USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 917 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 60 SER OG : rot 180:sc= 0.449 USER MOD Set 1.2: A 91 SER OG : rot -142:sc= 0.485 USER MOD Single : A 16 TYR OH : rot 172:sc= 1.19 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 179:sc= -0.0136 (180deg=-0.0147) USER MOD Single : A 28 ASN : amide:sc= 0.794 K(o=0.79,f=-0.19) USER MOD Single : A 29 LYS NZ :NH3+ 135:sc= 0.0183 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -0.211 K(o=-0.21,f=-2.2!) USER MOD Single : A 35 ASN : amide:sc= -0.0978 X(o=-0.098,f=-0.41) USER MOD Single : A 37 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0.955 K(o=0.96,f=-0.53) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.243 K(o=-0.24,f=-2.2!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0819 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0.0013) USER MOD Single : A 78 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00131) USER MOD Single : A 79 SER OG : rot 136:sc= 0.87 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 88:sc= 1.24 USER MOD Single : A 83 SER OG : rot 74:sc= 0.0799 USER MOD Single : A 93 ASN : amide:sc= 0.341 K(o=0.34,f=-4.2!) USER MOD Single : A 95 LYS NZ :NH3+ 158:sc= 0.247 (180deg=0.107) USER MOD Single : A 101 SER OG : rot 92:sc= 1.24 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.111 X(o=-0.11,f=-0.12) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 TYR OH : rot 30:sc= -0.0761 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.25 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 242 N TYR A 16 7.137 2.252 -9.273 1.00 0.00 N ATOM 243 CA TYR A 16 8.052 1.137 -9.160 1.00 0.00 C ATOM 244 C TYR A 16 8.044 0.384 -10.494 1.00 0.00 C ATOM 245 O TYR A 16 7.114 0.530 -11.295 1.00 0.00 O ATOM 246 CB TYR A 16 7.611 0.235 -7.994 1.00 0.00 C ATOM 247 CG TYR A 16 6.282 -0.459 -8.209 1.00 0.00 C ATOM 248 CD1 TYR A 16 6.216 -1.701 -8.870 1.00 0.00 C ATOM 249 CD2 TYR A 16 5.111 0.142 -7.720 1.00 0.00 C ATOM 250 CE1 TYR A 16 4.977 -2.349 -9.024 1.00 0.00 C ATOM 251 CE2 TYR A 16 3.887 -0.541 -7.789 1.00 0.00 C ATOM 252 CZ TYR A 16 3.813 -1.787 -8.453 1.00 0.00 C ATOM 253 OH TYR A 16 2.638 -2.465 -8.503 1.00 0.00 O ATOM 0 HA TYR A 16 9.067 1.474 -8.950 1.00 0.00 H new ATOM 0 HB2 TYR A 16 8.378 -0.520 -7.824 1.00 0.00 H new ATOM 0 HB3 TYR A 16 7.550 0.837 -7.087 1.00 0.00 H new ATOM 0 HD1 TYR A 16 7.116 -2.155 -9.258 1.00 0.00 H new ATOM 0 HD2 TYR A 16 5.152 1.132 -7.290 1.00 0.00 H new ATOM 0 HE1 TYR A 16 4.915 -3.274 -9.578 1.00 0.00 H new ATOM 0 HE2 TYR A 16 3.004 -0.116 -7.336 1.00 0.00 H new ATOM 0 HH TYR A 16 1.970 -2.002 -7.956 1.00 0.00 H new ATOM 263 N LYS A 17 9.033 -0.486 -10.708 1.00 0.00 N ATOM 264 CA LYS A 17 8.999 -1.520 -11.747 1.00 0.00 C ATOM 265 C LYS A 17 9.283 -2.868 -11.102 1.00 0.00 C ATOM 266 O LYS A 17 9.613 -2.931 -9.915 1.00 0.00 O ATOM 267 CB LYS A 17 9.958 -1.215 -12.923 1.00 0.00 C ATOM 268 CG LYS A 17 11.446 -1.395 -12.584 1.00 0.00 C ATOM 269 CD LYS A 17 12.381 -1.656 -13.769 1.00 0.00 C ATOM 270 CE LYS A 17 12.901 -0.333 -14.326 1.00 0.00 C ATOM 271 NZ LYS A 17 13.677 -0.500 -15.569 1.00 0.00 N ATOM 0 H LYS A 17 9.892 -0.493 -10.158 1.00 0.00 H new ATOM 0 HA LYS A 17 8.005 -1.539 -12.194 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.706 -1.865 -13.761 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.794 -0.190 -13.255 1.00 0.00 H new ATOM 0 HG2 LYS A 17 11.790 -0.500 -12.066 1.00 0.00 H new ATOM 0 HG3 LYS A 17 11.540 -2.225 -11.884 1.00 0.00 H new ATOM 0 HD2 LYS A 17 13.217 -2.280 -13.453 1.00 0.00 H new ATOM 0 HD3 LYS A 17 11.850 -2.204 -14.547 1.00 0.00 H new ATOM 0 HE2 LYS A 17 12.058 0.332 -14.516 1.00 0.00 H new ATOM 0 HE3 LYS A 17 13.526 0.151 -13.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 14.005 0.429 -15.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 14.498 -1.111 -15.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 13.076 -0.936 -16.297 1.00 0.00 H new ATOM 285 N ILE A 18 9.266 -3.928 -11.901 1.00 0.00 N ATOM 286 CA ILE A 18 9.838 -5.216 -11.548 1.00 0.00 C ATOM 287 C ILE A 18 10.797 -5.566 -12.700 1.00 0.00 C ATOM 288 O ILE A 18 10.639 -5.081 -13.828 1.00 0.00 O ATOM 289 CB ILE A 18 8.700 -6.236 -11.267 1.00 0.00 C ATOM 290 CG1 ILE A 18 7.720 -5.695 -10.189 1.00 0.00 C ATOM 291 CG2 ILE A 18 9.249 -7.601 -10.817 1.00 0.00 C ATOM 292 CD1 ILE A 18 6.583 -6.648 -9.805 1.00 0.00 C ATOM 0 H ILE A 18 8.845 -3.913 -12.830 1.00 0.00 H new ATOM 0 HA ILE A 18 10.413 -5.219 -10.622 1.00 0.00 H new ATOM 0 HB ILE A 18 8.165 -6.373 -12.207 1.00 0.00 H new ATOM 0 HG12 ILE A 18 8.289 -5.454 -9.291 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.285 -4.763 -10.551 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.420 -8.283 -10.631 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.889 -8.011 -11.598 1.00 0.00 H new ATOM 0 HG23 ILE A 18 9.828 -7.477 -9.902 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.955 -6.179 -9.047 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.982 -6.871 -10.687 1.00 0.00 H new ATOM 0 HD13 ILE A 18 7.002 -7.573 -9.408 1.00 0.00 H new ATOM 304 N VAL A 19 11.837 -6.346 -12.418 1.00 0.00 N ATOM 305 CA VAL A 19 12.785 -6.866 -13.379 1.00 0.00 C ATOM 306 C VAL A 19 12.571 -8.379 -13.473 1.00 0.00 C ATOM 307 O VAL A 19 11.429 -8.834 -13.436 1.00 0.00 O ATOM 308 CB VAL A 19 14.207 -6.388 -13.003 1.00 0.00 C ATOM 309 CG1 VAL A 19 14.352 -4.871 -13.162 1.00 0.00 C ATOM 310 CG2 VAL A 19 14.662 -6.748 -11.585 1.00 0.00 C ATOM 0 H VAL A 19 12.045 -6.643 -11.465 1.00 0.00 H new ATOM 0 HA VAL A 19 12.637 -6.484 -14.389 1.00 0.00 H new ATOM 0 HB VAL A 19 14.845 -6.927 -13.703 1.00 0.00 H new ATOM 0 HG11 VAL A 19 15.364 -4.572 -12.889 1.00 0.00 H new ATOM 0 HG12 VAL A 19 14.159 -4.594 -14.198 1.00 0.00 H new ATOM 0 HG13 VAL A 19 13.637 -4.367 -12.512 1.00 0.00 H new ATOM 0 HG21 VAL A 19 15.671 -6.369 -11.419 1.00 0.00 H new ATOM 0 HG22 VAL A 19 13.982 -6.300 -10.860 1.00 0.00 H new ATOM 0 HG23 VAL A 19 14.657 -7.831 -11.465 1.00 0.00 H new ATOM 320 N ASP A 20 13.657 -9.140 -13.596 1.00 0.00 N ATOM 321 CA ASP A 20 13.788 -10.576 -13.444 1.00 0.00 C ATOM 322 C ASP A 20 12.781 -11.154 -12.445 1.00 0.00 C ATOM 323 O ASP A 20 11.734 -11.665 -12.842 1.00 0.00 O ATOM 324 CB ASP A 20 15.229 -10.844 -13.005 1.00 0.00 C ATOM 325 CG ASP A 20 15.509 -12.336 -12.910 1.00 0.00 C ATOM 326 OD1 ASP A 20 15.373 -13.032 -13.937 1.00 0.00 O ATOM 327 OD2 ASP A 20 16.063 -12.745 -11.865 1.00 0.00 O ATOM 0 H ASP A 20 14.555 -8.716 -13.828 1.00 0.00 H new ATOM 0 HA ASP A 20 13.568 -11.072 -14.389 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.919 -10.387 -13.715 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.410 -10.375 -12.038 1.00 0.00 H new ATOM 332 N ASP A 21 13.092 -11.003 -11.155 1.00 0.00 N ATOM 333 CA ASP A 21 12.312 -11.411 -9.989 1.00 0.00 C ATOM 334 C ASP A 21 12.464 -10.354 -8.882 1.00 0.00 C ATOM 335 O ASP A 21 12.177 -10.640 -7.721 1.00 0.00 O ATOM 336 CB ASP A 21 12.796 -12.755 -9.409 1.00 0.00 C ATOM 337 CG ASP A 21 12.741 -13.971 -10.319 1.00 0.00 C ATOM 338 OD1 ASP A 21 11.756 -14.160 -11.070 1.00 0.00 O ATOM 339 OD2 ASP A 21 13.676 -14.803 -10.231 1.00 0.00 O ATOM 0 H ASP A 21 13.967 -10.556 -10.880 1.00 0.00 H new ATOM 0 HA ASP A 21 11.277 -11.515 -10.315 1.00 0.00 H new ATOM 0 HB2 ASP A 21 13.827 -12.628 -9.079 1.00 0.00 H new ATOM 0 HB3 ASP A 21 12.202 -12.972 -8.521 1.00 0.00 H new ATOM 344 N VAL A 22 12.985 -9.158 -9.192 1.00 0.00 N ATOM 345 CA VAL A 22 13.310 -8.136 -8.192 1.00 0.00 C ATOM 346 C VAL A 22 12.420 -6.920 -8.428 1.00 0.00 C ATOM 347 O VAL A 22 12.160 -6.553 -9.574 1.00 0.00 O ATOM 348 CB VAL A 22 14.829 -7.805 -8.150 1.00 0.00 C ATOM 349 CG1 VAL A 22 15.134 -6.881 -6.965 1.00 0.00 C ATOM 350 CG2 VAL A 22 15.675 -9.092 -8.104 1.00 0.00 C ATOM 0 H VAL A 22 13.193 -8.873 -10.149 1.00 0.00 H new ATOM 0 HA VAL A 22 13.099 -8.522 -7.195 1.00 0.00 H new ATOM 0 HB VAL A 22 15.099 -7.279 -9.066 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.200 -6.655 -6.945 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.569 -5.955 -7.071 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.850 -7.375 -6.036 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.733 -8.831 -8.075 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.418 -9.665 -7.213 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.473 -9.692 -8.991 1.00 0.00 H new ATOM 360 N VAL A 23 11.938 -6.309 -7.351 1.00 0.00 N ATOM 361 CA VAL A 23 11.085 -5.133 -7.385 1.00 0.00 C ATOM 362 C VAL A 23 11.985 -3.904 -7.249 1.00 0.00 C ATOM 363 O VAL A 23 12.828 -3.859 -6.355 1.00 0.00 O ATOM 364 CB VAL A 23 10.060 -5.231 -6.240 1.00 0.00 C ATOM 365 CG1 VAL A 23 9.088 -4.051 -6.293 1.00 0.00 C ATOM 366 CG2 VAL A 23 9.276 -6.553 -6.277 1.00 0.00 C ATOM 0 H VAL A 23 12.138 -6.630 -6.404 1.00 0.00 H new ATOM 0 HA VAL A 23 10.529 -5.057 -8.319 1.00 0.00 H new ATOM 0 HB VAL A 23 10.619 -5.202 -5.305 1.00 0.00 H new ATOM 0 HG11 VAL A 23 8.370 -4.134 -5.477 1.00 0.00 H new ATOM 0 HG12 VAL A 23 9.643 -3.118 -6.194 1.00 0.00 H new ATOM 0 HG13 VAL A 23 8.558 -4.059 -7.245 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.565 -6.578 -5.451 1.00 0.00 H new ATOM 0 HG22 VAL A 23 8.738 -6.630 -7.222 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.969 -7.390 -6.185 1.00 0.00 H new ATOM 376 N ILE A 24 11.828 -2.905 -8.119 1.00 0.00 N ATOM 377 CA ILE A 24 12.593 -1.663 -8.091 1.00 0.00 C ATOM 378 C ILE A 24 11.623 -0.594 -7.587 1.00 0.00 C ATOM 379 O ILE A 24 10.846 -0.054 -8.374 1.00 0.00 O ATOM 380 CB ILE A 24 13.160 -1.329 -9.495 1.00 0.00 C ATOM 381 CG1 ILE A 24 13.990 -2.416 -10.228 1.00 0.00 C ATOM 382 CG2 ILE A 24 13.994 -0.038 -9.507 1.00 0.00 C ATOM 383 CD1 ILE A 24 14.582 -3.546 -9.410 1.00 0.00 C ATOM 0 H ILE A 24 11.149 -2.941 -8.879 1.00 0.00 H new ATOM 0 HA ILE A 24 13.463 -1.732 -7.438 1.00 0.00 H new ATOM 0 HB ILE A 24 12.228 -1.230 -10.052 1.00 0.00 H new ATOM 0 HG12 ILE A 24 13.354 -2.859 -10.994 1.00 0.00 H new ATOM 0 HG13 ILE A 24 14.809 -1.916 -10.744 1.00 0.00 H new ATOM 0 HG21 ILE A 24 14.365 0.146 -10.515 1.00 0.00 H new ATOM 0 HG22 ILE A 24 13.372 0.800 -9.191 1.00 0.00 H new ATOM 0 HG23 ILE A 24 14.837 -0.143 -8.824 1.00 0.00 H new ATOM 0 HD11 ILE A 24 15.132 -4.221 -10.066 1.00 0.00 H new ATOM 0 HD12 ILE A 24 15.259 -3.137 -8.661 1.00 0.00 H new ATOM 0 HD13 ILE A 24 13.781 -4.094 -8.914 1.00 0.00 H new ATOM 395 N LEU A 25 11.616 -0.321 -6.281 1.00 0.00 N ATOM 396 CA LEU A 25 10.793 0.732 -5.684 1.00 0.00 C ATOM 397 C LEU A 25 11.499 2.062 -5.975 1.00 0.00 C ATOM 398 O LEU A 25 12.727 2.145 -5.808 1.00 0.00 O ATOM 399 CB LEU A 25 10.646 0.503 -4.168 1.00 0.00 C ATOM 400 CG LEU A 25 10.145 -0.910 -3.800 1.00 0.00 C ATOM 401 CD1 LEU A 25 10.250 -1.147 -2.296 1.00 0.00 C ATOM 402 CD2 LEU A 25 8.700 -1.172 -4.222 1.00 0.00 C ATOM 0 H LEU A 25 12.185 -0.828 -5.603 1.00 0.00 H new ATOM 0 HA LEU A 25 9.787 0.733 -6.104 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.610 0.673 -3.689 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.954 1.241 -3.763 1.00 0.00 H new ATOM 0 HG LEU A 25 10.789 -1.597 -4.349 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.892 -2.149 -2.060 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.290 -1.051 -1.984 1.00 0.00 H new ATOM 0 HD13 LEU A 25 9.644 -0.411 -1.768 1.00 0.00 H new ATOM 0 HD21 LEU A 25 8.414 -2.183 -3.932 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.042 -0.454 -3.732 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.612 -1.066 -5.303 1.00 0.00 H new ATOM 414 N MET A 26 10.771 3.085 -6.430 1.00 0.00 N ATOM 415 CA MET A 26 11.335 4.350 -6.904 1.00 0.00 C ATOM 416 C MET A 26 10.585 5.515 -6.238 1.00 0.00 C ATOM 417 O MET A 26 9.546 5.929 -6.748 1.00 0.00 O ATOM 418 CB MET A 26 11.294 4.399 -8.440 1.00 0.00 C ATOM 419 CG MET A 26 12.339 3.442 -9.027 1.00 0.00 C ATOM 420 SD MET A 26 12.367 3.292 -10.835 1.00 0.00 S ATOM 421 CE MET A 26 10.910 2.246 -11.045 1.00 0.00 C ATOM 0 H MET A 26 9.753 3.056 -6.480 1.00 0.00 H new ATOM 0 HA MET A 26 12.384 4.437 -6.622 1.00 0.00 H new ATOM 0 HB2 MET A 26 10.300 4.125 -8.794 1.00 0.00 H new ATOM 0 HB3 MET A 26 11.486 5.415 -8.784 1.00 0.00 H new ATOM 0 HG2 MET A 26 13.325 3.767 -8.696 1.00 0.00 H new ATOM 0 HG3 MET A 26 12.171 2.451 -8.604 1.00 0.00 H new ATOM 0 HE1 MET A 26 10.749 2.055 -12.106 1.00 0.00 H new ATOM 0 HE2 MET A 26 11.063 1.300 -10.525 1.00 0.00 H new ATOM 0 HE3 MET A 26 10.037 2.751 -10.631 1.00 0.00 H new ATOM 431 N PRO A 27 11.077 6.037 -5.095 1.00 0.00 N ATOM 432 CA PRO A 27 10.341 6.914 -4.171 1.00 0.00 C ATOM 433 C PRO A 27 10.237 8.377 -4.648 1.00 0.00 C ATOM 434 O PRO A 27 10.438 9.308 -3.870 1.00 0.00 O ATOM 435 CB PRO A 27 11.132 6.772 -2.854 1.00 0.00 C ATOM 436 CG PRO A 27 12.569 6.602 -3.317 1.00 0.00 C ATOM 437 CD PRO A 27 12.384 5.726 -4.550 1.00 0.00 C ATOM 0 HA PRO A 27 9.294 6.626 -4.078 1.00 0.00 H new ATOM 0 HB2 PRO A 27 11.016 7.651 -2.220 1.00 0.00 H new ATOM 0 HB3 PRO A 27 10.794 5.914 -2.274 1.00 0.00 H new ATOM 0 HG2 PRO A 27 13.039 7.556 -3.557 1.00 0.00 H new ATOM 0 HG3 PRO A 27 13.190 6.122 -2.561 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.165 5.923 -5.284 1.00 0.00 H new ATOM 0 HD3 PRO A 27 12.452 4.670 -4.287 1.00 0.00 H new ATOM 445 N ASN A 28 9.922 8.577 -5.927 1.00 0.00 N ATOM 446 CA ASN A 28 9.960 9.821 -6.696 1.00 0.00 C ATOM 447 C ASN A 28 9.272 11.012 -6.009 1.00 0.00 C ATOM 448 O ASN A 28 8.098 11.277 -6.257 1.00 0.00 O ATOM 449 CB ASN A 28 9.465 9.566 -8.143 1.00 0.00 C ATOM 450 CG ASN A 28 8.188 8.736 -8.284 1.00 0.00 C ATOM 451 OD1 ASN A 28 8.136 7.790 -9.068 1.00 0.00 O ATOM 452 ND2 ASN A 28 7.138 9.054 -7.558 1.00 0.00 N ATOM 0 H ASN A 28 9.604 7.799 -6.505 1.00 0.00 H new ATOM 0 HA ASN A 28 11.002 10.137 -6.748 1.00 0.00 H new ATOM 0 HB2 ASN A 28 9.302 10.530 -8.624 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.261 9.066 -8.694 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.276 8.515 -7.644 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.186 9.839 -6.909 1.00 0.00 H new ATOM 459 N LYS A 29 10.021 11.762 -5.193 1.00 0.00 N ATOM 460 CA LYS A 29 9.618 12.900 -4.354 1.00 0.00 C ATOM 461 C LYS A 29 8.226 12.773 -3.710 1.00 0.00 C ATOM 462 O LYS A 29 7.525 13.772 -3.566 1.00 0.00 O ATOM 463 CB LYS A 29 9.881 14.246 -5.071 1.00 0.00 C ATOM 464 CG LYS A 29 8.835 14.714 -6.108 1.00 0.00 C ATOM 465 CD LYS A 29 9.370 14.843 -7.539 1.00 0.00 C ATOM 466 CE LYS A 29 9.659 13.451 -8.099 1.00 0.00 C ATOM 467 NZ LYS A 29 9.794 13.431 -9.566 1.00 0.00 N ATOM 0 H LYS A 29 11.018 11.571 -5.093 1.00 0.00 H new ATOM 0 HA LYS A 29 10.271 12.881 -3.481 1.00 0.00 H new ATOM 0 HB2 LYS A 29 9.972 15.021 -4.310 1.00 0.00 H new ATOM 0 HB3 LYS A 29 10.846 14.178 -5.573 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.002 14.011 -6.107 1.00 0.00 H new ATOM 0 HG3 LYS A 29 8.438 15.679 -5.794 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.641 15.356 -8.167 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.278 15.446 -7.547 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.577 13.070 -7.651 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.856 12.775 -7.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.622 12.860 -9.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.938 13.017 -9.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.917 14.402 -9.917 1.00 0.00 H new ATOM 481 N GLU A 30 7.807 11.568 -3.314 1.00 0.00 N ATOM 482 CA GLU A 30 6.410 11.295 -2.947 1.00 0.00 C ATOM 483 C GLU A 30 6.243 10.743 -1.530 1.00 0.00 C ATOM 484 O GLU A 30 5.149 10.302 -1.179 1.00 0.00 O ATOM 485 CB GLU A 30 5.779 10.351 -3.980 1.00 0.00 C ATOM 486 CG GLU A 30 6.339 8.924 -3.874 1.00 0.00 C ATOM 487 CD GLU A 30 5.806 7.966 -4.937 1.00 0.00 C ATOM 488 OE1 GLU A 30 4.929 8.352 -5.755 1.00 0.00 O ATOM 489 OE2 GLU A 30 6.248 6.795 -4.906 1.00 0.00 O ATOM 0 H GLU A 30 8.421 10.757 -3.238 1.00 0.00 H new ATOM 0 HA GLU A 30 5.889 12.252 -2.951 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.699 10.328 -3.838 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.960 10.738 -4.983 1.00 0.00 H new ATOM 0 HG2 GLU A 30 7.426 8.965 -3.949 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.102 8.524 -2.888 1.00 0.00 H new ATOM 496 N LEU A 31 7.318 10.710 -0.737 1.00 0.00 N ATOM 497 CA LEU A 31 7.371 10.161 0.621 1.00 0.00 C ATOM 498 C LEU A 31 6.659 11.112 1.588 1.00 0.00 C ATOM 499 O LEU A 31 7.266 11.705 2.478 1.00 0.00 O ATOM 500 CB LEU A 31 8.842 9.878 0.989 1.00 0.00 C ATOM 501 CG LEU A 31 9.335 8.452 0.672 1.00 0.00 C ATOM 502 CD1 LEU A 31 8.801 7.826 -0.620 1.00 0.00 C ATOM 503 CD2 LEU A 31 10.865 8.478 0.587 1.00 0.00 C ATOM 0 H LEU A 31 8.218 11.083 -1.039 1.00 0.00 H new ATOM 0 HA LEU A 31 6.841 9.211 0.687 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.476 10.590 0.460 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.975 10.063 2.055 1.00 0.00 H new ATOM 0 HG LEU A 31 8.950 7.830 1.480 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.216 6.825 -0.738 1.00 0.00 H new ATOM 0 HD12 LEU A 31 7.714 7.765 -0.573 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.093 8.442 -1.471 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.234 7.477 0.363 1.00 0.00 H new ATOM 0 HD22 LEU A 31 11.174 9.164 -0.202 1.00 0.00 H new ATOM 0 HD23 LEU A 31 11.277 8.812 1.539 1.00 0.00 H new ATOM 515 N ASN A 32 5.357 11.276 1.376 1.00 0.00 N ATOM 516 CA ASN A 32 4.459 12.288 1.923 1.00 0.00 C ATOM 517 C ASN A 32 4.006 12.004 3.364 1.00 0.00 C ATOM 518 O ASN A 32 2.931 12.457 3.766 1.00 0.00 O ATOM 519 CB ASN A 32 3.263 12.447 0.964 1.00 0.00 C ATOM 520 CG ASN A 32 2.415 11.191 0.844 1.00 0.00 C ATOM 521 OD1 ASN A 32 1.787 10.749 1.797 1.00 0.00 O ATOM 522 ND2 ASN A 32 2.418 10.567 -0.320 1.00 0.00 N ATOM 0 H ASN A 32 4.855 10.641 0.756 1.00 0.00 H new ATOM 0 HA ASN A 32 5.010 13.226 1.995 1.00 0.00 H new ATOM 0 HB2 ASN A 32 2.636 13.268 1.310 1.00 0.00 H new ATOM 0 HB3 ASN A 32 3.633 12.723 -0.024 1.00 0.00 H new ATOM 0 HD21 ASN A 32 1.891 9.701 -0.436 1.00 0.00 H new ATOM 0 HD22 ASN A 32 2.947 10.951 -1.103 1.00 0.00 H new ATOM 529 N ILE A 33 4.808 11.275 4.151 1.00 0.00 N ATOM 530 CA ILE A 33 4.543 10.846 5.528 1.00 0.00 C ATOM 531 C ILE A 33 3.493 9.740 5.554 1.00 0.00 C ATOM 532 O ILE A 33 3.837 8.628 5.946 1.00 0.00 O ATOM 533 CB ILE A 33 4.283 12.057 6.466 1.00 0.00 C ATOM 534 CG1 ILE A 33 5.626 12.583 6.985 1.00 0.00 C ATOM 535 CG2 ILE A 33 3.260 11.834 7.595 1.00 0.00 C ATOM 536 CD1 ILE A 33 6.320 11.726 8.034 1.00 0.00 C ATOM 0 H ILE A 33 5.716 10.949 3.821 1.00 0.00 H new ATOM 0 HA ILE A 33 5.437 10.387 5.950 1.00 0.00 H new ATOM 0 HB ILE A 33 3.789 12.814 5.856 1.00 0.00 H new ATOM 0 HG12 ILE A 33 6.300 12.699 6.136 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.467 13.576 7.404 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.162 12.747 8.183 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.293 11.575 7.164 1.00 0.00 H new ATOM 0 HG23 ILE A 33 3.600 11.023 8.239 1.00 0.00 H new ATOM 0 HD11 ILE A 33 7.259 12.197 8.325 1.00 0.00 H new ATOM 0 HD12 ILE A 33 5.676 11.629 8.908 1.00 0.00 H new ATOM 0 HD13 ILE A 33 6.523 10.738 7.621 1.00 0.00 H new ATOM 548 N GLU A 34 2.250 9.965 5.126 1.00 0.00 N ATOM 549 CA GLU A 34 1.277 8.872 5.125 1.00 0.00 C ATOM 550 C GLU A 34 1.610 7.831 4.055 1.00 0.00 C ATOM 551 O GLU A 34 1.258 6.661 4.231 1.00 0.00 O ATOM 552 CB GLU A 34 -0.165 9.382 5.072 1.00 0.00 C ATOM 553 CG GLU A 34 -0.492 10.071 6.407 1.00 0.00 C ATOM 554 CD GLU A 34 -2.000 10.135 6.669 1.00 0.00 C ATOM 555 OE1 GLU A 34 -2.593 9.088 7.038 1.00 0.00 O ATOM 556 OE2 GLU A 34 -2.588 11.236 6.586 1.00 0.00 O ATOM 0 H GLU A 34 1.901 10.861 4.787 1.00 0.00 H new ATOM 0 HA GLU A 34 1.355 8.352 6.080 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.289 10.082 4.245 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -0.852 8.555 4.895 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -0.006 9.533 7.221 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -0.082 11.081 6.403 1.00 0.00 H new ATOM 563 N ASN A 35 2.433 8.212 3.070 1.00 0.00 N ATOM 564 CA ASN A 35 3.145 7.283 2.195 1.00 0.00 C ATOM 565 C ASN A 35 3.823 6.193 3.013 1.00 0.00 C ATOM 566 O ASN A 35 3.674 5.019 2.696 1.00 0.00 O ATOM 567 CB ASN A 35 4.212 8.002 1.364 1.00 0.00 C ATOM 568 CG ASN A 35 5.151 7.012 0.680 1.00 0.00 C ATOM 569 OD1 ASN A 35 6.212 6.698 1.213 1.00 0.00 O ATOM 570 ND2 ASN A 35 4.792 6.516 -0.490 1.00 0.00 N ATOM 0 H ASN A 35 2.623 9.191 2.858 1.00 0.00 H new ATOM 0 HA ASN A 35 2.406 6.844 1.525 1.00 0.00 H new ATOM 0 HB2 ASN A 35 3.729 8.626 0.612 1.00 0.00 H new ATOM 0 HB3 ASN A 35 4.789 8.667 2.007 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.401 5.856 -0.973 1.00 0.00 H new ATOM 0 HD22 ASN A 35 3.905 6.793 -0.911 1.00 0.00 H new ATOM 577 N ALA A 36 4.570 6.564 4.055 1.00 0.00 N ATOM 578 CA ALA A 36 5.300 5.615 4.877 1.00 0.00 C ATOM 579 C ALA A 36 4.331 4.690 5.613 1.00 0.00 C ATOM 580 O ALA A 36 4.597 3.498 5.768 1.00 0.00 O ATOM 581 CB ALA A 36 6.166 6.373 5.874 1.00 0.00 C ATOM 0 H ALA A 36 4.682 7.535 4.348 1.00 0.00 H new ATOM 0 HA ALA A 36 5.936 5.003 4.238 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.715 5.663 6.492 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.871 7.007 5.336 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.533 6.993 6.509 1.00 0.00 H new ATOM 587 N HIS A 37 3.196 5.238 6.054 1.00 0.00 N ATOM 588 CA HIS A 37 2.189 4.500 6.794 1.00 0.00 C ATOM 589 C HIS A 37 1.633 3.364 5.932 1.00 0.00 C ATOM 590 O HIS A 37 1.580 2.221 6.398 1.00 0.00 O ATOM 591 CB HIS A 37 1.083 5.443 7.297 1.00 0.00 C ATOM 592 CG HIS A 37 0.628 5.129 8.700 1.00 0.00 C ATOM 593 ND1 HIS A 37 0.075 3.947 9.146 1.00 0.00 N ATOM 594 CD2 HIS A 37 0.728 5.972 9.773 1.00 0.00 C ATOM 595 CE1 HIS A 37 -0.141 4.079 10.466 1.00 0.00 C ATOM 596 NE2 HIS A 37 0.249 5.293 10.899 1.00 0.00 N ATOM 0 H HIS A 37 2.955 6.217 5.902 1.00 0.00 H new ATOM 0 HA HIS A 37 2.648 4.052 7.675 1.00 0.00 H new ATOM 0 HB2 HIS A 37 1.446 6.470 7.261 1.00 0.00 H new ATOM 0 HB3 HIS A 37 0.229 5.383 6.623 1.00 0.00 H new ATOM 0 HD2 HIS A 37 1.109 6.982 9.754 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -0.570 3.313 11.095 1.00 0.00 H new ATOM 0 HE2 HIS A 37 0.204 5.646 11.855 1.00 0.00 H new ATOM 604 N LEU A 38 1.194 3.636 4.693 1.00 0.00 N ATOM 605 CA LEU A 38 0.656 2.583 3.837 1.00 0.00 C ATOM 606 C LEU A 38 1.750 1.783 3.132 1.00 0.00 C ATOM 607 O LEU A 38 1.462 0.658 2.727 1.00 0.00 O ATOM 608 CB LEU A 38 -0.489 3.110 2.954 1.00 0.00 C ATOM 609 CG LEU A 38 -0.261 3.571 1.506 1.00 0.00 C ATOM 610 CD1 LEU A 38 0.778 4.668 1.347 1.00 0.00 C ATOM 611 CD2 LEU A 38 0.048 2.418 0.546 1.00 0.00 C ATOM 0 H LEU A 38 1.203 4.565 4.272 1.00 0.00 H new ATOM 0 HA LEU A 38 0.180 1.829 4.464 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.244 2.324 2.917 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.932 3.953 3.485 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.223 4.003 1.231 1.00 0.00 H new ATOM 0 HD11 LEU A 38 0.872 4.930 0.293 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.469 5.547 1.913 1.00 0.00 H new ATOM 0 HD13 LEU A 38 1.739 4.316 1.721 1.00 0.00 H new ATOM 0 HD21 LEU A 38 0.198 2.812 -0.459 1.00 0.00 H new ATOM 0 HD22 LEU A 38 0.952 1.904 0.873 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.786 1.716 0.540 1.00 0.00 H new ATOM 623 N PHE A 39 2.996 2.279 3.085 1.00 0.00 N ATOM 624 CA PHE A 39 4.156 1.661 2.433 1.00 0.00 C ATOM 625 C PHE A 39 4.223 0.173 2.753 1.00 0.00 C ATOM 626 O PHE A 39 4.313 -0.655 1.852 1.00 0.00 O ATOM 627 CB PHE A 39 5.473 2.352 2.852 1.00 0.00 C ATOM 628 CG PHE A 39 6.550 2.502 1.789 1.00 0.00 C ATOM 629 CD1 PHE A 39 6.391 3.418 0.730 1.00 0.00 C ATOM 630 CD2 PHE A 39 7.775 1.822 1.922 1.00 0.00 C ATOM 631 CE1 PHE A 39 7.455 3.672 -0.154 1.00 0.00 C ATOM 632 CE2 PHE A 39 8.810 2.014 0.990 1.00 0.00 C ATOM 633 CZ PHE A 39 8.659 2.957 -0.040 1.00 0.00 C ATOM 0 H PHE A 39 3.232 3.169 3.525 1.00 0.00 H new ATOM 0 HA PHE A 39 4.033 1.787 1.357 1.00 0.00 H new ATOM 0 HB2 PHE A 39 5.228 3.346 3.227 1.00 0.00 H new ATOM 0 HB3 PHE A 39 5.897 1.792 3.686 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.448 3.927 0.597 1.00 0.00 H new ATOM 0 HD2 PHE A 39 7.922 1.144 2.750 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.346 4.421 -0.925 1.00 0.00 H new ATOM 0 HE2 PHE A 39 9.720 1.437 1.066 1.00 0.00 H new ATOM 0 HZ PHE A 39 9.463 3.131 -0.740 1.00 0.00 H new ATOM 643 N LYS A 40 4.140 -0.173 4.043 1.00 0.00 N ATOM 644 CA LYS A 40 4.169 -1.555 4.502 1.00 0.00 C ATOM 645 C LYS A 40 3.005 -2.354 3.921 1.00 0.00 C ATOM 646 O LYS A 40 3.235 -3.422 3.368 1.00 0.00 O ATOM 647 CB LYS A 40 4.216 -1.589 6.040 1.00 0.00 C ATOM 648 CG LYS A 40 4.375 -3.015 6.598 1.00 0.00 C ATOM 649 CD LYS A 40 3.066 -3.607 7.145 1.00 0.00 C ATOM 650 CE LYS A 40 3.311 -5.051 7.596 1.00 0.00 C ATOM 651 NZ LYS A 40 2.168 -5.644 8.320 1.00 0.00 N ATOM 0 H LYS A 40 4.050 0.507 4.798 1.00 0.00 H new ATOM 0 HA LYS A 40 5.074 -2.041 4.137 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.045 -0.973 6.388 1.00 0.00 H new ATOM 0 HB3 LYS A 40 3.302 -1.148 6.437 1.00 0.00 H new ATOM 0 HG2 LYS A 40 4.758 -3.665 5.811 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.120 -3.005 7.393 1.00 0.00 H new ATOM 0 HD2 LYS A 40 2.705 -3.009 7.982 1.00 0.00 H new ATOM 0 HD3 LYS A 40 2.293 -3.580 6.377 1.00 0.00 H new ATOM 0 HE2 LYS A 40 3.535 -5.663 6.722 1.00 0.00 H new ATOM 0 HE3 LYS A 40 4.191 -5.078 8.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 2.400 -6.620 8.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 1.967 -5.082 9.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 1.331 -5.649 7.703 1.00 0.00 H new ATOM 665 N LYS A 41 1.760 -1.889 4.070 1.00 0.00 N ATOM 666 CA LYS A 41 0.570 -2.611 3.599 1.00 0.00 C ATOM 667 C LYS A 41 0.670 -2.853 2.093 1.00 0.00 C ATOM 668 O LYS A 41 0.413 -3.977 1.660 1.00 0.00 O ATOM 669 CB LYS A 41 -0.714 -1.819 3.953 1.00 0.00 C ATOM 670 CG LYS A 41 -1.758 -2.583 4.801 1.00 0.00 C ATOM 671 CD LYS A 41 -3.071 -2.880 4.055 1.00 0.00 C ATOM 672 CE LYS A 41 -4.197 -3.319 5.008 1.00 0.00 C ATOM 673 NZ LYS A 41 -4.543 -4.754 4.923 1.00 0.00 N ATOM 0 H LYS A 41 1.547 -0.999 4.521 1.00 0.00 H new ATOM 0 HA LYS A 41 0.517 -3.578 4.099 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -0.426 -0.916 4.491 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -1.189 -1.499 3.026 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -1.321 -3.524 5.136 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -1.983 -2.000 5.694 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -3.386 -1.990 3.510 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.898 -3.662 3.316 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -3.901 -3.089 6.031 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -5.088 -2.729 4.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -5.308 -4.967 5.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -4.858 -4.979 3.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -3.707 -5.327 5.157 1.00 0.00 H new ATOM 687 N TRP A 42 1.047 -1.829 1.326 1.00 0.00 N ATOM 688 CA TRP A 42 1.260 -1.924 -0.107 1.00 0.00 C ATOM 689 C TRP A 42 2.363 -2.937 -0.397 1.00 0.00 C ATOM 690 O TRP A 42 2.035 -3.984 -0.943 1.00 0.00 O ATOM 691 CB TRP A 42 1.529 -0.531 -0.687 1.00 0.00 C ATOM 692 CG TRP A 42 2.210 -0.480 -2.018 1.00 0.00 C ATOM 693 CD1 TRP A 42 1.788 -1.051 -3.167 1.00 0.00 C ATOM 694 CD2 TRP A 42 3.483 0.146 -2.336 1.00 0.00 C ATOM 695 NE1 TRP A 42 2.700 -0.796 -4.170 1.00 0.00 N ATOM 696 CE2 TRP A 42 3.805 -0.118 -3.696 1.00 0.00 C ATOM 697 CE3 TRP A 42 4.420 0.874 -1.584 1.00 0.00 C ATOM 698 CZ2 TRP A 42 5.026 0.294 -4.255 1.00 0.00 C ATOM 699 CZ3 TRP A 42 5.629 1.312 -2.140 1.00 0.00 C ATOM 700 CH2 TRP A 42 5.933 1.039 -3.486 1.00 0.00 C ATOM 0 H TRP A 42 1.215 -0.894 1.698 1.00 0.00 H new ATOM 0 HA TRP A 42 0.364 -2.294 -0.606 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.577 -0.007 -0.771 1.00 0.00 H new ATOM 0 HB3 TRP A 42 2.136 0.024 0.028 1.00 0.00 H new ATOM 0 HD1 TRP A 42 0.877 -1.620 -3.283 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.573 -1.074 -5.143 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.203 1.102 -0.551 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 5.267 0.038 -5.276 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 6.332 1.862 -1.532 1.00 0.00 H new ATOM 0 HH2 TRP A 42 6.853 1.398 -3.922 1.00 0.00 H new ATOM 711 N VAL A 43 3.629 -2.691 -0.027 1.00 0.00 N ATOM 712 CA VAL A 43 4.732 -3.598 -0.359 1.00 0.00 C ATOM 713 C VAL A 43 4.432 -5.048 0.061 1.00 0.00 C ATOM 714 O VAL A 43 4.872 -5.972 -0.629 1.00 0.00 O ATOM 715 CB VAL A 43 6.073 -3.072 0.217 1.00 0.00 C ATOM 716 CG1 VAL A 43 7.260 -4.047 0.061 1.00 0.00 C ATOM 717 CG2 VAL A 43 6.485 -1.755 -0.455 1.00 0.00 C ATOM 0 H VAL A 43 3.912 -1.868 0.504 1.00 0.00 H new ATOM 0 HA VAL A 43 4.835 -3.617 -1.444 1.00 0.00 H new ATOM 0 HB VAL A 43 5.871 -2.941 1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.157 -3.600 0.490 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.036 -4.979 0.579 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.427 -4.251 -0.997 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.428 -1.410 -0.031 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.605 -1.915 -1.526 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.714 -1.003 -0.285 1.00 0.00 H new ATOM 727 N PHE A 44 3.682 -5.265 1.150 1.00 0.00 N ATOM 728 CA PHE A 44 3.212 -6.577 1.545 1.00 0.00 C ATOM 729 C PHE A 44 2.377 -7.191 0.421 1.00 0.00 C ATOM 730 O PHE A 44 2.812 -8.127 -0.236 1.00 0.00 O ATOM 731 CB PHE A 44 2.454 -6.516 2.887 1.00 0.00 C ATOM 732 CG PHE A 44 3.317 -6.823 4.099 1.00 0.00 C ATOM 733 CD1 PHE A 44 4.505 -6.102 4.312 1.00 0.00 C ATOM 734 CD2 PHE A 44 2.985 -7.875 4.975 1.00 0.00 C ATOM 735 CE1 PHE A 44 5.367 -6.425 5.375 1.00 0.00 C ATOM 736 CE2 PHE A 44 3.841 -8.199 6.044 1.00 0.00 C ATOM 737 CZ PHE A 44 5.033 -7.478 6.240 1.00 0.00 C ATOM 0 H PHE A 44 3.388 -4.519 1.780 1.00 0.00 H new ATOM 0 HA PHE A 44 4.069 -7.230 1.711 1.00 0.00 H new ATOM 0 HB2 PHE A 44 2.022 -5.522 3.004 1.00 0.00 H new ATOM 0 HB3 PHE A 44 1.624 -7.222 2.856 1.00 0.00 H new ATOM 0 HD1 PHE A 44 4.759 -5.288 3.649 1.00 0.00 H new ATOM 0 HD2 PHE A 44 2.073 -8.433 4.826 1.00 0.00 H new ATOM 0 HE1 PHE A 44 6.279 -5.867 5.524 1.00 0.00 H new ATOM 0 HE2 PHE A 44 3.582 -9.004 6.716 1.00 0.00 H new ATOM 0 HZ PHE A 44 5.691 -7.735 7.057 1.00 0.00 H new ATOM 747 N ASP A 45 1.179 -6.673 0.204 1.00 0.00 N ATOM 748 CA ASP A 45 0.184 -7.263 -0.698 1.00 0.00 C ATOM 749 C ASP A 45 0.620 -7.239 -2.159 1.00 0.00 C ATOM 750 O ASP A 45 0.239 -8.112 -2.938 1.00 0.00 O ATOM 751 CB ASP A 45 -1.170 -6.555 -0.550 1.00 0.00 C ATOM 752 CG ASP A 45 -1.991 -7.136 0.593 1.00 0.00 C ATOM 753 OD1 ASP A 45 -1.946 -8.358 0.849 1.00 0.00 O ATOM 754 OD2 ASP A 45 -2.688 -6.357 1.284 1.00 0.00 O ATOM 0 H ASP A 45 0.858 -5.816 0.654 1.00 0.00 H new ATOM 0 HA ASP A 45 0.086 -8.308 -0.405 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -1.007 -5.491 -0.376 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -1.730 -6.643 -1.481 1.00 0.00 H new ATOM 759 N GLU A 46 1.402 -6.233 -2.528 1.00 0.00 N ATOM 760 CA GLU A 46 1.851 -5.983 -3.882 1.00 0.00 C ATOM 761 C GLU A 46 2.989 -6.933 -4.266 1.00 0.00 C ATOM 762 O GLU A 46 3.102 -7.292 -5.440 1.00 0.00 O ATOM 763 CB GLU A 46 2.294 -4.516 -3.933 1.00 0.00 C ATOM 764 CG GLU A 46 2.496 -3.934 -5.330 1.00 0.00 C ATOM 765 CD GLU A 46 1.239 -3.307 -5.917 1.00 0.00 C ATOM 766 OE1 GLU A 46 0.207 -4.005 -6.078 1.00 0.00 O ATOM 767 OE2 GLU A 46 1.308 -2.117 -6.297 1.00 0.00 O ATOM 0 H GLU A 46 1.752 -5.544 -1.862 1.00 0.00 H new ATOM 0 HA GLU A 46 1.053 -6.164 -4.602 1.00 0.00 H new ATOM 0 HB2 GLU A 46 1.551 -3.913 -3.412 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.228 -4.418 -3.380 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.283 -3.181 -5.290 1.00 0.00 H new ATOM 0 HG3 GLU A 46 2.843 -4.723 -5.997 1.00 0.00 H new ATOM 774 N PHE A 47 3.832 -7.343 -3.307 1.00 0.00 N ATOM 775 CA PHE A 47 5.062 -8.073 -3.603 1.00 0.00 C ATOM 776 C PHE A 47 5.271 -9.215 -2.614 1.00 0.00 C ATOM 777 O PHE A 47 5.312 -10.370 -3.026 1.00 0.00 O ATOM 778 CB PHE A 47 6.274 -7.127 -3.616 1.00 0.00 C ATOM 779 CG PHE A 47 6.095 -5.838 -4.401 1.00 0.00 C ATOM 780 CD1 PHE A 47 5.948 -5.845 -5.801 1.00 0.00 C ATOM 781 CD2 PHE A 47 6.075 -4.615 -3.712 1.00 0.00 C ATOM 782 CE1 PHE A 47 5.784 -4.631 -6.492 1.00 0.00 C ATOM 783 CE2 PHE A 47 5.905 -3.402 -4.396 1.00 0.00 C ATOM 784 CZ PHE A 47 5.770 -3.411 -5.792 1.00 0.00 C ATOM 0 H PHE A 47 3.677 -7.177 -2.313 1.00 0.00 H new ATOM 0 HA PHE A 47 4.964 -8.506 -4.599 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.524 -6.872 -2.586 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.128 -7.666 -4.027 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.961 -6.779 -6.343 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.192 -4.608 -2.638 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.668 -4.636 -7.566 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.878 -2.469 -3.852 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.655 -2.481 -6.329 1.00 0.00 H new ATOM 794 N LEU A 48 5.433 -8.916 -1.324 1.00 0.00 N ATOM 795 CA LEU A 48 5.825 -9.906 -0.320 1.00 0.00 C ATOM 796 C LEU A 48 4.822 -11.054 -0.257 1.00 0.00 C ATOM 797 O LEU A 48 5.181 -12.199 -0.517 1.00 0.00 O ATOM 798 CB LEU A 48 5.992 -9.261 1.066 1.00 0.00 C ATOM 799 CG LEU A 48 7.028 -8.120 1.123 1.00 0.00 C ATOM 800 CD1 LEU A 48 7.267 -7.654 2.556 1.00 0.00 C ATOM 801 CD2 LEU A 48 8.381 -8.505 0.520 1.00 0.00 C ATOM 0 H LEU A 48 5.296 -7.979 -0.946 1.00 0.00 H new ATOM 0 HA LEU A 48 6.790 -10.312 -0.623 1.00 0.00 H new ATOM 0 HB2 LEU A 48 5.026 -8.874 1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.282 -10.033 1.779 1.00 0.00 H new ATOM 0 HG LEU A 48 6.596 -7.316 0.527 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.002 -6.849 2.559 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.331 -7.292 2.982 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.638 -8.487 3.152 1.00 0.00 H new ATOM 0 HD21 LEU A 48 9.065 -7.659 0.591 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.795 -9.353 1.066 1.00 0.00 H new ATOM 0 HD23 LEU A 48 8.248 -8.777 -0.527 1.00 0.00 H new ATOM 813 N ASN A 49 3.563 -10.746 0.041 1.00 0.00 N ATOM 814 CA ASN A 49 2.452 -11.689 0.055 1.00 0.00 C ATOM 815 C ASN A 49 2.273 -12.292 -1.336 1.00 0.00 C ATOM 816 O ASN A 49 1.959 -13.477 -1.448 1.00 0.00 O ATOM 817 CB ASN A 49 1.142 -10.997 0.470 1.00 0.00 C ATOM 818 CG ASN A 49 1.124 -10.457 1.897 1.00 0.00 C ATOM 819 OD1 ASN A 49 1.977 -10.767 2.720 1.00 0.00 O ATOM 820 ND2 ASN A 49 0.134 -9.654 2.258 1.00 0.00 N ATOM 0 H ASN A 49 3.280 -9.798 0.288 1.00 0.00 H new ATOM 0 HA ASN A 49 2.682 -12.470 0.780 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.950 -10.173 -0.217 1.00 0.00 H new ATOM 0 HB3 ASN A 49 0.322 -11.706 0.355 1.00 0.00 H new ATOM 0 HD21 ASN A 49 0.087 -9.300 3.213 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -0.581 -9.390 1.580 1.00 0.00 H new ATOM 827 N LYS A 50 2.512 -11.503 -2.397 1.00 0.00 N ATOM 828 CA LYS A 50 2.444 -11.963 -3.782 1.00 0.00 C ATOM 829 C LYS A 50 3.379 -13.152 -4.010 1.00 0.00 C ATOM 830 O LYS A 50 3.029 -14.024 -4.799 1.00 0.00 O ATOM 831 CB LYS A 50 2.793 -10.828 -4.769 1.00 0.00 C ATOM 832 CG LYS A 50 1.735 -10.565 -5.855 1.00 0.00 C ATOM 833 CD LYS A 50 2.366 -10.352 -7.236 1.00 0.00 C ATOM 834 CE LYS A 50 1.397 -9.738 -8.253 1.00 0.00 C ATOM 835 NZ LYS A 50 0.240 -10.594 -8.594 1.00 0.00 N ATOM 0 H LYS A 50 2.760 -10.518 -2.309 1.00 0.00 H new ATOM 0 HA LYS A 50 1.418 -12.280 -3.967 1.00 0.00 H new ATOM 0 HB2 LYS A 50 2.948 -9.909 -4.203 1.00 0.00 H new ATOM 0 HB3 LYS A 50 3.739 -11.067 -5.255 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.044 -11.407 -5.899 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.150 -9.686 -5.585 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.236 -9.703 -7.135 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.724 -11.309 -7.616 1.00 0.00 H new ATOM 0 HE2 LYS A 50 1.028 -8.791 -7.858 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.946 -9.510 -9.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -0.362 -10.104 -9.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 0.578 -11.489 -9.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -0.311 -10.792 -7.734 1.00 0.00 H new ATOM 849 N GLY A 51 4.535 -13.181 -3.339 1.00 0.00 N ATOM 850 CA GLY A 51 5.532 -14.237 -3.439 1.00 0.00 C ATOM 851 C GLY A 51 6.927 -13.746 -3.821 1.00 0.00 C ATOM 852 O GLY A 51 7.803 -14.571 -4.077 1.00 0.00 O ATOM 0 H GLY A 51 4.806 -12.442 -2.691 1.00 0.00 H new ATOM 0 HA2 GLY A 51 5.591 -14.757 -2.483 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.200 -14.966 -4.179 1.00 0.00 H new ATOM 856 N TYR A 52 7.164 -12.430 -3.852 1.00 0.00 N ATOM 857 CA TYR A 52 8.497 -11.873 -4.047 1.00 0.00 C ATOM 858 C TYR A 52 9.305 -11.957 -2.752 1.00 0.00 C ATOM 859 O TYR A 52 8.744 -12.024 -1.656 1.00 0.00 O ATOM 860 CB TYR A 52 8.397 -10.416 -4.521 1.00 0.00 C ATOM 861 CG TYR A 52 7.960 -10.301 -5.966 1.00 0.00 C ATOM 862 CD1 TYR A 52 8.939 -10.299 -6.972 1.00 0.00 C ATOM 863 CD2 TYR A 52 6.598 -10.269 -6.318 1.00 0.00 C ATOM 864 CE1 TYR A 52 8.571 -10.306 -8.325 1.00 0.00 C ATOM 865 CE2 TYR A 52 6.214 -10.250 -7.671 1.00 0.00 C ATOM 866 CZ TYR A 52 7.204 -10.295 -8.683 1.00 0.00 C ATOM 867 OH TYR A 52 6.849 -10.336 -9.999 1.00 0.00 O ATOM 0 H TYR A 52 6.434 -11.726 -3.742 1.00 0.00 H new ATOM 0 HA TYR A 52 9.010 -12.456 -4.812 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.690 -9.880 -3.888 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.365 -9.931 -4.399 1.00 0.00 H new ATOM 0 HD1 TYR A 52 9.985 -10.292 -6.702 1.00 0.00 H new ATOM 0 HD2 TYR A 52 5.844 -10.259 -5.545 1.00 0.00 H new ATOM 0 HE1 TYR A 52 9.331 -10.320 -9.092 1.00 0.00 H new ATOM 0 HE2 TYR A 52 5.168 -10.201 -7.937 1.00 0.00 H new ATOM 0 HH TYR A 52 5.872 -10.323 -10.075 1.00 0.00 H new ATOM 877 N ASN A 53 10.633 -11.881 -2.886 1.00 0.00 N ATOM 878 CA ASN A 53 11.614 -11.885 -1.800 1.00 0.00 C ATOM 879 C ASN A 53 12.798 -10.958 -2.099 1.00 0.00 C ATOM 880 O ASN A 53 13.809 -11.042 -1.407 1.00 0.00 O ATOM 881 CB ASN A 53 12.091 -13.334 -1.517 1.00 0.00 C ATOM 882 CG ASN A 53 11.670 -13.875 -0.148 1.00 0.00 C ATOM 883 OD1 ASN A 53 10.994 -13.226 0.644 1.00 0.00 O ATOM 884 ND2 ASN A 53 12.048 -15.105 0.159 1.00 0.00 N ATOM 0 H ASN A 53 11.074 -11.811 -3.803 1.00 0.00 H new ATOM 0 HA ASN A 53 11.128 -11.498 -0.904 1.00 0.00 H new ATOM 0 HB2 ASN A 53 11.698 -13.992 -2.292 1.00 0.00 H new ATOM 0 HB3 ASN A 53 13.178 -13.368 -1.590 1.00 0.00 H new ATOM 0 HD21 ASN A 53 11.777 -15.513 1.054 1.00 0.00 H new ATOM 0 HD22 ASN A 53 12.610 -15.645 -0.499 1.00 0.00 H new ATOM 891 N LYS A 54 12.736 -10.107 -3.130 1.00 0.00 N ATOM 892 CA LYS A 54 13.836 -9.234 -3.531 1.00 0.00 C ATOM 893 C LYS A 54 13.249 -7.882 -3.900 1.00 0.00 C ATOM 894 O LYS A 54 12.476 -7.775 -4.851 1.00 0.00 O ATOM 895 CB LYS A 54 14.658 -9.855 -4.670 1.00 0.00 C ATOM 896 CG LYS A 54 15.790 -10.784 -4.184 1.00 0.00 C ATOM 897 CD LYS A 54 15.823 -12.135 -4.906 1.00 0.00 C ATOM 898 CE LYS A 54 14.588 -12.944 -4.504 1.00 0.00 C ATOM 899 NZ LYS A 54 14.623 -14.325 -5.027 1.00 0.00 N ATOM 0 H LYS A 54 11.906 -10.007 -3.715 1.00 0.00 H new ATOM 0 HA LYS A 54 14.537 -9.104 -2.707 1.00 0.00 H new ATOM 0 HB2 LYS A 54 13.991 -10.420 -5.321 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.090 -9.056 -5.272 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.747 -10.282 -4.325 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.675 -10.955 -3.114 1.00 0.00 H new ATOM 0 HD2 LYS A 54 15.840 -11.985 -5.985 1.00 0.00 H new ATOM 0 HD3 LYS A 54 16.731 -12.679 -4.646 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.514 -12.972 -3.417 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.693 -12.442 -4.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.765 -14.831 -4.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 14.667 -14.302 -6.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 15.462 -14.815 -4.656 1.00 0.00 H new ATOM 913 N ILE A 55 13.592 -6.864 -3.123 1.00 0.00 N ATOM 914 CA ILE A 55 13.157 -5.476 -3.238 1.00 0.00 C ATOM 915 C ILE A 55 14.453 -4.661 -3.397 1.00 0.00 C ATOM 916 O ILE A 55 15.491 -5.056 -2.863 1.00 0.00 O ATOM 917 CB ILE A 55 12.324 -5.135 -1.976 1.00 0.00 C ATOM 918 CG1 ILE A 55 10.854 -5.630 -2.047 1.00 0.00 C ATOM 919 CG2 ILE A 55 12.245 -3.620 -1.775 1.00 0.00 C ATOM 920 CD1 ILE A 55 10.603 -7.138 -2.056 1.00 0.00 C ATOM 0 H ILE A 55 14.229 -6.995 -2.337 1.00 0.00 H new ATOM 0 HA ILE A 55 12.509 -5.259 -4.087 1.00 0.00 H new ATOM 0 HB ILE A 55 12.840 -5.640 -1.160 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.318 -5.208 -1.197 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.404 -5.211 -2.947 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.656 -3.401 -0.884 1.00 0.00 H new ATOM 0 HG22 ILE A 55 13.250 -3.216 -1.654 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.772 -3.162 -2.644 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.531 -7.328 -2.108 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.093 -7.583 -2.922 1.00 0.00 H new ATOM 0 HD13 ILE A 55 11.006 -7.579 -1.144 1.00 0.00 H new ATOM 932 N PHE A 56 14.397 -3.502 -4.056 1.00 0.00 N ATOM 933 CA PHE A 56 15.431 -2.471 -4.068 1.00 0.00 C ATOM 934 C PHE A 56 14.792 -1.107 -3.786 1.00 0.00 C ATOM 935 O PHE A 56 13.579 -0.958 -3.969 1.00 0.00 O ATOM 936 CB PHE A 56 16.179 -2.480 -5.420 1.00 0.00 C ATOM 937 CG PHE A 56 17.101 -3.669 -5.664 1.00 0.00 C ATOM 938 CD1 PHE A 56 17.807 -4.284 -4.610 1.00 0.00 C ATOM 939 CD2 PHE A 56 17.255 -4.175 -6.968 1.00 0.00 C ATOM 940 CE1 PHE A 56 18.609 -5.408 -4.862 1.00 0.00 C ATOM 941 CE2 PHE A 56 18.016 -5.325 -7.219 1.00 0.00 C ATOM 942 CZ PHE A 56 18.700 -5.942 -6.159 1.00 0.00 C ATOM 0 H PHE A 56 13.589 -3.247 -4.623 1.00 0.00 H new ATOM 0 HA PHE A 56 16.164 -2.675 -3.287 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.441 -2.447 -6.221 1.00 0.00 H new ATOM 0 HB3 PHE A 56 16.769 -1.567 -5.492 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.731 -3.890 -3.607 1.00 0.00 H new ATOM 0 HD2 PHE A 56 16.777 -3.667 -7.792 1.00 0.00 H new ATOM 0 HE1 PHE A 56 19.160 -5.866 -4.054 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.076 -5.732 -8.217 1.00 0.00 H new ATOM 0 HZ PHE A 56 19.295 -6.825 -6.340 1.00 0.00 H new ATOM 952 N LEU A 57 15.582 -0.103 -3.368 1.00 0.00 N ATOM 953 CA LEU A 57 15.137 1.295 -3.269 1.00 0.00 C ATOM 954 C LEU A 57 16.135 2.177 -4.031 1.00 0.00 C ATOM 955 O LEU A 57 17.315 2.128 -3.704 1.00 0.00 O ATOM 956 CB LEU A 57 15.046 1.679 -1.777 1.00 0.00 C ATOM 957 CG LEU A 57 14.386 3.043 -1.500 1.00 0.00 C ATOM 958 CD1 LEU A 57 12.884 3.010 -1.817 1.00 0.00 C ATOM 959 CD2 LEU A 57 14.569 3.422 -0.023 1.00 0.00 C ATOM 0 H LEU A 57 16.553 -0.241 -3.088 1.00 0.00 H new ATOM 0 HA LEU A 57 14.151 1.435 -3.713 1.00 0.00 H new ATOM 0 HB2 LEU A 57 14.485 0.906 -1.251 1.00 0.00 H new ATOM 0 HB3 LEU A 57 16.051 1.686 -1.356 1.00 0.00 H new ATOM 0 HG LEU A 57 14.867 3.780 -2.143 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.447 3.987 -1.611 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.739 2.762 -2.869 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.398 2.257 -1.197 1.00 0.00 H new ATOM 0 HD21 LEU A 57 14.100 4.388 0.166 1.00 0.00 H new ATOM 0 HD22 LEU A 57 14.105 2.664 0.607 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.633 3.484 0.208 1.00 0.00 H new ATOM 971 N VAL A 58 15.729 2.915 -5.075 1.00 0.00 N ATOM 972 CA VAL A 58 16.585 3.937 -5.707 1.00 0.00 C ATOM 973 C VAL A 58 16.492 5.208 -4.862 1.00 0.00 C ATOM 974 O VAL A 58 15.394 5.551 -4.433 1.00 0.00 O ATOM 975 CB VAL A 58 16.145 4.239 -7.161 1.00 0.00 C ATOM 976 CG1 VAL A 58 17.080 5.244 -7.866 1.00 0.00 C ATOM 977 CG2 VAL A 58 16.089 2.968 -8.018 1.00 0.00 C ATOM 0 H VAL A 58 14.808 2.824 -5.503 1.00 0.00 H new ATOM 0 HA VAL A 58 17.609 3.568 -5.754 1.00 0.00 H new ATOM 0 HB VAL A 58 15.149 4.673 -7.071 1.00 0.00 H new ATOM 0 HG11 VAL A 58 16.726 5.420 -8.882 1.00 0.00 H new ATOM 0 HG12 VAL A 58 17.085 6.185 -7.315 1.00 0.00 H new ATOM 0 HG13 VAL A 58 18.091 4.838 -7.900 1.00 0.00 H new ATOM 0 HG21 VAL A 58 15.776 3.225 -9.030 1.00 0.00 H new ATOM 0 HG22 VAL A 58 17.076 2.507 -8.049 1.00 0.00 H new ATOM 0 HG23 VAL A 58 15.375 2.268 -7.584 1.00 0.00 H new ATOM 987 N LEU A 59 17.603 5.920 -4.641 1.00 0.00 N ATOM 988 CA LEU A 59 17.620 7.140 -3.825 1.00 0.00 C ATOM 989 C LEU A 59 17.914 8.395 -4.662 1.00 0.00 C ATOM 990 O LEU A 59 18.106 9.472 -4.110 1.00 0.00 O ATOM 991 CB LEU A 59 18.597 7.033 -2.640 1.00 0.00 C ATOM 992 CG LEU A 59 18.593 5.769 -1.754 1.00 0.00 C ATOM 993 CD1 LEU A 59 18.919 6.178 -0.326 1.00 0.00 C ATOM 994 CD2 LEU A 59 17.293 4.978 -1.650 1.00 0.00 C ATOM 0 H LEU A 59 18.515 5.667 -5.022 1.00 0.00 H new ATOM 0 HA LEU A 59 16.615 7.244 -3.417 1.00 0.00 H new ATOM 0 HB2 LEU A 59 19.605 7.148 -3.038 1.00 0.00 H new ATOM 0 HB3 LEU A 59 18.413 7.887 -1.989 1.00 0.00 H new ATOM 0 HG LEU A 59 19.317 5.120 -2.248 1.00 0.00 H new ATOM 0 HD11 LEU A 59 18.920 5.296 0.314 1.00 0.00 H new ATOM 0 HD12 LEU A 59 19.902 6.648 -0.298 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.169 6.884 0.031 1.00 0.00 H new ATOM 0 HD21 LEU A 59 17.441 4.119 -0.996 1.00 0.00 H new ATOM 0 HD22 LEU A 59 16.511 5.616 -1.240 1.00 0.00 H new ATOM 0 HD23 LEU A 59 16.997 4.633 -2.641 1.00 0.00 H new ATOM 1006 N SER A 60 17.936 8.284 -5.990 1.00 0.00 N ATOM 1007 CA SER A 60 18.205 9.398 -6.891 1.00 0.00 C ATOM 1008 C SER A 60 17.028 10.368 -7.020 1.00 0.00 C ATOM 1009 O SER A 60 17.238 11.567 -7.200 1.00 0.00 O ATOM 1010 CB SER A 60 18.536 8.816 -8.264 1.00 0.00 C ATOM 1011 OG SER A 60 19.754 8.108 -8.186 1.00 0.00 O ATOM 0 H SER A 60 17.764 7.403 -6.475 1.00 0.00 H new ATOM 0 HA SER A 60 19.034 9.974 -6.480 1.00 0.00 H new ATOM 0 HB2 SER A 60 17.736 8.153 -8.594 1.00 0.00 H new ATOM 0 HB3 SER A 60 18.612 9.614 -9.002 1.00 0.00 H new ATOM 0 HG SER A 60 19.970 7.731 -9.064 1.00 0.00 H new ATOM 1017 N ASP A 61 15.791 9.871 -6.959 1.00 0.00 N ATOM 1018 CA ASP A 61 14.576 10.673 -7.194 1.00 0.00 C ATOM 1019 C ASP A 61 14.063 11.270 -5.875 1.00 0.00 C ATOM 1020 O ASP A 61 12.866 11.386 -5.615 1.00 0.00 O ATOM 1021 CB ASP A 61 13.540 9.808 -7.921 1.00 0.00 C ATOM 1022 CG ASP A 61 12.608 10.603 -8.851 1.00 0.00 C ATOM 1023 OD1 ASP A 61 12.136 11.707 -8.489 1.00 0.00 O ATOM 1024 OD2 ASP A 61 12.411 10.126 -9.989 1.00 0.00 O ATOM 0 H ASP A 61 15.597 8.893 -6.744 1.00 0.00 H new ATOM 0 HA ASP A 61 14.796 11.525 -7.838 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.060 9.049 -8.506 1.00 0.00 H new ATOM 0 HB3 ASP A 61 12.937 9.282 -7.181 1.00 0.00 H new ATOM 1029 N VAL A 62 15.008 11.533 -4.978 1.00 0.00 N ATOM 1030 CA VAL A 62 14.874 11.984 -3.610 1.00 0.00 C ATOM 1031 C VAL A 62 16.250 12.572 -3.252 1.00 0.00 C ATOM 1032 O VAL A 62 17.205 12.488 -4.031 1.00 0.00 O ATOM 1033 CB VAL A 62 14.387 10.780 -2.752 1.00 0.00 C ATOM 1034 CG1 VAL A 62 15.338 9.583 -2.738 1.00 0.00 C ATOM 1035 CG2 VAL A 62 14.028 11.127 -1.306 1.00 0.00 C ATOM 0 H VAL A 62 15.991 11.421 -5.226 1.00 0.00 H new ATOM 0 HA VAL A 62 14.130 12.760 -3.431 1.00 0.00 H new ATOM 0 HB VAL A 62 13.475 10.497 -3.277 1.00 0.00 H new ATOM 0 HG11 VAL A 62 14.918 8.792 -2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 62 15.472 9.213 -3.754 1.00 0.00 H new ATOM 0 HG13 VAL A 62 16.303 9.889 -2.333 1.00 0.00 H new ATOM 0 HG21 VAL A 62 13.700 10.227 -0.787 1.00 0.00 H new ATOM 0 HG22 VAL A 62 14.903 11.538 -0.802 1.00 0.00 H new ATOM 0 HG23 VAL A 62 13.225 11.864 -1.297 1.00 0.00 H new ATOM 1045 N GLU A 63 16.357 13.232 -2.111 1.00 0.00 N ATOM 1046 CA GLU A 63 17.592 13.724 -1.523 1.00 0.00 C ATOM 1047 C GLU A 63 17.597 13.250 -0.082 1.00 0.00 C ATOM 1048 O GLU A 63 18.594 12.692 0.366 1.00 0.00 O ATOM 1049 CB GLU A 63 17.701 15.259 -1.646 1.00 0.00 C ATOM 1050 CG GLU A 63 18.869 15.840 -0.810 1.00 0.00 C ATOM 1051 CD GLU A 63 19.295 17.282 -1.155 1.00 0.00 C ATOM 1052 OE1 GLU A 63 18.826 17.882 -2.152 1.00 0.00 O ATOM 1053 OE2 GLU A 63 20.158 17.829 -0.427 1.00 0.00 O ATOM 0 H GLU A 63 15.541 13.451 -1.539 1.00 0.00 H new ATOM 0 HA GLU A 63 18.466 13.337 -2.048 1.00 0.00 H new ATOM 0 HB2 GLU A 63 17.840 15.527 -2.693 1.00 0.00 H new ATOM 0 HB3 GLU A 63 16.765 15.714 -1.322 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.588 15.807 0.243 1.00 0.00 H new ATOM 0 HG3 GLU A 63 19.734 15.188 -0.929 1.00 0.00 H new ATOM 1060 N SER A 64 16.486 13.430 0.631 1.00 0.00 N ATOM 1061 CA SER A 64 16.372 13.104 2.038 1.00 0.00 C ATOM 1062 C SER A 64 14.983 12.551 2.352 1.00 0.00 C ATOM 1063 O SER A 64 14.099 12.559 1.496 1.00 0.00 O ATOM 1064 CB SER A 64 16.732 14.363 2.830 1.00 0.00 C ATOM 1065 OG SER A 64 15.994 15.517 2.474 1.00 0.00 O ATOM 0 H SER A 64 15.629 13.814 0.233 1.00 0.00 H new ATOM 0 HA SER A 64 17.061 12.310 2.325 1.00 0.00 H new ATOM 0 HB2 SER A 64 16.580 14.164 3.891 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.793 14.571 2.693 1.00 0.00 H new ATOM 0 HG SER A 64 16.283 16.273 3.026 1.00 0.00 H new ATOM 1071 N ILE A 65 14.792 12.053 3.570 1.00 0.00 N ATOM 1072 CA ILE A 65 13.578 11.391 4.019 1.00 0.00 C ATOM 1073 C ILE A 65 13.262 11.872 5.443 1.00 0.00 C ATOM 1074 O ILE A 65 14.164 12.329 6.162 1.00 0.00 O ATOM 1075 CB ILE A 65 13.824 9.868 3.902 1.00 0.00 C ATOM 1076 CG1 ILE A 65 12.542 9.061 4.115 1.00 0.00 C ATOM 1077 CG2 ILE A 65 14.925 9.411 4.870 1.00 0.00 C ATOM 1078 CD1 ILE A 65 12.650 7.632 3.553 1.00 0.00 C ATOM 0 H ILE A 65 15.507 12.103 4.296 1.00 0.00 H new ATOM 0 HA ILE A 65 12.702 11.631 3.416 1.00 0.00 H new ATOM 0 HB ILE A 65 14.161 9.676 2.883 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.318 9.014 5.181 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.708 9.575 3.637 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.077 8.337 4.767 1.00 0.00 H new ATOM 0 HG22 ILE A 65 15.853 9.933 4.638 1.00 0.00 H new ATOM 0 HG23 ILE A 65 14.627 9.638 5.894 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.715 7.100 3.729 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.846 7.676 2.482 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.465 7.106 4.050 1.00 0.00 H new ATOM 1090 N ASP A 66 12.001 11.759 5.868 1.00 0.00 N ATOM 1091 CA ASP A 66 11.620 12.077 7.241 1.00 0.00 C ATOM 1092 C ASP A 66 12.111 10.985 8.178 1.00 0.00 C ATOM 1093 O ASP A 66 12.189 9.804 7.817 1.00 0.00 O ATOM 1094 CB ASP A 66 10.100 12.207 7.415 1.00 0.00 C ATOM 1095 CG ASP A 66 9.566 13.469 6.755 1.00 0.00 C ATOM 1096 OD1 ASP A 66 9.868 14.579 7.249 1.00 0.00 O ATOM 1097 OD2 ASP A 66 8.896 13.339 5.708 1.00 0.00 O ATOM 0 H ASP A 66 11.228 11.449 5.279 1.00 0.00 H new ATOM 0 HA ASP A 66 12.078 13.037 7.479 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.608 11.335 6.984 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.855 12.220 8.477 1.00 0.00 H new ATOM 1102 N SER A 67 12.334 11.363 9.435 1.00 0.00 N ATOM 1103 CA SER A 67 12.494 10.451 10.556 1.00 0.00 C ATOM 1104 C SER A 67 11.126 9.888 10.992 1.00 0.00 C ATOM 1105 O SER A 67 10.744 9.930 12.161 1.00 0.00 O ATOM 1106 CB SER A 67 13.285 11.176 11.654 1.00 0.00 C ATOM 1107 OG SER A 67 14.669 11.108 11.332 1.00 0.00 O ATOM 0 H SER A 67 12.410 12.344 9.705 1.00 0.00 H new ATOM 0 HA SER A 67 13.073 9.569 10.283 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.964 12.215 11.729 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.098 10.714 12.623 1.00 0.00 H new ATOM 0 HG SER A 67 15.189 11.569 12.023 1.00 0.00 H new ATOM 1113 N PHE A 68 10.398 9.326 10.026 1.00 0.00 N ATOM 1114 CA PHE A 68 9.296 8.399 10.178 1.00 0.00 C ATOM 1115 C PHE A 68 9.641 7.239 9.246 1.00 0.00 C ATOM 1116 O PHE A 68 10.029 6.153 9.682 1.00 0.00 O ATOM 1117 CB PHE A 68 7.968 9.077 9.775 1.00 0.00 C ATOM 1118 CG PHE A 68 6.727 8.200 9.833 1.00 0.00 C ATOM 1119 CD1 PHE A 68 6.627 7.131 10.745 1.00 0.00 C ATOM 1120 CD2 PHE A 68 5.654 8.460 8.961 1.00 0.00 C ATOM 1121 CE1 PHE A 68 5.476 6.324 10.768 1.00 0.00 C ATOM 1122 CE2 PHE A 68 4.492 7.676 9.007 1.00 0.00 C ATOM 1123 CZ PHE A 68 4.406 6.592 9.898 1.00 0.00 C ATOM 0 H PHE A 68 10.585 9.529 9.044 1.00 0.00 H new ATOM 0 HA PHE A 68 9.162 8.062 11.206 1.00 0.00 H new ATOM 0 HB2 PHE A 68 7.811 9.938 10.425 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.072 9.459 8.759 1.00 0.00 H new ATOM 0 HD1 PHE A 68 7.438 6.931 11.429 1.00 0.00 H new ATOM 0 HD2 PHE A 68 5.726 9.270 8.250 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.414 5.495 11.457 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.661 7.906 8.356 1.00 0.00 H new ATOM 0 HZ PHE A 68 3.524 5.970 9.914 1.00 0.00 H new ATOM 1133 N SER A 69 9.574 7.533 7.950 1.00 0.00 N ATOM 1134 CA SER A 69 9.714 6.654 6.809 1.00 0.00 C ATOM 1135 C SER A 69 11.059 5.932 6.804 1.00 0.00 C ATOM 1136 O SER A 69 11.116 4.734 6.539 1.00 0.00 O ATOM 1137 CB SER A 69 9.520 7.503 5.544 1.00 0.00 C ATOM 1138 OG SER A 69 8.690 8.642 5.779 1.00 0.00 O ATOM 0 H SER A 69 9.403 8.493 7.651 1.00 0.00 H new ATOM 0 HA SER A 69 8.961 5.867 6.853 1.00 0.00 H new ATOM 0 HB2 SER A 69 10.492 7.834 5.178 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.077 6.888 4.761 1.00 0.00 H new ATOM 0 HG SER A 69 8.595 9.154 4.949 1.00 0.00 H new ATOM 1144 N LEU A 70 12.131 6.628 7.194 1.00 0.00 N ATOM 1145 CA LEU A 70 13.470 6.084 7.423 1.00 0.00 C ATOM 1146 C LEU A 70 13.431 4.797 8.245 1.00 0.00 C ATOM 1147 O LEU A 70 14.151 3.851 7.922 1.00 0.00 O ATOM 1148 CB LEU A 70 14.257 7.199 8.153 1.00 0.00 C ATOM 1149 CG LEU A 70 15.686 6.902 8.652 1.00 0.00 C ATOM 1150 CD1 LEU A 70 16.710 6.890 7.519 1.00 0.00 C ATOM 1151 CD2 LEU A 70 16.111 7.998 9.639 1.00 0.00 C ATOM 0 H LEU A 70 12.085 7.632 7.366 1.00 0.00 H new ATOM 0 HA LEU A 70 13.946 5.809 6.482 1.00 0.00 H new ATOM 0 HB2 LEU A 70 14.315 8.055 7.481 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.666 7.509 9.014 1.00 0.00 H new ATOM 0 HG LEU A 70 15.663 5.916 9.115 1.00 0.00 H new ATOM 0 HD11 LEU A 70 17.699 6.676 7.925 1.00 0.00 H new ATOM 0 HD12 LEU A 70 16.441 6.122 6.794 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.722 7.863 7.029 1.00 0.00 H new ATOM 0 HD21 LEU A 70 17.121 7.795 9.996 1.00 0.00 H new ATOM 0 HD22 LEU A 70 16.091 8.966 9.138 1.00 0.00 H new ATOM 0 HD23 LEU A 70 15.423 8.013 10.485 1.00 0.00 H new ATOM 1163 N GLY A 71 12.575 4.735 9.268 1.00 0.00 N ATOM 1164 CA GLY A 71 12.450 3.568 10.128 1.00 0.00 C ATOM 1165 C GLY A 71 11.601 2.475 9.480 1.00 0.00 C ATOM 1166 O GLY A 71 11.862 1.293 9.706 1.00 0.00 O ATOM 0 H GLY A 71 11.949 5.500 9.520 1.00 0.00 H new ATOM 0 HA2 GLY A 71 13.441 3.174 10.352 1.00 0.00 H new ATOM 0 HA3 GLY A 71 12.002 3.862 11.077 1.00 0.00 H new ATOM 1170 N VAL A 72 10.621 2.848 8.652 1.00 0.00 N ATOM 1171 CA VAL A 72 9.731 1.899 7.981 1.00 0.00 C ATOM 1172 C VAL A 72 10.533 1.147 6.909 1.00 0.00 C ATOM 1173 O VAL A 72 10.311 -0.042 6.689 1.00 0.00 O ATOM 1174 CB VAL A 72 8.520 2.624 7.339 1.00 0.00 C ATOM 1175 CG1 VAL A 72 7.492 1.602 6.822 1.00 0.00 C ATOM 1176 CG2 VAL A 72 7.805 3.570 8.314 1.00 0.00 C ATOM 0 H VAL A 72 10.422 3.823 8.428 1.00 0.00 H new ATOM 0 HA VAL A 72 9.339 1.196 8.715 1.00 0.00 H new ATOM 0 HB VAL A 72 8.926 3.217 6.519 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.649 2.128 6.375 1.00 0.00 H new ATOM 0 HG12 VAL A 72 7.959 0.963 6.073 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.139 0.990 7.652 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.967 4.048 7.808 1.00 0.00 H new ATOM 0 HG22 VAL A 72 7.437 3.002 9.168 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.503 4.332 8.659 1.00 0.00 H new ATOM 1186 N ILE A 73 11.506 1.802 6.271 1.00 0.00 N ATOM 1187 CA ILE A 73 12.406 1.163 5.318 1.00 0.00 C ATOM 1188 C ILE A 73 13.103 -0.034 5.985 1.00 0.00 C ATOM 1189 O ILE A 73 13.096 -1.136 5.433 1.00 0.00 O ATOM 1190 CB ILE A 73 13.353 2.236 4.730 1.00 0.00 C ATOM 1191 CG1 ILE A 73 12.611 3.238 3.810 1.00 0.00 C ATOM 1192 CG2 ILE A 73 14.537 1.628 3.971 1.00 0.00 C ATOM 1193 CD1 ILE A 73 11.815 2.628 2.649 1.00 0.00 C ATOM 0 H ILE A 73 11.690 2.796 6.404 1.00 0.00 H new ATOM 0 HA ILE A 73 11.868 0.740 4.470 1.00 0.00 H new ATOM 0 HB ILE A 73 13.741 2.776 5.594 1.00 0.00 H new ATOM 0 HG12 ILE A 73 11.927 3.825 4.423 1.00 0.00 H new ATOM 0 HG13 ILE A 73 13.344 3.931 3.397 1.00 0.00 H new ATOM 0 HG21 ILE A 73 15.168 2.427 3.580 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.120 1.003 4.647 1.00 0.00 H new ATOM 0 HG23 ILE A 73 14.167 1.021 3.145 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.340 3.424 2.076 1.00 0.00 H new ATOM 0 HD12 ILE A 73 12.489 2.067 2.001 1.00 0.00 H new ATOM 0 HD13 ILE A 73 11.050 1.959 3.044 1.00 0.00 H new ATOM 1205 N VAL A 74 13.637 0.126 7.200 1.00 0.00 N ATOM 1206 CA VAL A 74 14.177 -1.017 7.946 1.00 0.00 C ATOM 1207 C VAL A 74 13.101 -2.076 8.218 1.00 0.00 C ATOM 1208 O VAL A 74 13.410 -3.265 8.155 1.00 0.00 O ATOM 1209 CB VAL A 74 14.869 -0.532 9.235 1.00 0.00 C ATOM 1210 CG1 VAL A 74 15.055 -1.626 10.296 1.00 0.00 C ATOM 1211 CG2 VAL A 74 16.245 0.031 8.879 1.00 0.00 C ATOM 0 H VAL A 74 13.707 1.022 7.683 1.00 0.00 H new ATOM 0 HA VAL A 74 14.932 -1.507 7.331 1.00 0.00 H new ATOM 0 HB VAL A 74 14.213 0.223 9.668 1.00 0.00 H new ATOM 0 HG11 VAL A 74 15.549 -1.204 11.171 1.00 0.00 H new ATOM 0 HG12 VAL A 74 14.081 -2.022 10.584 1.00 0.00 H new ATOM 0 HG13 VAL A 74 15.667 -2.430 9.887 1.00 0.00 H new ATOM 0 HG21 VAL A 74 16.742 0.377 9.785 1.00 0.00 H new ATOM 0 HG22 VAL A 74 16.846 -0.748 8.410 1.00 0.00 H new ATOM 0 HG23 VAL A 74 16.129 0.866 8.188 1.00 0.00 H new ATOM 1221 N ASN A 75 11.845 -1.721 8.490 1.00 0.00 N ATOM 1222 CA ASN A 75 10.799 -2.679 8.775 1.00 0.00 C ATOM 1223 C ASN A 75 10.508 -3.588 7.578 1.00 0.00 C ATOM 1224 O ASN A 75 10.090 -4.732 7.762 1.00 0.00 O ATOM 1225 CB ASN A 75 9.552 -1.893 9.169 1.00 0.00 C ATOM 1226 CG ASN A 75 9.418 -1.746 10.662 1.00 0.00 C ATOM 1227 OD1 ASN A 75 9.714 -0.706 11.232 1.00 0.00 O ATOM 1228 ND2 ASN A 75 8.976 -2.778 11.342 1.00 0.00 N ATOM 0 H ASN A 75 11.532 -0.751 8.517 1.00 0.00 H new ATOM 0 HA ASN A 75 11.119 -3.335 9.585 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.588 -0.905 8.710 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.669 -2.395 8.775 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.877 -2.716 12.355 1.00 0.00 H new ATOM 0 HD22 ASN A 75 8.732 -3.641 10.857 1.00 0.00 H new ATOM 1235 N ILE A 76 10.734 -3.123 6.350 1.00 0.00 N ATOM 1236 CA ILE A 76 10.623 -3.973 5.166 1.00 0.00 C ATOM 1237 C ILE A 76 11.783 -4.978 5.159 1.00 0.00 C ATOM 1238 O ILE A 76 11.587 -6.138 4.795 1.00 0.00 O ATOM 1239 CB ILE A 76 10.537 -3.095 3.892 1.00 0.00 C ATOM 1240 CG1 ILE A 76 9.303 -2.169 4.059 1.00 0.00 C ATOM 1241 CG2 ILE A 76 10.479 -3.968 2.622 1.00 0.00 C ATOM 1242 CD1 ILE A 76 8.748 -1.493 2.809 1.00 0.00 C ATOM 0 H ILE A 76 10.996 -2.158 6.149 1.00 0.00 H new ATOM 0 HA ILE A 76 9.703 -4.558 5.186 1.00 0.00 H new ATOM 0 HB ILE A 76 11.429 -2.480 3.770 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.501 -2.756 4.506 1.00 0.00 H new ATOM 0 HG13 ILE A 76 9.564 -1.389 4.774 1.00 0.00 H new ATOM 0 HG21 ILE A 76 10.419 -3.327 1.742 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.377 -4.583 2.562 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.600 -4.611 2.663 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.889 -0.879 3.079 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.518 -0.864 2.363 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.439 -2.253 2.091 1.00 0.00 H new ATOM 1254 N LEU A 77 12.973 -4.583 5.633 1.00 0.00 N ATOM 1255 CA LEU A 77 14.117 -5.482 5.712 1.00 0.00 C ATOM 1256 C LEU A 77 13.823 -6.539 6.769 1.00 0.00 C ATOM 1257 O LEU A 77 14.079 -7.718 6.545 1.00 0.00 O ATOM 1258 CB LEU A 77 15.402 -4.676 5.998 1.00 0.00 C ATOM 1259 CG LEU A 77 16.739 -5.437 5.907 1.00 0.00 C ATOM 1260 CD1 LEU A 77 17.036 -6.278 7.147 1.00 0.00 C ATOM 1261 CD2 LEU A 77 16.872 -6.279 4.637 1.00 0.00 C ATOM 0 H LEU A 77 13.162 -3.638 5.968 1.00 0.00 H new ATOM 0 HA LEU A 77 14.284 -5.994 4.764 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.440 -3.840 5.300 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.321 -4.252 6.999 1.00 0.00 H new ATOM 0 HG LEU A 77 17.495 -4.654 5.855 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.991 -6.789 7.020 1.00 0.00 H new ATOM 0 HD12 LEU A 77 17.084 -5.631 8.023 1.00 0.00 H new ATOM 0 HD13 LEU A 77 16.245 -7.016 7.284 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.836 -6.788 4.637 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.072 -7.018 4.605 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.803 -5.632 3.763 1.00 0.00 H new ATOM 1273 N LYS A 78 13.225 -6.143 7.898 1.00 0.00 N ATOM 1274 CA LYS A 78 12.786 -7.059 8.946 1.00 0.00 C ATOM 1275 C LYS A 78 11.865 -8.136 8.398 1.00 0.00 C ATOM 1276 O LYS A 78 12.068 -9.299 8.745 1.00 0.00 O ATOM 1277 CB LYS A 78 12.075 -6.303 10.072 1.00 0.00 C ATOM 1278 CG LYS A 78 13.057 -5.424 10.834 1.00 0.00 C ATOM 1279 CD LYS A 78 12.424 -4.799 12.089 1.00 0.00 C ATOM 1280 CE LYS A 78 13.396 -4.905 13.269 1.00 0.00 C ATOM 1281 NZ LYS A 78 13.492 -6.280 13.812 1.00 0.00 N ATOM 0 H LYS A 78 13.032 -5.164 8.108 1.00 0.00 H new ATOM 0 HA LYS A 78 13.680 -7.538 9.345 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.276 -5.689 9.656 1.00 0.00 H new ATOM 0 HB3 LYS A 78 11.609 -7.013 10.755 1.00 0.00 H new ATOM 0 HG2 LYS A 78 13.924 -6.017 11.124 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.418 -4.632 10.178 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.178 -3.754 11.901 1.00 0.00 H new ATOM 0 HD3 LYS A 78 11.490 -5.308 12.328 1.00 0.00 H new ATOM 0 HE2 LYS A 78 14.385 -4.575 12.950 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.074 -4.228 14.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.136 -6.287 14.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 12.550 -6.601 14.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.858 -6.919 13.077 1.00 0.00 H new ATOM 1295 N SER A 79 10.875 -7.770 7.583 1.00 0.00 N ATOM 1296 CA SER A 79 9.990 -8.744 6.958 1.00 0.00 C ATOM 1297 C SER A 79 10.831 -9.713 6.131 1.00 0.00 C ATOM 1298 O SER A 79 10.825 -10.913 6.390 1.00 0.00 O ATOM 1299 CB SER A 79 8.914 -8.035 6.125 1.00 0.00 C ATOM 1300 OG SER A 79 7.892 -8.939 5.754 1.00 0.00 O ATOM 0 H SER A 79 10.668 -6.801 7.342 1.00 0.00 H new ATOM 0 HA SER A 79 9.460 -9.319 7.718 1.00 0.00 H new ATOM 0 HB2 SER A 79 8.488 -7.212 6.698 1.00 0.00 H new ATOM 0 HB3 SER A 79 9.365 -7.602 5.232 1.00 0.00 H new ATOM 0 HG SER A 79 7.017 -8.519 5.894 1.00 0.00 H new ATOM 1306 N ILE A 80 11.584 -9.190 5.167 1.00 0.00 N ATOM 1307 CA ILE A 80 12.279 -9.981 4.163 1.00 0.00 C ATOM 1308 C ILE A 80 13.316 -10.913 4.811 1.00 0.00 C ATOM 1309 O ILE A 80 13.417 -12.075 4.421 1.00 0.00 O ATOM 1310 CB ILE A 80 12.843 -8.987 3.125 1.00 0.00 C ATOM 1311 CG1 ILE A 80 11.666 -8.407 2.307 1.00 0.00 C ATOM 1312 CG2 ILE A 80 13.868 -9.625 2.189 1.00 0.00 C ATOM 1313 CD1 ILE A 80 12.098 -7.292 1.359 1.00 0.00 C ATOM 0 H ILE A 80 11.729 -8.186 5.062 1.00 0.00 H new ATOM 0 HA ILE A 80 11.613 -10.670 3.643 1.00 0.00 H new ATOM 0 HB ILE A 80 13.367 -8.198 3.665 1.00 0.00 H new ATOM 0 HG12 ILE A 80 11.200 -9.207 1.731 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.908 -8.023 2.991 1.00 0.00 H new ATOM 0 HG21 ILE A 80 14.229 -8.878 1.482 1.00 0.00 H new ATOM 0 HG22 ILE A 80 14.706 -10.007 2.773 1.00 0.00 H new ATOM 0 HG23 ILE A 80 13.402 -10.446 1.644 1.00 0.00 H new ATOM 0 HD11 ILE A 80 11.231 -6.923 0.811 1.00 0.00 H new ATOM 0 HD12 ILE A 80 12.538 -6.477 1.933 1.00 0.00 H new ATOM 0 HD13 ILE A 80 12.834 -7.678 0.654 1.00 0.00 H new ATOM 1325 N SER A 81 14.040 -10.435 5.822 1.00 0.00 N ATOM 1326 CA SER A 81 14.974 -11.203 6.637 1.00 0.00 C ATOM 1327 C SER A 81 14.257 -12.347 7.358 1.00 0.00 C ATOM 1328 O SER A 81 14.793 -13.452 7.444 1.00 0.00 O ATOM 1329 CB SER A 81 15.625 -10.221 7.623 1.00 0.00 C ATOM 1330 OG SER A 81 16.503 -10.822 8.546 1.00 0.00 O ATOM 0 H SER A 81 13.987 -9.457 6.106 1.00 0.00 H new ATOM 0 HA SER A 81 15.740 -11.671 6.018 1.00 0.00 H new ATOM 0 HB2 SER A 81 16.172 -9.466 7.058 1.00 0.00 H new ATOM 0 HB3 SER A 81 14.840 -9.701 8.172 1.00 0.00 H new ATOM 0 HG SER A 81 16.877 -10.135 9.136 1.00 0.00 H new ATOM 1336 N SER A 82 13.054 -12.103 7.879 1.00 0.00 N ATOM 1337 CA SER A 82 12.275 -13.129 8.558 1.00 0.00 C ATOM 1338 C SER A 82 11.768 -14.175 7.555 1.00 0.00 C ATOM 1339 O SER A 82 11.695 -15.358 7.900 1.00 0.00 O ATOM 1340 CB SER A 82 11.127 -12.476 9.335 1.00 0.00 C ATOM 1341 OG SER A 82 11.623 -11.436 10.168 1.00 0.00 O ATOM 0 H SER A 82 12.597 -11.192 7.841 1.00 0.00 H new ATOM 0 HA SER A 82 12.910 -13.653 9.272 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.391 -12.074 8.639 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.617 -13.225 9.941 1.00 0.00 H new ATOM 0 HG SER A 82 11.654 -10.598 9.661 1.00 0.00 H new ATOM 1347 N SER A 83 11.429 -13.756 6.332 1.00 0.00 N ATOM 1348 CA SER A 83 10.928 -14.619 5.277 1.00 0.00 C ATOM 1349 C SER A 83 12.011 -15.508 4.675 1.00 0.00 C ATOM 1350 O SER A 83 11.781 -16.716 4.548 1.00 0.00 O ATOM 1351 CB SER A 83 10.291 -13.767 4.178 1.00 0.00 C ATOM 1352 OG SER A 83 9.174 -13.073 4.711 1.00 0.00 O ATOM 0 H SER A 83 11.500 -12.779 6.049 1.00 0.00 H new ATOM 0 HA SER A 83 10.186 -15.279 5.726 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.019 -13.059 3.783 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.978 -14.399 3.347 1.00 0.00 H new ATOM 0 HG SER A 83 9.486 -12.340 5.282 1.00 0.00 H new ATOM 1358 N GLY A 84 13.147 -14.931 4.266 1.00 0.00 N ATOM 1359 CA GLY A 84 14.165 -15.643 3.504 1.00 0.00 C ATOM 1360 C GLY A 84 14.694 -14.898 2.276 1.00 0.00 C ATOM 1361 O GLY A 84 15.193 -15.561 1.367 1.00 0.00 O ATOM 0 H GLY A 84 13.381 -13.957 4.457 1.00 0.00 H new ATOM 0 HA2 GLY A 84 15.003 -15.864 4.165 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.753 -16.599 3.181 1.00 0.00 H new ATOM 1365 N GLY A 85 14.526 -13.577 2.166 1.00 0.00 N ATOM 1366 CA GLY A 85 14.857 -12.816 0.969 1.00 0.00 C ATOM 1367 C GLY A 85 15.962 -11.797 1.235 1.00 0.00 C ATOM 1368 O GLY A 85 16.605 -11.807 2.286 1.00 0.00 O ATOM 0 H GLY A 85 14.150 -13.002 2.920 1.00 0.00 H new ATOM 0 HA2 GLY A 85 15.173 -13.498 0.180 1.00 0.00 H new ATOM 0 HA3 GLY A 85 13.967 -12.301 0.607 1.00 0.00 H new ATOM 1372 N PHE A 86 16.169 -10.888 0.285 1.00 0.00 N ATOM 1373 CA PHE A 86 17.193 -9.844 0.313 1.00 0.00 C ATOM 1374 C PHE A 86 16.574 -8.498 -0.062 1.00 0.00 C ATOM 1375 O PHE A 86 15.578 -8.437 -0.782 1.00 0.00 O ATOM 1376 CB PHE A 86 18.339 -10.225 -0.639 1.00 0.00 C ATOM 1377 CG PHE A 86 19.418 -11.034 0.050 1.00 0.00 C ATOM 1378 CD1 PHE A 86 19.269 -12.429 0.168 1.00 0.00 C ATOM 1379 CD2 PHE A 86 20.551 -10.397 0.602 1.00 0.00 C ATOM 1380 CE1 PHE A 86 20.248 -13.191 0.823 1.00 0.00 C ATOM 1381 CE2 PHE A 86 21.514 -11.164 1.279 1.00 0.00 C ATOM 1382 CZ PHE A 86 21.369 -12.556 1.381 1.00 0.00 C ATOM 0 H PHE A 86 15.603 -10.857 -0.563 1.00 0.00 H new ATOM 0 HA PHE A 86 17.603 -9.752 1.319 1.00 0.00 H new ATOM 0 HB2 PHE A 86 17.938 -10.798 -1.475 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.778 -9.318 -1.055 1.00 0.00 H new ATOM 0 HD1 PHE A 86 18.398 -12.914 -0.247 1.00 0.00 H new ATOM 0 HD2 PHE A 86 20.676 -9.329 0.505 1.00 0.00 H new ATOM 0 HE1 PHE A 86 20.140 -14.263 0.898 1.00 0.00 H new ATOM 0 HE2 PHE A 86 22.371 -10.679 1.723 1.00 0.00 H new ATOM 0 HZ PHE A 86 22.121 -13.140 1.890 1.00 0.00 H new ATOM 1392 N PHE A 87 17.156 -7.398 0.415 1.00 0.00 N ATOM 1393 CA PHE A 87 16.743 -6.050 0.045 1.00 0.00 C ATOM 1394 C PHE A 87 17.955 -5.135 0.198 1.00 0.00 C ATOM 1395 O PHE A 87 18.751 -5.306 1.126 1.00 0.00 O ATOM 1396 CB PHE A 87 15.515 -5.623 0.879 1.00 0.00 C ATOM 1397 CG PHE A 87 15.252 -4.131 1.041 1.00 0.00 C ATOM 1398 CD1 PHE A 87 15.346 -3.249 -0.052 1.00 0.00 C ATOM 1399 CD2 PHE A 87 14.901 -3.616 2.304 1.00 0.00 C ATOM 1400 CE1 PHE A 87 15.157 -1.871 0.124 1.00 0.00 C ATOM 1401 CE2 PHE A 87 14.707 -2.234 2.481 1.00 0.00 C ATOM 1402 CZ PHE A 87 14.859 -1.359 1.393 1.00 0.00 C ATOM 0 H PHE A 87 17.934 -7.421 1.075 1.00 0.00 H new ATOM 0 HA PHE A 87 16.415 -5.993 -0.993 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.630 -6.072 0.427 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.619 -6.055 1.874 1.00 0.00 H new ATOM 0 HD1 PHE A 87 15.566 -3.637 -1.035 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.780 -4.286 3.142 1.00 0.00 H new ATOM 0 HE1 PHE A 87 15.241 -1.203 -0.721 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.441 -1.846 3.453 1.00 0.00 H new ATOM 0 HZ PHE A 87 14.746 -0.294 1.535 1.00 0.00 H new ATOM 1412 N ALA A 88 18.114 -4.195 -0.736 1.00 0.00 N ATOM 1413 CA ALA A 88 19.201 -3.235 -0.762 1.00 0.00 C ATOM 1414 C ALA A 88 18.750 -1.896 -1.339 1.00 0.00 C ATOM 1415 O ALA A 88 17.634 -1.791 -1.849 1.00 0.00 O ATOM 1416 CB ALA A 88 20.331 -3.810 -1.601 1.00 0.00 C ATOM 0 H ALA A 88 17.466 -4.084 -1.516 1.00 0.00 H new ATOM 0 HA ALA A 88 19.539 -3.053 0.258 1.00 0.00 H new ATOM 0 HB1 ALA A 88 21.158 -3.101 -1.632 1.00 0.00 H new ATOM 0 HB2 ALA A 88 20.672 -4.746 -1.159 1.00 0.00 H new ATOM 0 HB3 ALA A 88 19.974 -3.995 -2.614 1.00 0.00 H new ATOM 1422 N LEU A 89 19.606 -0.877 -1.275 1.00 0.00 N ATOM 1423 CA LEU A 89 19.331 0.445 -1.831 1.00 0.00 C ATOM 1424 C LEU A 89 20.340 0.731 -2.930 1.00 0.00 C ATOM 1425 O LEU A 89 21.343 0.030 -3.034 1.00 0.00 O ATOM 1426 CB LEU A 89 19.336 1.582 -0.793 1.00 0.00 C ATOM 1427 CG LEU A 89 19.027 1.247 0.673 1.00 0.00 C ATOM 1428 CD1 LEU A 89 18.768 2.539 1.457 1.00 0.00 C ATOM 1429 CD2 LEU A 89 17.896 0.253 0.929 1.00 0.00 C ATOM 0 H LEU A 89 20.521 -0.948 -0.830 1.00 0.00 H new ATOM 0 HA LEU A 89 18.315 0.419 -2.225 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.319 2.053 -0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 89 18.614 2.330 -1.120 1.00 0.00 H new ATOM 0 HG LEU A 89 19.921 0.729 1.021 1.00 0.00 H new ATOM 0 HD11 LEU A 89 18.549 2.296 2.497 1.00 0.00 H new ATOM 0 HD12 LEU A 89 19.652 3.176 1.411 1.00 0.00 H new ATOM 0 HD13 LEU A 89 17.919 3.065 1.021 1.00 0.00 H new ATOM 0 HD21 LEU A 89 17.779 0.103 2.002 1.00 0.00 H new ATOM 0 HD22 LEU A 89 16.967 0.644 0.514 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.133 -0.699 0.453 1.00 0.00 H new ATOM 1441 N VAL A 90 20.066 1.749 -3.736 1.00 0.00 N ATOM 1442 CA VAL A 90 20.723 1.999 -5.000 1.00 0.00 C ATOM 1443 C VAL A 90 20.885 3.509 -5.158 1.00 0.00 C ATOM 1444 O VAL A 90 19.927 4.259 -4.953 1.00 0.00 O ATOM 1445 CB VAL A 90 19.875 1.364 -6.119 1.00 0.00 C ATOM 1446 CG1 VAL A 90 20.366 1.783 -7.506 1.00 0.00 C ATOM 1447 CG2 VAL A 90 19.883 -0.170 -6.007 1.00 0.00 C ATOM 0 H VAL A 90 19.354 2.445 -3.514 1.00 0.00 H new ATOM 0 HA VAL A 90 21.716 1.552 -5.049 1.00 0.00 H new ATOM 0 HB VAL A 90 18.855 1.726 -5.994 1.00 0.00 H new ATOM 0 HG11 VAL A 90 19.744 1.315 -8.269 1.00 0.00 H new ATOM 0 HG12 VAL A 90 20.304 2.867 -7.602 1.00 0.00 H new ATOM 0 HG13 VAL A 90 21.400 1.465 -7.637 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.278 -0.596 -6.807 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.906 -0.536 -6.092 1.00 0.00 H new ATOM 0 HG23 VAL A 90 19.470 -0.467 -5.043 1.00 0.00 H new ATOM 1457 N SER A 91 22.075 3.931 -5.581 1.00 0.00 N ATOM 1458 CA SER A 91 22.502 5.317 -5.703 1.00 0.00 C ATOM 1459 C SER A 91 22.240 6.115 -4.406 1.00 0.00 C ATOM 1460 O SER A 91 21.628 7.180 -4.465 1.00 0.00 O ATOM 1461 CB SER A 91 21.845 5.897 -6.967 1.00 0.00 C ATOM 1462 OG SER A 91 22.388 7.147 -7.342 1.00 0.00 O ATOM 0 H SER A 91 22.805 3.276 -5.862 1.00 0.00 H new ATOM 0 HA SER A 91 23.583 5.388 -5.826 1.00 0.00 H new ATOM 0 HB2 SER A 91 21.965 5.192 -7.790 1.00 0.00 H new ATOM 0 HB3 SER A 91 20.774 6.008 -6.796 1.00 0.00 H new ATOM 0 HG SER A 91 21.673 7.727 -7.676 1.00 0.00 H new ATOM 1468 N PRO A 92 22.728 5.667 -3.233 1.00 0.00 N ATOM 1469 CA PRO A 92 22.562 6.356 -1.962 1.00 0.00 C ATOM 1470 C PRO A 92 23.468 7.584 -1.936 1.00 0.00 C ATOM 1471 O PRO A 92 24.692 7.462 -1.867 1.00 0.00 O ATOM 1472 CB PRO A 92 22.935 5.324 -0.897 1.00 0.00 C ATOM 1473 CG PRO A 92 24.022 4.503 -1.592 1.00 0.00 C ATOM 1474 CD PRO A 92 23.588 4.513 -3.050 1.00 0.00 C ATOM 0 HA PRO A 92 21.549 6.722 -1.792 1.00 0.00 H new ATOM 0 HB2 PRO A 92 23.304 5.797 0.013 1.00 0.00 H new ATOM 0 HB3 PRO A 92 22.082 4.708 -0.613 1.00 0.00 H new ATOM 0 HG2 PRO A 92 25.008 4.949 -1.463 1.00 0.00 H new ATOM 0 HG3 PRO A 92 24.076 3.489 -1.195 1.00 0.00 H new ATOM 0 HD2 PRO A 92 24.454 4.570 -3.709 1.00 0.00 H new ATOM 0 HD3 PRO A 92 23.058 3.594 -3.300 1.00 0.00 H new ATOM 1482 N ASN A 93 22.881 8.772 -2.040 1.00 0.00 N ATOM 1483 CA ASN A 93 23.626 10.014 -1.909 1.00 0.00 C ATOM 1484 C ASN A 93 24.155 10.177 -0.481 1.00 0.00 C ATOM 1485 O ASN A 93 23.733 9.502 0.461 1.00 0.00 O ATOM 1486 CB ASN A 93 22.767 11.218 -2.325 1.00 0.00 C ATOM 1487 CG ASN A 93 21.543 11.450 -1.435 1.00 0.00 C ATOM 1488 OD1 ASN A 93 21.018 10.533 -0.817 1.00 0.00 O ATOM 1489 ND2 ASN A 93 21.034 12.663 -1.343 1.00 0.00 N ATOM 0 H ASN A 93 21.884 8.898 -2.216 1.00 0.00 H new ATOM 0 HA ASN A 93 24.482 9.972 -2.583 1.00 0.00 H new ATOM 0 HB2 ASN A 93 23.387 12.114 -2.313 1.00 0.00 H new ATOM 0 HB3 ASN A 93 22.434 11.075 -3.353 1.00 0.00 H new ATOM 0 HD21 ASN A 93 20.212 12.829 -0.762 1.00 0.00 H new ATOM 0 HD22 ASN A 93 21.462 13.436 -1.853 1.00 0.00 H new ATOM 1496 N GLU A 94 25.090 11.101 -0.292 1.00 0.00 N ATOM 1497 CA GLU A 94 25.814 11.213 0.967 1.00 0.00 C ATOM 1498 C GLU A 94 24.914 11.708 2.114 1.00 0.00 C ATOM 1499 O GLU A 94 25.110 11.379 3.278 1.00 0.00 O ATOM 1500 CB GLU A 94 27.074 12.069 0.786 1.00 0.00 C ATOM 1501 CG GLU A 94 27.910 11.958 2.066 1.00 0.00 C ATOM 1502 CD GLU A 94 29.305 12.580 2.020 1.00 0.00 C ATOM 1503 OE1 GLU A 94 29.793 12.975 0.943 1.00 0.00 O ATOM 1504 OE2 GLU A 94 29.907 12.704 3.117 1.00 0.00 O ATOM 0 H GLU A 94 25.364 11.785 -0.997 1.00 0.00 H new ATOM 0 HA GLU A 94 26.138 10.215 1.262 1.00 0.00 H new ATOM 0 HB2 GLU A 94 27.648 11.725 -0.075 1.00 0.00 H new ATOM 0 HB3 GLU A 94 26.805 13.108 0.596 1.00 0.00 H new ATOM 0 HG2 GLU A 94 27.354 12.425 2.879 1.00 0.00 H new ATOM 0 HG3 GLU A 94 28.014 10.902 2.316 1.00 0.00 H new ATOM 1511 N LYS A 95 23.858 12.451 1.810 1.00 0.00 N ATOM 1512 CA LYS A 95 22.866 12.979 2.735 1.00 0.00 C ATOM 1513 C LYS A 95 22.130 11.825 3.413 1.00 0.00 C ATOM 1514 O LYS A 95 21.692 11.976 4.559 1.00 0.00 O ATOM 1515 CB LYS A 95 21.975 13.922 1.894 1.00 0.00 C ATOM 1516 CG LYS A 95 20.501 14.066 2.275 1.00 0.00 C ATOM 1517 CD LYS A 95 20.262 14.831 3.572 1.00 0.00 C ATOM 1518 CE LYS A 95 19.449 14.000 4.554 1.00 0.00 C ATOM 1519 NZ LYS A 95 20.051 14.035 5.893 1.00 0.00 N ATOM 0 H LYS A 95 23.659 12.718 0.846 1.00 0.00 H new ATOM 0 HA LYS A 95 23.289 13.550 3.561 1.00 0.00 H new ATOM 0 HB2 LYS A 95 22.423 14.915 1.923 1.00 0.00 H new ATOM 0 HB3 LYS A 95 22.018 13.583 0.859 1.00 0.00 H new ATOM 0 HG2 LYS A 95 19.976 14.573 1.465 1.00 0.00 H new ATOM 0 HG3 LYS A 95 20.062 13.072 2.366 1.00 0.00 H new ATOM 0 HD2 LYS A 95 21.218 15.099 4.022 1.00 0.00 H new ATOM 0 HD3 LYS A 95 19.738 15.763 3.358 1.00 0.00 H new ATOM 0 HE2 LYS A 95 18.428 14.379 4.600 1.00 0.00 H new ATOM 0 HE3 LYS A 95 19.391 12.969 4.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 19.330 13.799 6.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 20.826 13.343 5.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 20.424 14.987 6.081 1.00 0.00 H new ATOM 1533 N VAL A 96 22.017 10.695 2.724 1.00 0.00 N ATOM 1534 CA VAL A 96 21.551 9.431 3.240 1.00 0.00 C ATOM 1535 C VAL A 96 22.717 8.704 3.885 1.00 0.00 C ATOM 1536 O VAL A 96 22.548 8.332 5.036 1.00 0.00 O ATOM 1537 CB VAL A 96 20.894 8.662 2.068 1.00 0.00 C ATOM 1538 CG1 VAL A 96 20.733 7.144 2.264 1.00 0.00 C ATOM 1539 CG2 VAL A 96 19.554 9.327 1.707 1.00 0.00 C ATOM 0 H VAL A 96 22.264 10.643 1.736 1.00 0.00 H new ATOM 0 HA VAL A 96 20.797 9.543 4.020 1.00 0.00 H new ATOM 0 HB VAL A 96 21.597 8.735 1.239 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.262 6.711 1.381 1.00 0.00 H new ATOM 0 HG12 VAL A 96 21.713 6.690 2.412 1.00 0.00 H new ATOM 0 HG13 VAL A 96 20.110 6.954 3.138 1.00 0.00 H new ATOM 0 HG21 VAL A 96 19.090 8.787 0.882 1.00 0.00 H new ATOM 0 HG22 VAL A 96 18.892 9.305 2.573 1.00 0.00 H new ATOM 0 HG23 VAL A 96 19.729 10.361 1.410 1.00 0.00 H new ATOM 1549 N GLU A 97 23.888 8.528 3.270 1.00 0.00 N ATOM 1550 CA GLU A 97 24.971 7.766 3.900 1.00 0.00 C ATOM 1551 C GLU A 97 25.269 8.337 5.286 1.00 0.00 C ATOM 1552 O GLU A 97 25.494 7.589 6.236 1.00 0.00 O ATOM 1553 CB GLU A 97 26.228 7.790 3.024 1.00 0.00 C ATOM 1554 CG GLU A 97 26.228 6.716 1.926 1.00 0.00 C ATOM 1555 CD GLU A 97 26.612 5.344 2.484 1.00 0.00 C ATOM 1556 OE1 GLU A 97 27.722 5.231 3.052 1.00 0.00 O ATOM 1557 OE2 GLU A 97 25.822 4.376 2.394 1.00 0.00 O ATOM 0 H GLU A 97 24.111 8.898 2.346 1.00 0.00 H new ATOM 0 HA GLU A 97 24.655 6.728 4.008 1.00 0.00 H new ATOM 0 HB2 GLU A 97 26.320 8.772 2.561 1.00 0.00 H new ATOM 0 HB3 GLU A 97 27.105 7.652 3.656 1.00 0.00 H new ATOM 0 HG2 GLU A 97 25.240 6.661 1.470 1.00 0.00 H new ATOM 0 HG3 GLU A 97 26.927 6.999 1.139 1.00 0.00 H new ATOM 1564 N ARG A 98 25.146 9.659 5.446 1.00 0.00 N ATOM 1565 CA ARG A 98 25.386 10.297 6.719 1.00 0.00 C ATOM 1566 C ARG A 98 24.402 9.814 7.772 1.00 0.00 C ATOM 1567 O ARG A 98 24.791 9.533 8.899 1.00 0.00 O ATOM 1568 CB ARG A 98 25.504 11.826 6.577 1.00 0.00 C ATOM 1569 CG ARG A 98 24.213 12.619 6.769 1.00 0.00 C ATOM 1570 CD ARG A 98 23.966 12.989 8.244 1.00 0.00 C ATOM 1571 NE ARG A 98 22.533 13.176 8.554 1.00 0.00 N ATOM 1572 CZ ARG A 98 22.027 13.746 9.660 1.00 0.00 C ATOM 1573 NH1 ARG A 98 22.839 14.250 10.585 1.00 0.00 N ATOM 1574 NH2 ARG A 98 20.710 13.792 9.848 1.00 0.00 N ATOM 0 H ARG A 98 24.880 10.300 4.698 1.00 0.00 H new ATOM 0 HA ARG A 98 26.363 9.988 7.091 1.00 0.00 H new ATOM 0 HB2 ARG A 98 26.237 12.182 7.301 1.00 0.00 H new ATOM 0 HB3 ARG A 98 25.900 12.049 5.586 1.00 0.00 H new ATOM 0 HG2 ARG A 98 24.256 13.529 6.171 1.00 0.00 H new ATOM 0 HG3 ARG A 98 23.372 12.034 6.398 1.00 0.00 H new ATOM 0 HD2 ARG A 98 24.372 12.206 8.884 1.00 0.00 H new ATOM 0 HD3 ARG A 98 24.507 13.905 8.480 1.00 0.00 H new ATOM 0 HE ARG A 98 21.864 12.840 7.861 1.00 0.00 H new ATOM 0 HH11 ARG A 98 23.850 14.204 10.456 1.00 0.00 H new ATOM 0 HH12 ARG A 98 22.451 14.682 11.424 1.00 0.00 H new ATOM 0 HH21 ARG A 98 20.081 13.393 9.151 1.00 0.00 H new ATOM 0 HH22 ARG A 98 20.330 14.226 10.689 1.00 0.00 H new ATOM 1588 N VAL A 99 23.113 9.749 7.448 1.00 0.00 N ATOM 1589 CA VAL A 99 22.096 9.511 8.447 1.00 0.00 C ATOM 1590 C VAL A 99 22.026 8.013 8.641 1.00 0.00 C ATOM 1591 O VAL A 99 21.960 7.534 9.769 1.00 0.00 O ATOM 1592 CB VAL A 99 20.787 10.207 8.019 1.00 0.00 C ATOM 1593 CG1 VAL A 99 20.043 9.626 6.852 1.00 0.00 C ATOM 1594 CG2 VAL A 99 19.790 10.306 9.180 1.00 0.00 C ATOM 0 H VAL A 99 22.756 9.859 6.499 1.00 0.00 H new ATOM 0 HA VAL A 99 22.317 9.946 9.422 1.00 0.00 H new ATOM 0 HB VAL A 99 21.161 11.179 7.696 1.00 0.00 H new ATOM 0 HG11 VAL A 99 19.145 10.214 6.663 1.00 0.00 H new ATOM 0 HG12 VAL A 99 20.681 9.644 5.968 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.762 8.597 7.076 1.00 0.00 H new ATOM 0 HG21 VAL A 99 18.882 10.802 8.838 1.00 0.00 H new ATOM 0 HG22 VAL A 99 19.545 9.305 9.536 1.00 0.00 H new ATOM 0 HG23 VAL A 99 20.234 10.881 9.993 1.00 0.00 H new ATOM 1604 N LEU A 100 22.151 7.274 7.545 1.00 0.00 N ATOM 1605 CA LEU A 100 22.161 5.845 7.497 1.00 0.00 C ATOM 1606 C LEU A 100 23.315 5.240 8.285 1.00 0.00 C ATOM 1607 O LEU A 100 23.130 4.137 8.796 1.00 0.00 O ATOM 1608 CB LEU A 100 22.070 5.374 6.025 1.00 0.00 C ATOM 1609 CG LEU A 100 20.608 5.399 5.531 1.00 0.00 C ATOM 1610 CD1 LEU A 100 19.760 6.626 5.319 1.00 0.00 C ATOM 1611 CD2 LEU A 100 20.259 4.282 4.546 1.00 0.00 C ATOM 0 H LEU A 100 22.253 7.695 6.622 1.00 0.00 H new ATOM 0 HA LEU A 100 21.277 5.464 8.008 1.00 0.00 H new ATOM 0 HB2 LEU A 100 22.683 6.018 5.394 1.00 0.00 H new ATOM 0 HB3 LEU A 100 22.472 4.365 5.936 1.00 0.00 H new ATOM 0 HG LEU A 100 20.264 5.249 6.554 1.00 0.00 H new ATOM 0 HD11 LEU A 100 18.772 6.329 4.966 1.00 0.00 H new ATOM 0 HD12 LEU A 100 19.661 7.167 6.260 1.00 0.00 H new ATOM 0 HD13 LEU A 100 20.232 7.271 4.577 1.00 0.00 H new ATOM 0 HD21 LEU A 100 19.214 4.372 4.249 1.00 0.00 H new ATOM 0 HD22 LEU A 100 20.895 4.362 3.665 1.00 0.00 H new ATOM 0 HD23 LEU A 100 20.419 3.314 5.022 1.00 0.00 H new ATOM 1623 N SER A 101 24.413 5.967 8.500 1.00 0.00 N ATOM 1624 CA SER A 101 25.576 5.481 9.242 1.00 0.00 C ATOM 1625 C SER A 101 25.639 6.100 10.653 1.00 0.00 C ATOM 1626 O SER A 101 26.617 5.938 11.384 1.00 0.00 O ATOM 1627 CB SER A 101 26.821 5.751 8.389 1.00 0.00 C ATOM 1628 OG SER A 101 27.807 4.746 8.553 1.00 0.00 O ATOM 0 H SER A 101 24.520 6.922 8.159 1.00 0.00 H new ATOM 0 HA SER A 101 25.508 4.407 9.417 1.00 0.00 H new ATOM 0 HB2 SER A 101 26.535 5.810 7.339 1.00 0.00 H new ATOM 0 HB3 SER A 101 27.242 6.719 8.659 1.00 0.00 H new ATOM 0 HG SER A 101 27.682 4.051 7.874 1.00 0.00 H new ATOM 1634 N LEU A 102 24.605 6.845 11.053 1.00 0.00 N ATOM 1635 CA LEU A 102 24.377 7.375 12.393 1.00 0.00 C ATOM 1636 C LEU A 102 23.222 6.643 13.074 1.00 0.00 C ATOM 1637 O LEU A 102 23.280 6.384 14.276 1.00 0.00 O ATOM 1638 CB LEU A 102 24.027 8.868 12.277 1.00 0.00 C ATOM 1639 CG LEU A 102 25.237 9.781 12.030 1.00 0.00 C ATOM 1640 CD1 LEU A 102 24.754 11.204 11.750 1.00 0.00 C ATOM 1641 CD2 LEU A 102 26.207 9.766 13.210 1.00 0.00 C ATOM 0 H LEU A 102 23.861 7.108 10.407 1.00 0.00 H new ATOM 0 HA LEU A 102 25.278 7.235 12.990 1.00 0.00 H new ATOM 0 HB2 LEU A 102 23.314 9.000 11.463 1.00 0.00 H new ATOM 0 HB3 LEU A 102 23.528 9.185 13.193 1.00 0.00 H new ATOM 0 HG LEU A 102 25.779 9.403 11.163 1.00 0.00 H new ATOM 0 HD11 LEU A 102 25.613 11.852 11.575 1.00 0.00 H new ATOM 0 HD12 LEU A 102 24.114 11.204 10.868 1.00 0.00 H new ATOM 0 HD13 LEU A 102 24.191 11.572 12.607 1.00 0.00 H new ATOM 0 HD21 LEU A 102 27.049 10.424 12.997 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.694 10.112 14.107 1.00 0.00 H new ATOM 0 HD23 LEU A 102 26.571 8.751 13.369 1.00 0.00 H new ATOM 1653 N THR A 103 22.173 6.332 12.313 1.00 0.00 N ATOM 1654 CA THR A 103 20.877 5.858 12.779 1.00 0.00 C ATOM 1655 C THR A 103 20.786 4.321 12.767 1.00 0.00 C ATOM 1656 O THR A 103 19.756 3.762 13.146 1.00 0.00 O ATOM 1657 CB THR A 103 19.818 6.550 11.894 1.00 0.00 C ATOM 1658 OG1 THR A 103 18.586 6.688 12.559 1.00 0.00 O ATOM 1659 CG2 THR A 103 19.580 5.857 10.548 1.00 0.00 C ATOM 0 H THR A 103 22.211 6.410 11.297 1.00 0.00 H new ATOM 0 HA THR A 103 20.709 6.118 13.824 1.00 0.00 H new ATOM 0 HB THR A 103 20.241 7.533 11.689 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.943 7.131 11.967 1.00 0.00 H new ATOM 0 HG21 THR A 103 18.823 6.404 9.986 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.510 5.837 9.980 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.238 4.837 10.720 1.00 0.00 H new ATOM 1667 N ASN A 104 21.863 3.637 12.357 1.00 0.00 N ATOM 1668 CA ASN A 104 21.914 2.208 12.042 1.00 0.00 C ATOM 1669 C ASN A 104 20.900 1.893 10.937 1.00 0.00 C ATOM 1670 O ASN A 104 19.803 1.396 11.184 1.00 0.00 O ATOM 1671 CB ASN A 104 21.838 1.276 13.271 1.00 0.00 C ATOM 1672 CG ASN A 104 21.995 1.966 14.620 1.00 0.00 C ATOM 1673 OD1 ASN A 104 23.047 2.528 14.913 1.00 0.00 O ATOM 1674 ND2 ASN A 104 20.981 1.961 15.462 1.00 0.00 N ATOM 0 H ASN A 104 22.767 4.092 12.231 1.00 0.00 H new ATOM 0 HA ASN A 104 22.909 1.985 11.655 1.00 0.00 H new ATOM 0 HB2 ASN A 104 20.879 0.758 13.255 1.00 0.00 H new ATOM 0 HB3 ASN A 104 22.613 0.515 13.178 1.00 0.00 H new ATOM 0 HD21 ASN A 104 21.066 2.426 16.366 1.00 0.00 H new ATOM 0 HD22 ASN A 104 20.111 1.492 15.210 1.00 0.00 H new ATOM 1681 N LEU A 105 21.283 2.186 9.694 1.00 0.00 N ATOM 1682 CA LEU A 105 20.519 1.879 8.489 1.00 0.00 C ATOM 1683 C LEU A 105 21.423 1.142 7.501 1.00 0.00 C ATOM 1684 O LEU A 105 21.100 0.031 7.076 1.00 0.00 O ATOM 1685 CB LEU A 105 19.940 3.133 7.855 1.00 0.00 C ATOM 1686 CG LEU A 105 18.487 3.079 7.351 1.00 0.00 C ATOM 1687 CD1 LEU A 105 18.160 1.849 6.502 1.00 0.00 C ATOM 1688 CD2 LEU A 105 17.531 3.220 8.527 1.00 0.00 C ATOM 0 H LEU A 105 22.164 2.660 9.494 1.00 0.00 H new ATOM 0 HA LEU A 105 19.676 1.244 8.762 1.00 0.00 H new ATOM 0 HB2 LEU A 105 20.011 3.940 8.584 1.00 0.00 H new ATOM 0 HB3 LEU A 105 20.576 3.407 7.013 1.00 0.00 H new ATOM 0 HG LEU A 105 18.359 3.922 6.672 1.00 0.00 H new ATOM 0 HD11 LEU A 105 17.117 1.890 6.188 1.00 0.00 H new ATOM 0 HD12 LEU A 105 18.803 1.833 5.622 1.00 0.00 H new ATOM 0 HD13 LEU A 105 18.327 0.946 7.090 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.503 3.181 8.167 1.00 0.00 H new ATOM 0 HD22 LEU A 105 17.699 2.406 9.232 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.705 4.174 9.025 1.00 0.00 H new ATOM 1700 N ASP A 106 22.566 1.745 7.157 1.00 0.00 N ATOM 1701 CA ASP A 106 23.574 1.242 6.210 1.00 0.00 C ATOM 1702 C ASP A 106 24.144 -0.106 6.638 1.00 0.00 C ATOM 1703 O ASP A 106 24.692 -0.856 5.829 1.00 0.00 O ATOM 1704 CB ASP A 106 24.724 2.253 6.031 1.00 0.00 C ATOM 1705 CG ASP A 106 25.690 2.384 7.224 1.00 0.00 C ATOM 1706 OD1 ASP A 106 25.260 2.086 8.364 1.00 0.00 O ATOM 1707 OD2 ASP A 106 26.834 2.846 7.011 1.00 0.00 O ATOM 0 H ASP A 106 22.830 2.647 7.552 1.00 0.00 H new ATOM 0 HA ASP A 106 23.061 1.108 5.257 1.00 0.00 H new ATOM 0 HB2 ASP A 106 25.300 1.968 5.150 1.00 0.00 H new ATOM 0 HB3 ASP A 106 24.293 3.233 5.827 1.00 0.00 H new ATOM 1712 N ARG A 107 23.970 -0.440 7.912 1.00 0.00 N ATOM 1713 CA ARG A 107 24.452 -1.642 8.559 1.00 0.00 C ATOM 1714 C ARG A 107 23.408 -2.749 8.700 1.00 0.00 C ATOM 1715 O ARG A 107 23.709 -3.853 9.147 1.00 0.00 O ATOM 1716 CB ARG A 107 25.005 -1.208 9.903 1.00 0.00 C ATOM 1717 CG ARG A 107 23.951 -0.718 10.885 1.00 0.00 C ATOM 1718 CD ARG A 107 23.760 -1.560 12.164 1.00 0.00 C ATOM 1719 NE ARG A 107 23.843 -3.027 11.978 1.00 0.00 N ATOM 1720 CZ ARG A 107 24.949 -3.785 12.082 1.00 0.00 C ATOM 1721 NH1 ARG A 107 26.086 -3.277 12.551 1.00 0.00 N ATOM 1722 NH2 ARG A 107 24.909 -5.045 11.666 1.00 0.00 N ATOM 0 H ARG A 107 23.456 0.163 8.555 1.00 0.00 H new ATOM 0 HA ARG A 107 25.218 -2.103 7.935 1.00 0.00 H new ATOM 0 HB2 ARG A 107 25.540 -2.046 10.350 1.00 0.00 H new ATOM 0 HB3 ARG A 107 25.734 -0.413 9.743 1.00 0.00 H new ATOM 0 HG2 ARG A 107 24.207 0.299 11.181 1.00 0.00 H new ATOM 0 HG3 ARG A 107 22.995 -0.668 10.363 1.00 0.00 H new ATOM 0 HD2 ARG A 107 24.514 -1.260 12.892 1.00 0.00 H new ATOM 0 HD3 ARG A 107 22.788 -1.320 12.595 1.00 0.00 H new ATOM 0 HE ARG A 107 22.975 -3.511 11.748 1.00 0.00 H new ATOM 0 HH11 ARG A 107 26.128 -2.299 12.838 1.00 0.00 H new ATOM 0 HH12 ARG A 107 26.916 -3.866 12.624 1.00 0.00 H new ATOM 0 HH21 ARG A 107 24.048 -5.426 11.274 1.00 0.00 H new ATOM 0 HH22 ARG A 107 25.740 -5.633 11.738 1.00 0.00 H new ATOM 1736 N ILE A 108 22.165 -2.416 8.393 1.00 0.00 N ATOM 1737 CA ILE A 108 20.981 -3.256 8.506 1.00 0.00 C ATOM 1738 C ILE A 108 20.550 -3.650 7.099 1.00 0.00 C ATOM 1739 O ILE A 108 20.125 -4.787 6.897 1.00 0.00 O ATOM 1740 CB ILE A 108 19.847 -2.528 9.275 1.00 0.00 C ATOM 1741 CG1 ILE A 108 20.347 -2.005 10.639 1.00 0.00 C ATOM 1742 CG2 ILE A 108 18.627 -3.450 9.447 1.00 0.00 C ATOM 1743 CD1 ILE A 108 19.258 -1.599 11.634 1.00 0.00 C ATOM 0 H ILE A 108 21.940 -1.488 8.034 1.00 0.00 H new ATOM 0 HA ILE A 108 21.210 -4.153 9.082 1.00 0.00 H new ATOM 0 HB ILE A 108 19.537 -1.666 8.685 1.00 0.00 H new ATOM 0 HG12 ILE A 108 20.964 -2.777 11.099 1.00 0.00 H new ATOM 0 HG13 ILE A 108 20.992 -1.144 10.463 1.00 0.00 H new ATOM 0 HG21 ILE A 108 17.844 -2.920 9.989 1.00 0.00 H new ATOM 0 HG22 ILE A 108 18.254 -3.746 8.467 1.00 0.00 H new ATOM 0 HG23 ILE A 108 18.918 -4.338 10.008 1.00 0.00 H new ATOM 0 HD11 ILE A 108 19.721 -1.247 12.556 1.00 0.00 H new ATOM 0 HD12 ILE A 108 18.652 -0.801 11.205 1.00 0.00 H new ATOM 0 HD13 ILE A 108 18.624 -2.459 11.851 1.00 0.00 H new ATOM 1755 N VAL A 109 20.657 -2.740 6.127 1.00 0.00 N ATOM 1756 CA VAL A 109 20.268 -2.981 4.755 1.00 0.00 C ATOM 1757 C VAL A 109 21.477 -2.783 3.852 1.00 0.00 C ATOM 1758 O VAL A 109 22.321 -1.928 4.131 1.00 0.00 O ATOM 1759 CB VAL A 109 19.101 -2.061 4.335 1.00 0.00 C ATOM 1760 CG1 VAL A 109 18.280 -2.736 3.245 1.00 0.00 C ATOM 1761 CG2 VAL A 109 18.147 -1.639 5.470 1.00 0.00 C ATOM 0 H VAL A 109 21.024 -1.802 6.285 1.00 0.00 H new ATOM 0 HA VAL A 109 19.914 -4.008 4.659 1.00 0.00 H new ATOM 0 HB VAL A 109 19.582 -1.147 3.986 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.458 -2.083 2.952 1.00 0.00 H new ATOM 0 HG12 VAL A 109 18.914 -2.932 2.380 1.00 0.00 H new ATOM 0 HG13 VAL A 109 17.879 -3.677 3.621 1.00 0.00 H new ATOM 0 HG21 VAL A 109 17.365 -0.995 5.067 1.00 0.00 H new ATOM 0 HG22 VAL A 109 17.695 -2.526 5.914 1.00 0.00 H new ATOM 0 HG23 VAL A 109 18.706 -1.097 6.233 1.00 0.00 H new ATOM 1771 N LYS A 110 21.568 -3.572 2.782 1.00 0.00 N ATOM 1772 CA LYS A 110 22.622 -3.440 1.783 1.00 0.00 C ATOM 1773 C LYS A 110 22.465 -2.141 1.001 1.00 0.00 C ATOM 1774 O LYS A 110 21.363 -1.590 0.937 1.00 0.00 O ATOM 1775 CB LYS A 110 22.581 -4.660 0.864 1.00 0.00 C ATOM 1776 CG LYS A 110 23.341 -5.846 1.481 1.00 0.00 C ATOM 1777 CD LYS A 110 24.669 -6.109 0.759 1.00 0.00 C ATOM 1778 CE LYS A 110 25.699 -4.976 0.808 1.00 0.00 C ATOM 1779 NZ LYS A 110 26.602 -5.069 1.967 1.00 0.00 N ATOM 0 H LYS A 110 20.908 -4.324 2.585 1.00 0.00 H new ATOM 0 HA LYS A 110 23.595 -3.398 2.273 1.00 0.00 H new ATOM 0 HB2 LYS A 110 21.545 -4.945 0.679 1.00 0.00 H new ATOM 0 HB3 LYS A 110 23.019 -4.406 -0.101 1.00 0.00 H new ATOM 0 HG2 LYS A 110 23.534 -5.646 2.535 1.00 0.00 H new ATOM 0 HG3 LYS A 110 22.719 -6.740 1.435 1.00 0.00 H new ATOM 0 HD2 LYS A 110 25.122 -7.003 1.188 1.00 0.00 H new ATOM 0 HD3 LYS A 110 24.453 -6.331 -0.286 1.00 0.00 H new ATOM 0 HE2 LYS A 110 26.290 -4.990 -0.108 1.00 0.00 H new ATOM 0 HE3 LYS A 110 25.177 -4.019 0.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 27.276 -4.277 1.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 26.046 -5.028 2.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 27.123 -5.968 1.930 1.00 0.00 H new ATOM 1793 N ILE A 111 23.536 -1.705 0.350 1.00 0.00 N ATOM 1794 CA ILE A 111 23.598 -0.484 -0.438 1.00 0.00 C ATOM 1795 C ILE A 111 24.472 -0.795 -1.668 1.00 0.00 C ATOM 1796 O ILE A 111 25.442 -1.546 -1.541 1.00 0.00 O ATOM 1797 CB ILE A 111 24.147 0.655 0.486 1.00 0.00 C ATOM 1798 CG1 ILE A 111 23.158 1.820 0.709 1.00 0.00 C ATOM 1799 CG2 ILE A 111 25.509 1.230 0.058 1.00 0.00 C ATOM 1800 CD1 ILE A 111 22.421 1.697 2.042 1.00 0.00 C ATOM 0 H ILE A 111 24.420 -2.214 0.358 1.00 0.00 H new ATOM 0 HA ILE A 111 22.632 -0.138 -0.806 1.00 0.00 H new ATOM 0 HB ILE A 111 24.286 0.131 1.432 1.00 0.00 H new ATOM 0 HG12 ILE A 111 23.699 2.766 0.680 1.00 0.00 H new ATOM 0 HG13 ILE A 111 22.434 1.842 -0.105 1.00 0.00 H new ATOM 0 HG21 ILE A 111 25.809 2.012 0.756 1.00 0.00 H new ATOM 0 HG22 ILE A 111 26.256 0.436 0.060 1.00 0.00 H new ATOM 0 HG23 ILE A 111 25.428 1.650 -0.945 1.00 0.00 H new ATOM 0 HD11 ILE A 111 21.736 2.537 2.158 1.00 0.00 H new ATOM 0 HD12 ILE A 111 21.858 0.764 2.062 1.00 0.00 H new ATOM 0 HD13 ILE A 111 23.143 1.702 2.859 1.00 0.00 H new ATOM 1812 N TYR A 112 24.134 -0.217 -2.824 1.00 0.00 N ATOM 1813 CA TYR A 112 24.766 -0.407 -4.130 1.00 0.00 C ATOM 1814 C TYR A 112 24.763 0.895 -4.928 1.00 0.00 C ATOM 1815 O TYR A 112 24.019 1.821 -4.601 1.00 0.00 O ATOM 1816 CB TYR A 112 23.960 -1.448 -4.912 1.00 0.00 C ATOM 1817 CG TYR A 112 24.092 -2.831 -4.335 1.00 0.00 C ATOM 1818 CD1 TYR A 112 25.236 -3.576 -4.645 1.00 0.00 C ATOM 1819 CD2 TYR A 112 23.130 -3.342 -3.446 1.00 0.00 C ATOM 1820 CE1 TYR A 112 25.426 -4.843 -4.091 1.00 0.00 C ATOM 1821 CE2 TYR A 112 23.295 -4.647 -2.931 1.00 0.00 C ATOM 1822 CZ TYR A 112 24.447 -5.402 -3.252 1.00 0.00 C ATOM 1823 OH TYR A 112 24.632 -6.650 -2.741 1.00 0.00 O ATOM 0 H TYR A 112 23.357 0.442 -2.874 1.00 0.00 H new ATOM 0 HA TYR A 112 25.796 -0.731 -3.979 1.00 0.00 H new ATOM 0 HB2 TYR A 112 22.909 -1.159 -4.918 1.00 0.00 H new ATOM 0 HB3 TYR A 112 24.294 -1.457 -5.949 1.00 0.00 H new ATOM 0 HD1 TYR A 112 25.976 -3.168 -5.317 1.00 0.00 H new ATOM 0 HD2 TYR A 112 22.276 -2.745 -3.161 1.00 0.00 H new ATOM 0 HE1 TYR A 112 26.328 -5.395 -4.308 1.00 0.00 H new ATOM 0 HE2 TYR A 112 22.537 -5.071 -2.289 1.00 0.00 H new ATOM 0 HH TYR A 112 25.591 -6.819 -2.630 1.00 0.00 H new ATOM 1833 N ASP A 113 25.531 0.959 -6.023 1.00 0.00 N ATOM 1834 CA ASP A 113 25.551 2.158 -6.858 1.00 0.00 C ATOM 1835 C ASP A 113 24.402 2.117 -7.856 1.00 0.00 C ATOM 1836 O ASP A 113 23.698 3.109 -8.055 1.00 0.00 O ATOM 1837 CB ASP A 113 26.881 2.267 -7.611 1.00 0.00 C ATOM 1838 CG ASP A 113 27.187 3.663 -8.148 1.00 0.00 C ATOM 1839 OD1 ASP A 113 26.522 4.660 -7.746 1.00 0.00 O ATOM 1840 OD2 ASP A 113 28.111 3.766 -8.971 1.00 0.00 O ATOM 0 H ASP A 113 26.137 0.204 -6.345 1.00 0.00 H new ATOM 0 HA ASP A 113 25.439 3.029 -6.212 1.00 0.00 H new ATOM 0 HB2 ASP A 113 27.688 1.962 -6.945 1.00 0.00 H new ATOM 0 HB3 ASP A 113 26.872 1.564 -8.444 1.00 0.00 H new ATOM 1845 N THR A 114 24.194 0.961 -8.486 1.00 0.00 N ATOM 1846 CA THR A 114 23.258 0.787 -9.587 1.00 0.00 C ATOM 1847 C THR A 114 22.346 -0.398 -9.296 1.00 0.00 C ATOM 1848 O THR A 114 22.474 -1.069 -8.272 1.00 0.00 O ATOM 1849 CB THR A 114 24.003 0.676 -10.932 1.00 0.00 C ATOM 1850 OG1 THR A 114 24.520 -0.618 -11.142 1.00 0.00 O ATOM 1851 CG2 THR A 114 25.134 1.692 -11.076 1.00 0.00 C ATOM 0 H THR A 114 24.685 0.102 -8.236 1.00 0.00 H new ATOM 0 HA THR A 114 22.622 1.667 -9.677 1.00 0.00 H new ATOM 0 HB THR A 114 23.251 0.894 -11.690 1.00 0.00 H new ATOM 0 HG1 THR A 114 24.983 -0.649 -12.005 1.00 0.00 H new ATOM 0 HG21 THR A 114 25.619 1.562 -12.044 1.00 0.00 H new ATOM 0 HG22 THR A 114 24.728 2.701 -11.006 1.00 0.00 H new ATOM 0 HG23 THR A 114 25.864 1.539 -10.281 1.00 0.00 H new ATOM 1859 N ILE A 115 21.398 -0.638 -10.198 1.00 0.00 N ATOM 1860 CA ILE A 115 20.534 -1.801 -10.097 1.00 0.00 C ATOM 1861 C ILE A 115 21.324 -3.035 -10.505 1.00 0.00 C ATOM 1862 O ILE A 115 21.188 -4.062 -9.849 1.00 0.00 O ATOM 1863 CB ILE A 115 19.249 -1.605 -10.928 1.00 0.00 C ATOM 1864 CG1 ILE A 115 18.292 -0.616 -10.234 1.00 0.00 C ATOM 1865 CG2 ILE A 115 18.509 -2.926 -11.217 1.00 0.00 C ATOM 1866 CD1 ILE A 115 17.610 -1.128 -8.959 1.00 0.00 C ATOM 0 H ILE A 115 21.212 -0.041 -11.004 1.00 0.00 H new ATOM 0 HA ILE A 115 20.203 -1.938 -9.067 1.00 0.00 H new ATOM 0 HB ILE A 115 19.569 -1.196 -11.886 1.00 0.00 H new ATOM 0 HG12 ILE A 115 18.850 0.287 -9.987 1.00 0.00 H new ATOM 0 HG13 ILE A 115 17.519 -0.328 -10.946 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.614 -2.721 -11.805 1.00 0.00 H new ATOM 0 HG22 ILE A 115 19.164 -3.595 -11.775 1.00 0.00 H new ATOM 0 HG23 ILE A 115 18.225 -3.397 -10.276 1.00 0.00 H new ATOM 0 HD11 ILE A 115 16.961 -0.351 -8.556 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.016 -2.011 -9.194 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.368 -1.387 -8.220 1.00 0.00 H new ATOM 1878 N SER A 116 22.129 -2.980 -11.568 1.00 0.00 N ATOM 1879 CA SER A 116 22.853 -4.165 -12.000 1.00 0.00 C ATOM 1880 C SER A 116 23.962 -4.503 -11.002 1.00 0.00 C ATOM 1881 O SER A 116 24.298 -5.677 -10.885 1.00 0.00 O ATOM 1882 CB SER A 116 23.401 -3.951 -13.412 1.00 0.00 C ATOM 1883 OG SER A 116 23.869 -5.157 -13.987 1.00 0.00 O ATOM 0 H SER A 116 22.291 -2.145 -12.131 1.00 0.00 H new ATOM 0 HA SER A 116 22.174 -5.017 -12.031 1.00 0.00 H new ATOM 0 HB2 SER A 116 22.620 -3.527 -14.044 1.00 0.00 H new ATOM 0 HB3 SER A 116 24.214 -3.225 -13.379 1.00 0.00 H new ATOM 0 HG SER A 116 24.209 -4.979 -14.889 1.00 0.00 H new ATOM 1889 N GLU A 117 24.488 -3.532 -10.239 1.00 0.00 N ATOM 1890 CA GLU A 117 25.400 -3.829 -9.148 1.00 0.00 C ATOM 1891 C GLU A 117 24.703 -4.608 -8.036 1.00 0.00 C ATOM 1892 O GLU A 117 25.384 -5.198 -7.207 1.00 0.00 O ATOM 1893 CB GLU A 117 25.987 -2.520 -8.590 1.00 0.00 C ATOM 1894 CG GLU A 117 27.513 -2.581 -8.574 1.00 0.00 C ATOM 1895 CD GLU A 117 28.124 -1.258 -8.111 1.00 0.00 C ATOM 1896 OE1 GLU A 117 27.700 -0.723 -7.059 1.00 0.00 O ATOM 1897 OE2 GLU A 117 29.044 -0.779 -8.820 1.00 0.00 O ATOM 0 H GLU A 117 24.291 -2.539 -10.365 1.00 0.00 H new ATOM 0 HA GLU A 117 26.205 -4.452 -9.537 1.00 0.00 H new ATOM 0 HB2 GLU A 117 25.657 -1.678 -9.199 1.00 0.00 H new ATOM 0 HB3 GLU A 117 25.614 -2.349 -7.580 1.00 0.00 H new ATOM 0 HG2 GLU A 117 27.839 -3.384 -7.913 1.00 0.00 H new ATOM 0 HG3 GLU A 117 27.879 -2.822 -9.572 1.00 0.00 H new ATOM 1904 N ALA A 118 23.366 -4.631 -8.011 1.00 0.00 N ATOM 1905 CA ALA A 118 22.592 -5.178 -6.919 1.00 0.00 C ATOM 1906 C ALA A 118 21.958 -6.492 -7.363 1.00 0.00 C ATOM 1907 O ALA A 118 21.881 -7.437 -6.588 1.00 0.00 O ATOM 1908 CB ALA A 118 21.536 -4.143 -6.503 1.00 0.00 C ATOM 0 H ALA A 118 22.792 -4.260 -8.768 1.00 0.00 H new ATOM 0 HA ALA A 118 23.224 -5.390 -6.056 1.00 0.00 H new ATOM 0 HB1 ALA A 118 20.942 -4.540 -5.679 1.00 0.00 H new ATOM 0 HB2 ALA A 118 22.031 -3.226 -6.185 1.00 0.00 H new ATOM 0 HB3 ALA A 118 20.884 -3.928 -7.350 1.00 0.00 H new ATOM 1914 N MET A 119 21.493 -6.569 -8.609 1.00 0.00 N ATOM 1915 CA MET A 119 20.535 -7.559 -9.063 1.00 0.00 C ATOM 1916 C MET A 119 21.061 -8.986 -8.933 1.00 0.00 C ATOM 1917 O MET A 119 20.314 -9.876 -8.521 1.00 0.00 O ATOM 1918 CB MET A 119 20.157 -7.239 -10.520 1.00 0.00 C ATOM 1919 CG MET A 119 18.706 -7.645 -10.755 1.00 0.00 C ATOM 1920 SD MET A 119 18.148 -7.786 -12.471 1.00 0.00 S ATOM 1921 CE MET A 119 18.884 -9.382 -12.913 1.00 0.00 C ATOM 0 H MET A 119 21.784 -5.925 -9.345 1.00 0.00 H new ATOM 0 HA MET A 119 19.652 -7.507 -8.425 1.00 0.00 H new ATOM 0 HB2 MET A 119 20.287 -6.175 -10.718 1.00 0.00 H new ATOM 0 HB3 MET A 119 20.814 -7.774 -11.206 1.00 0.00 H new ATOM 0 HG2 MET A 119 18.542 -8.606 -10.267 1.00 0.00 H new ATOM 0 HG3 MET A 119 18.067 -6.919 -10.252 1.00 0.00 H new ATOM 0 HE1 MET A 119 18.636 -9.623 -13.947 1.00 0.00 H new ATOM 0 HE2 MET A 119 19.967 -9.326 -12.803 1.00 0.00 H new ATOM 0 HE3 MET A 119 18.492 -10.158 -12.255 1.00 0.00 H new ATOM 1931 N GLU A 120 22.323 -9.201 -9.299 1.00 0.00 N ATOM 1932 CA GLU A 120 23.018 -10.475 -9.164 1.00 0.00 C ATOM 1933 C GLU A 120 23.781 -10.568 -7.850 1.00 0.00 C ATOM 1934 O GLU A 120 24.020 -11.671 -7.363 1.00 0.00 O ATOM 1935 CB GLU A 120 23.951 -10.657 -10.374 1.00 0.00 C ATOM 1936 CG GLU A 120 24.972 -9.517 -10.575 1.00 0.00 C ATOM 1937 CD GLU A 120 26.105 -9.901 -11.534 1.00 0.00 C ATOM 1938 OE1 GLU A 120 26.880 -10.840 -11.232 1.00 0.00 O ATOM 1939 OE2 GLU A 120 26.271 -9.247 -12.595 1.00 0.00 O ATOM 0 H GLU A 120 22.905 -8.471 -9.709 1.00 0.00 H new ATOM 0 HA GLU A 120 22.285 -11.282 -9.146 1.00 0.00 H new ATOM 0 HB2 GLU A 120 24.492 -11.596 -10.261 1.00 0.00 H new ATOM 0 HB3 GLU A 120 23.343 -10.746 -11.275 1.00 0.00 H new ATOM 0 HG2 GLU A 120 24.457 -8.637 -10.961 1.00 0.00 H new ATOM 0 HG3 GLU A 120 25.396 -9.240 -9.610 1.00 0.00 H new ATOM 1946 N GLU A 121 24.134 -9.432 -7.255 1.00 0.00 N ATOM 1947 CA GLU A 121 25.051 -9.406 -6.137 1.00 0.00 C ATOM 1948 C GLU A 121 24.261 -9.747 -4.877 1.00 0.00 C ATOM 1949 O GLU A 121 24.594 -10.712 -4.205 1.00 0.00 O ATOM 1950 CB GLU A 121 25.741 -8.041 -6.085 1.00 0.00 C ATOM 1951 CG GLU A 121 27.065 -8.082 -5.317 1.00 0.00 C ATOM 1952 CD GLU A 121 28.254 -8.520 -6.174 1.00 0.00 C ATOM 1953 OE1 GLU A 121 28.335 -9.708 -6.549 1.00 0.00 O ATOM 1954 OE2 GLU A 121 29.182 -7.706 -6.379 1.00 0.00 O ATOM 0 H GLU A 121 23.791 -8.514 -7.537 1.00 0.00 H new ATOM 0 HA GLU A 121 25.847 -10.144 -6.235 1.00 0.00 H new ATOM 0 HB2 GLU A 121 25.925 -7.691 -7.101 1.00 0.00 H new ATOM 0 HB3 GLU A 121 25.074 -7.318 -5.615 1.00 0.00 H new ATOM 0 HG2 GLU A 121 27.268 -7.093 -4.906 1.00 0.00 H new ATOM 0 HG3 GLU A 121 26.965 -8.764 -4.473 1.00 0.00 H new ATOM 1961 N VAL A 122 23.145 -9.053 -4.615 1.00 0.00 N ATOM 1962 CA VAL A 122 22.246 -9.219 -3.466 1.00 0.00 C ATOM 1963 C VAL A 122 21.894 -10.680 -3.202 1.00 0.00 C ATOM 1964 O VAL A 122 21.769 -11.089 -2.054 1.00 0.00 O ATOM 1965 CB VAL A 122 21.016 -8.307 -3.664 1.00 0.00 C ATOM 1966 CG1 VAL A 122 19.835 -8.939 -4.427 1.00 0.00 C ATOM 1967 CG2 VAL A 122 20.602 -7.721 -2.310 1.00 0.00 C ATOM 0 H VAL A 122 22.826 -8.313 -5.241 1.00 0.00 H new ATOM 0 HA VAL A 122 22.758 -8.906 -2.556 1.00 0.00 H new ATOM 0 HB VAL A 122 21.327 -7.505 -4.334 1.00 0.00 H new ATOM 0 HG11 VAL A 122 19.025 -8.214 -4.510 1.00 0.00 H new ATOM 0 HG12 VAL A 122 20.162 -9.233 -5.424 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.481 -9.817 -3.887 1.00 0.00 H new ATOM 0 HG21 VAL A 122 19.734 -7.076 -2.443 1.00 0.00 H new ATOM 0 HG22 VAL A 122 20.351 -8.531 -1.625 1.00 0.00 H new ATOM 0 HG23 VAL A 122 21.427 -7.139 -1.898 1.00 0.00 H new ATOM 1977 N ARG A 123 21.769 -11.484 -4.257 1.00 0.00 N ATOM 1978 CA ARG A 123 21.407 -12.895 -4.159 1.00 0.00 C ATOM 1979 C ARG A 123 22.424 -13.686 -3.344 1.00 0.00 C ATOM 1980 O ARG A 123 22.061 -14.666 -2.696 1.00 0.00 O ATOM 1981 CB ARG A 123 21.287 -13.481 -5.572 1.00 0.00 C ATOM 1982 CG ARG A 123 20.038 -12.953 -6.283 1.00 0.00 C ATOM 1983 CD ARG A 123 19.859 -13.629 -7.646 1.00 0.00 C ATOM 1984 NE ARG A 123 20.032 -12.682 -8.756 1.00 0.00 N ATOM 1985 CZ ARG A 123 20.424 -12.961 -10.004 1.00 0.00 C ATOM 1986 NH1 ARG A 123 21.028 -14.101 -10.298 1.00 0.00 N ATOM 1987 NH2 ARG A 123 20.195 -12.078 -10.962 1.00 0.00 N ATOM 0 H ARG A 123 21.918 -11.169 -5.215 1.00 0.00 H new ATOM 0 HA ARG A 123 20.451 -12.970 -3.641 1.00 0.00 H new ATOM 0 HB2 ARG A 123 22.174 -13.226 -6.151 1.00 0.00 H new ATOM 0 HB3 ARG A 123 21.245 -14.569 -5.516 1.00 0.00 H new ATOM 0 HG2 ARG A 123 19.159 -13.134 -5.665 1.00 0.00 H new ATOM 0 HG3 ARG A 123 20.119 -11.874 -6.415 1.00 0.00 H new ATOM 0 HD2 ARG A 123 20.580 -14.440 -7.746 1.00 0.00 H new ATOM 0 HD3 ARG A 123 18.866 -14.076 -7.702 1.00 0.00 H new ATOM 0 HE ARG A 123 19.831 -11.703 -8.552 1.00 0.00 H new ATOM 0 HH11 ARG A 123 21.204 -14.789 -9.566 1.00 0.00 H new ATOM 0 HH12 ARG A 123 21.318 -14.292 -11.257 1.00 0.00 H new ATOM 0 HH21 ARG A 123 19.726 -11.199 -10.744 1.00 0.00 H new ATOM 0 HH22 ARG A 123 20.488 -12.276 -11.919 1.00 0.00 H new ATOM 2001 N ARG A 124 23.695 -13.298 -3.404 1.00 0.00 N ATOM 2002 CA ARG A 124 24.834 -13.923 -2.747 1.00 0.00 C ATOM 2003 C ARG A 124 25.834 -12.796 -2.497 1.00 0.00 C ATOM 2004 O ARG A 124 26.903 -12.763 -3.106 1.00 0.00 O ATOM 2005 CB ARG A 124 25.399 -15.114 -3.566 1.00 0.00 C ATOM 2006 CG ARG A 124 25.001 -15.212 -5.054 1.00 0.00 C ATOM 2007 CD ARG A 124 25.520 -14.072 -5.941 1.00 0.00 C ATOM 2008 NE ARG A 124 26.927 -14.266 -6.328 1.00 0.00 N ATOM 2009 CZ ARG A 124 27.858 -13.313 -6.407 1.00 0.00 C ATOM 2010 NH1 ARG A 124 27.724 -12.186 -5.729 1.00 0.00 N ATOM 2011 NH2 ARG A 124 28.921 -13.493 -7.181 1.00 0.00 N ATOM 0 H ARG A 124 23.973 -12.483 -3.951 1.00 0.00 H new ATOM 0 HA ARG A 124 24.559 -14.387 -1.800 1.00 0.00 H new ATOM 0 HB2 ARG A 124 26.487 -15.073 -3.511 1.00 0.00 H new ATOM 0 HB3 ARG A 124 25.090 -16.036 -3.074 1.00 0.00 H new ATOM 0 HG2 ARG A 124 25.369 -16.158 -5.451 1.00 0.00 H new ATOM 0 HG3 ARG A 124 23.914 -15.239 -5.123 1.00 0.00 H new ATOM 0 HD2 ARG A 124 24.904 -14.002 -6.838 1.00 0.00 H new ATOM 0 HD3 ARG A 124 25.418 -13.125 -5.410 1.00 0.00 H new ATOM 0 HE ARG A 124 27.217 -15.217 -6.557 1.00 0.00 H new ATOM 0 HH11 ARG A 124 26.904 -12.040 -5.140 1.00 0.00 H new ATOM 0 HH12 ARG A 124 28.440 -11.463 -5.795 1.00 0.00 H new ATOM 0 HH21 ARG A 124 29.024 -14.357 -7.713 1.00 0.00 H new ATOM 0 HH22 ARG A 124 29.635 -12.767 -7.244 1.00 0.00 H new ATOM 2025 N LYS A 125 25.391 -11.806 -1.723 1.00 0.00 N ATOM 2026 CA LYS A 125 26.140 -10.584 -1.460 1.00 0.00 C ATOM 2027 C LYS A 125 27.513 -10.830 -0.852 1.00 0.00 C ATOM 2028 O LYS A 125 27.782 -11.978 -0.410 1.00 0.00 O ATOM 2029 CB LYS A 125 25.280 -9.593 -0.669 1.00 0.00 C ATOM 2030 CG LYS A 125 24.940 -10.028 0.756 1.00 0.00 C ATOM 2031 CD LYS A 125 26.130 -10.073 1.728 1.00 0.00 C ATOM 2032 CE LYS A 125 25.724 -10.048 3.197 1.00 0.00 C ATOM 2033 NZ LYS A 125 25.577 -8.674 3.722 1.00 0.00 N ATOM 0 H LYS A 125 24.485 -11.834 -1.254 1.00 0.00 H new ATOM 0 HA LYS A 125 26.366 -10.122 -2.421 1.00 0.00 H new ATOM 0 HB2 LYS A 125 25.801 -8.636 -0.626 1.00 0.00 H new ATOM 0 HB3 LYS A 125 24.351 -9.426 -1.214 1.00 0.00 H new ATOM 0 HG2 LYS A 125 24.189 -9.347 1.157 1.00 0.00 H new ATOM 0 HG3 LYS A 125 24.485 -11.018 0.718 1.00 0.00 H new ATOM 0 HD2 LYS A 125 26.710 -10.976 1.536 1.00 0.00 H new ATOM 0 HD3 LYS A 125 26.784 -9.225 1.527 1.00 0.00 H new ATOM 0 HE2 LYS A 125 24.782 -10.583 3.319 1.00 0.00 H new ATOM 0 HE3 LYS A 125 26.471 -10.580 3.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 25.300 -8.713 4.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 26.482 -8.169 3.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 24.845 -8.172 3.180 1.00 0.00 H new