.271 1.540 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -17.492 9.544 -0.347 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -13.268 9.004 -0.173 1.00 0.00 H new ATOM 0 HH TYR A 51 -14.242 10.453 -1.518 1.00 0.00 H new ATOM 831 N LEU A 52 -13.936 4.190 1.398 1.00 0.00 N ATOM 832 CA LEU A 52 -12.863 3.843 0.477 1.00 0.00 C ATOM 833 C LEU A 52 -13.231 2.612 -0.344 1.00 0.00 C ATOM 834 O LEU A 52 -13.004 2.578 -1.555 1.00 0.00 O ATOM 835 CB LEU A 52 -11.559 3.604 1.241 1.00 0.00 C ATOM 836 CG LEU A 52 -11.031 4.814 2.016 1.00 0.00 C ATOM 837 CD1 LEU A 52 -9.731 4.465 2.721 1.00 0.00 C ATOM 838 CD2 LEU A 52 -10.834 6.001 1.084 1.00 0.00 C ATOM 0 H LEU A 52 -13.694 4.090 2.384 1.00 0.00 H new ATOM 0 HA LEU A 52 -12.718 4.679 -0.207 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -11.711 2.782 1.940 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.795 3.283 0.533 1.00 0.00 H new ATOM 0 HG LEU A 52 -11.768 5.091 2.770 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -9.368 5.336 3.268 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.904 3.645 3.418 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.987 4.164 1.984 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.458 6.852 1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.116 5.738 0.307 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -11.786 6.264 0.624 1.00 0.00 H new ATOM 850 N GLU A 53 -13.814 1.614 0.316 1.00 0.00 N ATOM 851 CA GLU A 53 -14.261 0.405 -0.369 1.00 0.00 C ATOM 852 C GLU A 53 -15.300 0.749 -1.428 1.00 0.00 C ATOM 853 O GLU A 53 -15.275 0.217 -2.536 1.00 0.00 O ATOM 854 CB GLU A 53 -14.857 -0.597 0.619 1.00 0.00 C ATOM 855 CG GLU A 53 -15.295 -1.896 -0.039 1.00 0.00 C ATOM 856 CD GLU A 53 -16.015 -2.823 0.913 1.00 0.00 C ATOM 857 OE1 GLU A 53 -15.349 -3.450 1.759 1.00 0.00 O ATOM 858 OE2 GLU A 53 -17.256 -2.930 0.822 1.00 0.00 O ATOM 0 H GLU A 53 -13.987 1.619 1.321 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.392 -0.047 -0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -14.120 -0.818 1.391 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -15.714 -0.142 1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -15.949 -1.669 -0.881 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.420 -2.406 -0.443 1.00 0.00 H new ATOM 865 N SER A 54 -16.209 1.647 -1.079 1.00 0.00 N ATOM 866 CA SER A 54 -17.244 2.091 -1.997 1.00 0.00 C ATOM 867 C SER A 54 -16.620 2.713 -3.249 1.00 0.00 C ATOM 868 O SER A 54 -17.056 2.454 -4.372 1.00 0.00 O ATOM 869 CB SER A 54 -18.161 3.099 -1.294 1.00 0.00 C ATOM 870 OG SER A 54 -19.223 3.514 -2.137 1.00 0.00 O ATOM 0 H SER A 54 -16.249 2.085 -0.159 1.00 0.00 H new ATOM 0 HA SER A 54 -17.837 1.230 -2.306 1.00 0.00 H new ATOM 0 HB2 SER A 54 -18.569 2.651 -0.388 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.579 3.968 -0.986 1.00 0.00 H new ATOM 0 HG SER A 54 -19.789 4.155 -1.658 1.00 0.00 H new ATOM 876 N GLN A 55 -15.576 3.504 -3.052 1.00 0.00 N ATOM 877 CA GLN A 55 -14.927 4.202 -4.154 1.00 0.00 C ATOM 878 C GLN A 55 -14.135 3.251 -5.046 1.00 0.00 C ATOM 879 O GLN A 55 -14.166 3.378 -6.270 1.00 0.00 O ATOM 880 CB GLN A 55 -14.029 5.311 -3.612 1.00 0.00 C ATOM 881 CG GLN A 55 -14.705 6.675 -3.561 1.00 0.00 C ATOM 882 CD GLN A 55 -16.202 6.592 -3.316 1.00 0.00 C ATOM 883 OE1 GLN A 55 -16.995 6.543 -4.256 1.00 0.00 O ATOM 884 NE2 GLN A 55 -16.598 6.562 -2.057 1.00 0.00 N ATOM 0 H GLN A 55 -15.159 3.679 -2.138 1.00 0.00 H new ATOM 0 HA GLN A 55 -15.706 4.645 -4.774 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -13.698 5.041 -2.609 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -13.137 5.380 -4.234 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -14.247 7.271 -2.772 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -14.526 7.198 -4.501 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -15.910 6.605 -1.305 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -17.592 6.496 -1.836 1.00 0.00 H new ATOM 893 N VAL A 56 -13.433 2.297 -4.446 1.00 0.00 N ATOM 894 CA VAL A 56 -12.657 1.340 -5.227 1.00 0.00 C ATOM 895 C VAL A 56 -13.589 0.354 -5.932 1.00 0.00 C ATOM 896 O VAL A 56 -13.289 -0.134 -7.021 1.00 0.00 O ATOM 897 CB VAL A 56 -11.617 0.584 -4.358 1.00 0.00 C ATOM 898 CG1 VAL A 56 -12.287 -0.338 -3.350 1.00 0.00 C ATOM 899 CG2 VAL A 56 -10.645 -0.191 -5.236 1.00 0.00 C ATOM 0 H VAL A 56 -13.384 2.165 -3.436 1.00 0.00 H new ATOM 0 HA VAL A 56 -12.100 1.902 -5.976 1.00 0.00 H new ATOM 0 HB VAL A 56 -11.057 1.330 -3.795 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.525 -0.849 -2.761 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -12.924 0.248 -2.688 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -12.892 -1.075 -3.877 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.924 -0.714 -4.607 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -11.195 -0.915 -5.837 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -10.118 0.500 -5.894 1.00 0.00 H new ATOM 909 N ARG A 57 -14.744 0.100 -5.322 1.00 0.00 N ATOM 910 CA ARG A 57 -15.755 -0.773 -5.910 1.00 0.00 C ATOM 911 C ARG A 57 -16.349 -0.130 -7.161 1.00 0.00 C ATOM 912 O ARG A 57 -16.698 -0.815 -8.125 1.00 0.00 O ATOM 913 CB ARG A 57 -16.860 -1.057 -4.886 1.00 0.00 C ATOM 914 CG ARG A 57 -17.875 -2.091 -5.345 1.00 0.00 C ATOM 915 CD ARG A 57 -19.010 -2.250 -4.344 1.00 0.00 C ATOM 916 NE ARG A 57 -18.548 -2.695 -3.026 1.00 0.00 N ATOM 917 CZ ARG A 57 -18.839 -3.887 -2.503 1.00 0.00 C ATOM 918 NH1 ARG A 57 -19.474 -4.797 -3.233 1.00 0.00 N ATOM 919 NH2 ARG A 57 -18.477 -4.184 -1.258 1.00 0.00 N ATOM 0 H ARG A 57 -15.003 0.489 -4.416 1.00 0.00 H new ATOM 0 HA ARG A 57 -15.284 -1.714 -6.194 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -16.402 -1.399 -3.958 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -17.381 -0.126 -4.661 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -18.282 -1.797 -6.312 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -17.378 -3.051 -5.487 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -19.531 -1.299 -4.239 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -19.732 -2.968 -4.732 1.00 0.00 H new ATOM 0 HE ARG A 57 -17.971 -2.057 -2.478 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -19.740 -4.585 -4.195 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -19.696 -5.708 -2.832 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -17.973 -3.498 -0.696 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -18.703 -5.098 -0.865 1.00 0.00 H new ATOM 933 N ASN A 58 -16.445 1.195 -7.139 1.00 0.00 N ATOM 934 CA ASN A 58 -16.980 1.950 -8.268 1.00 0.00 C ATOM 935 C ASN A 58 -15.882 2.292 -9.268 1.00 0.00 C ATOM 936 O ASN A 58 -16.123 2.998 -10.248 1.00 0.00 O ATOM 937 CB ASN A 58 -17.645 3.243 -7.784 1.00 0.00 C ATOM 938 CG ASN A 58 -19.062 3.032 -7.279 1.00 0.00 C ATOM 939 OD1 ASN A 58 -20.020 3.109 -8.047 1.00 0.00 O ATOM 940 ND2 ASN A 58 -19.211 2.780 -5.988 1.00 0.00 N ATOM 0 H ASN A 58 -16.158 1.771 -6.348 1.00 0.00 H new ATOM 0 HA ASN A 58 -17.723 1.323 -8.761 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -17.043 3.678 -6.986 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -17.661 3.964 -8.601 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -20.144 2.642 -5.600 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -18.393 2.723 -5.382 1.00 0.00 H new ATOM 947 N GLY A 59 -14.671 1.806 -9.008 1.00 0.00 N ATOM 948 CA GLY A 59 -13.549 2.079 -9.893 1.00 0.00 C ATOM 949 C GLY A 59 -13.184 3.551 -9.930 1.00 0.00 C ATOM 950 O GLY A 59 -12.570 4.027 -10.886 1.00 0.00 O ATOM 0 H GLY A 59 -14.446 1.227 -8.199 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.684 1.501 -9.567 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.795 1.743 -10.900 1.00 0.00 H new ATOM 954 N ASP A 60 -13.564 4.271 -8.882 1.00 0.00 N ATOM 955 CA ASP A 60 -13.311 5.704 -8.799 1.00 0.00 C ATOM 956 C ASP A 60 -11.868 5.947 -8.390 1.00 0.00 C ATOM 957 O ASP A 60 -11.203 6.851 -8.897 1.00 0.00 O ATOM 958 CB ASP A 60 -14.276 6.355 -7.804 1.00 0.00 C ATOM 959 CG ASP A 60 -14.139 7.864 -7.740 1.00 0.00 C ATOM 960 OD1 ASP A 60 -14.095 8.511 -8.808 1.00 0.00 O ATOM 961 OD2 ASP A 60 -14.117 8.412 -6.619 1.00 0.00 O ATOM 0 H ASP A 60 -14.051 3.884 -8.074 1.00 0.00 H new ATOM 0 HA ASP A 60 -13.477 6.156 -9.777 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -15.299 6.101 -8.081 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -14.101 5.938 -6.812 1.00 0.00 H new ATOM 966 N ILE A 61 -11.382 5.119 -7.481 1.00 0.00 N ATOM 967 CA ILE A 61 -9.980 5.150 -7.100 1.00 0.00 C ATOM 968 C ILE A 61 -9.308 3.847 -7.514 1.00 0.00 C ATOM 969 O ILE A 61 -9.884 2.766 -7.371 1.00 0.00 O ATOM 970 CB ILE A 61 -9.785 5.385 -5.583 1.00 0.00 C ATOM 971 CG1 ILE A 61 -10.512 4.313 -4.766 1.00 0.00 C ATOM 972 CG2 ILE A 61 -10.267 6.778 -5.197 1.00 0.00 C ATOM 973 CD1 ILE A 61 -10.308 4.434 -3.270 1.00 0.00 C ATOM 0 H ILE A 61 -11.938 4.417 -6.993 1.00 0.00 H new ATOM 0 HA ILE A 61 -9.519 5.991 -7.618 1.00 0.00 H new ATOM 0 HB ILE A 61 -8.721 5.313 -5.358 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -11.579 4.367 -4.982 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -10.171 3.330 -5.090 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -10.124 6.929 -4.127 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -9.697 7.526 -5.749 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -11.325 6.877 -5.439 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -10.855 3.639 -2.763 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -9.246 4.348 -3.039 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -10.676 5.402 -2.930 1.00 0.00 H new ATOM 985 N SER A 62 -8.104 3.955 -8.053 1.00 0.00 N ATOM 986 CA SER A 62 -7.358 2.788 -8.500 1.00 0.00 C ATOM 987 C SER A 62 -6.833 2.009 -7.298 1.00 0.00 C ATOM 988 O SER A 62 -6.809 2.526 -6.184 1.00 0.00 O ATOM 989 CB SER A 62 -6.198 3.235 -9.389 1.00 0.00 C ATOM 990 OG SER A 62 -6.631 4.212 -10.319 1.00 0.00 O ATOM 0 H SER A 62 -7.620 4.842 -8.192 1.00 0.00 H new ATOM 0 HA SER A 62 -8.017 2.136 -9.073 1.00 0.00 H new ATOM 0 HB2 SER A 62 -5.396 3.642 -8.773 1.00 0.00 H new ATOM 0 HB3 SER A 62 -5.788 2.376 -9.920 1.00 0.00 H new ATOM 0 HG SER A 62 -6.591 5.099 -9.904 1.00 0.00 H new ATOM 996 N MET A 63 -6.404 0.771 -7.524 1.00 0.00 N ATOM 997 CA MET A 63 -5.876 -0.060 -6.444 1.00 0.00 C ATOM 998 C MET A 63 -4.638 0.590 -5.832 1.00 0.00 C ATOM 999 O MET A 63 -4.485 0.625 -4.615 1.00 0.00 O ATOM 1000 CB MET A 63 -5.543 -1.461 -6.956 1.00 0.00 C ATOM 1001 CG MET A 63 -5.068 -2.415 -5.870 1.00 0.00 C ATOM 1002 SD MET A 63 -6.269 -2.604 -4.534 1.00 0.00 S ATOM 1003 CE MET A 63 -7.699 -3.206 -5.429 1.00 0.00 C ATOM 0 H MET A 63 -6.411 0.322 -8.440 1.00 0.00 H new ATOM 0 HA MET A 63 -6.641 -0.149 -5.673 1.00 0.00 H new ATOM 0 HB2 MET A 63 -6.427 -1.882 -7.435 1.00 0.00 H new ATOM 0 HB3 MET A 63 -4.771 -1.384 -7.722 1.00 0.00 H new ATOM 0 HG2 MET A 63 -4.866 -3.391 -6.312 1.00 0.00 H new ATOM 0 HG3 MET A 63 -4.127 -2.051 -5.458 1.00 0.00 H new ATOM 0 HE1 MET A 63 -8.406 -3.650 -4.728 1.00 0.00 H new ATOM 0 HE2 MET A 63 -8.177 -2.377 -5.951 1.00 0.00 H new ATOM 0 HE3 MET A 63 -7.385 -3.958 -6.153 1.00 0.00 H new ATOM 1013 N LYS A 64 -3.772 1.115 -6.692 1.00 0.00 N ATOM 1014 CA LYS A 64 -2.592 1.859 -6.256 1.00 0.00 C ATOM 1015 C LYS A 64 -2.987 3.007 -5.321 1.00 0.00 C ATOM 1016 O LYS A 64 -2.315 3.270 -4.325 1.00 0.00 O ATOM 1017 CB LYS A 64 -1.843 2.391 -7.486 1.00 0.00 C ATOM 1018 CG LYS A 64 -0.649 3.278 -7.165 1.00 0.00 C ATOM 1019 CD LYS A 64 0.121 3.652 -8.425 1.00 0.00 C ATOM 1020 CE LYS A 64 1.153 4.734 -8.147 1.00 0.00 C ATOM 1021 NZ LYS A 64 2.000 5.028 -9.336 1.00 0.00 N ATOM 0 H LYS A 64 -3.865 1.039 -7.705 1.00 0.00 H new ATOM 0 HA LYS A 64 -1.935 1.191 -5.699 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -1.501 1.544 -8.081 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -2.541 2.954 -8.105 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -0.991 4.183 -6.664 1.00 0.00 H new ATOM 0 HG3 LYS A 64 0.014 2.761 -6.472 1.00 0.00 H new ATOM 0 HD2 LYS A 64 0.618 2.768 -8.825 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -0.575 3.999 -9.188 1.00 0.00 H new ATOM 0 HE2 LYS A 64 0.645 5.645 -7.832 1.00 0.00 H new ATOM 0 HE3 LYS A 64 1.789 4.422 -7.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.988 4.777 -9.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 1.664 4.472 -10.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.941 6.041 -9.563 1.00 0.00 H new ATOM 1035 N GLU A 65 -4.095 3.669 -5.635 1.00 0.00 N ATOM 1036 CA GLU A 65 -4.588 4.773 -4.821 1.00 0.00 C ATOM 1037 C GLU A 65 -5.222 4.251 -3.538 1.00 0.00 C ATOM 1038 O GLU A 65 -5.035 4.819 -2.465 1.00 0.00 O ATOM 1039 CB GLU A 65 -5.613 5.590 -5.603 1.00 0.00 C ATOM 1040 CG GLU A 65 -5.075 6.150 -6.906 1.00 0.00 C ATOM 1041 CD GLU A 65 -6.132 6.900 -7.688 1.00 0.00 C ATOM 1042 OE1 GLU A 65 -6.343 8.100 -7.413 1.00 0.00 O ATOM 1043 OE2 GLU A 65 -6.763 6.285 -8.575 1.00 0.00 O ATOM 0 H GLU A 65 -4.670 3.459 -6.451 1.00 0.00 H new ATOM 0 HA GLU A 65 -3.742 5.410 -4.563 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -6.479 4.963 -5.816 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -5.961 6.413 -4.979 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -4.240 6.818 -6.695 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -4.685 5.335 -7.516 1.00 0.00 H new ATOM 1050 N PHE A 66 -5.974 3.164 -3.667 1.00 0.00 N ATOM 1051 CA PHE A 66 -6.638 2.534 -2.533 1.00 0.00 C ATOM 1052 C PHE A 66 -5.612 2.094 -1.490 1.00 0.00 C ATOM 1053 O PHE A 66 -5.741 2.408 -0.307 1.00 0.00 O ATOM 1054 CB PHE A 66 -7.462 1.338 -3.022 1.00 0.00 C ATOM 1055 CG PHE A 66 -8.273 0.656 -1.956 1.00 0.00 C ATOM 1056 CD1 PHE A 66 -9.278 1.336 -1.287 1.00 0.00 C ATOM 1057 CD2 PHE A 66 -8.040 -0.672 -1.636 1.00 0.00 C ATOM 1058 CE1 PHE A 66 -10.034 0.704 -0.319 1.00 0.00 C ATOM 1059 CE2 PHE A 66 -8.791 -1.307 -0.667 1.00 0.00 C ATOM 1060 CZ PHE A 66 -9.789 -0.617 -0.008 1.00 0.00 C ATOM 0 H PHE A 66 -6.140 2.696 -4.558 1.00 0.00 H new ATOM 0 HA PHE A 66 -7.306 3.255 -2.063 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -8.134 1.676 -3.811 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -6.787 0.608 -3.469 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.472 2.371 -1.525 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.262 -1.217 -2.150 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -10.816 1.244 0.194 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -8.598 -2.342 -0.425 1.00 0.00 H new ATOM 0 HZ PHE A 66 -10.377 -1.112 0.751 1.00 0.00 H new ATOM 1070 N VAL A 67 -4.585 1.382 -1.945 1.00 0.00 N ATOM 1071 CA VAL A 67 -3.504 0.939 -1.072 1.00 0.00 C ATOM 1072 C VAL A 67 -2.787 2.135 -0.452 1.00 0.00 C ATOM 1073 O VAL A 67 -2.485 2.139 0.745 1.00 0.00 O ATOM 1074 CB VAL A 67 -2.488 0.063 -1.840 1.00 0.00 C ATOM 1075 CG1 VAL A 67 -1.303 -0.309 -0.959 1.00 0.00 C ATOM 1076 CG2 VAL A 67 -3.168 -1.189 -2.371 1.00 0.00 C ATOM 0 H VAL A 67 -4.479 1.099 -2.919 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.949 0.339 -0.278 1.00 0.00 H new ATOM 0 HB VAL A 67 -2.110 0.644 -2.681 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.606 -0.925 -1.527 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.798 0.598 -0.627 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -1.656 -0.867 -0.091 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -2.441 -1.797 -2.910 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -3.575 -1.763 -1.538 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -3.976 -0.906 -3.046 1.00 0.00 H new ATOM 1086 N ARG A 68 -2.531 3.152 -1.275 1.00 0.00 N ATOM 1087 CA ARG A 68 -1.892 4.378 -0.812 1.00 0.00 C ATOM 1088 C ARG A 68 -2.691 4.993 0.330 1.00 0.00 C ATOM 1089 O ARG A 68 -2.151 5.257 1.402 1.00 0.00 O ATOM 1090 CB ARG A 68 -1.771 5.384 -1.959 1.00 0.00 C ATOM 1091 CG ARG A 68 -1.031 6.657 -1.584 1.00 0.00 C ATOM 1092 CD ARG A 68 -1.120 7.690 -2.692 1.00 0.00 C ATOM 1093 NE ARG A 68 -0.262 8.849 -2.440 1.00 0.00 N ATOM 1094 CZ ARG A 68 -0.412 10.036 -3.026 1.00 0.00 C ATOM 1095 NH1 ARG A 68 -1.477 10.281 -3.780 1.00 0.00 N ATOM 1096 NH2 ARG A 68 0.497 10.984 -2.823 1.00 0.00 N ATOM 0 H ARG A 68 -2.759 3.148 -2.269 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.893 4.129 -0.453 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -1.256 4.908 -2.794 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.770 5.645 -2.308 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -1.451 7.068 -0.666 1.00 0.00 H new ATOM 0 HG3 ARG A 68 0.015 6.427 -1.381 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -0.837 7.230 -3.639 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -2.153 8.021 -2.795 1.00 0.00 H new ATOM 0 HE ARG A 68 0.501 8.741 -1.772 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -2.185 9.559 -3.913 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -1.587 11.191 -4.226 1.00 0.00 H new ATOM 0 HH21 ARG A 68 1.301 10.800 -2.223 1.00 0.00 H new ATOM 0 HH22 ARG A 68 0.391 11.896 -3.267 1.00 0.00 H new ATOM 1110 N ARG A 69 -3.982 5.196 0.091 1.00 0.00 N ATOM 1111 CA ARG A 69 -4.868 5.788 1.085 1.00 0.00 C ATOM 1112 C ARG A 69 -4.886 4.975 2.376 1.00 0.00 C ATOM 1113 O ARG A 69 -4.791 5.537 3.466 1.00 0.00 O ATOM 1114 CB ARG A 69 -6.293 5.910 0.539 1.00 0.00 C ATOM 1115 CG ARG A 69 -6.469 7.011 -0.493 1.00 0.00 C ATOM 1116 CD ARG A 69 -7.924 7.121 -0.917 1.00 0.00 C ATOM 1117 NE ARG A 69 -8.190 8.302 -1.741 1.00 0.00 N ATOM 1118 CZ ARG A 69 -8.952 9.324 -1.341 1.00 0.00 C ATOM 1119 NH1 ARG A 69 -9.404 9.368 -0.089 1.00 0.00 N ATOM 1120 NH2 ARG A 69 -9.237 10.315 -2.174 1.00 0.00 N ATOM 0 H ARG A 69 -4.440 4.957 -0.789 1.00 0.00 H new ATOM 0 HA ARG A 69 -4.481 6.782 1.308 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -6.582 4.959 0.093 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -6.975 6.093 1.370 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -6.133 7.962 -0.079 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -5.846 6.804 -1.363 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -8.204 6.226 -1.473 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -8.555 7.155 -0.029 1.00 0.00 H new ATOM 0 HE ARG A 69 -7.771 8.347 -2.670 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -9.168 8.621 0.565 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -9.986 10.148 0.216 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -8.874 10.300 -3.127 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -9.819 11.092 -1.862 1.00 0.00 H new ATOM 1134 N LEU A 70 -4.996 3.656 2.248 1.00 0.00 N ATOM 1135 CA LEU A 70 -5.077 2.776 3.412 1.00 0.00 C ATOM 1136 C LEU A 70 -3.852 2.925 4.310 1.00 0.00 C ATOM 1137 O LEU A 70 -3.973 3.175 5.510 1.00 0.00 O ATOM 1138 CB LEU A 70 -5.212 1.313 2.980 1.00 0.00 C ATOM 1139 CG LEU A 70 -6.515 0.946 2.268 1.00 0.00 C ATOM 1140 CD1 LEU A 70 -6.529 -0.534 1.925 1.00 0.00 C ATOM 1141 CD2 LEU A 70 -7.720 1.304 3.125 1.00 0.00 C ATOM 0 H LEU A 70 -5.031 3.172 1.351 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.962 3.070 3.976 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -4.379 1.070 2.320 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.113 0.682 3.864 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.573 1.520 1.343 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.462 -0.781 1.419 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -5.689 -0.764 1.270 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.446 -1.120 2.840 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.635 1.034 2.598 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.670 0.760 4.068 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.719 2.376 3.324 1.00 0.00 H new ATOM 1153 N ALA A 71 -2.674 2.789 3.720 1.00 0.00 N ATOM 1154 CA ALA A 71 -1.431 2.829 4.479 1.00 0.00 C ATOM 1155 C ALA A 71 -1.071 4.254 4.893 1.00 0.00 C ATOM 1156 O ALA A 71 -0.228 4.464 5.765 1.00 0.00 O ATOM 1157 CB ALA A 71 -0.310 2.200 3.670 1.00 0.00 C ATOM 0 H ALA A 71 -2.552 2.650 2.717 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.572 2.254 5.394 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.616 2.234 4.244 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -0.561 1.163 3.446 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -0.180 2.751 2.739 1.00 0.00 H new ATOM 1163 N LYS A 72 -1.716 5.231 4.272 1.00 0.00 N ATOM 1164 CA LYS A 72 -1.485 6.629 4.607 1.00 0.00 C ATOM 1165 C LYS A 72 -2.466 7.072 5.693 1.00 0.00 C ATOM 1166 O LYS A 72 -2.332 8.151 6.269 1.00 0.00 O ATOM 1167 CB LYS A 72 -1.650 7.501 3.361 1.00 0.00 C ATOM 1168 CG LYS A 72 -0.975 8.861 3.454 1.00 0.00 C ATOM 1169 CD LYS A 72 -1.278 9.710 2.227 1.00 0.00 C ATOM 1170 CE LYS A 72 -0.428 10.971 2.188 1.00 0.00 C ATOM 1171 NZ LYS A 72 1.000 10.668 1.910 1.00 0.00 N ATOM 0 H LYS A 72 -2.403 5.082 3.533 1.00 0.00 H new ATOM 0 HA LYS A 72 -0.468 6.741 4.982 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.246 6.966 2.502 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -2.714 7.648 3.173 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.315 9.379 4.351 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.103 8.729 3.552 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.099 9.123 1.326 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.333 9.983 2.225 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.812 11.644 1.422 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.509 11.493 3.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 1.483 11.533 1.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.455 10.316 2.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.063 9.943 1.167 1.00 0.00 H new ATOM 1185 N SER A 73 -3.451 6.226 5.966 1.00 0.00 N ATOM 1186 CA SER A 73 -4.469 6.530 6.963 1.00 0.00 C ATOM 1187 C SER A 73 -3.896 6.458 8.376 1.00 0.00 C ATOM 1188 O SER A 73 -2.972 5.684 8.641 1.00 0.00 O ATOM 1189 CB SER A 73 -5.651 5.569 6.825 1.00 0.00 C ATOM 1190 OG SER A 73 -6.322 5.765 5.592 1.00 0.00 O ATOM 0 H SER A 73 -3.567 5.321 5.509 1.00 0.00 H new ATOM 0 HA SER A 73 -4.816 7.548 6.789 1.00 0.00 H new ATOM 0 HB2 SER A 73 -5.298 4.540 6.892 1.00 0.00 H new ATOM 0 HB3 SER A 73 -6.347 5.721 7.650 1.00 0.00 H new ATOM 0 HG SER A 73 -5.679 5.697 4.855 1.00 0.00 H new ATOM 1196 N PRO A 74 -4.449 7.266 9.302 1.00 0.00 N ATOM 1197 CA PRO A 74 -3.998 7.319 10.702 1.00 0.00 C ATOM 1198 C PRO A 74 -3.956 5.946 11.371 1.00 0.00 C ATOM 1199 O PRO A 74 -3.195 5.728 12.313 1.00 0.00 O ATOM 1200 CB PRO A 74 -5.044 8.206 11.379 1.00 0.00 C ATOM 1201 CG PRO A 74 -5.573 9.066 10.285 1.00 0.00 C ATOM 1202 CD PRO A 74 -5.556 8.212 9.050 1.00 0.00 C ATOM 0 HA PRO A 74 -2.978 7.695 10.777 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -5.836 7.610 11.832 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -4.601 8.805 12.175 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -6.583 9.408 10.510 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.957 9.956 10.154 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -6.504 7.693 8.908 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -5.380 8.806 8.153 1.00 0.00 H new ATOM 1210 N LEU A 75 -4.773 5.024 10.872 1.00 0.00 N ATOM 1211 CA LEU A 75 -4.819 3.668 11.402 1.00 0.00 C ATOM 1212 C LEU A 75 -3.476 2.961 11.215 1.00 0.00 C ATOM 1213 O LEU A 75 -2.949 2.364 12.151 1.00 0.00 O ATOM 1214 CB LEU A 75 -5.935 2.870 10.720 1.00 0.00 C ATOM 1215 CG LEU A 75 -6.099 1.426 11.206 1.00 0.00 C ATOM 1216 CD1 LEU A 75 -6.423 1.395 12.691 1.00 0.00 C ATOM 1217 CD2 LEU A 75 -7.182 0.718 10.406 1.00 0.00 C ATOM 0 H LEU A 75 -5.415 5.194 10.098 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.027 3.728 12.470 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.878 3.395 10.869 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.745 2.855 9.647 1.00 0.00 H new ATOM 0 HG LEU A 75 -5.157 0.900 11.052 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -6.536 0.361 13.017 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.614 1.866 13.250 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -7.352 1.936 12.872 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -7.287 -0.307 10.763 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -8.129 1.244 10.530 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.908 0.709 9.351 1.00 0.00 H new ATOM 1229 N TYR A 76 -2.915 3.061 10.012 1.00 0.00 N ATOM 1230 CA TYR A 76 -1.649 2.404 9.702 1.00 0.00 C ATOM 1231 C TYR A 76 -0.484 3.244 10.216 1.00 0.00 C ATOM 1232 O TYR A 76 0.610 2.741 10.449 1.00 0.00 O ATOM 1233 CB TYR A 76 -1.517 2.170 8.192 1.00 0.00 C ATOM 1234 CG TYR A 76 -0.391 1.231 7.818 1.00 0.00 C ATOM 1235 CD1 TYR A 76 -0.543 -0.144 7.943 1.00 0.00 C ATOM 1236 CD2 TYR A 76 0.823 1.716 7.345 1.00 0.00 C ATOM 1237 CE1 TYR A 76 0.480 -1.009 7.607 1.00 0.00 C ATOM 1238 CE2 TYR A 76 1.851 0.858 7.007 1.00 0.00 C ATOM 1239 CZ TYR A 76 1.674 -0.503 7.139 1.00 0.00 C ATOM 1240 OH TYR A 76 2.700 -1.362 6.806 1.00 0.00 O ATOM 0 H TYR A 76 -3.317 3.590 9.238 1.00 0.00 H new ATOM 0 HA TYR A 76 -1.629 1.434 10.200 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.456 1.767 7.812 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.359 3.128 7.697 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -1.477 -0.544 8.309 1.00 0.00 H new ATOM 0 HD2 TYR A 76 0.965 2.782 7.240 1.00 0.00 H new ATOM 0 HE1 TYR A 76 0.345 -2.076 7.710 1.00 0.00 H new ATOM 0 HE2 TYR A 76 2.788 1.251 6.641 1.00 0.00 H new ATOM 0 HH TYR A 76 2.345 -2.269 6.698 1.00 0.00 H new ATOM 1250 N ARG A 77 -0.731 4.536 10.380 1.00 0.00 N ATOM 1251 CA ARG A 77 0.253 5.433 10.973 1.00 0.00 C ATOM 1252 C ARG A 77 0.404 5.138 12.462 1.00 0.00 C ATOM 1253 O ARG A 77 1.420 5.468 13.074 1.00 0.00 O ATOM 1254 CB ARG A 77 -0.160 6.889 10.755 1.00 0.00 C ATOM 1255 CG ARG A 77 -0.177 7.296 9.291 1.00 0.00 C ATOM 1256 CD ARG A 77 -0.861 8.636 9.092 1.00 0.00 C ATOM 1257 NE ARG A 77 -0.172 9.722 9.785 1.00 0.00 N ATOM 1258 CZ ARG A 77 -0.766 10.850 10.177 1.00 0.00 C ATOM 1259 NH1 ARG A 77 -2.063 11.036 9.959 1.00 0.00 N ATOM 1260 NH2 ARG A 77 -0.057 11.794 10.778 1.00 0.00 N ATOM 0 H ARG A 77 -1.605 4.988 10.111 1.00 0.00 H new ATOM 0 HA ARG A 77 1.215 5.270 10.488 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -1.151 7.046 11.180 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.526 7.539 11.298 1.00 0.00 H new ATOM 0 HG2 ARG A 77 0.845 7.349 8.916 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -0.692 6.534 8.707 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -0.909 8.861 8.027 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -1.888 8.573 9.451 1.00 0.00 H new ATOM 0 HE ARG A 77 0.823 9.611 9.981 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -2.610 10.314 9.490 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -2.512 11.901 10.261 1.00 0.00 H new ATOM 0 HH21 ARG A 77 0.941 11.657 10.940 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -0.509 12.658 11.079 1.00 0.00 H new ATOM 1274 N LYS A 78 -0.632 4.535 13.035 1.00 0.00 N ATOM 1275 CA LYS A 78 -0.613 4.124 14.432 1.00 0.00 C ATOM 1276 C LYS A 78 -0.166 2.668 14.560 1.00 0.00 C ATOM 1277 O LYS A 78 0.885 2.373 15.137 1.00 0.00 O ATOM 1278 CB LYS A 78 -2.003 4.285 15.050 1.00 0.00 C ATOM 1279 CG LYS A 78 -2.065 3.927 16.528 1.00 0.00 C ATOM 1280 CD LYS A 78 -3.502 3.788 17.007 1.00 0.00 C ATOM 1281 CE LYS A 78 -4.305 5.056 16.771 1.00 0.00 C ATOM 1282 NZ LYS A 78 -5.710 4.912 17.229 1.00 0.00 N ATOM 0 H LYS A 78 -1.502 4.319 12.548 1.00 0.00 H new ATOM 0 HA LYS A 78 0.095 4.760 14.963 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -2.330 5.317 14.922 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -2.708 3.658 14.504 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -1.531 2.993 16.700 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -1.558 4.696 17.111 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -3.978 2.956 16.489 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -3.508 3.547 18.070 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -3.835 5.887 17.297 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -4.292 5.302 15.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.226 5.798 17.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -6.167 4.135 16.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -5.723 4.702 18.248 1.00 0.00 H new ATOM 1296 N GLN A 79 -0.971 1.761 14.013 1.00 0.00 N ATOM 1297 CA GLN A 79 -0.697 0.337 14.105 1.00 0.00 C ATOM 1298 C GLN A 79 0.369 -0.055 13.093 1.00 0.00 C ATOM 1299 O GLN A 79 0.414 0.490 11.996 1.00 0.00 O ATOM 1300 CB GLN A 79 -1.975 -0.482 13.884 1.00 0.00 C ATOM 1301 CG GLN A 79 -3.085 -0.163 14.877 1.00 0.00 C ATOM 1302 CD GLN A 79 -4.273 -1.104 14.769 1.00 0.00 C ATOM 1303 OE1 GLN A 79 -5.412 -0.714 15.033 1.00 0.00 O ATOM 1304 NE2 GLN A 79 -4.019 -2.352 14.392 1.00 0.00 N ATOM 0 H GLN A 79 -1.822 1.992 13.500 1.00 0.00 H new ATOM 0 HA GLN A 79 -0.328 0.121 15.108 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -2.341 -0.302 12.873 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -1.733 -1.543 13.951 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -2.683 -0.210 15.889 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -3.424 0.860 14.716 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -3.062 -2.637 14.182 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -4.781 -3.026 14.312 1.00 0.00 H new ATOM 1313 N PHE A 80 1.221 -0.993 13.490 1.00 0.00 N ATOM 1314 CA PHE A 80 2.359 -1.442 12.678 1.00 0.00 C ATOM 1315 C PHE A 80 3.477 -0.399 12.643 1.00 0.00 C ATOM 1316 O PHE A 80 4.475 -0.583 11.945 1.00 0.00 O ATOM 1317 CB PHE A 80 1.938 -1.792 11.243 1.00 0.00 C ATOM 1318 CG PHE A 80 1.142 -3.061 11.118 1.00 0.00 C ATOM 1319 CD1 PHE A 80 1.782 -4.290 11.087 1.00 0.00 C ATOM 1320 CD2 PHE A 80 -0.239 -3.025 11.013 1.00 0.00 C ATOM 1321 CE1 PHE A 80 1.060 -5.459 10.953 1.00 0.00 C ATOM 1322 CE2 PHE A 80 -0.967 -4.192 10.882 1.00 0.00 C ATOM 1323 CZ PHE A 80 -0.316 -5.410 10.851 1.00 0.00 C ATOM 0 H PHE A 80 1.146 -1.470 14.389 1.00 0.00 H new ATOM 0 HA PHE A 80 2.737 -2.345 13.158 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.350 -0.968 10.839 1.00 0.00 H new ATOM 0 HB3 PHE A 80 2.833 -1.877 10.626 1.00 0.00 H new ATOM 0 HD1 PHE A 80 2.858 -4.334 11.169 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -0.752 -2.075 11.034 1.00 0.00 H new ATOM 0 HE1 PHE A 80 1.571 -6.410 10.928 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -2.043 -4.152 10.804 1.00 0.00 H new ATOM 0 HZ PHE A 80 -0.883 -6.323 10.747 1.00 0.00 H new ATOM 1333 N PHE A 81 3.326 0.683 13.400 1.00 0.00 N ATOM 1334 CA PHE A 81 4.334 1.735 13.412 1.00 0.00 C ATOM 1335 C PHE A 81 4.719 2.146 14.830 1.00 0.00 C ATOM 1336 O PHE A 81 5.842 1.909 15.258 1.00 0.00 O ATOM 1337 CB PHE A 81 3.847 2.955 12.629 1.00 0.00 C ATOM 1338 CG PHE A 81 4.870 4.055 12.549 1.00 0.00 C ATOM 1339 CD1 PHE A 81 6.019 3.890 11.792 1.00 0.00 C ATOM 1340 CD2 PHE A 81 4.684 5.245 13.231 1.00 0.00 C ATOM 1341 CE1 PHE A 81 6.966 4.893 11.718 1.00 0.00 C ATOM 1342 CE2 PHE A 81 5.627 6.251 13.160 1.00 0.00 C ATOM 1343 CZ PHE A 81 6.770 6.075 12.403 1.00 0.00 C ATOM 0 H PHE A 81 2.524 0.853 14.007 1.00 0.00 H new ATOM 0 HA PHE A 81 5.224 1.330 12.931 1.00 0.00 H new ATOM 0 HB2 PHE A 81 3.575 2.646 11.620 1.00 0.00 H new ATOM 0 HB3 PHE A 81 2.942 3.342 13.098 1.00 0.00 H new ATOM 0 HD1 PHE A 81 6.176 2.967 11.254 1.00 0.00 H new ATOM 0 HD2 PHE A 81 3.793 5.388 13.824 1.00 0.00 H new ATOM 0 HE1 PHE A 81 7.858 4.752 11.125 1.00 0.00 H new ATOM 0 HE2 PHE A 81 5.472 7.176 13.696 1.00 0.00 H new ATOM 0 HZ PHE A 81 7.508 6.861 12.348 1.00 0.00 H new ATOM 1353 N GLU A 82 3.780 2.752 15.555 1.00 0.00 N ATOM 1354 CA GLU A 82 4.065 3.300 16.885 1.00 0.00 C ATOM 1355 C GLU A 82 4.657 2.267 17.856 1.00 0.00 C ATOM 1356 O GLU A 82 5.681 2.543 18.484 1.00 0.00 O ATOM 1357 CB GLU A 82 2.816 3.950 17.482 1.00 0.00 C ATOM 1358 CG GLU A 82 2.524 5.321 16.900 1.00 0.00 C ATOM 1359 CD GLU A 82 3.621 6.323 17.212 1.00 0.00 C ATOM 1360 OE1 GLU A 82 4.668 6.300 16.535 1.00 0.00 O ATOM 1361 OE2 GLU A 82 3.450 7.124 18.155 1.00 0.00 O ATOM 0 H GLU A 82 2.816 2.877 15.246 1.00 0.00 H new ATOM 0 HA GLU A 82 4.832 4.061 16.744 1.00 0.00 H new ATOM 0 HB2 GLU A 82 1.958 3.299 17.312 1.00 0.00 H new ATOM 0 HB3 GLU A 82 2.940 4.039 18.561 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.407 5.238 15.819 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.577 5.687 17.296 1.00 0.00 H new ATOM 1368 N PRO A 83 4.050 1.066 18.005 1.00 0.00 N ATOM 1369 CA PRO A 83 4.583 0.038 18.908 1.00 0.00 C ATOM 1370 C PRO A 83 5.836 -0.651 18.358 1.00 0.00 C ATOM 1371 O PRO A 83 6.308 -1.643 18.914 1.00 0.00 O ATOM 1372 CB PRO A 83 3.432 -0.960 19.026 1.00 0.00 C ATOM 1373 CG PRO A 83 2.674 -0.818 17.753 1.00 0.00 C ATOM 1374 CD PRO A 83 2.801 0.624 17.347 1.00 0.00 C ATOM 0 HA PRO A 83 4.900 0.465 19.859 1.00 0.00 H new ATOM 0 HB2 PRO A 83 3.802 -1.977 19.155 1.00 0.00 H new ATOM 0 HB3 PRO A 83 2.803 -0.738 19.888 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.078 -1.476 16.984 1.00 0.00 H new ATOM 0 HG3 PRO A 83 1.628 -1.093 17.890 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.860 0.731 16.264 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.944 1.210 17.679 1.00 0.00 H new ATOM 1382 N PHE A 84 6.374 -0.116 17.270 1.00 0.00 N ATOM 1383 CA PHE A 84 7.562 -0.676 16.646 1.00 0.00 C ATOM 1384 C PHE A 84 8.609 0.410 16.437 1.00 0.00 C ATOM 1385 O PHE A 84 8.297 1.600 16.446 1.00 0.00 O ATOM 1386 CB PHE A 84 7.218 -1.315 15.293 1.00 0.00 C ATOM 1387 CG PHE A 84 6.273 -2.482 15.382 1.00 0.00 C ATOM 1388 CD1 PHE A 84 6.755 -3.765 15.585 1.00 0.00 C ATOM 1389 CD2 PHE A 84 4.905 -2.297 15.261 1.00 0.00 C ATOM 1390 CE1 PHE A 84 5.891 -4.840 15.663 1.00 0.00 C ATOM 1391 CE2 PHE A 84 4.037 -3.368 15.338 1.00 0.00 C ATOM 1392 CZ PHE A 84 4.530 -4.642 15.543 1.00 0.00 C ATOM 0 H PHE A 84 6.003 0.710 16.800 1.00 0.00 H new ATOM 0 HA PHE A 84 7.960 -1.444 17.309 1.00 0.00 H new ATOM 0 HB2 PHE A 84 6.779 -0.555 14.647 1.00 0.00 H new ATOM 0 HB3 PHE A 84 8.140 -1.645 14.815 1.00 0.00 H new ATOM 0 HD1 PHE A 84 7.818 -3.926 15.683 1.00 0.00 H new ATOM 0 HD2 PHE A 84 4.513 -1.303 15.105 1.00 0.00 H new ATOM 0 HE1 PHE A 84 6.280 -5.835 15.818 1.00 0.00 H new ATOM 0 HE2 PHE A 84 2.973 -3.210 15.238 1.00 0.00 H new ATOM 0 HZ PHE A 84 3.853 -5.481 15.609 1.00 0.00 H new ATOM 1402 N ILE A 85 9.852 -0.004 16.265 1.00 0.00 N ATOM 1403 CA ILE A 85 10.915 0.921 15.913 1.00 0.00 C ATOM 1404 C ILE A 85 10.902 1.149 14.397 1.00 0.00 C ATOM 1405 O ILE A 85 10.416 0.296 13.651 1.00 0.00 O ATOM 1406 CB ILE A 85 12.296 0.388 16.381 1.00 0.00 C ATOM 1407 CG1 ILE A 85 13.418 1.385 16.061 1.00 0.00 C ATOM 1408 CG2 ILE A 85 12.584 -0.969 15.757 1.00 0.00 C ATOM 1409 CD1 ILE A 85 14.782 0.948 16.553 1.00 0.00 C ATOM 0 H ILE A 85 10.150 -0.974 16.363 1.00 0.00 H new ATOM 0 HA ILE A 85 10.745 1.870 16.421 1.00 0.00 H new ATOM 0 HB ILE A 85 12.260 0.269 17.464 1.00 0.00 H new ATOM 0 HG12 ILE A 85 13.462 1.534 14.982 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.173 2.349 16.507 1.00 0.00 H new ATOM 0 HG21 ILE A 85 13.556 -1.327 16.097 1.00 0.00 H new ATOM 0 HG22 ILE A 85 11.812 -1.678 16.056 1.00 0.00 H new ATOM 0 HG23 ILE A 85 12.591 -0.876 14.671 1.00 0.00 H new ATOM 0 HD11 ILE A 85 15.523 1.703 16.290 1.00 0.00 H new ATOM 0 HD12 ILE A 85 14.756 0.826 17.636 1.00 0.00 H new ATOM 0 HD13 ILE A 85 15.050 -0.001 16.088 1.00 0.00 H new ATOM 1421 N ASN A 86 11.412 2.295 13.951 1.00 0.00 N ATOM 1422 CA ASN A 86 11.404 2.657 12.525 1.00 0.00 C ATOM 1423 C ASN A 86 11.964 1.543 11.634 1.00 0.00 C ATOM 1424 O ASN A 86 11.454 1.298 10.543 1.00 0.00 O ATOM 1425 CB ASN A 86 12.197 3.948 12.292 1.00 0.00 C ATOM 1426 CG ASN A 86 11.398 5.205 12.592 1.00 0.00 C ATOM 1427 OD1 ASN A 86 10.739 5.755 11.712 1.00 0.00 O ATOM 1428 ND2 ASN A 86 11.447 5.666 13.832 1.00 0.00 N ATOM 0 H ASN A 86 11.840 2.996 14.556 1.00 0.00 H new ATOM 0 HA ASN A 86 10.361 2.811 12.248 1.00 0.00 H new ATOM 0 HB2 ASN A 86 13.090 3.936 12.917 1.00 0.00 H new ATOM 0 HB3 ASN A 86 12.533 3.978 11.256 1.00 0.00 H new ATOM 0 HD21 ASN A 86 10.926 6.506 14.085 1.00 0.00 H new ATOM 0 HD22 ASN A 86 12.005 5.181 14.535 1.00 0.00 H new ATOM 1435 N SER A 87 12.996 0.857 12.111 1.00 0.00 N ATOM 1436 CA SER A 87 13.635 -0.205 11.338 1.00 0.00 C ATOM 1437 C SER A 87 12.725 -1.430 11.206 1.00 0.00 C ATOM 1438 O SER A 87 12.835 -2.198 10.249 1.00 0.00 O ATOM 1439 CB SER A 87 14.957 -0.583 12.001 1.00 0.00 C ATOM 1440 OG SER A 87 14.811 -0.617 13.411 1.00 0.00 O ATOM 0 H SER A 87 13.409 1.016 13.030 1.00 0.00 H new ATOM 0 HA SER A 87 13.825 0.163 10.330 1.00 0.00 H new ATOM 0 HB2 SER A 87 15.287 -1.557 11.640 1.00 0.00 H new ATOM 0 HB3 SER A 87 15.728 0.137 11.726 1.00 0.00 H new ATOM 0 HG SER A 87 15.666 -0.862 13.823 1.00 0.00 H new ATOM 1446 N ARG A 88 11.816 -1.597 12.161 1.00 0.00 N ATOM 1447 CA ARG A 88 10.852 -2.691 12.120 1.00 0.00 C ATOM 1448 C ARG A 88 9.686 -2.338 11.214 1.00 0.00 C ATOM 1449 O ARG A 88 9.261 -3.147 10.386 1.00 0.00 O ATOM 1450 CB ARG A 88 10.333 -3.022 13.520 1.00 0.00 C ATOM 1451 CG ARG A 88 11.280 -3.879 14.343 1.00 0.00 C ATOM 1452 CD ARG A 88 11.536 -5.212 13.662 1.00 0.00 C ATOM 1453 NE ARG A 88 12.242 -6.152 14.526 1.00 0.00 N ATOM 1454 CZ ARG A 88 12.089 -7.473 14.459 1.00 0.00 C ATOM 1455 NH1 ARG A 88 11.259 -7.998 13.561 1.00 0.00 N ATOM 1456 NH2 ARG A 88 12.760 -8.262 15.290 1.00 0.00 N ATOM 0 H ARG A 88 11.727 -0.988 12.974 1.00 0.00 H new ATOM 0 HA ARG A 88 11.363 -3.568 11.723 1.00 0.00 H new ATOM 0 HB2 ARG A 88 10.143 -2.092 14.055 1.00 0.00 H new ATOM 0 HB3 ARG A 88 9.377 -3.539 13.429 1.00 0.00 H new ATOM 0 HG2 ARG A 88 12.223 -3.352 14.485 1.00 0.00 H new ATOM 0 HG3 ARG A 88 10.857 -4.047 15.333 1.00 0.00 H new ATOM 0 HD2 ARG A 88 10.586 -5.648 13.355 1.00 0.00 H new ATOM 0 HD3 ARG A 88 12.119 -5.048 12.756 1.00 0.00 H new ATOM 0 HE ARG A 88 12.889 -5.776 15.220 1.00 0.00 H new ATOM 0 HH11 ARG A 88 10.742 -7.389 12.927 1.00 0.00 H new ATOM 0 HH12 ARG A 88 11.140 -9.010 13.507 1.00 0.00 H new ATOM 0 HH21 ARG A 88 13.393 -7.856 15.980 1.00 0.00 H new ATOM 0 HH22 ARG A 88 12.643 -9.274 15.239 1.00 0.00 H new ATOM 1470 N ALA A 89 9.181 -1.120 11.370 1.00 0.00 N ATOM 1471 CA ALA A 89 8.061 -0.638 10.568 1.00 0.00 C ATOM 1472 C ALA A 89 8.439 -0.579 9.092 1.00 0.00 C ATOM 1473 O ALA A 89 7.590 -0.745 8.216 1.00 0.00 O ATOM 1474 CB ALA A 89 7.614 0.730 11.060 1.00 0.00 C ATOM 0 H ALA A 89 9.531 -0.444 12.049 1.00 0.00 H new ATOM 0 HA ALA A 89 7.232 -1.337 10.677 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.778 1.079 10.454 1.00 0.00 H new ATOM 0 HB2 ALA A 89 7.302 0.658 12.102 1.00 0.00 H new ATOM 0 HB3 ALA A 89 8.441 1.435 10.977 1.00 0.00 H new ATOM 1480 N LEU A 90 9.723 -0.351 8.836 1.00 0.00 N ATOM 1481 CA LEU A 90 10.255 -0.298 7.481 1.00 0.00 C ATOM 1482 C LEU A 90 9.949 -1.593 6.726 1.00 0.00 C ATOM 1483 O LEU A 90 9.395 -1.566 5.626 1.00 0.00 O ATOM 1484 CB LEU A 90 11.769 -0.066 7.534 1.00 0.00 C ATOM 1485 CG LEU A 90 12.431 0.305 6.204 1.00 0.00 C ATOM 1486 CD1 LEU A 90 11.925 1.650 5.713 1.00 0.00 C ATOM 1487 CD2 LEU A 90 13.944 0.330 6.355 1.00 0.00 C ATOM 0 H LEU A 90 10.423 -0.198 9.562 1.00 0.00 H new ATOM 0 HA LEU A 90 9.779 0.526 6.950 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.971 0.728 8.253 1.00 0.00 H new ATOM 0 HB3 LEU A 90 12.243 -0.970 7.915 1.00 0.00 H new ATOM 0 HG LEU A 90 12.168 -0.452 5.465 1.00 0.00 H new ATOM 0 HD11 LEU A 90 12.407 1.897 4.767 1.00 0.00 H new ATOM 0 HD12 LEU A 90 10.846 1.602 5.569 1.00 0.00 H new ATOM 0 HD13 LEU A 90 12.159 2.418 6.450 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.400 0.595 5.401 1.00 0.00 H new ATOM 0 HD22 LEU A 90 14.222 1.067 7.108 1.00 0.00 H new ATOM 0 HD23 LEU A 90 14.295 -0.655 6.664 1.00 0.00 H new ATOM 1499 N GLU A 91 10.291 -2.726 7.336 1.00 0.00 N ATOM 1500 CA GLU A 91 10.086 -4.033 6.711 1.00 0.00 C ATOM 1501 C GLU A 91 8.593 -4.318 6.582 1.00 0.00 C ATOM 1502 O GLU A 91 8.138 -4.849 5.572 1.00 0.00 O ATOM 1503 CB GLU A 91 10.780 -5.125 7.537 1.00 0.00 C ATOM 1504 CG GLU A 91 11.122 -6.397 6.762 1.00 0.00 C ATOM 1505 CD GLU A 91 9.942 -7.332 6.547 1.00 0.00 C ATOM 1506 OE1 GLU A 91 9.284 -7.704 7.542 1.00 0.00 O ATOM 1507 OE2 GLU A 91 9.694 -7.733 5.387 1.00 0.00 O ATOM 0 H GLU A 91 10.712 -2.766 8.264 1.00 0.00 H new ATOM 0 HA GLU A 91 10.524 -4.027 5.713 1.00 0.00 H new ATOM 0 HB2 GLU A 91 11.698 -4.714 7.957 1.00 0.00 H new ATOM 0 HB3 GLU A 91 10.137 -5.390 8.376 1.00 0.00 H new ATOM 0 HG2 GLU A 91 11.532 -6.118 5.791 1.00 0.00 H new ATOM 0 HG3 GLU A 91 11.905 -6.935 7.296 1.00 0.00 H new ATOM 1514 N LEU A 92 7.832 -3.930 7.601 1.00 0.00 N ATOM 1515 CA LEU A 92 6.386 -4.113 7.593 1.00 0.00 C ATOM 1516 C LEU A 92 5.751 -3.369 6.420 1.00 0.00 C ATOM 1517 O LEU A 92 4.891 -3.910 5.720 1.00 0.00 O ATOM 1518 CB LEU A 92 5.782 -3.629 8.915 1.00 0.00 C ATOM 1519 CG LEU A 92 6.237 -4.400 10.156 1.00 0.00 C ATOM 1520 CD1 LEU A 92 5.655 -3.779 11.415 1.00 0.00 C ATOM 1521 CD2 LEU A 92 5.841 -5.864 10.050 1.00 0.00 C ATOM 0 H LEU A 92 8.195 -3.486 8.444 1.00 0.00 H new ATOM 0 HA LEU A 92 6.177 -5.177 7.478 1.00 0.00 H new ATOM 0 HB2 LEU A 92 6.033 -2.577 9.048 1.00 0.00 H new ATOM 0 HB3 LEU A 92 4.696 -3.691 8.845 1.00 0.00 H new ATOM 0 HG LEU A 92 7.324 -4.342 10.216 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.990 -4.341 12.286 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.990 -2.745 11.499 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.567 -3.804 11.363 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.173 -6.396 10.941 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.757 -5.942 9.963 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.308 -6.305 9.169 1.00 0.00 H new ATOM 1533 N ALA A 93 6.185 -2.131 6.206 1.00 0.00 N ATOM 1534 CA ALA A 93 5.680 -1.320 5.106 1.00 0.00 C ATOM 1535 C ALA A 93 6.040 -1.945 3.763 1.00 0.00 C ATOM 1536 O ALA A 93 5.176 -2.143 2.907 1.00 0.00 O ATOM 1537 CB ALA A 93 6.221 0.101 5.199 1.00 0.00 C ATOM 0 H ALA A 93 6.887 -1.667 6.782 1.00 0.00 H new ATOM 0 HA ALA A 93 4.593 -1.281 5.181 1.00 0.00 H new ATOM 0 HB1 ALA A 93 5.834 0.693 4.370 1.00 0.00 H new ATOM 0 HB2 ALA A 93 5.907 0.549 6.142 1.00 0.00 H new ATOM 0 HB3 ALA A 93 7.310 0.080 5.152 1.00 0.00 H new ATOM 1543 N PHE A 94 7.315 -2.275 3.598 1.00 0.00 N ATOM 1544 CA PHE A 94 7.800 -2.902 2.372 1.00 0.00 C ATOM 1545 C PHE A 94 7.071 -4.211 2.086 1.00 0.00 C ATOM 1546 O PHE A 94 6.719 -4.494 0.941 1.00 0.00 O ATOM 1547 CB PHE A 94 9.302 -3.157 2.463 1.00 0.00 C ATOM 1548 CG PHE A 94 10.151 -2.002 2.018 1.00 0.00 C ATOM 1549 CD1 PHE A 94 10.380 -0.922 2.854 1.00 0.00 C ATOM 1550 CD2 PHE A 94 10.731 -2.004 0.760 1.00 0.00 C ATOM 1551 CE1 PHE A 94 11.172 0.132 2.445 1.00 0.00 C ATOM 1552 CE2 PHE A 94 11.525 -0.953 0.346 1.00 0.00 C ATOM 1553 CZ PHE A 94 11.745 0.116 1.190 1.00 0.00 C ATOM 0 H PHE A 94 8.037 -2.118 4.302 1.00 0.00 H new ATOM 0 HA PHE A 94 7.599 -2.214 1.550 1.00 0.00 H new ATOM 0 HB2 PHE A 94 9.555 -3.403 3.494 1.00 0.00 H new ATOM 0 HB3 PHE A 94 9.548 -4.029 1.857 1.00 0.00 H new ATOM 0 HD1 PHE A 94 9.934 -0.904 3.837 1.00 0.00 H new ATOM 0 HD2 PHE A 94 10.560 -2.838 0.095 1.00 0.00 H new ATOM 0 HE1 PHE A 94 11.343 0.968 3.107 1.00 0.00 H new ATOM 0 HE2 PHE A 94 11.973 -0.968 -0.637 1.00 0.00 H new ATOM 0 HZ PHE A 94 12.365 0.940 0.869 1.00 0.00 H new ATOM 1563 N ARG A 95 6.833 -4.995 3.130 1.00 0.00 N ATOM 1564 CA ARG A 95 6.192 -6.295 2.986 1.00 0.00 C ATOM 1565 C ARG A 95 4.724 -6.149 2.570 1.00 0.00 C ATOM 1566 O ARG A 95 4.167 -7.037 1.929 1.00 0.00 O ATOM 1567 CB ARG A 95 6.293 -7.089 4.292 1.00 0.00 C ATOM 1568 CG ARG A 95 5.827 -8.530 4.165 1.00 0.00 C ATOM 1569 CD ARG A 95 5.996 -9.294 5.469 1.00 0.00 C ATOM 1570 NE ARG A 95 5.234 -8.696 6.569 1.00 0.00 N ATOM 1571 CZ ARG A 95 3.912 -8.820 6.718 1.00 0.00 C ATOM 1572 NH1 ARG A 95 3.199 -9.474 5.807 1.00 0.00 N ATOM 1573 NH2 ARG A 95 3.308 -8.296 7.780 1.00 0.00 N ATOM 0 H ARG A 95 7.076 -4.751 4.090 1.00 0.00 H new ATOM 0 HA ARG A 95 6.715 -6.838 2.199 1.00 0.00 H new ATOM 0 HB2 ARG A 95 7.328 -7.079 4.634 1.00 0.00 H new ATOM 0 HB3 ARG A 95 5.699 -6.590 5.058 1.00 0.00 H new ATOM 0 HG2 ARG A 95 4.779 -8.548 3.866 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.392 -9.027 3.376 1.00 0.00 H new ATOM 0 HD2 ARG A 95 5.675 -10.326 5.327 1.00 0.00 H new ATOM 0 HD3 ARG A 95 7.052 -9.323 5.736 1.00 0.00 H new ATOM 0 HE ARG A 95 5.745 -8.151 7.264 1.00 0.00 H new ATOM 0 HH11 ARG A 95 3.661 -9.881 4.994 1.00 0.00 H new ATOM 0 HH12 ARG A 95 2.190 -9.569 5.921 1.00 0.00 H new ATOM 0 HH21 ARG A 95 3.854 -7.798 8.483 1.00 0.00 H new ATOM 0 HH22 ARG A 95 2.299 -8.392 7.892 1.00 0.00 H new ATOM 1587 N HIS A 96 4.098 -5.033 2.937 1.00 0.00 N ATOM 1588 CA HIS A 96 2.695 -4.796 2.583 1.00 0.00 C ATOM 1589 C HIS A 96 2.561 -4.166 1.197 1.00 0.00 C ATOM 1590 O HIS A 96 1.510 -4.262 0.566 1.00 0.00 O ATOM 1591 CB HIS A 96 2.007 -3.892 3.613 1.00 0.00 C ATOM 1592 CG HIS A 96 1.747 -4.550 4.935 1.00 0.00 C ATOM 1593 ND1 HIS A 96 1.880 -3.893 6.141 1.00 0.00 N ATOM 1594 CD2 HIS A 96 1.335 -5.805 5.237 1.00 0.00 C ATOM 1595 CE1 HIS A 96 1.565 -4.715 7.123 1.00 0.00 C ATOM 1596 NE2 HIS A 96 1.231 -5.877 6.604 1.00 0.00 N ATOM 0 H HIS A 96 4.533 -4.283 3.475 1.00 0.00 H new ATOM 0 HA HIS A 96 2.207 -5.771 2.576 1.00 0.00 H new ATOM 0 HB2 HIS A 96 2.626 -3.009 3.775 1.00 0.00 H new ATOM 0 HB3 HIS A 96 1.060 -3.546 3.200 1.00 0.00 H new ATOM 0 HD2 HIS A 96 1.128 -6.599 4.535 1.00 0.00 H new ATOM 0 HE1 HIS A 96 1.579 -4.475 8.176 1.00 0.00 H new ATOM 0 HE2 HIS A 96 0.941 -6.700 7.133 1.00 0.00 H new ATOM 1605 N ILE A 97 3.619 -3.516 0.731 1.00 0.00 N ATOM 1606 CA ILE A 97 3.572 -2.804 -0.544 1.00 0.00 C ATOM 1607 C ILE A 97 4.246 -3.600 -1.660 1.00 0.00 C ATOM 1608 O ILE A 97 3.616 -3.930 -2.664 1.00 0.00 O ATOM 1609 CB ILE A 97 4.232 -1.411 -0.431 1.00 0.00 C ATOM 1610 CG1 ILE A 97 3.524 -0.581 0.647 1.00 0.00 C ATOM 1611 CG2 ILE A 97 4.199 -0.688 -1.773 1.00 0.00 C ATOM 1612 CD1 ILE A 97 4.158 0.768 0.898 1.00 0.00 C ATOM 0 H ILE A 97 4.517 -3.466 1.212 1.00 0.00 H new ATOM 0 HA ILE A 97 2.519 -2.679 -0.796 1.00 0.00 H new ATOM 0 HB ILE A 97 5.275 -1.542 -0.144 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.485 -0.434 0.354 1.00 0.00 H new ATOM 0 HG13 ILE A 97 3.515 -1.146 1.579 1.00 0.00 H new ATOM 0 HG21 ILE A 97 4.669 0.290 -1.671 1.00 0.00 H new ATOM 0 HG22 ILE A 97 4.740 -1.274 -2.516 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.165 -0.562 -2.093 1.00 0.00 H new ATOM 0 HD11 ILE A 97 3.600 1.294 1.673 1.00 0.00 H new ATOM 0 HD12 ILE A 97 5.189 0.631 1.223 1.00 0.00 H new ATOM 0 HD13 ILE A 97 4.143 1.354 -0.021 1.00 0.00 H new ATOM 1624 N LEU A 98 5.525 -3.900 -1.482 1.00 0.00 N ATOM 1625 CA LEU A 98 6.297 -4.593 -2.507 1.00 0.00 C ATOM 1626 C LEU A 98 6.289 -6.097 -2.263 1.00 0.00 C ATOM 1627 O LEU A 98 6.453 -6.893 -3.189 1.00 0.00 O ATOM 1628 CB LEU A 98 7.739 -4.080 -2.523 1.00 0.00 C ATOM 1629 CG LEU A 98 7.897 -2.582 -2.793 1.00 0.00 C ATOM 1630 CD1 LEU A 98 9.358 -2.176 -2.702 1.00 0.00 C ATOM 1631 CD2 LEU A 98 7.331 -2.221 -4.159 1.00 0.00 C ATOM 0 H LEU A 98 6.051 -3.675 -0.638 1.00 0.00 H new ATOM 0 HA LEU A 98 5.835 -4.393 -3.474 1.00 0.00 H new ATOM 0 HB2 LEU A 98 8.200 -4.310 -1.562 1.00 0.00 H new ATOM 0 HB3 LEU A 98 8.295 -4.630 -3.283 1.00 0.00 H new ATOM 0 HG LEU A 98 7.338 -2.037 -2.033 1.00 0.00 H new ATOM 0 HD11 LEU A 98 9.452 -1.108 -2.897 1.00 0.00 H new ATOM 0 HD12 LEU A 98 9.736 -2.397 -1.704 1.00 0.00 H new ATOM 0 HD13 LEU A 98 9.937 -2.731 -3.440 1.00 0.00 H new ATOM 0 HD21 LEU A 98 7.453 -1.152 -4.332 1.00 0.00 H new ATOM 0 HD22 LEU A 98 7.863 -2.777 -4.932 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.272 -2.476 -4.193 1.00 0.00 H new ATOM 1643 N GLY A 99 6.111 -6.476 -1.005 1.00 0.00 N ATOM 1644 CA GLY A 99 6.123 -7.877 -0.643 1.00 0.00 C ATOM 1645 C GLY A 99 7.507 -8.346 -0.256 1.00 0.00 C ATOM 1646 O GLY A 99 7.750 -9.542 -0.107 1.00 0.00 O ATOM 0 H GLY A 99 5.958 -5.835 -0.227 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.437 -8.043 0.188 1.00 0.00 H new ATOM 0 HA3 GLY A 99 5.759 -8.472 -1.481 1.00 0.00 H new ATOM 1650 N ARG A 100 8.416 -7.394 -0.091 1.00 0.00 N ATOM 1651 CA ARG A 100 9.793 -7.693 0.267 1.00 0.00 C ATOM 1652 C ARG A 100 10.420 -6.485 0.952 1.00 0.00 C ATOM 1653 O ARG A 100 10.317 -5.365 0.454 1.00 0.00 O ATOM 1654 CB ARG A 100 10.603 -8.058 -0.982 1.00 0.00 C ATOM 1655 CG ARG A 100 11.995 -8.603 -0.688 1.00 0.00 C ATOM 1656 CD ARG A 100 11.958 -10.084 -0.331 1.00 0.00 C ATOM 1657 NE ARG A 100 11.212 -10.358 0.898 1.00 0.00 N ATOM 1658 CZ ARG A 100 10.481 -11.454 1.097 1.00 0.00 C ATOM 1659 NH1 ARG A 100 10.364 -12.366 0.140 1.00 0.00 N ATOM 1660 NH2 ARG A 100 9.867 -11.636 2.257 1.00 0.00 N ATOM 0 H ARG A 100 8.220 -6.399 -0.201 1.00 0.00 H new ATOM 0 HA ARG A 100 9.801 -8.542 0.950 1.00 0.00 H new ATOM 0 HB2 ARG A 100 10.049 -8.800 -1.556 1.00 0.00 H new ATOM 0 HB3 ARG A 100 10.697 -7.173 -1.611 1.00 0.00 H new ATOM 0 HG2 ARG A 100 12.635 -8.454 -1.558 1.00 0.00 H new ATOM 0 HG3 ARG A 100 12.439 -8.042 0.134 1.00 0.00 H new ATOM 0 HD2 ARG A 100 11.508 -10.639 -1.154 1.00 0.00 H new ATOM 0 HD3 ARG A 100 12.978 -10.451 -0.219 1.00 0.00 H new ATOM 0 HE ARG A 100 11.254 -9.668 1.648 1.00 0.00 H new ATOM 0 HH11 ARG A 100 10.835 -12.230 -0.754 1.00 0.00 H new ATOM 0 HH12 ARG A 100 9.803 -13.203 0.299 1.00 0.00 H new ATOM 0 HH21 ARG A 100 9.954 -10.938 2.995 1.00 0.00 H new ATOM 0 HH22 ARG A 100 9.307 -12.474 2.412 1.00 0.00 H new ATOM 1674 N GLY A 101 11.052 -6.714 2.093 1.00 0.00 N ATOM 1675 CA GLY A 101 11.702 -5.638 2.811 1.00 0.00 C ATOM 1676 C GLY A 101 13.103 -5.370 2.302 1.00 0.00 C ATOM 1677 O GLY A 101 13.644 -6.162 1.525 1.00 0.00 O ATOM 0 H GLY A 101 11.126 -7.630 2.536 1.00 0.00 H new ATOM 0 HA2 GLY A 101 11.105 -4.731 2.719 1.00 0.00 H new ATOM 0 HA3 GLY A 101 11.745 -5.886 3.872 1.00 0.00 H new ATOM 1681 N PRO A 102 13.720 -4.257 2.731 1.00 0.00 N ATOM 1682 CA PRO A 102 15.069 -3.879 2.299 1.00 0.00 C ATOM 1683 C PRO A 102 16.118 -4.885 2.768 1.00 0.00 C ATOM 1684 O PRO A 102 15.999 -5.465 3.851 1.00 0.00 O ATOM 1685 CB PRO A 102 15.289 -2.512 2.955 1.00 0.00 C ATOM 1686 CG PRO A 102 14.350 -2.485 4.109 1.00 0.00 C ATOM 1687 CD PRO A 102 13.152 -3.287 3.683 1.00 0.00 C ATOM 0 HA PRO A 102 15.164 -3.853 1.213 1.00 0.00 H new ATOM 0 HB2 PRO A 102 16.322 -2.393 3.283 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.081 -1.701 2.257 1.00 0.00 H new ATOM 0 HG2 PRO A 102 14.811 -2.914 4.998 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.067 -1.462 4.359 1.00 0.00 H new ATOM 0 HD2 PRO A 102 12.678 -3.784 4.530 1.00 0.00 H new ATOM 0 HD3 PRO A 102 12.393 -2.660 3.215 1.00 0.00 H new ATOM 1695 N SER A 103 17.135 -5.094 1.949 1.00 0.00 N ATOM 1696 CA SER A 103 18.131 -6.119 2.221 1.00 0.00 C ATOM 1697 C SER A 103 19.541 -5.531 2.314 1.00 0.00 C ATOM 1698 O SER A 103 20.383 -6.039 3.053 1.00 0.00 O ATOM 1699 CB SER A 103 18.064 -7.186 1.130 1.00 0.00 C ATOM 1700 OG SER A 103 16.725 -7.628 0.947 1.00 0.00 O ATOM 0 H SER A 103 17.294 -4.568 1.090 1.00 0.00 H new ATOM 0 HA SER A 103 17.909 -6.568 3.189 1.00 0.00 H new ATOM 0 HB2 SER A 103 18.451 -6.783 0.194 1.00 0.00 H new ATOM 0 HB3 SER A 103 18.698 -8.030 1.400 1.00 0.00 H new ATOM 0 HG SER A 103 16.699 -8.310 0.244 1.00 0.00 H new ATOM 1706 N SER A 104 19.792 -4.459 1.576 1.00 0.00 N ATOM 1707 CA SER A 104 21.111 -3.833 1.572 1.00 0.00 C ATOM 1708 C SER A 104 21.170 -2.694 2.586 1.00 0.00 C ATOM 1709 O SER A 104 20.165 -2.034 2.834 1.00 0.00 O ATOM 1710 CB SER A 104 21.429 -3.310 0.174 1.00 0.00 C ATOM 1711 OG SER A 104 21.231 -4.318 -0.800 1.00 0.00 O ATOM 0 H SER A 104 19.105 -4.005 0.974 1.00 0.00 H new ATOM 0 HA SER A 104 21.853 -4.580 1.853 1.00 0.00 H new ATOM 0 HB2 SER A 104 20.795 -2.452 -0.051 1.00 0.00 H new ATOM 0 HB3 SER A 104 22.461 -2.962 0.138 1.00 0.00 H new ATOM 0 HG SER A 104 21.439 -3.960 -1.688 1.00 0.00 H new ATOM 1717 N ARG A 105 22.345 -2.453 3.159 1.00 0.00 N ATOM 1718 CA ARG A 105 22.493 -1.418 4.179 1.00 0.00 C ATOM 1719 C ARG A 105 22.256 -0.027 3.593 1.00 0.00 C ATOM 1720 O ARG A 105 21.552 0.787 4.186 1.00 0.00 O ATOM 1721 CB ARG A 105 23.873 -1.477 4.836 1.00 0.00 C ATOM 1722 CG ARG A 105 24.057 -0.419 5.909 1.00 0.00 C ATOM 1723 CD ARG A 105 25.415 -0.505 6.582 1.00 0.00 C ATOM 1724 NE ARG A 105 25.583 0.559 7.571 1.00 0.00 N ATOM 1725 CZ ARG A 105 26.431 0.506 8.599 1.00 0.00 C ATOM 1726 NH1 ARG A 105 27.194 -0.564 8.791 1.00 0.00 N ATOM 1727 NH2 ARG A 105 26.517 1.525 9.445 1.00 0.00 N ATOM 0 H ARG A 105 23.204 -2.956 2.937 1.00 0.00 H new ATOM 0 HA ARG A 105 21.738 -1.609 4.942 1.00 0.00 H new ATOM 0 HB2 ARG A 105 24.020 -2.464 5.276 1.00 0.00 H new ATOM 0 HB3 ARG A 105 24.640 -1.351 4.072 1.00 0.00 H new ATOM 0 HG2 ARG A 105 23.937 0.569 5.465 1.00 0.00 H new ATOM 0 HG3 ARG A 105 23.275 -0.528 6.660 1.00 0.00 H new ATOM 0 HD2 ARG A 105 25.523 -1.476 7.066 1.00 0.00 H new ATOM 0 HD3 ARG A 105 26.201 -0.434 5.831 1.00 0.00 H new ATOM 0 HE ARG A 105 25.013 1.399 7.468 1.00 0.00 H new ATOM 0 HH11 ARG A 105 27.134 -1.355 8.149 1.00 0.00 H new ATOM 0 HH12 ARG A 105 27.840 -0.595 9.580 1.00 0.00 H new ATOM 0 HH21 ARG A 105 25.934 2.351 9.310 1.00 0.00 H new ATOM 0 HH22 ARG A 105 27.166 1.482 10.231 1.00 0.00 H new ATOM 1741 N GLU A 106 22.844 0.233 2.429 1.00 0.00 N ATOM 1742 CA GLU A 106 22.647 1.500 1.730 1.00 0.00 C ATOM 1743 C GLU A 106 21.163 1.697 1.437 1.00 0.00 C ATOM 1744 O GLU A 106 20.609 2.785 1.594 1.00 0.00 O ATOM 1745 CB GLU A 106 23.453 1.486 0.425 1.00 0.00 C ATOM 1746 CG GLU A 106 23.383 2.776 -0.375 1.00 0.00 C ATOM 1747 CD GLU A 106 24.035 3.943 0.335 1.00 0.00 C ATOM 1748 OE1 GLU A 106 25.263 3.888 0.572 1.00 0.00 O ATOM 1749 OE2 GLU A 106 23.327 4.922 0.646 1.00 0.00 O ATOM 0 H GLU A 106 23.463 -0.419 1.948 1.00 0.00 H new ATOM 0 HA GLU A 106 22.992 2.325 2.353 1.00 0.00 H new ATOM 0 HB2 GLU A 106 24.496 1.276 0.660 1.00 0.00 H new ATOM 0 HB3 GLU A 106 23.095 0.667 -0.199 1.00 0.00 H new ATOM 0 HG2 GLU A 106 23.868 2.627 -1.340 1.00 0.00 H new ATOM 0 HG3 GLU A 106 22.339 3.017 -0.577 1.00 0.00 H new ATOM 1756 N GLU A 107 20.533 0.602 1.043 1.00 0.00 N ATOM 1757 CA GLU A 107 19.114 0.567 0.738 1.00 0.00 C ATOM 1758 C GLU A 107 18.283 0.873 1.987 1.00 0.00 C ATOM 1759 O GLU A 107 17.412 1.750 1.971 1.00 0.00 O ATOM 1760 CB GLU A 107 18.790 -0.818 0.184 1.00 0.00 C ATOM 1761 CG GLU A 107 17.344 -1.043 -0.200 1.00 0.00 C ATOM 1762 CD GLU A 107 17.156 -2.404 -0.832 1.00 0.00 C ATOM 1763 OE1 GLU A 107 17.089 -3.404 -0.089 1.00 0.00 O ATOM 1764 OE2 GLU A 107 17.112 -2.484 -2.079 1.00 0.00 O ATOM 0 H GLU A 107 20.999 -0.297 0.925 1.00 0.00 H new ATOM 0 HA GLU A 107 18.866 1.329 -0.001 1.00 0.00 H new ATOM 0 HB2 GLU A 107 19.413 -0.994 -0.693 1.00 0.00 H new ATOM 0 HB3 GLU A 107 19.070 -1.563 0.929 1.00 0.00 H new ATOM 0 HG2 GLU A 107 16.712 -0.958 0.684 1.00 0.00 H new ATOM 0 HG3 GLU A 107 17.024 -0.268 -0.896 1.00 0.00 H new ATOM 1771 N VAL A 108 18.574 0.160 3.072 1.00 0.00 N ATOM 1772 CA VAL A 108 17.888 0.369 4.340 1.00 0.00 C ATOM 1773 C VAL A 108 18.054 1.808 4.815 1.00 0.00 C ATOM 1774 O VAL A 108 17.076 2.472 5.146 1.00 0.00 O ATOM 1775 CB VAL A 108 18.403 -0.587 5.443 1.00 0.00 C ATOM 1776 CG1 VAL A 108 17.778 -0.255 6.793 1.00 0.00 C ATOM 1777 CG2 VAL A 108 18.116 -2.033 5.080 1.00 0.00 C ATOM 0 H VAL A 108 19.285 -0.571 3.096 1.00 0.00 H new ATOM 0 HA VAL A 108 16.834 0.158 4.162 1.00 0.00 H new ATOM 0 HB VAL A 108 19.482 -0.452 5.519 1.00 0.00 H new ATOM 0 HG11 VAL A 108 18.158 -0.942 7.549 1.00 0.00 H new ATOM 0 HG12 VAL A 108 18.034 0.767 7.071 1.00 0.00 H new ATOM 0 HG13 VAL A 108 16.694 -0.352 6.726 1.00 0.00 H new ATOM 0 HG21 VAL A 108 18.487 -2.687 5.869 1.00 0.00 H new ATOM 0 HG22 VAL A 108 17.041 -2.173 4.967 1.00 0.00 H new ATOM 0 HG23 VAL A 108 18.614 -2.278 4.142 1.00 0.00 H new ATOM 1787 N GLN A 109 19.295 2.285 4.823 1.00 0.00 N ATOM 1788 CA GLN A 109 19.611 3.617 5.306 1.00 0.00 C ATOM 1789 C GLN A 109 18.850 4.690 4.531 1.00 0.00 C ATOM 1790 O GLN A 109 18.353 5.654 5.119 1.00 0.00 O ATOM 1791 CB GLN A 109 21.110 3.865 5.192 1.00 0.00 C ATOM 1792 CG GLN A 109 21.529 5.229 5.692 1.00 0.00 C ATOM 1793 CD GLN A 109 22.995 5.522 5.451 1.00 0.00 C ATOM 1794 OE1 GLN A 109 23.379 6.671 5.232 1.00 0.00 O ATOM 1795 NE2 GLN A 109 23.826 4.493 5.498 1.00 0.00 N ATOM 0 H GLN A 109 20.104 1.758 4.495 1.00 0.00 H new ATOM 0 HA GLN A 109 19.305 3.676 6.351 1.00 0.00 H new ATOM 0 HB2 GLN A 109 21.642 3.099 5.756 1.00 0.00 H new ATOM 0 HB3 GLN A 109 21.411 3.759 4.150 1.00 0.00 H new ATOM 0 HG2 GLN A 109 20.926 5.992 5.199 1.00 0.00 H new ATOM 0 HG3 GLN A 109 21.321 5.298 6.760 1.00 0.00 H new ATOM 0 HE21 GLN A 109 23.468 3.556 5.682 1.00 0.00 H new ATOM 0 HE22 GLN A 109 24.825 4.637 5.350 1.00 0.00 H new ATOM 1804 N LYS A 110 18.760 4.519 3.215 1.00 0.00 N ATOM 1805 CA LYS A 110 18.072 5.482 2.365 1.00 0.00 C ATOM 1806 C LYS A 110 16.619 5.640 2.799 1.00 0.00 C ATOM 1807 O LYS A 110 16.152 6.750 3.045 1.00 0.00 O ATOM 1808 CB LYS A 110 18.146 5.047 0.898 1.00 0.00 C ATOM 1809 CG LYS A 110 17.531 6.049 -0.070 1.00 0.00 C ATOM 1810 CD LYS A 110 17.758 5.637 -1.518 1.00 0.00 C ATOM 1811 CE LYS A 110 17.192 6.657 -2.497 1.00 0.00 C ATOM 1812 NZ LYS A 110 15.705 6.721 -2.446 1.00 0.00 N ATOM 0 H LYS A 110 19.155 3.722 2.716 1.00 0.00 H new ATOM 0 HA LYS A 110 18.568 6.447 2.468 1.00 0.00 H new ATOM 0 HB2 LYS A 110 19.190 4.888 0.628 1.00 0.00 H new ATOM 0 HB3 LYS A 110 17.638 4.089 0.786 1.00 0.00 H new ATOM 0 HG2 LYS A 110 16.461 6.133 0.122 1.00 0.00 H new ATOM 0 HG3 LYS A 110 17.964 7.035 0.101 1.00 0.00 H new ATOM 0 HD2 LYS A 110 18.826 5.516 -1.697 1.00 0.00 H new ATOM 0 HD3 LYS A 110 17.293 4.667 -1.696 1.00 0.00 H new ATOM 0 HE2 LYS A 110 17.604 7.641 -2.273 1.00 0.00 H new ATOM 0 HE3 LYS A 110 17.508 6.402 -3.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 15.360 7.365 -3.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 15.311 5.771 -2.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 15.404 7.072 -1.514 1.00 0.00 H new ATOM 1826 N TYR A 111 15.917 4.523 2.926 1.00 0.00 N ATOM 1827 CA TYR A 111 14.508 4.555 3.294 1.00 0.00 C ATOM 1828 C TYR A 111 14.321 4.859 4.776 1.00 0.00 C ATOM 1829 O TYR A 111 13.336 5.486 5.167 1.00 0.00 O ATOM 1830 CB TYR A 111 13.832 3.237 2.925 1.00 0.00 C ATOM 1831 CG TYR A 111 13.714 3.033 1.435 1.00 0.00 C ATOM 1832 CD1 TYR A 111 12.722 3.677 0.707 1.00 0.00 C ATOM 1833 CD2 TYR A 111 14.595 2.206 0.752 1.00 0.00 C ATOM 1834 CE1 TYR A 111 12.610 3.502 -0.659 1.00 0.00 C ATOM 1835 CE2 TYR A 111 14.490 2.024 -0.614 1.00 0.00 C ATOM 1836 CZ TYR A 111 13.496 2.675 -1.314 1.00 0.00 C ATOM 1837 OH TYR A 111 13.393 2.505 -2.675 1.00 0.00 O ATOM 0 H TYR A 111 16.297 3.588 2.781 1.00 0.00 H new ATOM 0 HA TYR A 111 14.036 5.361 2.732 1.00 0.00 H new ATOM 0 HB2 TYR A 111 14.398 2.411 3.356 1.00 0.00 H new ATOM 0 HB3 TYR A 111 12.838 3.208 3.370 1.00 0.00 H new ATOM 0 HD1 TYR A 111 12.026 4.326 1.218 1.00 0.00 H new ATOM 0 HD2 TYR A 111 15.376 1.696 1.297 1.00 0.00 H new ATOM 0 HE1 TYR A 111 11.833 4.010 -1.210 1.00 0.00 H new ATOM 0 HE2 TYR A 111 15.182 1.376 -1.130 1.00 0.00 H new ATOM 0 HH TYR A 111 14.093 1.892 -2.982 1.00 0.00 H new ATOM 1847 N PHE A 112 15.272 4.431 5.594 1.00 0.00 N ATOM 1848 CA PHE A 112 15.226 4.693 7.027 1.00 0.00 C ATOM 1849 C PHE A 112 15.288 6.192 7.293 1.00 0.00 C ATOM 1850 O PHE A 112 14.631 6.702 8.197 1.00 0.00 O ATOM 1851 CB PHE A 112 16.381 3.980 7.740 1.00 0.00 C ATOM 1852 CG PHE A 112 16.352 4.113 9.238 1.00 0.00 C ATOM 1853 CD1 PHE A 112 15.581 3.256 10.006 1.00 0.00 C ATOM 1854 CD2 PHE A 112 17.103 5.088 9.877 1.00 0.00 C ATOM 1855 CE1 PHE A 112 15.557 3.370 11.382 1.00 0.00 C ATOM 1856 CE2 PHE A 112 17.080 5.207 11.252 1.00 0.00 C ATOM 1857 CZ PHE A 112 16.306 4.347 12.005 1.00 0.00 C ATOM 0 H PHE A 112 16.087 3.899 5.289 1.00 0.00 H new ATOM 0 HA PHE A 112 14.285 4.307 7.419 1.00 0.00 H new ATOM 0 HB2 PHE A 112 16.357 2.922 7.479 1.00 0.00 H new ATOM 0 HB3 PHE A 112 17.325 4.379 7.369 1.00 0.00 H new ATOM 0 HD1 PHE A 112 14.992 2.490 9.523 1.00 0.00 H new ATOM 0 HD2 PHE A 112 17.712 5.761 9.293 1.00 0.00 H new ATOM 0 HE1 PHE A 112 14.953 2.695 11.970 1.00 0.00 H new ATOM 0 HE2 PHE A 112 17.667 5.972 11.738 1.00 0.00 H new ATOM 0 HZ PHE A 112 16.287 4.439 13.081 1.00 0.00 H new ATOM 1867 N SER A 113 16.074 6.893 6.491 1.00 0.00 N ATOM 1868 CA SER A 113 16.205 8.333 6.624 1.00 0.00 C ATOM 1869 C SER A 113 14.931 9.039 6.158 1.00 0.00 C ATOM 1870 O SER A 113 14.600 10.123 6.635 1.00 0.00 O ATOM 1871 CB SER A 113 17.408 8.818 5.819 1.00 0.00 C ATOM 1872 OG SER A 113 18.586 8.129 6.214 1.00 0.00 O ATOM 0 H SER A 113 16.631 6.486 5.740 1.00 0.00 H new ATOM 0 HA SER A 113 16.359 8.575 7.676 1.00 0.00 H new ATOM 0 HB2 SER A 113 17.228 8.661 4.756 1.00 0.00 H new ATOM 0 HB3 SER A 113 17.541 9.890 5.965 1.00 0.00 H new ATOM 0 HG SER A 113 18.519 7.188 5.948 1.00 0.00 H new ATOM 1878 N ILE A 114 14.213 8.408 5.235 1.00 0.00 N ATOM 1879 CA ILE A 114 12.959 8.955 4.734 1.00 0.00 C ATOM 1880 C ILE A 114 11.871 8.871 5.802 1.00 0.00 C ATOM 1881 O ILE A 114 11.223 9.867 6.118 1.00 0.00 O ATOM 1882 CB ILE A 114 12.482 8.217 3.460 1.00 0.00 C ATOM 1883 CG1 ILE A 114 13.523 8.363 2.345 1.00 0.00 C ATOM 1884 CG2 ILE A 114 11.126 8.747 3.001 1.00 0.00 C ATOM 1885 CD1 ILE A 114 13.204 7.561 1.101 1.00 0.00 C ATOM 0 H ILE A 114 14.479 7.516 4.819 1.00 0.00 H new ATOM 0 HA ILE A 114 13.143 9.999 4.481 1.00 0.00 H new ATOM 0 HB ILE A 114 12.368 7.159 3.696 1.00 0.00 H new ATOM 0 HG12 ILE A 114 13.607 9.416 2.075 1.00 0.00 H new ATOM 0 HG13 ILE A 114 14.496 8.053 2.726 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.811 8.213 2.104 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.390 8.595 3.790 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.207 9.811 2.780 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.986 7.716 0.358 1.00 0.00 H new ATOM 0 HD12 ILE A 114 13.149 6.502 1.355 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.247 7.887 0.694 1.00 0.00 H new ATOM 1897 N VAL A 115 11.696 7.683 6.371 1.00 0.00 N ATOM 1898 CA VAL A 115 10.633 7.449 7.348 1.00 0.00 C ATOM 1899 C VAL A 115 10.869 8.236 8.642 1.00 0.00 C ATOM 1900 O VAL A 115 9.923 8.668 9.293 1.00 0.00 O ATOM 1901 CB VAL A 115 10.468 5.940 7.663 1.00 0.00 C ATOM 1902 CG1 VAL A 115 11.715 5.369 8.318 1.00 0.00 C ATOM 1903 CG2 VAL A 115 9.243 5.689 8.531 1.00 0.00 C ATOM 0 H VAL A 115 12.275 6.866 6.174 1.00 0.00 H new ATOM 0 HA VAL A 115 9.709 7.807 6.895 1.00 0.00 H new ATOM 0 HB VAL A 115 10.323 5.425 6.713 1.00 0.00 H new ATOM 0 HG11 VAL A 115 11.565 4.309 8.525 1.00 0.00 H new ATOM 0 HG12 VAL A 115 12.566 5.491 7.648 1.00 0.00 H new ATOM 0 HG13 VAL A 115 11.910 5.897 9.251 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.154 4.622 8.735 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.346 6.231 9.471 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.350 6.034 8.009 1.00 0.00 H new ATOM 1913 N SER A 116 12.127 8.447 8.999 1.00 0.00 N ATOM 1914 CA SER A 116 12.449 9.158 10.227 1.00 0.00 C ATOM 1915 C SER A 116 12.303 10.670 10.056 1.00 0.00 C ATOM 1916 O SER A 116 11.881 11.373 10.978 1.00 0.00 O ATOM 1917 CB SER A 116 13.865 8.808 10.672 1.00 0.00 C ATOM 1918 OG SER A 116 14.779 8.938 9.597 1.00 0.00 O ATOM 0 H SER A 116 12.936 8.139 8.460 1.00 0.00 H new ATOM 0 HA SER A 116 11.742 8.845 10.995 1.00 0.00 H new ATOM 0 HB2 SER A 116 14.165 9.462 11.491 1.00 0.00 H new ATOM 0 HB3 SER A 116 13.889 7.787 11.054 1.00 0.00 H new ATOM 0 HG SER A 116 14.987 8.051 9.235 1.00 0.00 H new ATOM 1924 N SER A 117 12.643 11.166 8.875 1.00 0.00 N ATOM 1925 CA SER A 117 12.596 12.596 8.612 1.00 0.00 C ATOM 1926 C SER A 117 11.206 13.041 8.153 1.00 0.00 C ATOM 1927 O SER A 117 10.685 14.052 8.622 1.00 0.00 O ATOM 1928 CB SER A 117 13.640 12.972 7.558 1.00 0.00 C ATOM 1929 OG SER A 117 14.934 12.531 7.943 1.00 0.00 O ATOM 0 H SER A 117 12.954 10.600 8.085 1.00 0.00 H new ATOM 0 HA SER A 117 12.820 13.112 9.546 1.00 0.00 H new ATOM 0 HB2 SER A 117 13.371 12.528 6.600 1.00 0.00 H new ATOM 0 HB3 SER A 117 13.647 14.053 7.418 1.00 0.00 H new ATOM 0 HG SER A 117 15.099 11.638 7.574 1.00 0.00 H new ATOM 1935 N GLY A 118 10.606 12.284 7.244 1.00 0.00 N ATOM 1936 CA GLY A 118 9.333 12.684 6.673 1.00 0.00 C ATOM 1937 C GLY A 118 8.151 11.987 7.313 1.00 0.00 C ATOM 1938 O GLY A 118 7.007 12.409 7.138 1.00 0.00 O ATOM 0 H GLY A 118 10.977 11.401 6.892 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.215 13.762 6.783 1.00 0.00 H new ATOM 0 HA3 GLY A 118 9.338 12.471 5.604 1.00 0.00 H new ATOM 1942 N GLY A 119 8.420 10.919 8.044 1.00 0.00 N ATOM 1943 CA GLY A 119 7.357 10.178 8.688 1.00 0.00 C ATOM 1944 C GLY A 119 6.969 8.938 7.908 1.00 0.00 C ATOM 1945 O GLY A 119 7.374 8.769 6.754 1.00 0.00 O ATOM 0 H GLY A 119 9.358 10.550 8.204 1.00 0.00 H new ATOM 0 HA2 GLY A 119 7.673 9.890 9.691 1.00 0.00 H new ATOM 0 HA3 GLY A 119 6.485 10.822 8.801 1.00 0.00 H new ATOM 1949 N LEU A 120 6.177 8.076 8.535 1.00 0.00 N ATOM 1950 CA LEU A 120 5.726 6.837 7.902 1.00 0.00 C ATOM 1951 C LEU A 120 4.940 7.104 6.611 1.00 0.00 C ATOM 1952 O LEU A 120 5.236 6.498 5.581 1.00 0.00 O ATOM 1953 CB LEU A 120 4.869 6.014 8.867 1.00 0.00 C ATOM 1954 CG LEU A 120 4.342 4.697 8.293 1.00 0.00 C ATOM 1955 CD1 LEU A 120 5.469 3.690 8.110 1.00 0.00 C ATOM 1956 CD2 LEU A 120 3.249 4.134 9.181 1.00 0.00 C ATOM 0 H LEU A 120 5.831 8.211 9.485 1.00 0.00 H new ATOM 0 HA LEU A 120 6.620 6.271 7.642 1.00 0.00 H new ATOM 0 HB2 LEU A 120 5.458 5.796 9.758 1.00 0.00 H new ATOM 0 HB3 LEU A 120 4.021 6.620 9.186 1.00 0.00 H new ATOM 0 HG LEU A 120 3.916 4.898 7.310 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.066 2.763 7.701 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.212 4.097 7.424 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.936 3.488 9.074 1.00 0.00 H new ATOM 0 HD21 LEU A 120 2.884 3.197 8.760 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.649 3.952 10.179 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.428 4.848 9.244 1.00 0.00 H new ATOM 1968 N PRO A 121 3.929 8.010 6.632 1.00 0.00 N ATOM 1969 CA PRO A 121 3.123 8.317 5.444 1.00 0.00 C ATOM 1970 C PRO A 121 3.962 8.800 4.260 1.00 0.00 C ATOM 1971 O PRO A 121 3.539 8.684 3.112 1.00 0.00 O ATOM 1972 CB PRO A 121 2.171 9.426 5.912 1.00 0.00 C ATOM 1973 CG PRO A 121 2.762 9.945 7.176 1.00 0.00 C ATOM 1974 CD PRO A 121 3.469 8.784 7.801 1.00 0.00 C ATOM 0 HA PRO A 121 2.611 7.427 5.079 1.00 0.00 H new ATOM 0 HB2 PRO A 121 2.088 10.214 5.164 1.00 0.00 H new ATOM 0 HB3 PRO A 121 1.166 9.037 6.078 1.00 0.00 H new ATOM 0 HG2 PRO A 121 3.454 10.763 6.977 1.00 0.00 H new ATOM 0 HG3 PRO A 121 1.989 10.335 7.838 1.00 0.00 H new ATOM 0 HD2 PRO A 121 4.302 9.107 8.425 1.00 0.00 H new ATOM 0 HD3 PRO A 121 2.803 8.200 8.436 1.00 0.00 H new ATOM 1982 N ALA A 122 5.144 9.339 4.544 1.00 0.00 N ATOM 1983 CA ALA A 122 6.055 9.779 3.493 1.00 0.00 C ATOM 1984 C ALA A 122 6.786 8.583 2.893 1.00 0.00 C ATOM 1985 O ALA A 122 6.918 8.469 1.674 1.00 0.00 O ATOM 1986 CB ALA A 122 7.048 10.797 4.037 1.00 0.00 C ATOM 0 H ALA A 122 5.493 9.481 5.492 1.00 0.00 H new ATOM 0 HA ALA A 122 5.472 10.259 2.707 1.00 0.00 H new ATOM 0 HB1 ALA A 122 7.719 11.113 3.238 1.00 0.00 H new ATOM 0 HB2 ALA A 122 6.508 11.662 4.421 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.629 10.345 4.841 1.00 0.00 H new ATOM 1992 N LEU A 123 7.243 7.688 3.764 1.00 0.00 N ATOM 1993 CA LEU A 123 7.902 6.457 3.343 1.00 0.00 C ATOM 1994 C LEU A 123 6.974 5.634 2.457 1.00 0.00 C ATOM 1995 O LEU A 123 7.347 5.209 1.363 1.00 0.00 O ATOM 1996 CB LEU A 123 8.303 5.634 4.571 1.00 0.00 C ATOM 1997 CG LEU A 123 8.869 4.243 4.270 1.00 0.00 C ATOM 1998 CD1 LEU A 123 10.263 4.346 3.670 1.00 0.00 C ATOM 1999 CD2 LEU A 123 8.882 3.394 5.530 1.00 0.00 C ATOM 0 H LEU A 123 7.167 7.795 4.776 1.00 0.00 H new ATOM 0 HA LEU A 123 8.795 6.717 2.774 1.00 0.00 H new ATOM 0 HB2 LEU A 123 9.046 6.196 5.138 1.00 0.00 H new ATOM 0 HB3 LEU A 123 7.430 5.522 5.214 1.00 0.00 H new ATOM 0 HG LEU A 123 8.224 3.759 3.537 1.00 0.00 H new ATOM 0 HD11 LEU A 123 10.645 3.346 3.464 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.218 4.916 2.742 1.00 0.00 H new ATOM 0 HD13 LEU A 123 10.926 4.850 4.374 1.00 0.00 H new ATOM 0 HD21 LEU A 123 9.287 2.408 5.300 1.00 0.00 H new ATOM 0 HD22 LEU A 123 9.503 3.874 6.286 1.00 0.00 H new ATOM 0 HD23 LEU A 123 7.865 3.289 5.909 1.00 0.00 H new ATOM 2011 N VAL A 124 5.759 5.430 2.946 1.00 0.00 N ATOM 2012 CA VAL A 124 4.755 4.659 2.228 1.00 0.00 C ATOM 2013 C VAL A 124 4.416 5.316 0.896 1.00 0.00 C ATOM 2014 O VAL A 124 4.326 4.645 -0.134 1.00 0.00 O ATOM 2015 CB VAL A 124 3.465 4.514 3.063 1.00 0.00 C ATOM 2016 CG1 VAL A 124 2.369 3.830 2.259 1.00 0.00 C ATOM 2017 CG2 VAL A 124 3.743 3.751 4.352 1.00 0.00 C ATOM 0 H VAL A 124 5.443 5.792 3.846 1.00 0.00 H new ATOM 0 HA VAL A 124 5.175 3.670 2.046 1.00 0.00 H new ATOM 0 HB VAL A 124 3.117 5.514 3.324 1.00 0.00 H new ATOM 0 HG11 VAL A 124 1.471 3.740 2.871 1.00 0.00 H new ATOM 0 HG12 VAL A 124 2.146 4.422 1.371 1.00 0.00 H new ATOM 0 HG13 VAL A 124 2.704 2.837 1.958 1.00 0.00 H new ATOM 0 HG21 VAL A 124 2.821 3.659 4.927 1.00 0.00 H new ATOM 0 HG22 VAL A 124 4.121 2.757 4.112 1.00 0.00 H new ATOM 0 HG23 VAL A 124 4.485 4.290 4.941 1.00 0.00 H new ATOM 2027 N ASP A 125 4.253 6.635 0.923 1.00 0.00 N ATOM 2028 CA ASP A 125 3.848 7.387 -0.259 1.00 0.00 C ATOM 2029 C ASP A 125 4.870 7.219 -1.375 1.00 0.00 C ATOM 2030 O ASP A 125 4.512 6.990 -2.528 1.00 0.00 O ATOM 2031 CB ASP A 125 3.691 8.870 0.080 1.00 0.00 C ATOM 2032 CG ASP A 125 2.667 9.562 -0.795 1.00 0.00 C ATOM 2033 OD1 ASP A 125 1.470 9.532 -0.441 1.00 0.00 O ATOM 2034 OD2 ASP A 125 3.045 10.154 -1.821 1.00 0.00 O ATOM 0 H ASP A 125 4.396 7.207 1.755 1.00 0.00 H new ATOM 0 HA ASP A 125 2.888 6.997 -0.598 1.00 0.00 H new ATOM 0 HB2 ASP A 125 3.398 8.971 1.125 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.654 9.368 -0.031 1.00 0.00 H new ATOM 2039 N ALA A 126 6.147 7.312 -1.014 1.00 0.00 N ATOM 2040 CA ALA A 126 7.233 7.153 -1.974 1.00 0.00 C ATOM 2041 C ALA A 126 7.208 5.764 -2.609 1.00 0.00 C ATOM 2042 O ALA A 126 7.352 5.627 -3.826 1.00 0.00 O ATOM 2043 CB ALA A 126 8.576 7.402 -1.300 1.00 0.00 C ATOM 0 H ALA A 126 6.455 7.497 -0.059 1.00 0.00 H new ATOM 0 HA ALA A 126 7.094 7.889 -2.766 1.00 0.00 H new ATOM 0 HB1 ALA A 126 9.377 7.280 -2.029 1.00 0.00 H new ATOM 0 HB2 ALA A 126 8.600 8.416 -0.901 1.00 0.00 H new ATOM 0 HB3 ALA A 126 8.713 6.689 -0.487 1.00 0.00 H new ATOM 2049 N LEU A 127 7.007 4.745 -1.779 1.00 0.00 N ATOM 2050 CA LEU A 127 7.001 3.363 -2.245 1.00 0.00 C ATOM 2051 C LEU A 127 5.862 3.108 -3.227 1.00 0.00 C ATOM 2052 O LEU A 127 6.078 2.568 -4.310 1.00 0.00 O ATOM 2053 CB LEU A 127 6.885 2.404 -1.060 1.00 0.00 C ATOM 2054 CG LEU A 127 8.095 2.378 -0.126 1.00 0.00 C ATOM 2055 CD1 LEU A 127 7.842 1.452 1.056 1.00 0.00 C ATOM 2056 CD2 LEU A 127 9.341 1.947 -0.886 1.00 0.00 C ATOM 0 H LEU A 127 6.846 4.851 -0.777 1.00 0.00 H new ATOM 0 HA LEU A 127 7.943 3.187 -2.764 1.00 0.00 H new ATOM 0 HB2 LEU A 127 6.003 2.674 -0.479 1.00 0.00 H new ATOM 0 HB3 LEU A 127 6.719 1.397 -1.442 1.00 0.00 H new ATOM 0 HG LEU A 127 8.255 3.385 0.259 1.00 0.00 H new ATOM 0 HD11 LEU A 127 8.715 1.448 1.708 1.00 0.00 H new ATOM 0 HD12 LEU A 127 6.974 1.803 1.614 1.00 0.00 H new ATOM 0 HD13 LEU A 127 7.656 0.441 0.693 1.00 0.00 H new ATOM 0 HD21 LEU A 127 10.194 1.933 -0.208 1.00 0.00 H new ATOM 0 HD22 LEU A 127 9.189 0.949 -1.298 1.00 0.00 H new ATOM 0 HD23 LEU A 127 9.534 2.649 -1.697 1.00 0.00 H new ATOM 2068 N VAL A 128 4.655 3.509 -2.848 1.00 0.00 N ATOM 2069 CA VAL A 128 3.476 3.273 -3.676 1.00 0.00 C ATOM 2070 C VAL A 128 3.518 4.115 -4.955 1.00 0.00 C ATOM 2071 O VAL A 128 3.071 3.680 -6.016 1.00 0.00 O ATOM 2072 CB VAL A 128 2.174 3.581 -2.900 1.00 0.00 C ATOM 2073 CG1 VAL A 128 0.947 3.293 -3.754 1.00 0.00 C ATOM 2074 CG2 VAL A 128 2.119 2.786 -1.604 1.00 0.00 C ATOM 0 H VAL A 128 4.465 3.999 -1.974 1.00 0.00 H new ATOM 0 HA VAL A 128 3.484 2.217 -3.947 1.00 0.00 H new ATOM 0 HB VAL A 128 2.174 4.643 -2.654 1.00 0.00 H new ATOM 0 HG11 VAL A 128 0.046 3.518 -3.184 1.00 0.00 H new ATOM 0 HG12 VAL A 128 0.974 3.913 -4.650 1.00 0.00 H new ATOM 0 HG13 VAL A 128 0.942 2.241 -4.040 1.00 0.00 H new ATOM 0 HG21 VAL A 128 1.195 3.018 -1.074 1.00 0.00 H new ATOM 0 HG22 VAL A 128 2.150 1.720 -1.829 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.972 3.050 -0.979 1.00 0.00 H new ATOM 2084 N ASP A 129 4.071 5.316 -4.850 1.00 0.00 N ATOM 2085 CA ASP A 129 4.121 6.248 -5.976 1.00 0.00 C ATOM 2086 C ASP A 129 5.049 5.767 -7.090 1.00 0.00 C ATOM 2087 O ASP A 129 4.788 6.030 -8.265 1.00 0.00 O ATOM 2088 CB ASP A 129 4.563 7.636 -5.496 1.00 0.00 C ATOM 2089 CG ASP A 129 5.011 8.534 -6.631 1.00 0.00 C ATOM 2090 OD1 ASP A 129 4.150 9.032 -7.384 1.00 0.00 O ATOM 2091 OD2 ASP A 129 6.235 8.733 -6.783 1.00 0.00 O ATOM 0 H ASP A 129 4.494 5.672 -3.993 1.00 0.00 H new ATOM 0 HA ASP A 129 3.114 6.303 -6.389 1.00 0.00 H new ATOM 0 HB2 ASP A 129 3.738 8.112 -4.966 1.00 0.00 H new ATOM 0 HB3 ASP A 129 5.379 7.526 -4.782 1.00 0.00 H new ATOM 2096 N SER A 130 6.109 5.054 -6.720 1.00 0.00 N ATOM 2097 CA SER A 130 7.168 4.693 -7.661 1.00 0.00 C ATOM 2098 C SER A 130 6.618 4.068 -8.944 1.00 0.00 C ATOM 2099 O SER A 130 5.765 3.172 -8.909 1.00 0.00 O ATOM 2100 CB SER A 130 8.166 3.740 -6.997 1.00 0.00 C ATOM 2101 OG SER A 130 7.543 2.531 -6.602 1.00 0.00 O ATOM 0 H SER A 130 6.259 4.713 -5.771 1.00 0.00 H new ATOM 0 HA SER A 130 7.677 5.615 -7.941 1.00 0.00 H new ATOM 0 HB2 SER A 130 8.979 3.522 -7.689 1.00 0.00 H new ATOM 0 HB3 SER A 130 8.609 4.224 -6.127 1.00 0.00 H new ATOM 0 HG SER A 130 7.051 2.674 -5.767 1.00 0.00 H new ATOM 2107 N GLN A 131 7.102 4.565 -10.080 1.00 0.00 N ATOM 2108 CA GLN A 131 6.742 4.013 -11.382 1.00 0.00 C ATOM 2109 C GLN A 131 7.220 2.572 -11.488 1.00 0.00 C ATOM 2110 O GLN A 131 6.593 1.741 -12.141 1.00 0.00 O ATOM 2111 CB GLN A 131 7.349 4.857 -12.510 1.00 0.00 C ATOM 2112 CG GLN A 131 6.467 6.008 -12.984 1.00 0.00 C ATOM 2113 CD GLN A 131 5.847 6.799 -11.848 1.00 0.00 C ATOM 2114 OE1 GLN A 131 6.437 7.752 -11.338 1.00 0.00 O ATOM 2115 NE2 GLN A 131 4.637 6.424 -11.464 1.00 0.00 N ATOM 0 H GLN A 131 7.748 5.353 -10.124 1.00 0.00 H new ATOM 0 HA GLN A 131 5.657 4.034 -11.481 1.00 0.00 H new ATOM 0 HB2 GLN A 131 8.302 5.262 -12.171 1.00 0.00 H new ATOM 0 HB3 GLN A 131 7.563 4.207 -13.358 1.00 0.00 H new ATOM 0 HG2 GLN A 131 7.061 6.680 -13.603 1.00 0.00 H new ATOM 0 HG3 GLN A 131 5.673 5.611 -13.616 1.00 0.00 H new ATOM 0 HE21 GLN A 131 4.183 5.628 -11.913 1.00 0.00 H new ATOM 0 HE22 GLN A 131 4.158 6.931 -10.719 1.00 0.00 H new ATOM 2124 N GLU A 132 8.338 2.294 -10.831 1.00 0.00 N ATOM 2125 CA GLU A 132 8.885 0.951 -10.760 1.00 0.00 C ATOM 2126 C GLU A 132 7.828 -0.026 -10.254 1.00 0.00 C ATOM 2127 O GLU A 132 7.564 -1.046 -10.884 1.00 0.00 O ATOM 2128 CB GLU A 132 10.117 0.911 -9.842 1.00 0.00 C ATOM 2129 CG GLU A 132 11.247 1.847 -10.263 1.00 0.00 C ATOM 2130 CD GLU A 132 11.072 3.269 -9.759 1.00 0.00 C ATOM 2131 OE1 GLU A 132 10.244 4.010 -10.320 1.00 0.00 O ATOM 2132 OE2 GLU A 132 11.770 3.654 -8.798 1.00 0.00 O ATOM 0 H GLU A 132 8.889 2.994 -10.334 1.00 0.00 H new ATOM 0 HA GLU A 132 9.191 0.656 -11.764 1.00 0.00 H new ATOM 0 HB2 GLU A 132 9.808 1.167 -8.828 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.499 -0.109 -9.811 1.00 0.00 H new ATOM 0 HG2 GLU A 132 12.193 1.452 -9.893 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.311 1.860 -11.351 1.00 0.00 H new ATOM 2139 N TYR A 133 7.209 0.307 -9.130 1.00 0.00 N ATOM 2140 CA TYR A 133 6.164 -0.524 -8.556 1.00 0.00 C ATOM 2141 C TYR A 133 4.945 -0.582 -9.475 1.00 0.00 C ATOM 2142 O TYR A 133 4.485 -1.662 -9.847 1.00 0.00 O ATOM 2143 CB TYR A 133 5.767 0.018 -7.178 1.00 0.00 C ATOM 2144 CG TYR A 133 4.535 -0.631 -6.585 1.00 0.00 C ATOM 2145 CD1 TYR A 133 4.552 -1.955 -6.171 1.00 0.00 C ATOM 2146 CD2 TYR A 133 3.356 0.088 -6.439 1.00 0.00 C ATOM 2147 CE1 TYR A 133 3.429 -2.547 -5.630 1.00 0.00 C ATOM 2148 CE2 TYR A 133 2.228 -0.497 -5.899 1.00 0.00 C ATOM 2149 CZ TYR A 133 2.271 -1.814 -5.496 1.00 0.00 C ATOM 2150 OH TYR A 133 1.151 -2.400 -4.957 1.00 0.00 O ATOM 0 H TYR A 133 7.415 1.152 -8.596 1.00 0.00 H new ATOM 0 HA TYR A 133 6.550 -1.537 -8.444 1.00 0.00 H new ATOM 0 HB2 TYR A 133 6.602 -0.120 -6.492 1.00 0.00 H new ATOM 0 HB3 TYR A 133 5.595 1.091 -7.258 1.00 0.00 H new ATOM 0 HD1 TYR A 133 5.459 -2.532 -6.274 1.00 0.00 H new ATOM 0 HD2 TYR A 133 3.321 1.121 -6.753 1.00 0.00 H new ATOM 0 HE1 TYR A 133 3.458 -3.579 -5.314 1.00 0.00 H new ATOM 0 HE2 TYR A 133 1.318 0.074 -5.793 1.00 0.00 H new ATOM 0 HH TYR A 133 0.420 -1.747 -4.931 1.00 0.00 H new ATOM 2160 N ALA A 134 4.452 0.584 -9.860 1.00 0.00 N ATOM 2161 CA ALA A 134 3.206 0.683 -10.609 1.00 0.00 C ATOM 2162 C ALA A 134 3.272 -0.038 -11.955 1.00 0.00 C ATOM 2163 O ALA A 134 2.334 -0.733 -12.335 1.00 0.00 O ATOM 2164 CB ALA A 134 2.840 2.140 -10.812 1.00 0.00 C ATOM 0 H ALA A 134 4.897 1.481 -9.666 1.00 0.00 H new ATOM 0 HA ALA A 134 2.434 0.188 -10.021 1.00 0.00 H new ATOM 0 HB1 ALA A 134 1.908 2.206 -11.373 1.00 0.00 H new ATOM 0 HB2 ALA A 134 2.716 2.622 -9.843 1.00 0.00 H new ATOM 0 HB3 ALA A 134 3.633 2.641 -11.367 1.00 0.00 H new ATOM 2170 N ASP A 135 4.375 0.118 -12.671 1.00 0.00 N ATOM 2171 CA ASP A 135 4.501 -0.462 -14.004 1.00 0.00 C ATOM 2172 C ASP A 135 4.916 -1.929 -13.959 1.00 0.00 C ATOM 2173 O ASP A 135 4.395 -2.747 -14.718 1.00 0.00 O ATOM 2174 CB ASP A 135 5.506 0.331 -14.844 1.00 0.00 C ATOM 2175 CG ASP A 135 4.927 1.624 -15.379 1.00 0.00 C ATOM 2176 OD1 ASP A 135 4.340 1.602 -16.483 1.00 0.00 O ATOM 2177 OD2 ASP A 135 5.059 2.668 -14.710 1.00 0.00 O ATOM 0 H ASP A 135 5.194 0.638 -12.355 1.00 0.00 H new ATOM 0 HA ASP A 135 3.515 -0.408 -14.466 1.00 0.00 H new ATOM 0 HB2 ASP A 135 6.384 0.554 -14.238 1.00 0.00 H new ATOM 0 HB3 ASP A 135 5.842 -0.285 -15.678 1.00 0.00 H new ATOM 2182 N TYR A 136 5.853 -2.263 -13.081 1.00 0.00 N ATOM 2183 CA TYR A 136 6.405 -3.612 -13.044 1.00 0.00 C ATOM 2184 C TYR A 136 5.448 -4.583 -12.361 1.00 0.00 C ATOM 2185 O TYR A 136 5.380 -5.756 -12.721 1.00 0.00 O ATOM 2186 CB TYR A 136 7.750 -3.602 -12.321 1.00 0.00 C ATOM 2187 CG TYR A 136 8.606 -4.816 -12.591 1.00 0.00 C ATOM 2188 CD1 TYR A 136 9.371 -4.893 -13.745 1.00 0.00 C ATOM 2189 CD2 TYR A 136 8.657 -5.874 -11.694 1.00 0.00 C ATOM 2190 CE1 TYR A 136 10.169 -5.991 -13.998 1.00 0.00 C ATOM 2191 CE2 TYR A 136 9.452 -6.977 -11.940 1.00 0.00 C ATOM 2192 CZ TYR A 136 10.206 -7.031 -13.095 1.00 0.00 C ATOM 2193 OH TYR A 136 11.006 -8.122 -13.346 1.00 0.00 O ATOM 0 H TYR A 136 6.245 -1.624 -12.389 1.00 0.00 H new ATOM 0 HA TYR A 136 6.549 -3.950 -14.070 1.00 0.00 H new ATOM 0 HB2 TYR A 136 8.302 -2.709 -12.616 1.00 0.00 H new ATOM 0 HB3 TYR A 136 7.573 -3.527 -11.248 1.00 0.00 H new ATOM 0 HD1 TYR A 136 9.342 -4.081 -14.457 1.00 0.00 H new ATOM 0 HD2 TYR A 136 8.067 -5.834 -10.791 1.00 0.00 H new ATOM 0 HE1 TYR A 136 10.762 -6.034 -14.900 1.00 0.00 H new ATOM 0 HE2 TYR A 136 9.483 -7.792 -11.233 1.00 0.00 H new ATOM 0 HH TYR A 136 10.920 -8.766 -12.613 1.00 0.00 H new ATOM 2203 N PHE A 137 4.706 -4.093 -11.378 1.00 0.00 N ATOM 2204 CA PHE A 137 3.805 -4.949 -10.618 1.00 0.00 C ATOM 2205 C PHE A 137 2.356 -4.754 -11.056 1.00 0.00 C ATOM 2206 O PHE A 137 1.607 -5.721 -11.193 1.00 0.00 O ATOM 2207 CB PHE A 137 3.945 -4.679 -9.117 1.00 0.00 C ATOM 2208 CG PHE A 137 5.324 -4.950 -8.576 1.00 0.00 C ATOM 2209 CD1 PHE A 137 6.298 -3.963 -8.589 1.00 0.00 C ATOM 2210 CD2 PHE A 137 5.648 -6.193 -8.056 1.00 0.00 C ATOM 2211 CE1 PHE A 137 7.564 -4.209 -8.098 1.00 0.00 C ATOM 2212 CE2 PHE A 137 6.915 -6.443 -7.561 1.00 0.00 C ATOM 2213 CZ PHE A 137 7.873 -5.450 -7.584 1.00 0.00 C ATOM 0 H PHE A 137 4.709 -3.115 -11.089 1.00 0.00 H new ATOM 0 HA PHE A 137 4.083 -5.984 -10.817 1.00 0.00 H new ATOM 0 HB2 PHE A 137 3.685 -3.639 -8.919 1.00 0.00 H new ATOM 0 HB3 PHE A 137 3.226 -5.296 -8.578 1.00 0.00 H new ATOM 0 HD1 PHE A 137 6.062 -2.988 -8.989 1.00 0.00 H new ATOM 0 HD2 PHE A 137 4.903 -6.975 -8.037 1.00 0.00 H new ATOM 0 HE1 PHE A 137 8.312 -3.430 -8.116 1.00 0.00 H new ATOM 0 HE2 PHE A 137 7.155 -7.415 -7.156 1.00 0.00 H new ATOM 0 HZ PHE A 137 8.863 -5.645 -7.200 1.00 0.00 H new ATOM 2223 N GLY A 138 1.970 -3.505 -11.289 1.00 0.00 N ATOM 2224 CA GLY A 138 0.609 -3.212 -11.695 1.00 0.00 C ATOM 2225 C GLY A 138 -0.090 -2.287 -10.719 1.00 0.00 C ATOM 2226 O GLY A 138 0.014 -2.465 -9.509 1.00 0.00 O ATOM 0 H GLY A 138 2.576 -2.689 -11.204 1.00 0.00 H new ATOM 0 HA2 GLY A 138 0.617 -2.755 -12.685 1.00 0.00 H new ATOM 0 HA3 GLY A 138 0.047 -4.143 -11.778 1.00 0.00 H new ATOM 2230 N GLU A 139 -0.801 -1.294 -11.243 1.00 0.00 N ATOM 2231 CA GLU A 139 -1.483 -0.314 -10.401 1.00 0.00 C ATOM 2232 C GLU A 139 -2.919 -0.745 -10.106 1.00 0.00 C ATOM 2233 O GLU A 139 -3.622 -0.123 -9.303 1.00 0.00 O ATOM 2234 CB GLU A 139 -1.480 1.072 -11.063 1.00 0.00 C ATOM 2235 CG GLU A 139 -2.296 1.165 -12.348 1.00 0.00 C ATOM 2236 CD GLU A 139 -1.630 0.492 -13.532 1.00 0.00 C ATOM 2237 OE1 GLU A 139 -1.861 -0.720 -13.746 1.00 0.00 O ATOM 2238 OE2 GLU A 139 -0.874 1.178 -14.253 1.00 0.00 O ATOM 0 H GLU A 139 -0.921 -1.146 -12.245 1.00 0.00 H new ATOM 0 HA GLU A 139 -0.938 -0.256 -9.459 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -1.865 1.801 -10.350 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -0.450 1.353 -11.281 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.273 0.711 -12.183 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -2.468 2.215 -12.585 1.00 0.00 H new ATOM 2245 N GLU A 140 -3.349 -1.806 -10.770 1.00 0.00 N ATOM 2246 CA GLU A 140 -4.699 -2.328 -10.607 1.00 0.00 C ATOM 2247 C GLU A 140 -4.691 -3.626 -9.804 1.00 0.00 C ATOM 2248 O GLU A 140 -5.732 -4.084 -9.333 1.00 0.00 O ATOM 2249 CB GLU A 140 -5.325 -2.570 -11.978 1.00 0.00 C ATOM 2250 CG GLU A 140 -4.442 -3.399 -12.892 1.00 0.00 C ATOM 2251 CD GLU A 140 -5.082 -3.687 -14.229 1.00 0.00 C ATOM 2252 OE1 GLU A 140 -5.146 -2.770 -15.076 1.00 0.00 O ATOM 2253 OE2 GLU A 140 -5.491 -4.842 -14.450 1.00 0.00 O ATOM 0 H GLU A 140 -2.777 -2.328 -11.434 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.289 -1.593 -10.060 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -6.283 -3.075 -11.851 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -5.531 -1.610 -12.452 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -3.500 -2.874 -13.052 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -4.202 -4.341 -12.400 1.00 0.00 H new ATOM 2260 N THR A 141 -3.517 -4.210 -9.646 1.00 0.00 N ATOM 2261 CA THR A 141 -3.389 -5.489 -8.971 1.00 0.00 C ATOM 2262 C THR A 141 -3.171 -5.292 -7.471 1.00 0.00 C ATOM 2263 O THR A 141 -2.511 -4.342 -7.057 1.00 0.00 O ATOM 2264 CB THR A 141 -2.221 -6.297 -9.571 1.00 0.00 C ATOM 2265 OG1 THR A 141 -2.331 -6.310 -11.003 1.00 0.00 O ATOM 2266 CG2 THR A 141 -2.218 -7.729 -9.055 1.00 0.00 C ATOM 0 H THR A 141 -2.636 -3.817 -9.977 1.00 0.00 H new ATOM 0 HA THR A 141 -4.316 -6.044 -9.116 1.00 0.00 H new ATOM 0 HB THR A 141 -1.288 -5.820 -9.270 1.00 0.00 H new ATOM 0 HG1 THR A 141 -1.587 -6.822 -11.384 1.00 0.00 H new ATOM 0 HG21 THR A 141 -1.383 -8.273 -9.496 1.00 0.00 H new ATOM 0 HG22 THR A 141 -2.115 -7.725 -7.970 1.00 0.00 H new ATOM 0 HG23 THR A 141 -3.154 -8.216 -9.329 1.00 0.00 H new ATOM 2274 N VAL A 142 -3.763 -6.169 -6.670 1.00 0.00 N ATOM 2275 CA VAL A 142 -3.563 -6.153 -5.229 1.00 0.00 C ATOM 2276 C VAL A 142 -2.137 -6.576 -4.898 1.00 0.00 C ATOM 2277 O VAL A 142 -1.655 -7.590 -5.410 1.00 0.00 O ATOM 2278 CB VAL A 142 -4.561 -7.094 -4.512 1.00 0.00 C ATOM 2279 CG1 VAL A 142 -4.299 -7.133 -3.013 1.00 0.00 C ATOM 2280 CG2 VAL A 142 -5.987 -6.654 -4.787 1.00 0.00 C ATOM 0 H VAL A 142 -4.389 -6.904 -6.998 1.00 0.00 H new ATOM 0 HA VAL A 142 -3.737 -5.136 -4.877 1.00 0.00 H new ATOM 0 HB VAL A 142 -4.419 -8.101 -4.905 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -5.015 -7.802 -2.536 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -3.287 -7.494 -2.830 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -4.407 -6.131 -2.599 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -6.679 -7.324 -4.277 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.131 -5.637 -4.422 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -6.177 -6.684 -5.860 1.00 0.00 H new ATOM 2290 N PRO A 143 -1.440 -5.792 -4.059 1.00 0.00 N ATOM 2291 CA PRO A 143 -0.065 -6.086 -3.653 1.00 0.00 C ATOM 2292 C PRO A 143 0.076 -7.481 -3.054 1.00 0.00 C ATOM 2293 O PRO A 143 -0.457 -7.771 -1.983 1.00 0.00 O ATOM 2294 CB PRO A 143 0.240 -5.022 -2.595 1.00 0.00 C ATOM 2295 CG PRO A 143 -0.708 -3.910 -2.883 1.00 0.00 C ATOM 2296 CD PRO A 143 -1.944 -4.551 -3.448 1.00 0.00 C ATOM 0 HA PRO A 143 0.618 -6.066 -4.503 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.095 -5.414 -1.588 1.00 0.00 H new ATOM 0 HB3 PRO A 143 1.275 -4.686 -2.660 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -0.939 -3.350 -1.977 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -0.276 -3.204 -3.592 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -2.680 -4.757 -2.671 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -2.428 -3.909 -4.184 1.00 0.00 H new