USER MOD reduce.3.24.130724 H: found=0, std=0, add=917, rem=0, adj=24 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 64 SER OG : rot -124:sc= 0.992 USER MOD Set 1.2: A 95 LYS NZ :NH3+ -167:sc= 1.18 (180deg=0) USER MOD Set 2.1: A 60 SER OG : rot -160:sc= 0.571 USER MOD Set 2.2: A 91 SER OG : rot 140:sc= 0.298 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ -166:sc=-0.00181 (180deg=-0.116) USER MOD Single : A 26 MET CE :methyl -167:sc= 0 (180deg=-0.0912) USER MOD Single : A 28 ASN : amide:sc= 1.05 K(o=1,f=-0.18) USER MOD Single : A 29 LYS NZ :NH3+ -154:sc= 0.879 (180deg=0.47) USER MOD Single : A 32 ASN : amide:sc= -1.38 X(o=-1.4,f=-1.3) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.27) 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= 1.11 K(o=1.1,f=-0.5) 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 X(o=0,f=0) USER MOD Single : A 54 LYS NZ :NH3+ -126:sc= 1.2 (180deg=-0.445) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0562 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 161:sc= 0.37 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= 0.38 K(o=0.38,f=-0.25) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -140:sc= 0 USER MOD Single : A 104 ASN :FLIP amide:sc= 0 F(o=-0.88,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 TYR OH : rot 180:sc= -0.0702 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0623 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 MET CE :methyl -178:sc= 0 (180deg=-0.00836) USER MOD Single : A 125 LYS NZ :NH3+ 148:sc= -0.311 (180deg=-1.82!) USER MOD ----------------------------------------------------------------- ATOM 242 N TYR A 16 8.390 2.917 -8.933 1.00 0.00 N ATOM 243 CA TYR A 16 8.934 1.584 -8.850 1.00 0.00 C ATOM 244 C TYR A 16 8.911 0.813 -10.174 1.00 0.00 C ATOM 245 O TYR A 16 8.061 1.040 -11.035 1.00 0.00 O ATOM 246 CB TYR A 16 8.173 0.823 -7.759 1.00 0.00 C ATOM 247 CG TYR A 16 6.875 0.162 -8.177 1.00 0.00 C ATOM 248 CD1 TYR A 16 6.884 -1.153 -8.684 1.00 0.00 C ATOM 249 CD2 TYR A 16 5.655 0.848 -8.043 1.00 0.00 C ATOM 250 CE1 TYR A 16 5.693 -1.754 -9.118 1.00 0.00 C ATOM 251 CE2 TYR A 16 4.458 0.236 -8.444 1.00 0.00 C ATOM 252 CZ TYR A 16 4.473 -1.057 -9.010 1.00 0.00 C ATOM 253 OH TYR A 16 3.324 -1.620 -9.462 1.00 0.00 O ATOM 0 HA TYR A 16 9.991 1.674 -8.601 1.00 0.00 H new ATOM 0 HB2 TYR A 16 8.833 0.055 -7.355 1.00 0.00 H new ATOM 0 HB3 TYR A 16 7.957 1.517 -6.947 1.00 0.00 H new ATOM 0 HD1 TYR A 16 7.813 -1.701 -8.739 1.00 0.00 H new ATOM 0 HD2 TYR A 16 5.639 1.846 -7.631 1.00 0.00 H new ATOM 0 HE1 TYR A 16 5.711 -2.750 -9.535 1.00 0.00 H new ATOM 0 HE2 TYR A 16 3.520 0.757 -8.319 1.00 0.00 H new ATOM 0 HH TYR A 16 2.576 -1.005 -9.309 1.00 0.00 H new ATOM 263 N LYS A 17 9.800 -0.175 -10.285 1.00 0.00 N ATOM 264 CA LYS A 17 9.825 -1.203 -11.315 1.00 0.00 C ATOM 265 C LYS A 17 9.760 -2.574 -10.640 1.00 0.00 C ATOM 266 O LYS A 17 9.987 -2.698 -9.439 1.00 0.00 O ATOM 267 CB LYS A 17 11.132 -1.065 -12.117 1.00 0.00 C ATOM 268 CG LYS A 17 11.066 -1.743 -13.486 1.00 0.00 C ATOM 269 CD LYS A 17 12.352 -2.437 -13.932 1.00 0.00 C ATOM 270 CE LYS A 17 13.352 -1.495 -14.589 1.00 0.00 C ATOM 271 NZ LYS A 17 12.902 -1.038 -15.918 1.00 0.00 N ATOM 0 H LYS A 17 10.564 -0.281 -9.618 1.00 0.00 H new ATOM 0 HA LYS A 17 8.976 -1.095 -11.990 1.00 0.00 H new ATOM 0 HB2 LYS A 17 11.359 -0.008 -12.252 1.00 0.00 H new ATOM 0 HB3 LYS A 17 11.952 -1.497 -11.543 1.00 0.00 H new ATOM 0 HG2 LYS A 17 10.262 -2.479 -13.471 1.00 0.00 H new ATOM 0 HG3 LYS A 17 10.799 -0.994 -14.232 1.00 0.00 H new ATOM 0 HD2 LYS A 17 12.821 -2.907 -13.067 1.00 0.00 H new ATOM 0 HD3 LYS A 17 12.102 -3.234 -14.632 1.00 0.00 H new ATOM 0 HE2 LYS A 17 13.511 -0.630 -13.945 1.00 0.00 H new ATOM 0 HE3 LYS A 17 14.313 -2.000 -14.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 13.699 -0.601 -16.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 12.550 -1.850 -16.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 12.139 -0.340 -15.805 1.00 0.00 H new ATOM 285 N ILE A 18 9.585 -3.615 -11.435 1.00 0.00 N ATOM 286 CA ILE A 18 9.931 -4.997 -11.171 1.00 0.00 C ATOM 287 C ILE A 18 10.741 -5.432 -12.408 1.00 0.00 C ATOM 288 O ILE A 18 10.327 -5.132 -13.532 1.00 0.00 O ATOM 289 CB ILE A 18 8.648 -5.836 -10.958 1.00 0.00 C ATOM 290 CG1 ILE A 18 7.667 -5.225 -9.927 1.00 0.00 C ATOM 291 CG2 ILE A 18 9.045 -7.254 -10.522 1.00 0.00 C ATOM 292 CD1 ILE A 18 6.330 -5.972 -9.824 1.00 0.00 C ATOM 0 H ILE A 18 9.163 -3.504 -12.357 1.00 0.00 H new ATOM 0 HA ILE A 18 10.514 -5.136 -10.260 1.00 0.00 H new ATOM 0 HB ILE A 18 8.116 -5.852 -11.909 1.00 0.00 H new ATOM 0 HG12 ILE A 18 8.144 -5.216 -8.947 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.472 -4.187 -10.196 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.147 -7.853 -10.369 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.660 -7.714 -11.295 1.00 0.00 H new ATOM 0 HG23 ILE A 18 9.610 -7.204 -9.591 1.00 0.00 H new ATOM 0 HD11 ILE A 18 5.697 -5.485 -9.082 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.830 -5.958 -10.793 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.512 -7.004 -9.524 1.00 0.00 H new ATOM 304 N VAL A 19 11.916 -6.044 -12.221 1.00 0.00 N ATOM 305 CA VAL A 19 12.717 -6.673 -13.269 1.00 0.00 C ATOM 306 C VAL A 19 12.265 -8.138 -13.405 1.00 0.00 C ATOM 307 O VAL A 19 11.062 -8.394 -13.355 1.00 0.00 O ATOM 308 CB VAL A 19 14.224 -6.490 -12.973 1.00 0.00 C ATOM 309 CG1 VAL A 19 14.646 -5.026 -13.101 1.00 0.00 C ATOM 310 CG2 VAL A 19 14.679 -7.012 -11.606 1.00 0.00 C ATOM 0 H VAL A 19 12.348 -6.116 -11.300 1.00 0.00 H new ATOM 0 HA VAL A 19 12.561 -6.197 -14.237 1.00 0.00 H new ATOM 0 HB VAL A 19 14.716 -7.101 -13.729 1.00 0.00 H new ATOM 0 HG11 VAL A 19 15.711 -4.934 -12.886 1.00 0.00 H new ATOM 0 HG12 VAL A 19 14.449 -4.678 -14.115 1.00 0.00 H new ATOM 0 HG13 VAL A 19 14.080 -4.421 -12.393 1.00 0.00 H new ATOM 0 HG21 VAL A 19 15.749 -6.840 -11.489 1.00 0.00 H new ATOM 0 HG22 VAL A 19 14.139 -6.487 -10.818 1.00 0.00 H new ATOM 0 HG23 VAL A 19 14.473 -8.080 -11.538 1.00 0.00 H new ATOM 320 N ASP A 20 13.190 -9.082 -13.625 1.00 0.00 N ATOM 321 CA ASP A 20 13.019 -10.521 -13.558 1.00 0.00 C ATOM 322 C ASP A 20 12.139 -10.913 -12.373 1.00 0.00 C ATOM 323 O ASP A 20 10.944 -11.133 -12.536 1.00 0.00 O ATOM 324 CB ASP A 20 14.399 -11.193 -13.485 1.00 0.00 C ATOM 325 CG ASP A 20 14.319 -12.699 -13.224 1.00 0.00 C ATOM 326 OD1 ASP A 20 13.723 -13.411 -14.068 1.00 0.00 O ATOM 327 OD2 ASP A 20 14.935 -13.161 -12.239 1.00 0.00 O ATOM 0 H ASP A 20 14.147 -8.829 -13.873 1.00 0.00 H new ATOM 0 HA ASP A 20 12.510 -10.866 -14.458 1.00 0.00 H new ATOM 0 HB2 ASP A 20 14.931 -11.020 -14.421 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.984 -10.724 -12.694 1.00 0.00 H new ATOM 332 N ASP A 21 12.701 -10.922 -11.165 1.00 0.00 N ATOM 333 CA ASP A 21 11.976 -11.272 -9.945 1.00 0.00 C ATOM 334 C ASP A 21 12.288 -10.308 -8.801 1.00 0.00 C ATOM 335 O ASP A 21 11.852 -10.526 -7.676 1.00 0.00 O ATOM 336 CB ASP A 21 12.182 -12.759 -9.596 1.00 0.00 C ATOM 337 CG ASP A 21 13.018 -13.041 -8.342 1.00 0.00 C ATOM 338 OD1 ASP A 21 14.178 -12.598 -8.230 1.00 0.00 O ATOM 339 OD2 ASP A 21 12.514 -13.760 -7.448 1.00 0.00 O ATOM 0 H ASP A 21 13.680 -10.685 -11.005 1.00 0.00 H new ATOM 0 HA ASP A 21 10.908 -11.151 -10.125 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.203 -13.222 -9.469 1.00 0.00 H new ATOM 0 HB3 ASP A 21 12.658 -13.249 -10.445 1.00 0.00 H new ATOM 344 N VAL A 22 12.989 -9.208 -9.076 1.00 0.00 N ATOM 345 CA VAL A 22 13.326 -8.220 -8.062 1.00 0.00 C ATOM 346 C VAL A 22 12.453 -6.988 -8.277 1.00 0.00 C ATOM 347 O VAL A 22 12.267 -6.549 -9.413 1.00 0.00 O ATOM 348 CB VAL A 22 14.845 -7.939 -8.039 1.00 0.00 C ATOM 349 CG1 VAL A 22 15.172 -7.052 -6.835 1.00 0.00 C ATOM 350 CG2 VAL A 22 15.649 -9.255 -8.007 1.00 0.00 C ATOM 0 H VAL A 22 13.337 -8.981 -10.008 1.00 0.00 H new ATOM 0 HA VAL A 22 13.108 -8.597 -7.063 1.00 0.00 H new ATOM 0 HB VAL A 22 15.131 -7.415 -8.951 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.243 -6.850 -6.812 1.00 0.00 H new ATOM 0 HG12 VAL A 22 14.627 -6.112 -6.917 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.880 -7.562 -5.917 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.715 -9.030 -7.991 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.385 -9.821 -7.114 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.416 -9.845 -8.893 1.00 0.00 H new ATOM 360 N VAL A 23 11.891 -6.445 -7.200 1.00 0.00 N ATOM 361 CA VAL A 23 11.186 -5.169 -7.191 1.00 0.00 C ATOM 362 C VAL A 23 12.233 -4.070 -7.009 1.00 0.00 C ATOM 363 O VAL A 23 13.234 -4.275 -6.328 1.00 0.00 O ATOM 364 CB VAL A 23 10.167 -5.144 -6.037 1.00 0.00 C ATOM 365 CG1 VAL A 23 9.250 -3.916 -6.112 1.00 0.00 C ATOM 366 CG2 VAL A 23 9.303 -6.409 -5.990 1.00 0.00 C ATOM 0 H VAL A 23 11.915 -6.894 -6.285 1.00 0.00 H new ATOM 0 HA VAL A 23 10.639 -5.018 -8.122 1.00 0.00 H new ATOM 0 HB VAL A 23 10.761 -5.095 -5.124 1.00 0.00 H new ATOM 0 HG11 VAL A 23 8.546 -3.936 -5.280 1.00 0.00 H new ATOM 0 HG12 VAL A 23 9.852 -3.009 -6.056 1.00 0.00 H new ATOM 0 HG13 VAL A 23 8.700 -3.929 -7.053 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.602 -6.340 -5.158 1.00 0.00 H new ATOM 0 HG22 VAL A 23 8.750 -6.507 -6.924 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.942 -7.281 -5.854 1.00 0.00 H new ATOM 376 N ILE A 24 12.020 -2.893 -7.587 1.00 0.00 N ATOM 377 CA ILE A 24 12.872 -1.724 -7.461 1.00 0.00 C ATOM 378 C ILE A 24 11.949 -0.555 -7.099 1.00 0.00 C ATOM 379 O ILE A 24 11.412 0.055 -8.014 1.00 0.00 O ATOM 380 CB ILE A 24 13.639 -1.488 -8.797 1.00 0.00 C ATOM 381 CG1 ILE A 24 14.676 -2.565 -9.156 1.00 0.00 C ATOM 382 CG2 ILE A 24 14.477 -0.213 -8.661 1.00 0.00 C ATOM 383 CD1 ILE A 24 14.140 -3.843 -9.772 1.00 0.00 C ATOM 0 H ILE A 24 11.210 -2.724 -8.183 1.00 0.00 H new ATOM 0 HA ILE A 24 13.632 -1.843 -6.689 1.00 0.00 H new ATOM 0 HB ILE A 24 12.859 -1.467 -9.559 1.00 0.00 H new ATOM 0 HG12 ILE A 24 15.395 -2.128 -9.849 1.00 0.00 H new ATOM 0 HG13 ILE A 24 15.224 -2.826 -8.251 1.00 0.00 H new ATOM 0 HG21 ILE A 24 15.020 -0.034 -9.589 1.00 0.00 H new ATOM 0 HG22 ILE A 24 13.821 0.633 -8.455 1.00 0.00 H new ATOM 0 HG23 ILE A 24 15.187 -0.330 -7.842 1.00 0.00 H new ATOM 0 HD11 ILE A 24 14.967 -4.522 -9.980 1.00 0.00 H new ATOM 0 HD12 ILE A 24 13.446 -4.318 -9.078 1.00 0.00 H new ATOM 0 HD13 ILE A 24 13.621 -3.609 -10.701 1.00 0.00 H new ATOM 395 N LEU A 25 11.710 -0.233 -5.821 1.00 0.00 N ATOM 396 CA LEU A 25 10.986 0.977 -5.440 1.00 0.00 C ATOM 397 C LEU A 25 11.871 2.192 -5.712 1.00 0.00 C ATOM 398 O LEU A 25 12.884 2.340 -5.033 1.00 0.00 O ATOM 399 CB LEU A 25 10.582 0.925 -3.959 1.00 0.00 C ATOM 400 CG LEU A 25 9.492 -0.094 -3.567 1.00 0.00 C ATOM 401 CD1 LEU A 25 8.443 -0.340 -4.643 1.00 0.00 C ATOM 402 CD2 LEU A 25 9.980 -1.463 -3.125 1.00 0.00 C ATOM 0 H LEU A 25 12.012 -0.802 -5.030 1.00 0.00 H new ATOM 0 HA LEU A 25 10.073 1.052 -6.031 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.474 0.710 -3.372 1.00 0.00 H new ATOM 0 HB3 LEU A 25 10.239 1.917 -3.666 1.00 0.00 H new ATOM 0 HG LEU A 25 9.058 0.421 -2.710 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.717 -1.069 -4.283 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.934 0.595 -4.875 1.00 0.00 H new ATOM 0 HD13 LEU A 25 8.927 -0.723 -5.542 1.00 0.00 H new ATOM 0 HD21 LEU A 25 9.125 -2.091 -2.875 1.00 0.00 H new ATOM 0 HD22 LEU A 25 10.546 -1.926 -3.933 1.00 0.00 H new ATOM 0 HD23 LEU A 25 10.619 -1.356 -2.249 1.00 0.00 H new ATOM 414 N MET A 26 11.525 3.046 -6.684 1.00 0.00 N ATOM 415 CA MET A 26 12.284 4.254 -7.044 1.00 0.00 C ATOM 416 C MET A 26 11.448 5.435 -6.495 1.00 0.00 C ATOM 417 O MET A 26 10.492 5.824 -7.157 1.00 0.00 O ATOM 418 CB MET A 26 12.363 4.382 -8.580 1.00 0.00 C ATOM 419 CG MET A 26 12.869 3.125 -9.271 1.00 0.00 C ATOM 420 SD MET A 26 13.888 3.390 -10.740 1.00 0.00 S ATOM 421 CE MET A 26 13.386 1.943 -11.698 1.00 0.00 C ATOM 0 H MET A 26 10.691 2.914 -7.256 1.00 0.00 H new ATOM 0 HA MET A 26 13.298 4.229 -6.645 1.00 0.00 H new ATOM 0 HB2 MET A 26 11.374 4.626 -8.967 1.00 0.00 H new ATOM 0 HB3 MET A 26 13.019 5.215 -8.833 1.00 0.00 H new ATOM 0 HG2 MET A 26 13.447 2.545 -8.551 1.00 0.00 H new ATOM 0 HG3 MET A 26 12.009 2.517 -9.553 1.00 0.00 H new ATOM 0 HE1 MET A 26 14.071 1.805 -12.534 1.00 0.00 H new ATOM 0 HE2 MET A 26 13.408 1.059 -11.061 1.00 0.00 H new ATOM 0 HE3 MET A 26 12.375 2.091 -12.078 1.00 0.00 H new ATOM 431 N PRO A 27 11.639 5.942 -5.267 1.00 0.00 N ATOM 432 CA PRO A 27 10.751 6.931 -4.664 1.00 0.00 C ATOM 433 C PRO A 27 11.053 8.346 -5.178 1.00 0.00 C ATOM 434 O PRO A 27 12.164 8.851 -4.993 1.00 0.00 O ATOM 435 CB PRO A 27 11.002 6.808 -3.162 1.00 0.00 C ATOM 436 CG PRO A 27 12.467 6.386 -3.075 1.00 0.00 C ATOM 437 CD PRO A 27 12.654 5.535 -4.332 1.00 0.00 C ATOM 0 HA PRO A 27 9.706 6.755 -4.918 1.00 0.00 H new ATOM 0 HB2 PRO A 27 10.826 7.753 -2.648 1.00 0.00 H new ATOM 0 HB3 PRO A 27 10.344 6.069 -2.705 1.00 0.00 H new ATOM 0 HG2 PRO A 27 13.135 7.247 -3.067 1.00 0.00 H new ATOM 0 HG3 PRO A 27 12.670 5.817 -2.168 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.648 5.682 -4.753 1.00 0.00 H new ATOM 0 HD3 PRO A 27 12.561 4.475 -4.098 1.00 0.00 H new ATOM 445 N ASN A 28 10.071 9.036 -5.757 1.00 0.00 N ATOM 446 CA ASN A 28 10.211 10.419 -6.208 1.00 0.00 C ATOM 447 C ASN A 28 9.819 11.421 -5.106 1.00 0.00 C ATOM 448 O ASN A 28 8.783 12.082 -5.156 1.00 0.00 O ATOM 449 CB ASN A 28 9.538 10.630 -7.582 1.00 0.00 C ATOM 450 CG ASN A 28 8.061 10.252 -7.694 1.00 0.00 C ATOM 451 OD1 ASN A 28 7.681 9.419 -8.509 1.00 0.00 O ATOM 452 ND2 ASN A 28 7.186 10.885 -6.943 1.00 0.00 N ATOM 0 H ASN A 28 9.145 8.645 -5.928 1.00 0.00 H new ATOM 0 HA ASN A 28 11.265 10.632 -6.388 1.00 0.00 H new ATOM 0 HB2 ASN A 28 9.641 11.681 -7.852 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.093 10.055 -8.323 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.191 10.683 -7.039 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.503 11.578 -6.265 1.00 0.00 H new ATOM 459 N LYS A 29 10.677 11.603 -4.098 1.00 0.00 N ATOM 460 CA LYS A 29 10.389 12.432 -2.905 1.00 0.00 C ATOM 461 C LYS A 29 9.109 12.004 -2.166 1.00 0.00 C ATOM 462 O LYS A 29 8.526 12.801 -1.438 1.00 0.00 O ATOM 463 CB LYS A 29 10.339 13.961 -3.175 1.00 0.00 C ATOM 464 CG LYS A 29 11.179 14.555 -4.318 1.00 0.00 C ATOM 465 CD LYS A 29 10.350 14.891 -5.576 1.00 0.00 C ATOM 466 CE LYS A 29 10.760 14.057 -6.788 1.00 0.00 C ATOM 467 NZ LYS A 29 12.035 14.522 -7.378 1.00 0.00 N ATOM 0 H LYS A 29 11.604 11.178 -4.079 1.00 0.00 H new ATOM 0 HA LYS A 29 11.250 12.244 -2.263 1.00 0.00 H new ATOM 0 HB2 LYS A 29 9.298 14.226 -3.362 1.00 0.00 H new ATOM 0 HB3 LYS A 29 10.636 14.465 -2.255 1.00 0.00 H new ATOM 0 HG2 LYS A 29 11.672 15.460 -3.964 1.00 0.00 H new ATOM 0 HG3 LYS A 29 11.964 13.849 -4.587 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.293 14.725 -5.366 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.466 15.949 -5.811 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.857 13.012 -6.492 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.974 14.103 -7.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.065 14.267 -8.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 12.107 15.555 -7.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 12.831 14.071 -6.883 1.00 0.00 H new ATOM 481 N GLU A 30 8.604 10.800 -2.421 1.00 0.00 N ATOM 482 CA GLU A 30 7.230 10.427 -2.106 1.00 0.00 C ATOM 483 C GLU A 30 7.122 9.638 -0.807 1.00 0.00 C ATOM 484 O GLU A 30 6.071 9.060 -0.535 1.00 0.00 O ATOM 485 CB GLU A 30 6.604 9.727 -3.314 1.00 0.00 C ATOM 486 CG GLU A 30 7.232 8.366 -3.592 1.00 0.00 C ATOM 487 CD GLU A 30 6.771 7.809 -4.928 1.00 0.00 C ATOM 488 OE1 GLU A 30 5.586 7.426 -5.063 1.00 0.00 O ATOM 489 OE2 GLU A 30 7.636 7.653 -5.813 1.00 0.00 O ATOM 0 H GLU A 30 9.142 10.050 -2.856 1.00 0.00 H new ATOM 0 HA GLU A 30 6.650 11.330 -1.914 1.00 0.00 H new ATOM 0 HB2 GLU A 30 5.535 9.602 -3.143 1.00 0.00 H new ATOM 0 HB3 GLU A 30 6.714 10.361 -4.194 1.00 0.00 H new ATOM 0 HG2 GLU A 30 8.318 8.457 -3.588 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.967 7.671 -2.795 1.00 0.00 H new ATOM 496 N LEU A 31 8.177 9.610 0.014 1.00 0.00 N ATOM 497 CA LEU A 31 8.086 9.026 1.346 1.00 0.00 C ATOM 498 C LEU A 31 7.428 10.087 2.231 1.00 0.00 C ATOM 499 O LEU A 31 8.087 10.723 3.043 1.00 0.00 O ATOM 500 CB LEU A 31 9.473 8.570 1.852 1.00 0.00 C ATOM 501 CG LEU A 31 10.112 7.311 1.208 1.00 0.00 C ATOM 502 CD1 LEU A 31 9.379 6.709 -0.003 1.00 0.00 C ATOM 503 CD2 LEU A 31 11.553 7.609 0.767 1.00 0.00 C ATOM 0 H LEU A 31 9.096 9.984 -0.223 1.00 0.00 H new ATOM 0 HA LEU A 31 7.483 8.118 1.355 1.00 0.00 H new ATOM 0 HB2 LEU A 31 10.166 9.401 1.717 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.394 8.391 2.924 1.00 0.00 H new ATOM 0 HG LEU A 31 10.052 6.569 2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.924 5.836 -0.361 1.00 0.00 H new ATOM 0 HD12 LEU A 31 8.372 6.413 0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.320 7.452 -0.799 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.988 6.716 0.317 1.00 0.00 H new ATOM 0 HD22 LEU A 31 11.550 8.419 0.037 1.00 0.00 H new ATOM 0 HD23 LEU A 31 12.145 7.904 1.633 1.00 0.00 H new ATOM 515 N ASN A 32 6.132 10.315 2.050 1.00 0.00 N ATOM 516 CA ASN A 32 5.293 11.114 2.941 1.00 0.00 C ATOM 517 C ASN A 32 4.671 10.151 3.951 1.00 0.00 C ATOM 518 O ASN A 32 4.428 9.003 3.582 1.00 0.00 O ATOM 519 CB ASN A 32 4.223 11.857 2.119 1.00 0.00 C ATOM 520 CG ASN A 32 3.255 10.951 1.360 1.00 0.00 C ATOM 521 OD1 ASN A 32 2.098 10.801 1.735 1.00 0.00 O ATOM 522 ND2 ASN A 32 3.677 10.330 0.272 1.00 0.00 N ATOM 0 H ASN A 32 5.618 9.937 1.254 1.00 0.00 H new ATOM 0 HA ASN A 32 5.870 11.874 3.468 1.00 0.00 H new ATOM 0 HB2 ASN A 32 3.650 12.497 2.789 1.00 0.00 H new ATOM 0 HB3 ASN A 32 4.723 12.511 1.404 1.00 0.00 H new ATOM 0 HD21 ASN A 32 3.040 9.729 -0.252 1.00 0.00 H new ATOM 0 HD22 ASN A 32 4.639 10.452 -0.044 1.00 0.00 H new ATOM 529 N ILE A 33 4.397 10.561 5.198 1.00 0.00 N ATOM 530 CA ILE A 33 3.850 9.653 6.227 1.00 0.00 C ATOM 531 C ILE A 33 2.513 9.064 5.739 1.00 0.00 C ATOM 532 O ILE A 33 2.260 7.879 5.934 1.00 0.00 O ATOM 533 CB ILE A 33 3.808 10.304 7.634 1.00 0.00 C ATOM 534 CG1 ILE A 33 2.901 9.698 8.725 1.00 0.00 C ATOM 535 CG2 ILE A 33 3.359 11.739 7.654 1.00 0.00 C ATOM 536 CD1 ILE A 33 3.138 8.240 8.920 1.00 0.00 C ATOM 0 H ILE A 33 4.544 11.517 5.523 1.00 0.00 H new ATOM 0 HA ILE A 33 4.528 8.811 6.364 1.00 0.00 H new ATOM 0 HB ILE A 33 4.860 10.131 7.863 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.073 10.220 9.667 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.857 9.860 8.456 1.00 0.00 H new ATOM 0 HG21 ILE A 33 3.362 12.107 8.680 1.00 0.00 H new ATOM 0 HG22 ILE A 33 4.038 12.341 7.051 1.00 0.00 H new ATOM 0 HG23 ILE A 33 2.351 11.811 7.246 1.00 0.00 H new ATOM 0 HD11 ILE A 33 2.474 7.864 9.699 1.00 0.00 H new ATOM 0 HD12 ILE A 33 2.940 7.711 7.988 1.00 0.00 H new ATOM 0 HD13 ILE A 33 4.174 8.076 9.217 1.00 0.00 H new ATOM 548 N GLU A 34 1.698 9.811 4.986 1.00 0.00 N ATOM 549 CA GLU A 34 0.422 9.311 4.461 1.00 0.00 C ATOM 550 C GLU A 34 0.596 8.158 3.464 1.00 0.00 C ATOM 551 O GLU A 34 -0.388 7.535 3.059 1.00 0.00 O ATOM 552 CB GLU A 34 -0.387 10.405 3.758 1.00 0.00 C ATOM 553 CG GLU A 34 -0.396 11.781 4.423 1.00 0.00 C ATOM 554 CD GLU A 34 -0.861 12.872 3.460 1.00 0.00 C ATOM 555 OE1 GLU A 34 -1.656 12.559 2.546 1.00 0.00 O ATOM 556 OE2 GLU A 34 -0.308 13.990 3.516 1.00 0.00 O ATOM 0 H GLU A 34 1.903 10.775 4.724 1.00 0.00 H new ATOM 0 HA GLU A 34 -0.111 8.955 5.342 1.00 0.00 H new ATOM 0 HB2 GLU A 34 0.000 10.518 2.745 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.418 10.063 3.669 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -1.052 11.760 5.293 1.00 0.00 H new ATOM 0 HG3 GLU A 34 0.605 12.017 4.784 1.00 0.00 H new ATOM 563 N ASN A 35 1.824 7.917 3.007 1.00 0.00 N ATOM 564 CA ASN A 35 2.232 6.729 2.250 1.00 0.00 C ATOM 565 C ASN A 35 3.150 5.821 3.060 1.00 0.00 C ATOM 566 O ASN A 35 3.176 4.623 2.820 1.00 0.00 O ATOM 567 CB ASN A 35 2.948 7.095 0.943 1.00 0.00 C ATOM 568 CG ASN A 35 2.965 5.906 -0.016 1.00 0.00 C ATOM 569 OD1 ASN A 35 1.897 5.452 -0.407 1.00 0.00 O ATOM 570 ND2 ASN A 35 4.114 5.410 -0.452 1.00 0.00 N ATOM 0 H ASN A 35 2.594 8.568 3.159 1.00 0.00 H new ATOM 0 HA ASN A 35 1.307 6.199 2.021 1.00 0.00 H new ATOM 0 HB2 ASN A 35 2.446 7.941 0.472 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.969 7.410 1.158 1.00 0.00 H new ATOM 0 HD21 ASN A 35 4.116 4.641 -1.122 1.00 0.00 H new ATOM 0 HD22 ASN A 35 4.996 5.798 -0.118 1.00 0.00 H new ATOM 577 N ALA A 36 3.902 6.346 4.028 1.00 0.00 N ATOM 578 CA ALA A 36 4.789 5.568 4.879 1.00 0.00 C ATOM 579 C ALA A 36 3.994 4.654 5.820 1.00 0.00 C ATOM 580 O ALA A 36 4.380 3.510 6.058 1.00 0.00 O ATOM 581 CB ALA A 36 5.717 6.480 5.661 1.00 0.00 C ATOM 0 H ALA A 36 3.908 7.343 4.243 1.00 0.00 H new ATOM 0 HA ALA A 36 5.399 4.931 4.238 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.372 5.879 6.291 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.319 7.067 4.968 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.127 7.150 6.286 1.00 0.00 H new ATOM 587 N HIS A 37 2.856 5.134 6.328 1.00 0.00 N ATOM 588 CA HIS A 37 1.868 4.321 7.025 1.00 0.00 C ATOM 589 C HIS A 37 1.439 3.160 6.124 1.00 0.00 C ATOM 590 O HIS A 37 1.442 2.007 6.557 1.00 0.00 O ATOM 591 CB HIS A 37 0.670 5.199 7.424 1.00 0.00 C ATOM 592 CG HIS A 37 -0.565 4.412 7.780 1.00 0.00 C ATOM 593 ND1 HIS A 37 -1.773 4.460 7.113 1.00 0.00 N ATOM 594 CD2 HIS A 37 -0.678 3.489 8.785 1.00 0.00 C ATOM 595 CE1 HIS A 37 -2.601 3.587 7.707 1.00 0.00 C ATOM 596 NE2 HIS A 37 -1.971 2.958 8.715 1.00 0.00 N ATOM 0 H HIS A 37 2.595 6.118 6.263 1.00 0.00 H new ATOM 0 HA HIS A 37 2.298 3.903 7.935 1.00 0.00 H new ATOM 0 HB2 HIS A 37 0.953 5.819 8.275 1.00 0.00 H new ATOM 0 HB3 HIS A 37 0.435 5.874 6.601 1.00 0.00 H new ATOM 0 HD2 HIS A 37 0.087 3.221 9.498 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -3.627 3.414 7.417 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -2.362 2.231 9.315 1.00 0.00 H new ATOM 604 N LEU A 38 1.120 3.448 4.859 1.00 0.00 N ATOM 605 CA LEU A 38 0.721 2.426 3.900 1.00 0.00 C ATOM 606 C LEU A 38 1.873 1.523 3.501 1.00 0.00 C ATOM 607 O LEU A 38 1.610 0.416 3.068 1.00 0.00 O ATOM 608 CB LEU A 38 0.176 3.044 2.607 1.00 0.00 C ATOM 609 CG LEU A 38 -1.021 3.984 2.789 1.00 0.00 C ATOM 610 CD1 LEU A 38 -1.337 4.640 1.443 1.00 0.00 C ATOM 611 CD2 LEU A 38 -2.213 3.192 3.338 1.00 0.00 C ATOM 0 H LEU A 38 1.132 4.394 4.477 1.00 0.00 H new ATOM 0 HA LEU A 38 -0.049 1.847 4.409 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.980 3.595 2.119 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.114 2.239 1.932 1.00 0.00 H new ATOM 0 HG LEU A 38 -0.793 4.771 3.508 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.187 5.312 1.557 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -0.470 5.206 1.102 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.579 3.870 0.711 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.065 3.860 3.468 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.477 2.399 2.638 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.946 2.753 4.299 1.00 0.00 H new ATOM 623 N PHE A 39 3.120 1.971 3.614 1.00 0.00 N ATOM 624 CA PHE A 39 4.281 1.385 2.946 1.00 0.00 C ATOM 625 C PHE A 39 4.434 -0.095 3.256 1.00 0.00 C ATOM 626 O PHE A 39 4.783 -0.858 2.366 1.00 0.00 O ATOM 627 CB PHE A 39 5.545 2.138 3.364 1.00 0.00 C ATOM 628 CG PHE A 39 6.599 2.407 2.310 1.00 0.00 C ATOM 629 CD1 PHE A 39 6.309 3.227 1.201 1.00 0.00 C ATOM 630 CD2 PHE A 39 7.917 1.972 2.523 1.00 0.00 C ATOM 631 CE1 PHE A 39 7.337 3.701 0.373 1.00 0.00 C ATOM 632 CE2 PHE A 39 8.935 2.367 1.638 1.00 0.00 C ATOM 633 CZ PHE A 39 8.654 3.251 0.580 1.00 0.00 C ATOM 0 H PHE A 39 3.359 2.777 4.191 1.00 0.00 H new ATOM 0 HA PHE A 39 4.128 1.478 1.871 1.00 0.00 H new ATOM 0 HB2 PHE A 39 5.239 3.097 3.781 1.00 0.00 H new ATOM 0 HB3 PHE A 39 6.016 1.576 4.170 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.285 3.493 0.987 1.00 0.00 H new ATOM 0 HD2 PHE A 39 8.148 1.336 3.365 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.120 4.405 -0.416 1.00 0.00 H new ATOM 0 HE2 PHE A 39 9.938 1.990 1.771 1.00 0.00 H new ATOM 0 HZ PHE A 39 9.448 3.584 -0.072 1.00 0.00 H new ATOM 643 N LYS A 40 4.154 -0.500 4.499 1.00 0.00 N ATOM 644 CA LYS A 40 4.008 -1.900 4.869 1.00 0.00 C ATOM 645 C LYS A 40 2.924 -2.534 4.005 1.00 0.00 C ATOM 646 O LYS A 40 3.246 -3.413 3.223 1.00 0.00 O ATOM 647 CB LYS A 40 3.693 -1.993 6.369 1.00 0.00 C ATOM 648 CG LYS A 40 3.498 -3.429 6.877 1.00 0.00 C ATOM 649 CD LYS A 40 2.763 -3.454 8.220 1.00 0.00 C ATOM 650 CE LYS A 40 2.484 -4.900 8.638 1.00 0.00 C ATOM 651 NZ LYS A 40 1.558 -4.955 9.787 1.00 0.00 N ATOM 0 H LYS A 40 4.022 0.145 5.278 1.00 0.00 H new ATOM 0 HA LYS A 40 4.932 -2.450 4.692 1.00 0.00 H new ATOM 0 HB2 LYS A 40 4.503 -1.527 6.930 1.00 0.00 H new ATOM 0 HB3 LYS A 40 2.790 -1.419 6.577 1.00 0.00 H new ATOM 0 HG2 LYS A 40 2.934 -4.003 6.142 1.00 0.00 H new ATOM 0 HG3 LYS A 40 4.469 -3.914 6.983 1.00 0.00 H new ATOM 0 HD2 LYS A 40 3.363 -2.956 8.982 1.00 0.00 H new ATOM 0 HD3 LYS A 40 1.826 -2.902 8.141 1.00 0.00 H new ATOM 0 HE2 LYS A 40 2.058 -5.448 7.798 1.00 0.00 H new ATOM 0 HE3 LYS A 40 3.421 -5.393 8.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 1.387 -5.947 10.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 1.977 -4.451 10.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 0.657 -4.505 9.528 1.00 0.00 H new ATOM 665 N LYS A 41 1.664 -2.103 4.139 1.00 0.00 N ATOM 666 CA LYS A 41 0.518 -2.682 3.438 1.00 0.00 C ATOM 667 C LYS A 41 0.788 -2.786 1.940 1.00 0.00 C ATOM 668 O LYS A 41 0.553 -3.838 1.365 1.00 0.00 O ATOM 669 CB LYS A 41 -0.750 -1.845 3.712 1.00 0.00 C ATOM 670 CG LYS A 41 -1.992 -2.726 3.952 1.00 0.00 C ATOM 671 CD LYS A 41 -2.780 -2.943 2.658 1.00 0.00 C ATOM 672 CE LYS A 41 -4.017 -3.810 2.882 1.00 0.00 C ATOM 673 NZ LYS A 41 -5.064 -3.549 1.874 1.00 0.00 N ATOM 0 H LYS A 41 1.410 -1.327 4.750 1.00 0.00 H new ATOM 0 HA LYS A 41 0.357 -3.692 3.815 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -0.583 -1.211 4.583 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -0.935 -1.183 2.866 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -1.684 -3.689 4.358 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -2.635 -2.257 4.697 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -3.082 -1.978 2.251 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.136 -3.415 1.916 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -3.734 -4.862 2.847 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.417 -3.621 3.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -5.886 -4.158 2.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -5.353 -2.551 1.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -4.691 -3.754 0.925 1.00 0.00 H new ATOM 687 N TRP A 42 1.295 -1.716 1.332 1.00 0.00 N ATOM 688 CA TRP A 42 1.671 -1.660 -0.064 1.00 0.00 C ATOM 689 C TRP A 42 2.778 -2.672 -0.338 1.00 0.00 C ATOM 690 O TRP A 42 2.502 -3.639 -1.027 1.00 0.00 O ATOM 691 CB TRP A 42 2.013 -0.221 -0.449 1.00 0.00 C ATOM 692 CG TRP A 42 2.655 -0.043 -1.787 1.00 0.00 C ATOM 693 CD1 TRP A 42 2.153 -0.388 -2.992 1.00 0.00 C ATOM 694 CD2 TRP A 42 3.972 0.492 -2.060 1.00 0.00 C ATOM 695 NE1 TRP A 42 3.062 -0.074 -3.986 1.00 0.00 N ATOM 696 CE2 TRP A 42 4.201 0.507 -3.466 1.00 0.00 C ATOM 697 CE3 TRP A 42 4.995 0.964 -1.227 1.00 0.00 C ATOM 698 CZ2 TRP A 42 5.383 1.037 -4.017 1.00 0.00 C ATOM 699 CZ3 TRP A 42 6.191 1.454 -1.757 1.00 0.00 C ATOM 700 CH2 TRP A 42 6.374 1.535 -3.149 1.00 0.00 C ATOM 0 H TRP A 42 1.458 -0.837 1.822 1.00 0.00 H new ATOM 0 HA TRP A 42 0.839 -1.948 -0.707 1.00 0.00 H new ATOM 0 HB2 TRP A 42 1.097 0.370 -0.424 1.00 0.00 H new ATOM 0 HB3 TRP A 42 2.678 0.190 0.310 1.00 0.00 H new ATOM 0 HD1 TRP A 42 1.186 -0.841 -3.155 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.910 -0.250 -4.979 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.856 0.949 -0.156 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 5.527 1.061 -5.087 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 6.981 1.773 -1.093 1.00 0.00 H new ATOM 0 HH2 TRP A 42 7.273 1.978 -3.552 1.00 0.00 H new ATOM 711 N VAL A 43 4.002 -2.524 0.181 1.00 0.00 N ATOM 712 CA VAL A 43 5.080 -3.459 -0.154 1.00 0.00 C ATOM 713 C VAL A 43 4.675 -4.919 0.111 1.00 0.00 C ATOM 714 O VAL A 43 5.087 -5.801 -0.646 1.00 0.00 O ATOM 715 CB VAL A 43 6.392 -3.046 0.547 1.00 0.00 C ATOM 716 CG1 VAL A 43 7.509 -4.096 0.448 1.00 0.00 C ATOM 717 CG2 VAL A 43 6.911 -1.729 -0.058 1.00 0.00 C ATOM 0 H VAL A 43 4.268 -1.778 0.824 1.00 0.00 H new ATOM 0 HA VAL A 43 5.267 -3.404 -1.226 1.00 0.00 H new ATOM 0 HB VAL A 43 6.144 -2.935 1.603 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.397 -3.732 0.964 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.176 -5.026 0.909 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.747 -4.276 -0.600 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.837 -1.440 0.439 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.098 -1.867 -1.123 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.165 -0.946 0.081 1.00 0.00 H new ATOM 727 N PHE A 44 3.851 -5.180 1.131 1.00 0.00 N ATOM 728 CA PHE A 44 3.253 -6.467 1.398 1.00 0.00 C ATOM 729 C PHE A 44 2.381 -6.887 0.205 1.00 0.00 C ATOM 730 O PHE A 44 2.748 -7.755 -0.581 1.00 0.00 O ATOM 731 CB PHE A 44 2.457 -6.415 2.714 1.00 0.00 C ATOM 732 CG PHE A 44 3.202 -6.600 4.035 1.00 0.00 C ATOM 733 CD1 PHE A 44 4.418 -5.943 4.332 1.00 0.00 C ATOM 734 CD2 PHE A 44 2.605 -7.404 5.026 1.00 0.00 C ATOM 735 CE1 PHE A 44 5.015 -6.094 5.601 1.00 0.00 C ATOM 736 CE2 PHE A 44 3.215 -7.575 6.278 1.00 0.00 C ATOM 737 CZ PHE A 44 4.422 -6.920 6.568 1.00 0.00 C ATOM 0 H PHE A 44 3.581 -4.468 1.810 1.00 0.00 H new ATOM 0 HA PHE A 44 4.030 -7.222 1.521 1.00 0.00 H new ATOM 0 HB2 PHE A 44 1.949 -5.451 2.754 1.00 0.00 H new ATOM 0 HB3 PHE A 44 1.683 -7.181 2.662 1.00 0.00 H new ATOM 0 HD1 PHE A 44 4.891 -5.323 3.585 1.00 0.00 H new ATOM 0 HD2 PHE A 44 1.666 -7.895 4.819 1.00 0.00 H new ATOM 0 HE1 PHE A 44 5.932 -5.572 5.829 1.00 0.00 H new ATOM 0 HE2 PHE A 44 2.755 -8.211 7.020 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.892 -7.051 7.531 1.00 0.00 H new ATOM 747 N ASP A 45 1.214 -6.278 0.073 1.00 0.00 N ATOM 748 CA ASP A 45 0.141 -6.666 -0.849 1.00 0.00 C ATOM 749 C ASP A 45 0.460 -6.396 -2.316 1.00 0.00 C ATOM 750 O ASP A 45 -0.219 -6.917 -3.203 1.00 0.00 O ATOM 751 CB ASP A 45 -1.192 -6.005 -0.466 1.00 0.00 C ATOM 752 CG ASP A 45 -1.850 -6.728 0.703 1.00 0.00 C ATOM 753 OD1 ASP A 45 -2.007 -7.969 0.626 1.00 0.00 O ATOM 754 OD2 ASP A 45 -2.202 -6.047 1.690 1.00 0.00 O ATOM 0 H ASP A 45 0.970 -5.459 0.630 1.00 0.00 H new ATOM 0 HA ASP A 45 0.051 -7.747 -0.745 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -1.021 -4.962 -0.202 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -1.863 -6.010 -1.325 1.00 0.00 H new ATOM 759 N GLU A 46 1.482 -5.612 -2.619 1.00 0.00 N ATOM 760 CA GLU A 46 1.941 -5.347 -3.968 1.00 0.00 C ATOM 761 C GLU A 46 2.993 -6.382 -4.372 1.00 0.00 C ATOM 762 O GLU A 46 3.012 -6.786 -5.534 1.00 0.00 O ATOM 763 CB GLU A 46 2.491 -3.913 -4.030 1.00 0.00 C ATOM 764 CG GLU A 46 2.361 -3.264 -5.406 1.00 0.00 C ATOM 765 CD GLU A 46 0.979 -2.632 -5.566 1.00 0.00 C ATOM 766 OE1 GLU A 46 -0.044 -3.362 -5.576 1.00 0.00 O ATOM 767 OE2 GLU A 46 0.903 -1.388 -5.615 1.00 0.00 O ATOM 0 H GLU A 46 2.031 -5.128 -1.908 1.00 0.00 H new ATOM 0 HA GLU A 46 1.117 -5.430 -4.676 1.00 0.00 H new ATOM 0 HB2 GLU A 46 1.965 -3.300 -3.298 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.542 -3.924 -3.741 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.132 -2.504 -5.532 1.00 0.00 H new ATOM 0 HG3 GLU A 46 2.519 -4.011 -6.184 1.00 0.00 H new ATOM 774 N PHE A 47 3.821 -6.869 -3.429 1.00 0.00 N ATOM 775 CA PHE A 47 4.997 -7.675 -3.750 1.00 0.00 C ATOM 776 C PHE A 47 5.138 -8.875 -2.816 1.00 0.00 C ATOM 777 O PHE A 47 5.119 -10.008 -3.283 1.00 0.00 O ATOM 778 CB PHE A 47 6.271 -6.820 -3.718 1.00 0.00 C ATOM 779 CG PHE A 47 6.159 -5.460 -4.384 1.00 0.00 C ATOM 780 CD1 PHE A 47 5.907 -5.344 -5.764 1.00 0.00 C ATOM 781 CD2 PHE A 47 6.268 -4.303 -3.596 1.00 0.00 C ATOM 782 CE1 PHE A 47 5.739 -4.071 -6.339 1.00 0.00 C ATOM 783 CE2 PHE A 47 6.061 -3.035 -4.161 1.00 0.00 C ATOM 784 CZ PHE A 47 5.811 -2.917 -5.539 1.00 0.00 C ATOM 0 H PHE A 47 3.688 -6.712 -2.430 1.00 0.00 H new ATOM 0 HA PHE A 47 4.857 -8.058 -4.761 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.564 -6.674 -2.678 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.074 -7.377 -4.200 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.843 -6.229 -6.379 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.513 -4.389 -2.548 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.554 -3.980 -7.399 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.094 -2.153 -3.539 1.00 0.00 H new ATOM 0 HZ PHE A 47 5.674 -1.942 -5.983 1.00 0.00 H new ATOM 794 N LEU A 48 5.283 -8.673 -1.506 1.00 0.00 N ATOM 795 CA LEU A 48 5.569 -9.775 -0.584 1.00 0.00 C ATOM 796 C LEU A 48 4.478 -10.847 -0.590 1.00 0.00 C ATOM 797 O LEU A 48 4.754 -12.008 -0.867 1.00 0.00 O ATOM 798 CB LEU A 48 5.791 -9.288 0.849 1.00 0.00 C ATOM 799 CG LEU A 48 6.878 -8.220 1.055 1.00 0.00 C ATOM 800 CD1 LEU A 48 7.319 -8.200 2.520 1.00 0.00 C ATOM 801 CD2 LEU A 48 8.125 -8.409 0.192 1.00 0.00 C ATOM 0 H LEU A 48 5.208 -7.759 -1.059 1.00 0.00 H new ATOM 0 HA LEU A 48 6.493 -10.222 -0.951 1.00 0.00 H new ATOM 0 HB2 LEU A 48 4.848 -8.890 1.223 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.040 -10.151 1.467 1.00 0.00 H new ATOM 0 HG LEU A 48 6.415 -7.281 0.753 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.089 -7.441 2.658 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.463 -7.968 3.154 1.00 0.00 H new ATOM 0 HD13 LEU A 48 7.719 -9.176 2.793 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.838 -7.612 0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.581 -9.373 0.418 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.847 -8.378 -0.861 1.00 0.00 H new ATOM 813 N ASN A 49 3.226 -10.464 -0.331 1.00 0.00 N ATOM 814 CA ASN A 49 2.052 -11.342 -0.412 1.00 0.00 C ATOM 815 C ASN A 49 1.790 -11.777 -1.861 1.00 0.00 C ATOM 816 O ASN A 49 0.928 -12.609 -2.120 1.00 0.00 O ATOM 817 CB ASN A 49 0.787 -10.637 0.118 1.00 0.00 C ATOM 818 CG ASN A 49 0.764 -10.352 1.614 1.00 0.00 C ATOM 819 OD1 ASN A 49 1.572 -10.867 2.384 1.00 0.00 O ATOM 820 ND2 ASN A 49 -0.142 -9.502 2.071 1.00 0.00 N ATOM 0 H ASN A 49 2.992 -9.511 -0.052 1.00 0.00 H new ATOM 0 HA ASN A 49 2.268 -12.215 0.204 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.670 -9.693 -0.414 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.079 -11.251 -0.129 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -0.171 -9.273 3.064 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -0.811 -9.076 1.430 1.00 0.00 H new ATOM 827 N LYS A 50 2.480 -11.187 -2.839 1.00 0.00 N ATOM 828 CA LYS A 50 2.497 -11.569 -4.242 1.00 0.00 C ATOM 829 C LYS A 50 3.595 -12.611 -4.539 1.00 0.00 C ATOM 830 O LYS A 50 3.729 -13.017 -5.691 1.00 0.00 O ATOM 831 CB LYS A 50 2.761 -10.287 -5.057 1.00 0.00 C ATOM 832 CG LYS A 50 1.682 -9.928 -6.067 1.00 0.00 C ATOM 833 CD LYS A 50 2.345 -9.535 -7.391 1.00 0.00 C ATOM 834 CE LYS A 50 1.375 -8.892 -8.371 1.00 0.00 C ATOM 835 NZ LYS A 50 0.734 -9.870 -9.266 1.00 0.00 N ATOM 0 H LYS A 50 3.077 -10.381 -2.655 1.00 0.00 H new ATOM 0 HA LYS A 50 1.544 -12.027 -4.508 1.00 0.00 H new ATOM 0 HB2 LYS A 50 2.880 -9.454 -4.365 1.00 0.00 H new ATOM 0 HB3 LYS A 50 3.708 -10.400 -5.585 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.012 -10.775 -6.219 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.075 -9.104 -5.692 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.163 -8.843 -7.191 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.783 -10.422 -7.850 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.605 -8.357 -7.815 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.907 -8.153 -8.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 0.084 -9.377 -9.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 1.463 -10.364 -9.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 0.201 -10.561 -8.700 1.00 0.00 H new ATOM 849 N GLY A 51 4.409 -12.992 -3.555 1.00 0.00 N ATOM 850 CA GLY A 51 5.454 -14.001 -3.680 1.00 0.00 C ATOM 851 C GLY A 51 6.846 -13.431 -3.966 1.00 0.00 C ATOM 852 O GLY A 51 7.767 -14.212 -4.208 1.00 0.00 O ATOM 0 H GLY A 51 4.355 -12.592 -2.618 1.00 0.00 H new ATOM 0 HA2 GLY A 51 5.494 -14.582 -2.759 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.184 -14.690 -4.480 1.00 0.00 H new ATOM 856 N TYR A 52 7.033 -12.105 -3.970 1.00 0.00 N ATOM 857 CA TYR A 52 8.353 -11.514 -4.171 1.00 0.00 C ATOM 858 C TYR A 52 9.171 -11.614 -2.887 1.00 0.00 C ATOM 859 O TYR A 52 8.667 -11.475 -1.768 1.00 0.00 O ATOM 860 CB TYR A 52 8.267 -10.056 -4.640 1.00 0.00 C ATOM 861 CG TYR A 52 7.819 -9.919 -6.083 1.00 0.00 C ATOM 862 CD1 TYR A 52 6.459 -9.980 -6.407 1.00 0.00 C ATOM 863 CD2 TYR A 52 8.765 -9.821 -7.115 1.00 0.00 C ATOM 864 CE1 TYR A 52 6.042 -9.966 -7.747 1.00 0.00 C ATOM 865 CE2 TYR A 52 8.370 -9.838 -8.464 1.00 0.00 C ATOM 866 CZ TYR A 52 6.995 -9.912 -8.787 1.00 0.00 C ATOM 867 OH TYR A 52 6.580 -9.986 -10.083 1.00 0.00 O ATOM 0 H TYR A 52 6.284 -11.425 -3.836 1.00 0.00 H new ATOM 0 HA TYR A 52 8.850 -12.077 -4.961 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.573 -9.515 -3.998 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.243 -9.585 -4.523 1.00 0.00 H new ATOM 0 HD1 TYR A 52 5.723 -10.038 -5.618 1.00 0.00 H new ATOM 0 HD2 TYR A 52 9.813 -9.731 -6.869 1.00 0.00 H new ATOM 0 HE1 TYR A 52 4.989 -9.997 -7.983 1.00 0.00 H new ATOM 0 HE2 TYR A 52 9.111 -9.795 -9.248 1.00 0.00 H new ATOM 0 HH TYR A 52 7.356 -9.934 -10.679 1.00 0.00 H new ATOM 877 N ASN A 53 10.477 -11.780 -3.068 1.00 0.00 N ATOM 878 CA ASN A 53 11.463 -12.064 -2.040 1.00 0.00 C ATOM 879 C ASN A 53 12.725 -11.246 -2.287 1.00 0.00 C ATOM 880 O ASN A 53 13.760 -11.526 -1.697 1.00 0.00 O ATOM 881 CB ASN A 53 11.737 -13.578 -1.995 1.00 0.00 C ATOM 882 CG ASN A 53 10.554 -14.381 -1.463 1.00 0.00 C ATOM 883 OD1 ASN A 53 9.962 -15.179 -2.171 1.00 0.00 O ATOM 884 ND2 ASN A 53 10.163 -14.184 -0.215 1.00 0.00 N ATOM 0 H ASN A 53 10.898 -11.715 -3.995 1.00 0.00 H new ATOM 0 HA ASN A 53 11.082 -11.771 -1.062 1.00 0.00 H new ATOM 0 HB2 ASN A 53 11.985 -13.927 -2.997 1.00 0.00 H new ATOM 0 HB3 ASN A 53 12.608 -13.766 -1.368 1.00 0.00 H new ATOM 0 HD21 ASN A 53 9.365 -14.700 0.157 1.00 0.00 H new ATOM 0 HD22 ASN A 53 10.659 -13.516 0.376 1.00 0.00 H new ATOM 891 N LYS A 54 12.683 -10.228 -3.143 1.00 0.00 N ATOM 892 CA LYS A 54 13.811 -9.361 -3.423 1.00 0.00 C ATOM 893 C LYS A 54 13.230 -8.012 -3.772 1.00 0.00 C ATOM 894 O LYS A 54 12.485 -7.891 -4.746 1.00 0.00 O ATOM 895 CB LYS A 54 14.652 -9.939 -4.563 1.00 0.00 C ATOM 896 CG LYS A 54 15.812 -10.824 -4.066 1.00 0.00 C ATOM 897 CD LYS A 54 15.913 -12.116 -4.879 1.00 0.00 C ATOM 898 CE LYS A 54 14.719 -13.031 -4.600 1.00 0.00 C ATOM 899 NZ LYS A 54 14.581 -14.034 -5.675 1.00 0.00 N ATOM 0 H LYS A 54 11.844 -9.983 -3.669 1.00 0.00 H new ATOM 0 HA LYS A 54 14.481 -9.271 -2.568 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.010 -10.526 -5.220 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.056 -9.121 -5.160 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.749 -10.273 -4.138 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.663 -11.065 -3.013 1.00 0.00 H new ATOM 0 HD2 LYS A 54 15.954 -11.879 -5.942 1.00 0.00 H new ATOM 0 HD3 LYS A 54 16.839 -12.635 -4.632 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.852 -13.532 -3.641 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.807 -12.438 -4.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.616 -13.998 -6.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 15.265 -13.829 -6.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 14.764 -14.983 -5.290 1.00 0.00 H new ATOM 913 N ILE A 55 13.533 -7.012 -2.958 1.00 0.00 N ATOM 914 CA ILE A 55 13.147 -5.627 -3.167 1.00 0.00 C ATOM 915 C ILE A 55 14.460 -4.849 -3.230 1.00 0.00 C ATOM 916 O ILE A 55 15.417 -5.230 -2.558 1.00 0.00 O ATOM 917 CB ILE A 55 12.230 -5.168 -1.998 1.00 0.00 C ATOM 918 CG1 ILE A 55 10.764 -5.643 -2.090 1.00 0.00 C ATOM 919 CG2 ILE A 55 12.174 -3.636 -1.884 1.00 0.00 C ATOM 920 CD1 ILE A 55 10.533 -7.147 -2.124 1.00 0.00 C ATOM 0 H ILE A 55 14.074 -7.149 -2.104 1.00 0.00 H new ATOM 0 HA ILE A 55 12.574 -5.468 -4.081 1.00 0.00 H new ATOM 0 HB ILE A 55 12.697 -5.632 -1.129 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.220 -5.235 -1.238 1.00 0.00 H new ATOM 0 HG13 ILE A 55 10.322 -5.211 -2.988 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.523 -3.356 -1.056 1.00 0.00 H new ATOM 0 HG22 ILE A 55 13.177 -3.248 -1.705 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.783 -3.216 -2.811 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.464 -7.350 -2.189 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.037 -7.573 -2.992 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.933 -7.597 -1.215 1.00 0.00 H new ATOM 932 N PHE A 56 14.485 -3.717 -3.934 1.00 0.00 N ATOM 933 CA PHE A 56 15.490 -2.674 -3.787 1.00 0.00 C ATOM 934 C PHE A 56 14.814 -1.330 -3.480 1.00 0.00 C ATOM 935 O PHE A 56 13.625 -1.160 -3.774 1.00 0.00 O ATOM 936 CB PHE A 56 16.405 -2.622 -5.028 1.00 0.00 C ATOM 937 CG PHE A 56 17.181 -3.897 -5.343 1.00 0.00 C ATOM 938 CD1 PHE A 56 17.705 -4.687 -4.303 1.00 0.00 C ATOM 939 CD2 PHE A 56 17.350 -4.341 -6.674 1.00 0.00 C ATOM 940 CE1 PHE A 56 18.295 -5.921 -4.588 1.00 0.00 C ATOM 941 CE2 PHE A 56 17.962 -5.570 -6.958 1.00 0.00 C ATOM 942 CZ PHE A 56 18.417 -6.375 -5.908 1.00 0.00 C ATOM 0 H PHE A 56 13.784 -3.498 -4.642 1.00 0.00 H new ATOM 0 HA PHE A 56 16.136 -2.905 -2.940 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.794 -2.369 -5.895 1.00 0.00 H new ATOM 0 HB3 PHE A 56 17.119 -1.810 -4.894 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.651 -4.339 -3.282 1.00 0.00 H new ATOM 0 HD2 PHE A 56 17.001 -3.722 -7.487 1.00 0.00 H new ATOM 0 HE1 PHE A 56 18.663 -6.534 -3.779 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.082 -5.893 -7.981 1.00 0.00 H new ATOM 0 HZ PHE A 56 18.859 -7.339 -6.113 1.00 0.00 H new ATOM 952 N LEU A 57 15.545 -0.379 -2.884 1.00 0.00 N ATOM 953 CA LEU A 57 15.120 1.006 -2.632 1.00 0.00 C ATOM 954 C LEU A 57 16.057 1.913 -3.396 1.00 0.00 C ATOM 955 O LEU A 57 17.251 1.832 -3.149 1.00 0.00 O ATOM 956 CB LEU A 57 15.269 1.370 -1.140 1.00 0.00 C ATOM 957 CG LEU A 57 14.941 2.841 -0.807 1.00 0.00 C ATOM 958 CD1 LEU A 57 13.509 3.221 -1.210 1.00 0.00 C ATOM 959 CD2 LEU A 57 15.134 3.069 0.695 1.00 0.00 C ATOM 0 H LEU A 57 16.491 -0.561 -2.549 1.00 0.00 H new ATOM 0 HA LEU A 57 14.078 1.116 -2.933 1.00 0.00 H new ATOM 0 HB2 LEU A 57 14.616 0.723 -0.554 1.00 0.00 H new ATOM 0 HB3 LEU A 57 16.292 1.159 -0.827 1.00 0.00 H new ATOM 0 HG LEU A 57 15.618 3.475 -1.380 1.00 0.00 H new ATOM 0 HD11 LEU A 57 13.324 4.265 -0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 57 13.384 3.081 -2.284 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.801 2.587 -0.677 1.00 0.00 H new ATOM 0 HD21 LEU A 57 14.904 4.106 0.938 1.00 0.00 H new ATOM 0 HD22 LEU A 57 14.468 2.410 1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 57 16.168 2.853 0.966 1.00 0.00 H new ATOM 971 N VAL A 58 15.571 2.769 -4.284 1.00 0.00 N ATOM 972 CA VAL A 58 16.424 3.737 -4.947 1.00 0.00 C ATOM 973 C VAL A 58 16.375 5.068 -4.204 1.00 0.00 C ATOM 974 O VAL A 58 15.440 5.334 -3.446 1.00 0.00 O ATOM 975 CB VAL A 58 16.158 3.754 -6.463 1.00 0.00 C ATOM 976 CG1 VAL A 58 15.561 2.478 -7.063 1.00 0.00 C ATOM 977 CG2 VAL A 58 15.768 5.080 -7.089 1.00 0.00 C ATOM 0 H VAL A 58 14.590 2.810 -4.560 1.00 0.00 H new ATOM 0 HA VAL A 58 17.474 3.450 -4.893 1.00 0.00 H new ATOM 0 HB VAL A 58 17.175 3.691 -6.850 1.00 0.00 H new ATOM 0 HG11 VAL A 58 15.420 2.612 -8.135 1.00 0.00 H new ATOM 0 HG12 VAL A 58 16.238 1.642 -6.888 1.00 0.00 H new ATOM 0 HG13 VAL A 58 14.600 2.270 -6.593 1.00 0.00 H new ATOM 0 HG21 VAL A 58 15.611 4.945 -8.159 1.00 0.00 H new ATOM 0 HG22 VAL A 58 14.848 5.442 -6.630 1.00 0.00 H new ATOM 0 HG23 VAL A 58 16.564 5.807 -6.928 1.00 0.00 H new ATOM 987 N LEU A 59 17.404 5.893 -4.379 1.00 0.00 N ATOM 988 CA LEU A 59 17.624 7.080 -3.562 1.00 0.00 C ATOM 989 C LEU A 59 17.927 8.310 -4.432 1.00 0.00 C ATOM 990 O LEU A 59 18.369 9.331 -3.906 1.00 0.00 O ATOM 991 CB LEU A 59 18.716 6.748 -2.521 1.00 0.00 C ATOM 992 CG LEU A 59 18.310 5.636 -1.523 1.00 0.00 C ATOM 993 CD1 LEU A 59 19.529 4.985 -0.872 1.00 0.00 C ATOM 994 CD2 LEU A 59 17.350 6.173 -0.456 1.00 0.00 C ATOM 0 H LEU A 59 18.114 5.754 -5.098 1.00 0.00 H new ATOM 0 HA LEU A 59 16.720 7.355 -3.019 1.00 0.00 H new ATOM 0 HB2 LEU A 59 19.622 6.441 -3.044 1.00 0.00 H new ATOM 0 HB3 LEU A 59 18.960 7.652 -1.964 1.00 0.00 H new ATOM 0 HG LEU A 59 17.791 4.867 -2.095 1.00 0.00 H new ATOM 0 HD11 LEU A 59 19.201 4.210 -0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 59 20.159 4.540 -1.642 1.00 0.00 H new ATOM 0 HD13 LEU A 59 20.098 5.740 -0.330 1.00 0.00 H new ATOM 0 HD21 LEU A 59 17.083 5.370 0.230 1.00 0.00 H new ATOM 0 HD22 LEU A 59 17.835 6.977 0.098 1.00 0.00 H new ATOM 0 HD23 LEU A 59 16.449 6.555 -0.936 1.00 0.00 H new ATOM 1006 N SER A 60 17.684 8.238 -5.745 1.00 0.00 N ATOM 1007 CA SER A 60 18.046 9.265 -6.712 1.00 0.00 C ATOM 1008 C SER A 60 17.075 10.437 -6.798 1.00 0.00 C ATOM 1009 O SER A 60 17.545 11.572 -6.909 1.00 0.00 O ATOM 1010 CB SER A 60 18.154 8.629 -8.095 1.00 0.00 C ATOM 1011 OG SER A 60 19.198 7.683 -8.093 1.00 0.00 O ATOM 0 H SER A 60 17.216 7.438 -6.171 1.00 0.00 H new ATOM 0 HA SER A 60 18.994 9.676 -6.365 1.00 0.00 H new ATOM 0 HB2 SER A 60 17.213 8.148 -8.361 1.00 0.00 H new ATOM 0 HB3 SER A 60 18.344 9.395 -8.846 1.00 0.00 H new ATOM 0 HG SER A 60 19.483 7.508 -9.014 1.00 0.00 H new ATOM 1017 N ASP A 61 15.763 10.199 -6.865 1.00 0.00 N ATOM 1018 CA ASP A 61 14.794 11.281 -7.081 1.00 0.00 C ATOM 1019 C ASP A 61 14.365 11.896 -5.749 1.00 0.00 C ATOM 1020 O ASP A 61 13.907 13.041 -5.739 1.00 0.00 O ATOM 1021 CB ASP A 61 13.549 10.803 -7.851 1.00 0.00 C ATOM 1022 CG ASP A 61 13.762 10.740 -9.361 1.00 0.00 C ATOM 1023 OD1 ASP A 61 14.235 9.704 -9.876 1.00 0.00 O ATOM 1024 OD2 ASP A 61 13.467 11.743 -10.052 1.00 0.00 O ATOM 0 H ASP A 61 15.347 9.272 -6.774 1.00 0.00 H new ATOM 0 HA ASP A 61 15.296 12.035 -7.687 1.00 0.00 H new ATOM 0 HB2 ASP A 61 13.264 9.815 -7.490 1.00 0.00 H new ATOM 0 HB3 ASP A 61 12.717 11.474 -7.636 1.00 0.00 H new ATOM 1029 N VAL A 62 14.491 11.155 -4.642 1.00 0.00 N ATOM 1030 CA VAL A 62 14.338 11.641 -3.273 1.00 0.00 C ATOM 1031 C VAL A 62 15.612 12.377 -2.838 1.00 0.00 C ATOM 1032 O VAL A 62 16.681 12.184 -3.422 1.00 0.00 O ATOM 1033 CB VAL A 62 13.984 10.436 -2.363 1.00 0.00 C ATOM 1034 CG1 VAL A 62 15.108 9.408 -2.173 1.00 0.00 C ATOM 1035 CG2 VAL A 62 13.519 10.852 -0.968 1.00 0.00 C ATOM 0 H VAL A 62 14.711 10.160 -4.681 1.00 0.00 H new ATOM 0 HA VAL A 62 13.526 12.364 -3.196 1.00 0.00 H new ATOM 0 HB VAL A 62 13.173 9.967 -2.919 1.00 0.00 H new ATOM 0 HG11 VAL A 62 14.761 8.606 -1.522 1.00 0.00 H new ATOM 0 HG12 VAL A 62 15.389 8.993 -3.141 1.00 0.00 H new ATOM 0 HG13 VAL A 62 15.973 9.894 -1.721 1.00 0.00 H new ATOM 0 HG21 VAL A 62 13.287 9.963 -0.382 1.00 0.00 H new ATOM 0 HG22 VAL A 62 14.310 11.416 -0.474 1.00 0.00 H new ATOM 0 HG23 VAL A 62 12.628 11.474 -1.052 1.00 0.00 H new ATOM 1045 N GLU A 63 15.524 13.178 -1.777 1.00 0.00 N ATOM 1046 CA GLU A 63 16.680 13.780 -1.128 1.00 0.00 C ATOM 1047 C GLU A 63 16.807 13.280 0.313 1.00 0.00 C ATOM 1048 O GLU A 63 17.924 13.081 0.780 1.00 0.00 O ATOM 1049 CB GLU A 63 16.536 15.303 -1.182 1.00 0.00 C ATOM 1050 CG GLU A 63 17.746 15.999 -0.547 1.00 0.00 C ATOM 1051 CD GLU A 63 17.640 17.516 -0.638 1.00 0.00 C ATOM 1052 OE1 GLU A 63 17.660 18.055 -1.764 1.00 0.00 O ATOM 1053 OE2 GLU A 63 17.595 18.169 0.433 1.00 0.00 O ATOM 0 H GLU A 63 14.636 13.428 -1.341 1.00 0.00 H new ATOM 0 HA GLU A 63 17.592 13.491 -1.650 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.431 15.624 -2.218 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.626 15.603 -0.662 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.828 15.703 0.499 1.00 0.00 H new ATOM 0 HG3 GLU A 63 18.658 15.668 -1.044 1.00 0.00 H new ATOM 1060 N SER A 64 15.695 13.086 1.031 1.00 0.00 N ATOM 1061 CA SER A 64 15.728 12.571 2.391 1.00 0.00 C ATOM 1062 C SER A 64 14.378 11.949 2.751 1.00 0.00 C ATOM 1063 O SER A 64 13.405 11.993 1.992 1.00 0.00 O ATOM 1064 CB SER A 64 16.100 13.714 3.357 1.00 0.00 C ATOM 1065 OG SER A 64 17.126 13.356 4.267 1.00 0.00 O ATOM 0 H SER A 64 14.757 13.282 0.683 1.00 0.00 H new ATOM 0 HA SER A 64 16.483 11.789 2.474 1.00 0.00 H new ATOM 0 HB2 SER A 64 16.420 14.581 2.779 1.00 0.00 H new ATOM 0 HB3 SER A 64 15.214 14.013 3.916 1.00 0.00 H new ATOM 0 HG SER A 64 16.813 13.498 5.185 1.00 0.00 H new ATOM 1071 N ILE A 65 14.350 11.381 3.949 1.00 0.00 N ATOM 1072 CA ILE A 65 13.285 10.576 4.517 1.00 0.00 C ATOM 1073 C ILE A 65 13.011 11.086 5.947 1.00 0.00 C ATOM 1074 O ILE A 65 13.862 11.754 6.539 1.00 0.00 O ATOM 1075 CB ILE A 65 13.740 9.101 4.387 1.00 0.00 C ATOM 1076 CG1 ILE A 65 12.615 8.144 4.789 1.00 0.00 C ATOM 1077 CG2 ILE A 65 15.040 8.794 5.151 1.00 0.00 C ATOM 1078 CD1 ILE A 65 12.853 6.699 4.316 1.00 0.00 C ATOM 0 H ILE A 65 15.133 11.481 4.596 1.00 0.00 H new ATOM 0 HA ILE A 65 12.325 10.651 4.007 1.00 0.00 H new ATOM 0 HB ILE A 65 13.970 8.942 3.333 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.510 8.152 5.874 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.674 8.505 4.375 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.301 7.744 5.017 1.00 0.00 H new ATOM 0 HG22 ILE A 65 15.845 9.420 4.766 1.00 0.00 H new ATOM 0 HG23 ILE A 65 14.896 9.000 6.212 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.020 6.071 4.632 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.929 6.680 3.229 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.778 6.321 4.751 1.00 0.00 H new ATOM 1090 N ASP A 66 11.855 10.814 6.546 1.00 0.00 N ATOM 1091 CA ASP A 66 11.397 11.454 7.787 1.00 0.00 C ATOM 1092 C ASP A 66 11.743 10.566 8.987 1.00 0.00 C ATOM 1093 O ASP A 66 12.100 9.396 8.814 1.00 0.00 O ATOM 1094 CB ASP A 66 9.880 11.749 7.705 1.00 0.00 C ATOM 1095 CG ASP A 66 9.342 12.765 8.727 1.00 0.00 C ATOM 1096 OD1 ASP A 66 10.107 13.253 9.586 1.00 0.00 O ATOM 1097 OD2 ASP A 66 8.135 13.098 8.666 1.00 0.00 O ATOM 0 H ASP A 66 11.193 10.130 6.179 1.00 0.00 H new ATOM 0 HA ASP A 66 11.909 12.407 7.919 1.00 0.00 H new ATOM 0 HB2 ASP A 66 9.653 12.114 6.703 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.339 10.812 7.833 1.00 0.00 H new ATOM 1102 N SER A 67 11.609 11.087 10.204 1.00 0.00 N ATOM 1103 CA SER A 67 11.595 10.406 11.501 1.00 0.00 C ATOM 1104 C SER A 67 10.372 9.475 11.654 1.00 0.00 C ATOM 1105 O SER A 67 9.827 9.289 12.746 1.00 0.00 O ATOM 1106 CB SER A 67 11.583 11.505 12.572 1.00 0.00 C ATOM 1107 OG SER A 67 12.858 12.105 12.713 1.00 0.00 O ATOM 0 H SER A 67 11.496 12.094 10.321 1.00 0.00 H new ATOM 0 HA SER A 67 12.471 9.765 11.599 1.00 0.00 H new ATOM 0 HB2 SER A 67 10.849 12.266 12.306 1.00 0.00 H new ATOM 0 HB3 SER A 67 11.271 11.081 13.527 1.00 0.00 H new ATOM 0 HG SER A 67 12.817 12.802 13.401 1.00 0.00 H new ATOM 1113 N PHE A 68 9.903 8.908 10.550 1.00 0.00 N ATOM 1114 CA PHE A 68 8.882 7.893 10.485 1.00 0.00 C ATOM 1115 C PHE A 68 9.418 6.813 9.565 1.00 0.00 C ATOM 1116 O PHE A 68 9.722 5.699 9.989 1.00 0.00 O ATOM 1117 CB PHE A 68 7.557 8.494 9.992 1.00 0.00 C ATOM 1118 CG PHE A 68 6.446 7.481 10.020 1.00 0.00 C ATOM 1119 CD1 PHE A 68 6.291 6.586 8.951 1.00 0.00 C ATOM 1120 CD2 PHE A 68 5.594 7.405 11.133 1.00 0.00 C ATOM 1121 CE1 PHE A 68 5.339 5.558 9.022 1.00 0.00 C ATOM 1122 CE2 PHE A 68 4.622 6.397 11.193 1.00 0.00 C ATOM 1123 CZ PHE A 68 4.504 5.461 10.148 1.00 0.00 C ATOM 0 H PHE A 68 10.251 9.166 9.627 1.00 0.00 H new ATOM 0 HA PHE A 68 8.661 7.468 11.464 1.00 0.00 H new ATOM 0 HB2 PHE A 68 7.289 9.346 10.616 1.00 0.00 H new ATOM 0 HB3 PHE A 68 7.683 8.869 8.976 1.00 0.00 H new ATOM 0 HD1 PHE A 68 6.907 6.689 8.070 1.00 0.00 H new ATOM 0 HD2 PHE A 68 5.687 8.119 11.938 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.248 4.845 8.216 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.961 6.338 12.045 1.00 0.00 H new ATOM 0 HZ PHE A 68 3.772 4.669 10.212 1.00 0.00 H new ATOM 1133 N SER A 69 9.547 7.156 8.289 1.00 0.00 N ATOM 1134 CA SER A 69 9.763 6.194 7.235 1.00 0.00 C ATOM 1135 C SER A 69 11.180 5.618 7.285 1.00 0.00 C ATOM 1136 O SER A 69 11.389 4.467 6.915 1.00 0.00 O ATOM 1137 CB SER A 69 9.417 6.838 5.889 1.00 0.00 C ATOM 1138 OG SER A 69 8.582 7.981 6.039 1.00 0.00 O ATOM 0 H SER A 69 9.503 8.121 7.962 1.00 0.00 H new ATOM 0 HA SER A 69 9.101 5.339 7.374 1.00 0.00 H new ATOM 0 HB2 SER A 69 10.336 7.126 5.379 1.00 0.00 H new ATOM 0 HB3 SER A 69 8.917 6.105 5.255 1.00 0.00 H new ATOM 0 HG SER A 69 8.387 8.362 5.157 1.00 0.00 H new ATOM 1144 N LEU A 70 12.151 6.336 7.852 1.00 0.00 N ATOM 1145 CA LEU A 70 13.487 5.795 8.108 1.00 0.00 C ATOM 1146 C LEU A 70 13.408 4.510 8.949 1.00 0.00 C ATOM 1147 O LEU A 70 14.167 3.571 8.720 1.00 0.00 O ATOM 1148 CB LEU A 70 14.296 6.898 8.812 1.00 0.00 C ATOM 1149 CG LEU A 70 15.788 6.598 9.041 1.00 0.00 C ATOM 1150 CD1 LEU A 70 16.567 6.565 7.721 1.00 0.00 C ATOM 1151 CD2 LEU A 70 16.374 7.721 9.904 1.00 0.00 C ATOM 0 H LEU A 70 12.034 7.306 8.146 1.00 0.00 H new ATOM 0 HA LEU A 70 13.979 5.513 7.177 1.00 0.00 H new ATOM 0 HB2 LEU A 70 14.216 7.812 8.223 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.834 7.100 9.778 1.00 0.00 H new ATOM 0 HG LEU A 70 15.873 5.623 9.522 1.00 0.00 H new ATOM 0 HD11 LEU A 70 17.616 6.350 7.923 1.00 0.00 H new ATOM 0 HD12 LEU A 70 16.156 5.789 7.075 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.483 7.532 7.225 1.00 0.00 H new ATOM 0 HD21 LEU A 70 17.433 7.530 10.080 1.00 0.00 H new ATOM 0 HD22 LEU A 70 16.258 8.674 9.388 1.00 0.00 H new ATOM 0 HD23 LEU A 70 15.848 7.759 10.858 1.00 0.00 H new ATOM 1163 N GLY A 71 12.423 4.430 9.847 1.00 0.00 N ATOM 1164 CA GLY A 71 12.120 3.258 10.655 1.00 0.00 C ATOM 1165 C GLY A 71 11.024 2.346 10.079 1.00 0.00 C ATOM 1166 O GLY A 71 10.679 1.355 10.729 1.00 0.00 O ATOM 0 H GLY A 71 11.795 5.211 10.034 1.00 0.00 H new ATOM 0 HA2 GLY A 71 13.032 2.674 10.779 1.00 0.00 H new ATOM 0 HA3 GLY A 71 11.815 3.587 11.648 1.00 0.00 H new ATOM 1170 N VAL A 72 10.457 2.636 8.899 1.00 0.00 N ATOM 1171 CA VAL A 72 9.611 1.696 8.152 1.00 0.00 C ATOM 1172 C VAL A 72 10.474 0.907 7.158 1.00 0.00 C ATOM 1173 O VAL A 72 10.207 -0.268 6.925 1.00 0.00 O ATOM 1174 CB VAL A 72 8.405 2.413 7.479 1.00 0.00 C ATOM 1175 CG1 VAL A 72 8.578 2.913 6.036 1.00 0.00 C ATOM 1176 CG2 VAL A 72 7.214 1.453 7.427 1.00 0.00 C ATOM 0 H VAL A 72 10.574 3.536 8.434 1.00 0.00 H new ATOM 0 HA VAL A 72 9.169 0.982 8.847 1.00 0.00 H new ATOM 0 HB VAL A 72 8.278 3.296 8.105 1.00 0.00 H new ATOM 0 HG11 VAL A 72 7.656 3.390 5.703 1.00 0.00 H new ATOM 0 HG12 VAL A 72 9.394 3.634 5.996 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.806 2.070 5.384 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.366 1.950 6.956 1.00 0.00 H new ATOM 0 HG22 VAL A 72 7.484 0.570 6.848 1.00 0.00 H new ATOM 0 HG23 VAL A 72 6.943 1.154 8.440 1.00 0.00 H new ATOM 1186 N ILE A 73 11.529 1.520 6.611 1.00 0.00 N ATOM 1187 CA ILE A 73 12.471 0.880 5.697 1.00 0.00 C ATOM 1188 C ILE A 73 13.070 -0.359 6.378 1.00 0.00 C ATOM 1189 O ILE A 73 12.988 -1.460 5.836 1.00 0.00 O ATOM 1190 CB ILE A 73 13.496 1.943 5.222 1.00 0.00 C ATOM 1191 CG1 ILE A 73 13.038 2.736 3.974 1.00 0.00 C ATOM 1192 CG2 ILE A 73 14.859 1.333 4.851 1.00 0.00 C ATOM 1193 CD1 ILE A 73 11.568 3.155 3.853 1.00 0.00 C ATOM 0 H ILE A 73 11.754 2.497 6.798 1.00 0.00 H new ATOM 0 HA ILE A 73 11.991 0.505 4.793 1.00 0.00 H new ATOM 0 HB ILE A 73 13.578 2.605 6.084 1.00 0.00 H new ATOM 0 HG12 ILE A 73 13.643 3.641 3.920 1.00 0.00 H new ATOM 0 HG13 ILE A 73 13.282 2.137 3.097 1.00 0.00 H new ATOM 0 HG21 ILE A 73 15.535 2.124 4.526 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.281 0.829 5.721 1.00 0.00 H new ATOM 0 HG23 ILE A 73 14.728 0.613 4.043 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.421 3.701 2.921 1.00 0.00 H new ATOM 0 HD12 ILE A 73 10.935 2.268 3.858 1.00 0.00 H new ATOM 0 HD13 ILE A 73 11.302 3.795 4.694 1.00 0.00 H new ATOM 1205 N VAL A 74 13.626 -0.214 7.585 1.00 0.00 N ATOM 1206 CA VAL A 74 14.149 -1.357 8.334 1.00 0.00 C ATOM 1207 C VAL A 74 13.040 -2.379 8.589 1.00 0.00 C ATOM 1208 O VAL A 74 13.280 -3.574 8.465 1.00 0.00 O ATOM 1209 CB VAL A 74 14.809 -0.873 9.638 1.00 0.00 C ATOM 1210 CG1 VAL A 74 15.061 -2.036 10.605 1.00 0.00 C ATOM 1211 CG2 VAL A 74 16.124 -0.162 9.298 1.00 0.00 C ATOM 0 H VAL A 74 13.725 0.682 8.062 1.00 0.00 H new ATOM 0 HA VAL A 74 14.917 -1.859 7.745 1.00 0.00 H new ATOM 0 HB VAL A 74 14.133 -0.179 10.137 1.00 0.00 H new ATOM 0 HG11 VAL A 74 15.528 -1.658 11.515 1.00 0.00 H new ATOM 0 HG12 VAL A 74 14.113 -2.513 10.855 1.00 0.00 H new ATOM 0 HG13 VAL A 74 15.721 -2.764 10.134 1.00 0.00 H new ATOM 0 HG21 VAL A 74 16.598 0.184 10.216 1.00 0.00 H new ATOM 0 HG22 VAL A 74 16.790 -0.855 8.784 1.00 0.00 H new ATOM 0 HG23 VAL A 74 15.920 0.691 8.651 1.00 0.00 H new ATOM 1221 N ASN A 75 11.821 -1.949 8.907 1.00 0.00 N ATOM 1222 CA ASN A 75 10.701 -2.848 9.168 1.00 0.00 C ATOM 1223 C ASN A 75 10.456 -3.816 8.013 1.00 0.00 C ATOM 1224 O ASN A 75 10.096 -4.974 8.224 1.00 0.00 O ATOM 1225 CB ASN A 75 9.442 -1.995 9.333 1.00 0.00 C ATOM 1226 CG ASN A 75 8.454 -2.591 10.293 1.00 0.00 C ATOM 1227 OD1 ASN A 75 7.360 -3.007 9.925 1.00 0.00 O ATOM 1228 ND2 ASN A 75 8.779 -2.546 11.560 1.00 0.00 N ATOM 0 H ASN A 75 11.582 -0.961 8.991 1.00 0.00 H new ATOM 0 HA ASN A 75 10.934 -3.430 10.060 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.725 -1.002 9.681 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.965 -1.868 8.361 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.116 -2.861 12.268 1.00 0.00 H new ATOM 0 HD22 ASN A 75 9.695 -2.196 11.839 1.00 0.00 H new ATOM 1235 N ILE A 76 10.603 -3.331 6.779 1.00 0.00 N ATOM 1236 CA ILE A 76 10.450 -4.145 5.584 1.00 0.00 C ATOM 1237 C ILE A 76 11.621 -5.134 5.497 1.00 0.00 C ATOM 1238 O ILE A 76 11.407 -6.266 5.081 1.00 0.00 O ATOM 1239 CB ILE A 76 10.310 -3.230 4.343 1.00 0.00 C ATOM 1240 CG1 ILE A 76 8.939 -2.507 4.403 1.00 0.00 C ATOM 1241 CG2 ILE A 76 10.468 -4.038 3.042 1.00 0.00 C ATOM 1242 CD1 ILE A 76 8.721 -1.437 3.335 1.00 0.00 C ATOM 0 H ILE A 76 10.833 -2.356 6.585 1.00 0.00 H new ATOM 0 HA ILE A 76 9.537 -4.740 5.627 1.00 0.00 H new ATOM 0 HB ILE A 76 11.104 -2.483 4.348 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.149 -3.253 4.314 1.00 0.00 H new ATOM 0 HG13 ILE A 76 8.832 -2.045 5.384 1.00 0.00 H new ATOM 0 HG21 ILE A 76 10.365 -3.372 2.185 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.452 -4.506 3.022 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.698 -4.809 2.997 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.734 -0.991 3.462 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.484 -0.664 3.433 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.789 -1.891 2.346 1.00 0.00 H new ATOM 1254 N LEU A 77 12.834 -4.771 5.934 1.00 0.00 N ATOM 1255 CA LEU A 77 13.961 -5.699 5.970 1.00 0.00 C ATOM 1256 C LEU A 77 13.649 -6.830 6.936 1.00 0.00 C ATOM 1257 O LEU A 77 13.753 -7.994 6.558 1.00 0.00 O ATOM 1258 CB LEU A 77 15.270 -4.957 6.319 1.00 0.00 C ATOM 1259 CG LEU A 77 16.552 -5.811 6.344 1.00 0.00 C ATOM 1260 CD1 LEU A 77 16.768 -6.544 7.668 1.00 0.00 C ATOM 1261 CD2 LEU A 77 16.660 -6.805 5.185 1.00 0.00 C ATOM 0 H LEU A 77 13.056 -3.833 6.269 1.00 0.00 H new ATOM 0 HA LEU A 77 14.114 -6.137 4.984 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.409 -4.151 5.598 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.149 -4.492 7.297 1.00 0.00 H new ATOM 0 HG LEU A 77 17.347 -5.075 6.225 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.688 -7.126 7.616 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.843 -5.818 8.478 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.927 -7.211 7.856 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.589 -7.368 5.274 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.815 -7.493 5.216 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.653 -6.263 4.239 1.00 0.00 H new ATOM 1273 N LYS A 78 13.222 -6.503 8.158 1.00 0.00 N ATOM 1274 CA LYS A 78 12.889 -7.506 9.166 1.00 0.00 C ATOM 1275 C LYS A 78 11.884 -8.504 8.599 1.00 0.00 C ATOM 1276 O LYS A 78 12.120 -9.708 8.695 1.00 0.00 O ATOM 1277 CB LYS A 78 12.398 -6.842 10.466 1.00 0.00 C ATOM 1278 CG LYS A 78 13.453 -5.860 10.995 1.00 0.00 C ATOM 1279 CD LYS A 78 13.275 -5.470 12.466 1.00 0.00 C ATOM 1280 CE LYS A 78 14.563 -4.772 12.924 1.00 0.00 C ATOM 1281 NZ LYS A 78 14.659 -4.608 14.386 1.00 0.00 N ATOM 0 H LYS A 78 13.099 -5.541 8.473 1.00 0.00 H new ATOM 0 HA LYS A 78 13.789 -8.063 9.427 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.461 -6.316 10.282 1.00 0.00 H new ATOM 0 HB3 LYS A 78 12.193 -7.605 11.217 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.441 -6.303 10.866 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.427 -4.956 10.387 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.418 -4.807 12.585 1.00 0.00 H new ATOM 0 HD3 LYS A 78 13.082 -6.353 13.075 1.00 0.00 H new ATOM 0 HE2 LYS A 78 15.421 -5.346 12.574 1.00 0.00 H new ATOM 0 HE3 LYS A 78 14.622 -3.791 12.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 15.552 -4.130 14.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.859 -4.036 14.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.634 -5.542 14.843 1.00 0.00 H new ATOM 1295 N SER A 79 10.826 -7.994 7.972 1.00 0.00 N ATOM 1296 CA SER A 79 9.782 -8.743 7.294 1.00 0.00 C ATOM 1297 C SER A 79 10.365 -9.630 6.181 1.00 0.00 C ATOM 1298 O SER A 79 10.253 -10.849 6.278 1.00 0.00 O ATOM 1299 CB SER A 79 8.772 -7.704 6.797 1.00 0.00 C ATOM 1300 OG SER A 79 7.600 -8.243 6.227 1.00 0.00 O ATOM 0 H SER A 79 10.670 -6.987 7.924 1.00 0.00 H new ATOM 0 HA SER A 79 9.281 -9.448 7.958 1.00 0.00 H new ATOM 0 HB2 SER A 79 8.491 -7.063 7.632 1.00 0.00 H new ATOM 0 HB3 SER A 79 9.260 -7.069 6.058 1.00 0.00 H new ATOM 0 HG SER A 79 6.897 -7.560 6.218 1.00 0.00 H new ATOM 1306 N ILE A 80 11.015 -9.064 5.154 1.00 0.00 N ATOM 1307 CA ILE A 80 11.565 -9.805 4.010 1.00 0.00 C ATOM 1308 C ILE A 80 12.504 -10.908 4.481 1.00 0.00 C ATOM 1309 O ILE A 80 12.439 -12.035 3.995 1.00 0.00 O ATOM 1310 CB ILE A 80 12.266 -8.840 3.022 1.00 0.00 C ATOM 1311 CG1 ILE A 80 11.183 -8.025 2.290 1.00 0.00 C ATOM 1312 CG2 ILE A 80 13.148 -9.570 1.982 1.00 0.00 C ATOM 1313 CD1 ILE A 80 11.781 -6.964 1.371 1.00 0.00 C ATOM 0 H ILE A 80 11.176 -8.059 5.094 1.00 0.00 H new ATOM 0 HA ILE A 80 10.742 -10.282 3.478 1.00 0.00 H new ATOM 0 HB ILE A 80 12.930 -8.198 3.600 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.557 -8.699 1.705 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.535 -7.545 3.023 1.00 0.00 H new ATOM 0 HG21 ILE A 80 13.611 -8.838 1.320 1.00 0.00 H new ATOM 0 HG22 ILE A 80 13.924 -10.136 2.497 1.00 0.00 H new ATOM 0 HG23 ILE A 80 12.531 -10.251 1.396 1.00 0.00 H new ATOM 0 HD11 ILE A 80 10.978 -6.416 0.877 1.00 0.00 H new ATOM 0 HD12 ILE A 80 12.385 -6.272 1.958 1.00 0.00 H new ATOM 0 HD13 ILE A 80 12.408 -7.445 0.620 1.00 0.00 H new ATOM 1325 N SER A 81 13.391 -10.588 5.412 1.00 0.00 N ATOM 1326 CA SER A 81 14.349 -11.527 5.947 1.00 0.00 C ATOM 1327 C SER A 81 13.594 -12.680 6.638 1.00 0.00 C ATOM 1328 O SER A 81 13.928 -13.837 6.400 1.00 0.00 O ATOM 1329 CB SER A 81 15.297 -10.709 6.829 1.00 0.00 C ATOM 1330 OG SER A 81 16.540 -11.337 7.054 1.00 0.00 O ATOM 0 H SER A 81 13.461 -9.655 5.818 1.00 0.00 H new ATOM 0 HA SER A 81 14.962 -12.028 5.197 1.00 0.00 H new ATOM 0 HB2 SER A 81 15.468 -9.739 6.362 1.00 0.00 H new ATOM 0 HB3 SER A 81 14.815 -10.520 7.788 1.00 0.00 H new ATOM 0 HG SER A 81 17.098 -10.764 7.621 1.00 0.00 H new ATOM 1336 N SER A 82 12.516 -12.397 7.384 1.00 0.00 N ATOM 1337 CA SER A 82 11.642 -13.409 7.983 1.00 0.00 C ATOM 1338 C SER A 82 10.844 -14.217 6.945 1.00 0.00 C ATOM 1339 O SER A 82 10.404 -15.329 7.238 1.00 0.00 O ATOM 1340 CB SER A 82 10.679 -12.718 8.966 1.00 0.00 C ATOM 1341 OG SER A 82 10.411 -13.517 10.101 1.00 0.00 O ATOM 0 H SER A 82 12.225 -11.441 7.590 1.00 0.00 H new ATOM 0 HA SER A 82 12.280 -14.125 8.502 1.00 0.00 H new ATOM 0 HB2 SER A 82 11.108 -11.768 9.285 1.00 0.00 H new ATOM 0 HB3 SER A 82 9.743 -12.489 8.455 1.00 0.00 H new ATOM 0 HG SER A 82 9.798 -13.041 10.699 1.00 0.00 H new ATOM 1347 N SER A 83 10.619 -13.675 5.746 1.00 0.00 N ATOM 1348 CA SER A 83 10.047 -14.420 4.639 1.00 0.00 C ATOM 1349 C SER A 83 11.075 -15.310 3.944 1.00 0.00 C ATOM 1350 O SER A 83 10.663 -16.274 3.298 1.00 0.00 O ATOM 1351 CB SER A 83 9.479 -13.468 3.590 1.00 0.00 C ATOM 1352 OG SER A 83 8.199 -12.966 3.951 1.00 0.00 O ATOM 0 H SER A 83 10.832 -12.703 5.522 1.00 0.00 H new ATOM 0 HA SER A 83 9.263 -15.045 5.067 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.167 -12.634 3.449 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.407 -13.986 2.634 1.00 0.00 H new ATOM 0 HG SER A 83 7.876 -12.360 3.252 1.00 0.00 H new ATOM 1358 N GLY A 84 12.369 -14.992 4.002 1.00 0.00 N ATOM 1359 CA GLY A 84 13.358 -15.692 3.198 1.00 0.00 C ATOM 1360 C GLY A 84 13.841 -14.903 1.985 1.00 0.00 C ATOM 1361 O GLY A 84 14.418 -15.510 1.080 1.00 0.00 O ATOM 0 H GLY A 84 12.751 -14.256 4.597 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.215 -15.935 3.826 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.933 -16.637 2.859 1.00 0.00 H new ATOM 1365 N GLY A 85 13.614 -13.588 1.901 1.00 0.00 N ATOM 1366 CA GLY A 85 14.156 -12.781 0.831 1.00 0.00 C ATOM 1367 C GLY A 85 15.421 -12.053 1.235 1.00 0.00 C ATOM 1368 O GLY A 85 16.000 -12.299 2.293 1.00 0.00 O ATOM 0 H GLY A 85 13.052 -13.067 2.574 1.00 0.00 H new ATOM 0 HA2 GLY A 85 14.366 -13.417 -0.029 1.00 0.00 H new ATOM 0 HA3 GLY A 85 13.408 -12.054 0.514 1.00 0.00 H new ATOM 1372 N PHE A 86 15.823 -11.118 0.385 1.00 0.00 N ATOM 1373 CA PHE A 86 16.857 -10.128 0.658 1.00 0.00 C ATOM 1374 C PHE A 86 16.345 -8.756 0.214 1.00 0.00 C ATOM 1375 O PHE A 86 15.399 -8.653 -0.569 1.00 0.00 O ATOM 1376 CB PHE A 86 18.167 -10.486 -0.068 1.00 0.00 C ATOM 1377 CG PHE A 86 19.253 -11.101 0.806 1.00 0.00 C ATOM 1378 CD1 PHE A 86 19.058 -12.426 1.246 1.00 0.00 C ATOM 1379 CD2 PHE A 86 20.421 -10.394 1.212 1.00 0.00 C ATOM 1380 CE1 PHE A 86 19.966 -13.033 2.126 1.00 0.00 C ATOM 1381 CE2 PHE A 86 21.281 -10.995 2.150 1.00 0.00 C ATOM 1382 CZ PHE A 86 21.069 -12.310 2.596 1.00 0.00 C ATOM 0 H PHE A 86 15.423 -11.024 -0.549 1.00 0.00 H new ATOM 0 HA PHE A 86 17.075 -10.111 1.726 1.00 0.00 H new ATOM 0 HB2 PHE A 86 17.937 -11.182 -0.875 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.565 -9.582 -0.530 1.00 0.00 H new ATOM 0 HD1 PHE A 86 18.198 -12.981 0.901 1.00 0.00 H new ATOM 0 HD2 PHE A 86 20.642 -9.417 0.808 1.00 0.00 H new ATOM 0 HE1 PHE A 86 19.815 -14.055 2.440 1.00 0.00 H new ATOM 0 HE2 PHE A 86 22.120 -10.434 2.534 1.00 0.00 H new ATOM 0 HZ PHE A 86 21.754 -12.761 3.298 1.00 0.00 H new ATOM 1392 N PHE A 87 16.974 -7.688 0.689 1.00 0.00 N ATOM 1393 CA PHE A 87 16.656 -6.317 0.319 1.00 0.00 C ATOM 1394 C PHE A 87 17.946 -5.499 0.362 1.00 0.00 C ATOM 1395 O PHE A 87 18.851 -5.803 1.143 1.00 0.00 O ATOM 1396 CB PHE A 87 15.538 -5.822 1.255 1.00 0.00 C ATOM 1397 CG PHE A 87 15.292 -4.329 1.391 1.00 0.00 C ATOM 1398 CD1 PHE A 87 15.316 -3.466 0.279 1.00 0.00 C ATOM 1399 CD2 PHE A 87 15.001 -3.804 2.665 1.00 0.00 C ATOM 1400 CE1 PHE A 87 15.123 -2.087 0.456 1.00 0.00 C ATOM 1401 CE2 PHE A 87 14.780 -2.427 2.840 1.00 0.00 C ATOM 1402 CZ PHE A 87 14.851 -1.566 1.732 1.00 0.00 C ATOM 0 H PHE A 87 17.739 -7.755 1.360 1.00 0.00 H new ATOM 0 HA PHE A 87 16.272 -6.220 -0.696 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.606 -6.279 0.923 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.747 -6.212 2.251 1.00 0.00 H new ATOM 0 HD1 PHE A 87 15.483 -3.865 -0.711 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.947 -4.466 3.516 1.00 0.00 H new ATOM 0 HE1 PHE A 87 15.184 -1.423 -0.393 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.557 -2.033 3.821 1.00 0.00 H new ATOM 0 HZ PHE A 87 14.697 -0.505 1.861 1.00 0.00 H new ATOM 1412 N ALA A 88 18.073 -4.500 -0.512 1.00 0.00 N ATOM 1413 CA ALA A 88 19.212 -3.597 -0.591 1.00 0.00 C ATOM 1414 C ALA A 88 18.789 -2.241 -1.156 1.00 0.00 C ATOM 1415 O ALA A 88 17.644 -2.093 -1.580 1.00 0.00 O ATOM 1416 CB ALA A 88 20.283 -4.215 -1.473 1.00 0.00 C ATOM 0 H ALA A 88 17.357 -4.293 -1.208 1.00 0.00 H new ATOM 0 HA ALA A 88 19.608 -3.440 0.412 1.00 0.00 H new ATOM 0 HB1 ALA A 88 21.137 -3.541 -1.534 1.00 0.00 H new ATOM 0 HB2 ALA A 88 20.601 -5.166 -1.047 1.00 0.00 H new ATOM 0 HB3 ALA A 88 19.880 -4.382 -2.472 1.00 0.00 H new ATOM 1422 N LEU A 89 19.677 -1.245 -1.158 1.00 0.00 N ATOM 1423 CA LEU A 89 19.364 0.100 -1.638 1.00 0.00 C ATOM 1424 C LEU A 89 20.220 0.426 -2.864 1.00 0.00 C ATOM 1425 O LEU A 89 21.100 -0.364 -3.219 1.00 0.00 O ATOM 1426 CB LEU A 89 19.484 1.180 -0.546 1.00 0.00 C ATOM 1427 CG LEU A 89 19.378 0.752 0.934 1.00 0.00 C ATOM 1428 CD1 LEU A 89 19.341 2.015 1.793 1.00 0.00 C ATOM 1429 CD2 LEU A 89 18.161 -0.093 1.331 1.00 0.00 C ATOM 0 H LEU A 89 20.636 -1.350 -0.826 1.00 0.00 H new ATOM 0 HA LEU A 89 18.314 0.107 -1.929 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.444 1.679 -0.678 1.00 0.00 H new ATOM 0 HB3 LEU A 89 18.710 1.925 -0.731 1.00 0.00 H new ATOM 0 HG LEU A 89 20.246 0.112 1.093 1.00 0.00 H new ATOM 0 HD11 LEU A 89 19.266 1.738 2.844 1.00 0.00 H new ATOM 0 HD12 LEU A 89 20.253 2.590 1.633 1.00 0.00 H new ATOM 0 HD13 LEU A 89 18.477 2.619 1.515 1.00 0.00 H new ATOM 0 HD21 LEU A 89 18.210 -0.324 2.395 1.00 0.00 H new ATOM 0 HD22 LEU A 89 17.248 0.464 1.122 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.159 -1.020 0.758 1.00 0.00 H new ATOM 1441 N VAL A 90 19.932 1.551 -3.531 1.00 0.00 N ATOM 1442 CA VAL A 90 20.465 1.901 -4.836 1.00 0.00 C ATOM 1443 C VAL A 90 20.645 3.422 -4.934 1.00 0.00 C ATOM 1444 O VAL A 90 19.791 4.176 -4.463 1.00 0.00 O ATOM 1445 CB VAL A 90 19.459 1.394 -5.895 1.00 0.00 C ATOM 1446 CG1 VAL A 90 19.880 1.762 -7.317 1.00 0.00 C ATOM 1447 CG2 VAL A 90 19.129 -0.097 -5.810 1.00 0.00 C ATOM 0 H VAL A 90 19.300 2.260 -3.157 1.00 0.00 H new ATOM 0 HA VAL A 90 21.441 1.443 -4.998 1.00 0.00 H new ATOM 0 HB VAL A 90 18.537 1.921 -5.648 1.00 0.00 H new ATOM 0 HG11 VAL A 90 19.142 1.384 -8.024 1.00 0.00 H new ATOM 0 HG12 VAL A 90 19.947 2.846 -7.407 1.00 0.00 H new ATOM 0 HG13 VAL A 90 20.852 1.319 -7.535 1.00 0.00 H new ATOM 0 HG21 VAL A 90 18.416 -0.357 -6.593 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.041 -0.680 -5.941 1.00 0.00 H new ATOM 0 HG23 VAL A 90 18.694 -0.318 -4.835 1.00 0.00 H new ATOM 1457 N SER A 91 21.707 3.846 -5.626 1.00 0.00 N ATOM 1458 CA SER A 91 22.126 5.230 -5.872 1.00 0.00 C ATOM 1459 C SER A 91 22.051 6.143 -4.619 1.00 0.00 C ATOM 1460 O SER A 91 21.320 7.137 -4.597 1.00 0.00 O ATOM 1461 CB SER A 91 21.443 5.798 -7.131 1.00 0.00 C ATOM 1462 OG SER A 91 20.264 5.153 -7.583 1.00 0.00 O ATOM 0 H SER A 91 22.345 3.180 -6.062 1.00 0.00 H new ATOM 0 HA SER A 91 23.194 5.212 -6.089 1.00 0.00 H new ATOM 0 HB2 SER A 91 21.202 6.844 -6.940 1.00 0.00 H new ATOM 0 HB3 SER A 91 22.169 5.781 -7.944 1.00 0.00 H new ATOM 0 HG SER A 91 19.616 5.826 -7.880 1.00 0.00 H new ATOM 1468 N PRO A 92 22.787 5.816 -3.543 1.00 0.00 N ATOM 1469 CA PRO A 92 22.674 6.454 -2.243 1.00 0.00 C ATOM 1470 C PRO A 92 23.525 7.730 -2.205 1.00 0.00 C ATOM 1471 O PRO A 92 24.718 7.682 -1.903 1.00 0.00 O ATOM 1472 CB PRO A 92 23.137 5.370 -1.263 1.00 0.00 C ATOM 1473 CG PRO A 92 24.251 4.665 -2.040 1.00 0.00 C ATOM 1474 CD PRO A 92 23.787 4.766 -3.485 1.00 0.00 C ATOM 0 HA PRO A 92 21.668 6.793 -1.994 1.00 0.00 H new ATOM 0 HB2 PRO A 92 23.503 5.798 -0.330 1.00 0.00 H new ATOM 0 HB3 PRO A 92 22.329 4.686 -1.005 1.00 0.00 H new ATOM 0 HG2 PRO A 92 25.215 5.152 -1.892 1.00 0.00 H new ATOM 0 HG3 PRO A 92 24.366 3.628 -1.726 1.00 0.00 H new ATOM 0 HD2 PRO A 92 24.625 4.996 -4.143 1.00 0.00 H new ATOM 0 HD3 PRO A 92 23.369 3.817 -3.822 1.00 0.00 H new ATOM 1482 N ASN A 93 22.925 8.880 -2.529 1.00 0.00 N ATOM 1483 CA ASN A 93 23.657 10.151 -2.474 1.00 0.00 C ATOM 1484 C ASN A 93 24.102 10.444 -1.042 1.00 0.00 C ATOM 1485 O ASN A 93 23.487 9.983 -0.079 1.00 0.00 O ATOM 1486 CB ASN A 93 22.883 11.369 -3.011 1.00 0.00 C ATOM 1487 CG ASN A 93 21.652 11.048 -3.815 1.00 0.00 C ATOM 1488 OD1 ASN A 93 21.674 10.898 -5.033 1.00 0.00 O ATOM 1489 ND2 ASN A 93 20.543 10.967 -3.116 1.00 0.00 N ATOM 0 H ASN A 93 21.953 8.959 -2.827 1.00 0.00 H new ATOM 0 HA ASN A 93 24.511 10.011 -3.137 1.00 0.00 H new ATOM 0 HB2 ASN A 93 22.592 11.994 -2.167 1.00 0.00 H new ATOM 0 HB3 ASN A 93 23.556 11.962 -3.630 1.00 0.00 H new ATOM 0 HD21 ASN A 93 19.658 10.773 -3.584 1.00 0.00 H new ATOM 0 HD22 ASN A 93 20.567 11.098 -2.105 1.00 0.00 H new ATOM 1496 N GLU A 94 25.096 11.320 -0.896 1.00 0.00 N ATOM 1497 CA GLU A 94 25.825 11.521 0.355 1.00 0.00 C ATOM 1498 C GLU A 94 24.901 12.055 1.454 1.00 0.00 C ATOM 1499 O GLU A 94 25.018 11.665 2.613 1.00 0.00 O ATOM 1500 CB GLU A 94 27.031 12.449 0.117 1.00 0.00 C ATOM 1501 CG GLU A 94 27.759 12.730 1.440 1.00 0.00 C ATOM 1502 CD GLU A 94 29.079 13.488 1.291 1.00 0.00 C ATOM 1503 OE1 GLU A 94 29.041 14.681 0.913 1.00 0.00 O ATOM 1504 OE2 GLU A 94 30.130 12.919 1.684 1.00 0.00 O ATOM 0 H GLU A 94 25.422 11.918 -1.655 1.00 0.00 H new ATOM 0 HA GLU A 94 26.202 10.559 0.701 1.00 0.00 H new ATOM 0 HB2 GLU A 94 27.718 11.988 -0.593 1.00 0.00 H new ATOM 0 HB3 GLU A 94 26.695 13.386 -0.327 1.00 0.00 H new ATOM 0 HG2 GLU A 94 27.097 13.303 2.089 1.00 0.00 H new ATOM 0 HG3 GLU A 94 27.954 11.782 1.941 1.00 0.00 H new ATOM 1511 N LYS A 95 23.922 12.894 1.106 1.00 0.00 N ATOM 1512 CA LYS A 95 22.959 13.458 2.045 1.00 0.00 C ATOM 1513 C LYS A 95 22.196 12.335 2.721 1.00 0.00 C ATOM 1514 O LYS A 95 21.806 12.460 3.876 1.00 0.00 O ATOM 1515 CB LYS A 95 22.050 14.427 1.265 1.00 0.00 C ATOM 1516 CG LYS A 95 21.346 15.526 2.082 1.00 0.00 C ATOM 1517 CD LYS A 95 19.994 15.160 2.717 1.00 0.00 C ATOM 1518 CE LYS A 95 20.102 14.649 4.158 1.00 0.00 C ATOM 1519 NZ LYS A 95 19.044 15.201 5.018 1.00 0.00 N ATOM 0 H LYS A 95 23.777 13.204 0.145 1.00 0.00 H new ATOM 0 HA LYS A 95 23.448 14.021 2.840 1.00 0.00 H new ATOM 0 HB2 LYS A 95 22.650 14.909 0.493 1.00 0.00 H new ATOM 0 HB3 LYS A 95 21.286 13.840 0.755 1.00 0.00 H new ATOM 0 HG2 LYS A 95 22.020 15.842 2.878 1.00 0.00 H new ATOM 0 HG3 LYS A 95 21.194 16.388 1.432 1.00 0.00 H new ATOM 0 HD2 LYS A 95 19.347 16.037 2.701 1.00 0.00 H new ATOM 0 HD3 LYS A 95 19.512 14.397 2.106 1.00 0.00 H new ATOM 0 HE2 LYS A 95 20.042 13.561 4.162 1.00 0.00 H new ATOM 0 HE3 LYS A 95 21.077 14.916 4.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 19.274 15.014 6.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 18.973 16.227 4.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 18.136 14.752 4.782 1.00 0.00 H new ATOM 1533 N VAL A 96 22.018 11.219 2.030 1.00 0.00 N ATOM 1534 CA VAL A 96 21.351 10.068 2.571 1.00 0.00 C ATOM 1535 C VAL A 96 22.371 9.109 3.201 1.00 0.00 C ATOM 1536 O VAL A 96 22.093 8.606 4.284 1.00 0.00 O ATOM 1537 CB VAL A 96 20.415 9.506 1.471 1.00 0.00 C ATOM 1538 CG1 VAL A 96 20.531 8.012 1.191 1.00 0.00 C ATOM 1539 CG2 VAL A 96 18.954 9.830 1.812 1.00 0.00 C ATOM 0 H VAL A 96 22.339 11.096 1.070 1.00 0.00 H new ATOM 0 HA VAL A 96 20.698 10.299 3.412 1.00 0.00 H new ATOM 0 HB VAL A 96 20.747 10.002 0.558 1.00 0.00 H new ATOM 0 HG11 VAL A 96 19.829 7.734 0.405 1.00 0.00 H new ATOM 0 HG12 VAL A 96 21.547 7.780 0.870 1.00 0.00 H new ATOM 0 HG13 VAL A 96 20.300 7.453 2.098 1.00 0.00 H new ATOM 0 HG21 VAL A 96 18.302 9.432 1.034 1.00 0.00 H new ATOM 0 HG22 VAL A 96 18.695 9.378 2.769 1.00 0.00 H new ATOM 0 HG23 VAL A 96 18.826 10.911 1.875 1.00 0.00 H new ATOM 1549 N GLU A 97 23.577 8.906 2.658 1.00 0.00 N ATOM 1550 CA GLU A 97 24.581 8.059 3.319 1.00 0.00 C ATOM 1551 C GLU A 97 24.907 8.629 4.707 1.00 0.00 C ATOM 1552 O GLU A 97 25.107 7.877 5.664 1.00 0.00 O ATOM 1553 CB GLU A 97 25.864 7.950 2.481 1.00 0.00 C ATOM 1554 CG GLU A 97 25.716 7.085 1.218 1.00 0.00 C ATOM 1555 CD GLU A 97 26.379 5.695 1.301 1.00 0.00 C ATOM 1556 OE1 GLU A 97 26.369 5.045 2.373 1.00 0.00 O ATOM 1557 OE2 GLU A 97 26.977 5.283 0.272 1.00 0.00 O ATOM 0 H GLU A 97 23.881 9.311 1.773 1.00 0.00 H new ATOM 0 HA GLU A 97 24.164 7.057 3.423 1.00 0.00 H new ATOM 0 HB2 GLU A 97 26.180 8.951 2.188 1.00 0.00 H new ATOM 0 HB3 GLU A 97 26.657 7.534 3.102 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.655 6.953 1.008 1.00 0.00 H new ATOM 0 HG3 GLU A 97 26.143 7.625 0.373 1.00 0.00 H new ATOM 1564 N ARG A 98 24.873 9.960 4.864 1.00 0.00 N ATOM 1565 CA ARG A 98 25.186 10.600 6.133 1.00 0.00 C ATOM 1566 C ARG A 98 24.162 10.284 7.211 1.00 0.00 C ATOM 1567 O ARG A 98 24.484 10.356 8.388 1.00 0.00 O ATOM 1568 CB ARG A 98 25.378 12.107 5.928 1.00 0.00 C ATOM 1569 CG ARG A 98 24.087 12.919 6.022 1.00 0.00 C ATOM 1570 CD ARG A 98 23.795 13.384 7.456 1.00 0.00 C ATOM 1571 NE ARG A 98 23.866 14.855 7.515 1.00 0.00 N ATOM 1572 CZ ARG A 98 23.222 15.713 8.312 1.00 0.00 C ATOM 1573 NH1 ARG A 98 22.521 15.297 9.361 1.00 0.00 N ATOM 1574 NH2 ARG A 98 23.280 17.004 8.014 1.00 0.00 N ATOM 0 H ARG A 98 24.629 10.611 4.118 1.00 0.00 H new ATOM 0 HA ARG A 98 26.126 10.187 6.498 1.00 0.00 H new ATOM 0 HB2 ARG A 98 26.082 12.477 6.673 1.00 0.00 H new ATOM 0 HB3 ARG A 98 25.830 12.275 4.950 1.00 0.00 H new ATOM 0 HG2 ARG A 98 24.158 13.788 5.368 1.00 0.00 H new ATOM 0 HG3 ARG A 98 23.254 12.316 5.661 1.00 0.00 H new ATOM 0 HD2 ARG A 98 22.807 13.043 7.767 1.00 0.00 H new ATOM 0 HD3 ARG A 98 24.515 12.946 8.147 1.00 0.00 H new ATOM 0 HE ARG A 98 24.504 15.284 6.845 1.00 0.00 H new ATOM 0 HH11 ARG A 98 22.465 14.301 9.574 1.00 0.00 H new ATOM 0 HH12 ARG A 98 22.039 15.973 9.953 1.00 0.00 H new ATOM 0 HH21 ARG A 98 23.805 17.316 7.197 1.00 0.00 H new ATOM 0 HH22 ARG A 98 22.800 17.685 8.602 1.00 0.00 H new ATOM 1588 N VAL A 99 22.914 9.997 6.850 1.00 0.00 N ATOM 1589 CA VAL A 99 21.872 9.713 7.819 1.00 0.00 C ATOM 1590 C VAL A 99 21.779 8.206 7.985 1.00 0.00 C ATOM 1591 O VAL A 99 21.704 7.731 9.117 1.00 0.00 O ATOM 1592 CB VAL A 99 20.570 10.442 7.417 1.00 0.00 C ATOM 1593 CG1 VAL A 99 19.835 9.952 6.187 1.00 0.00 C ATOM 1594 CG2 VAL A 99 19.566 10.458 8.573 1.00 0.00 C ATOM 0 H VAL A 99 22.602 9.956 5.880 1.00 0.00 H new ATOM 0 HA VAL A 99 22.097 10.106 8.810 1.00 0.00 H new ATOM 0 HB VAL A 99 20.947 11.432 7.161 1.00 0.00 H new ATOM 0 HG11 VAL A 99 18.943 10.558 6.031 1.00 0.00 H new ATOM 0 HG12 VAL A 99 20.487 10.034 5.317 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.546 8.910 6.327 1.00 0.00 H new ATOM 0 HG21 VAL A 99 18.660 10.977 8.261 1.00 0.00 H new ATOM 0 HG22 VAL A 99 19.319 9.434 8.854 1.00 0.00 H new ATOM 0 HG23 VAL A 99 20.004 10.974 9.428 1.00 0.00 H new ATOM 1604 N LEU A 100 21.903 7.459 6.883 1.00 0.00 N ATOM 1605 CA LEU A 100 21.893 6.008 6.828 1.00 0.00 C ATOM 1606 C LEU A 100 23.017 5.395 7.670 1.00 0.00 C ATOM 1607 O LEU A 100 22.917 4.208 7.985 1.00 0.00 O ATOM 1608 CB LEU A 100 22.049 5.518 5.372 1.00 0.00 C ATOM 1609 CG LEU A 100 20.905 5.723 4.344 1.00 0.00 C ATOM 1610 CD1 LEU A 100 20.392 4.405 3.773 1.00 0.00 C ATOM 1611 CD2 LEU A 100 19.670 6.514 4.800 1.00 0.00 C ATOM 0 H LEU A 100 22.019 7.880 5.961 1.00 0.00 H new ATOM 0 HA LEU A 100 20.934 5.687 7.233 1.00 0.00 H new ATOM 0 HB2 LEU A 100 22.938 6.000 4.964 1.00 0.00 H new ATOM 0 HB3 LEU A 100 22.256 4.449 5.413 1.00 0.00 H new ATOM 0 HG LEU A 100 21.417 6.334 3.601 1.00 0.00 H new ATOM 0 HD11 LEU A 100 19.593 4.604 3.059 1.00 0.00 H new ATOM 0 HD12 LEU A 100 21.207 3.885 3.269 1.00 0.00 H new ATOM 0 HD13 LEU A 100 20.009 3.783 4.582 1.00 0.00 H new ATOM 0 HD21 LEU A 100 18.955 6.577 3.980 1.00 0.00 H new ATOM 0 HD22 LEU A 100 19.206 6.008 5.647 1.00 0.00 H new ATOM 0 HD23 LEU A 100 19.971 7.519 5.097 1.00 0.00 H new ATOM 1623 N SER A 101 24.044 6.146 8.090 1.00 0.00 N ATOM 1624 CA SER A 101 25.099 5.563 8.906 1.00 0.00 C ATOM 1625 C SER A 101 24.711 5.811 10.364 1.00 0.00 C ATOM 1626 O SER A 101 24.530 4.892 11.166 1.00 0.00 O ATOM 1627 CB SER A 101 26.435 6.178 8.477 1.00 0.00 C ATOM 1628 OG SER A 101 27.491 5.348 8.894 1.00 0.00 O ATOM 0 H SER A 101 24.160 7.137 7.880 1.00 0.00 H new ATOM 0 HA SER A 101 25.218 4.487 8.780 1.00 0.00 H new ATOM 0 HB2 SER A 101 26.460 6.299 7.394 1.00 0.00 H new ATOM 0 HB3 SER A 101 26.546 7.171 8.912 1.00 0.00 H new ATOM 0 HG SER A 101 28.345 5.741 8.618 1.00 0.00 H new ATOM 1634 N LEU A 102 24.439 7.082 10.653 1.00 0.00 N ATOM 1635 CA LEU A 102 24.094 7.661 11.936 1.00 0.00 C ATOM 1636 C LEU A 102 22.915 6.945 12.581 1.00 0.00 C ATOM 1637 O LEU A 102 22.936 6.692 13.785 1.00 0.00 O ATOM 1638 CB LEU A 102 23.736 9.144 11.710 1.00 0.00 C ATOM 1639 CG LEU A 102 24.841 10.198 11.625 1.00 0.00 C ATOM 1640 CD1 LEU A 102 25.251 10.641 13.023 1.00 0.00 C ATOM 1641 CD2 LEU A 102 26.055 9.625 10.954 1.00 0.00 C ATOM 0 H LEU A 102 24.458 7.793 9.922 1.00 0.00 H new ATOM 0 HA LEU A 102 24.945 7.559 12.610 1.00 0.00 H new ATOM 0 HB2 LEU A 102 23.163 9.201 10.784 1.00 0.00 H new ATOM 0 HB3 LEU A 102 23.067 9.442 12.517 1.00 0.00 H new ATOM 0 HG LEU A 102 24.456 11.043 11.055 1.00 0.00 H new ATOM 0 HD11 LEU A 102 26.038 11.391 12.951 1.00 0.00 H new ATOM 0 HD12 LEU A 102 24.389 11.067 13.537 1.00 0.00 H new ATOM 0 HD13 LEU A 102 25.619 9.782 13.584 1.00 0.00 H new ATOM 0 HD21 LEU A 102 26.834 10.386 10.900 1.00 0.00 H new ATOM 0 HD22 LEU A 102 26.419 8.773 11.527 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.795 9.300 9.947 1.00 0.00 H new ATOM 1653 N THR A 103 21.866 6.659 11.812 1.00 0.00 N ATOM 1654 CA THR A 103 20.670 6.008 12.328 1.00 0.00 C ATOM 1655 C THR A 103 20.876 4.497 12.469 1.00 0.00 C ATOM 1656 O THR A 103 20.143 3.867 13.228 1.00 0.00 O ATOM 1657 CB THR A 103 19.490 6.390 11.420 1.00 0.00 C ATOM 1658 OG1 THR A 103 18.254 6.043 11.999 1.00 0.00 O ATOM 1659 CG2 THR A 103 19.575 5.876 9.976 1.00 0.00 C ATOM 0 H THR A 103 21.824 6.873 10.816 1.00 0.00 H new ATOM 0 HA THR A 103 20.447 6.353 13.338 1.00 0.00 H new ATOM 0 HB THR A 103 19.561 7.475 11.340 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.657 5.689 11.307 1.00 0.00 H new ATOM 0 HG21 THR A 103 18.694 6.201 9.422 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.471 6.275 9.500 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.620 4.787 9.980 1.00 0.00 H new ATOM 1667 N ASN A 104 21.899 3.943 11.805 1.00 0.00 N ATOM 1668 CA ASN A 104 22.041 2.545 11.416 1.00 0.00 C ATOM 1669 C ASN A 104 20.928 2.208 10.434 1.00 0.00 C ATOM 1670 O ASN A 104 19.804 1.895 10.824 1.00 0.00 O ATOM 1671 CB ASN A 104 22.090 1.557 12.593 1.00 0.00 C ATOM 1672 CG ASN A 104 23.341 1.621 13.454 1.00 0.00 C ATOM 1673 OD1 ASN A 104 24.132 2.681 13.411 1.00 0.00 O flip ATOM 1674 ND2 ASN A 104 23.620 0.676 14.185 1.00 0.00 N flip ATOM 0 H ASN A 104 22.699 4.502 11.509 1.00 0.00 H new ATOM 0 HA ASN A 104 23.016 2.429 10.942 1.00 0.00 H new ATOM 0 HB2 ASN A 104 21.223 1.735 13.230 1.00 0.00 H new ATOM 0 HB3 ASN A 104 21.994 0.545 12.199 1.00 0.00 H new ATOM 0 HD21 ASN A 104 23.010 -0.141 14.218 1.00 0.00 H new ATOM 0 HD22 ASN A 104 24.462 0.707 14.760 1.00 0.00 H new ATOM 1681 N LEU A 105 21.249 2.325 9.148 1.00 0.00 N ATOM 1682 CA LEU A 105 20.434 1.881 8.032 1.00 0.00 C ATOM 1683 C LEU A 105 21.291 1.002 7.123 1.00 0.00 C ATOM 1684 O LEU A 105 20.970 -0.168 6.965 1.00 0.00 O ATOM 1685 CB LEU A 105 19.849 3.099 7.295 1.00 0.00 C ATOM 1686 CG LEU A 105 18.473 2.877 6.651 1.00 0.00 C ATOM 1687 CD1 LEU A 105 18.425 1.612 5.793 1.00 0.00 C ATOM 1688 CD2 LEU A 105 17.400 2.863 7.733 1.00 0.00 C ATOM 0 H LEU A 105 22.125 2.752 8.847 1.00 0.00 H new ATOM 0 HA LEU A 105 19.589 1.287 8.379 1.00 0.00 H new ATOM 0 HB2 LEU A 105 19.773 3.927 8.000 1.00 0.00 H new ATOM 0 HB3 LEU A 105 20.550 3.405 6.519 1.00 0.00 H new ATOM 0 HG LEU A 105 18.280 3.706 5.970 1.00 0.00 H new ATOM 0 HD11 LEU A 105 17.430 1.503 5.361 1.00 0.00 H new ATOM 0 HD12 LEU A 105 19.161 1.687 4.993 1.00 0.00 H new ATOM 0 HD13 LEU A 105 18.649 0.744 6.412 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.424 2.705 7.275 1.00 0.00 H new ATOM 0 HD22 LEU A 105 17.605 2.057 8.438 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.403 3.817 8.261 1.00 0.00 H new ATOM 1700 N ASP A 106 22.423 1.505 6.614 1.00 0.00 N ATOM 1701 CA ASP A 106 23.411 0.687 5.880 1.00 0.00 C ATOM 1702 C ASP A 106 23.908 -0.482 6.740 1.00 0.00 C ATOM 1703 O ASP A 106 24.162 -1.586 6.268 1.00 0.00 O ATOM 1704 CB ASP A 106 24.610 1.554 5.465 1.00 0.00 C ATOM 1705 CG ASP A 106 25.867 0.712 5.206 1.00 0.00 C ATOM 1706 OD1 ASP A 106 25.919 -0.070 4.228 1.00 0.00 O ATOM 1707 OD2 ASP A 106 26.783 0.793 6.060 1.00 0.00 O ATOM 0 H ASP A 106 22.684 2.488 6.696 1.00 0.00 H new ATOM 0 HA ASP A 106 22.920 0.286 4.993 1.00 0.00 H new ATOM 0 HB2 ASP A 106 24.358 2.115 4.565 1.00 0.00 H new ATOM 0 HB3 ASP A 106 24.818 2.284 6.247 1.00 0.00 H new ATOM 1712 N ARG A 107 23.983 -0.275 8.053 1.00 0.00 N ATOM 1713 CA ARG A 107 24.414 -1.308 8.996 1.00 0.00 C ATOM 1714 C ARG A 107 23.364 -2.408 9.157 1.00 0.00 C ATOM 1715 O ARG A 107 23.578 -3.360 9.905 1.00 0.00 O ATOM 1716 CB ARG A 107 24.809 -0.663 10.333 1.00 0.00 C ATOM 1717 CG ARG A 107 25.857 0.435 10.083 1.00 0.00 C ATOM 1718 CD ARG A 107 26.580 0.910 11.340 1.00 0.00 C ATOM 1719 NE ARG A 107 27.723 1.748 10.950 1.00 0.00 N ATOM 1720 CZ ARG A 107 28.323 2.699 11.668 1.00 0.00 C ATOM 1721 NH1 ARG A 107 27.897 2.983 12.894 1.00 0.00 N ATOM 1722 NH2 ARG A 107 29.357 3.353 11.151 1.00 0.00 N ATOM 0 H ARG A 107 23.747 0.614 8.495 1.00 0.00 H new ATOM 0 HA ARG A 107 25.297 -1.803 8.592 1.00 0.00 H new ATOM 0 HB2 ARG A 107 23.930 -0.238 10.818 1.00 0.00 H new ATOM 0 HB3 ARG A 107 25.212 -1.418 11.008 1.00 0.00 H new ATOM 0 HG2 ARG A 107 26.595 0.062 9.373 1.00 0.00 H new ATOM 0 HG3 ARG A 107 25.367 1.289 9.615 1.00 0.00 H new ATOM 0 HD2 ARG A 107 25.898 1.476 11.975 1.00 0.00 H new ATOM 0 HD3 ARG A 107 26.922 0.055 11.923 1.00 0.00 H new ATOM 0 HE ARG A 107 28.103 1.582 10.018 1.00 0.00 H new ATOM 0 HH11 ARG A 107 27.108 2.473 13.291 1.00 0.00 H new ATOM 0 HH12 ARG A 107 28.359 3.711 13.439 1.00 0.00 H new ATOM 0 HH21 ARG A 107 29.686 3.127 10.212 1.00 0.00 H new ATOM 0 HH22 ARG A 107 29.822 4.082 11.693 1.00 0.00 H new ATOM 1736 N ILE A 108 22.221 -2.287 8.482 1.00 0.00 N ATOM 1737 CA ILE A 108 21.082 -3.177 8.575 1.00 0.00 C ATOM 1738 C ILE A 108 20.774 -3.726 7.183 1.00 0.00 C ATOM 1739 O ILE A 108 20.495 -4.918 7.075 1.00 0.00 O ATOM 1740 CB ILE A 108 19.889 -2.458 9.250 1.00 0.00 C ATOM 1741 CG1 ILE A 108 20.358 -1.785 10.564 1.00 0.00 C ATOM 1742 CG2 ILE A 108 18.769 -3.477 9.501 1.00 0.00 C ATOM 1743 CD1 ILE A 108 19.255 -1.242 11.471 1.00 0.00 C ATOM 0 H ILE A 108 22.065 -1.524 7.824 1.00 0.00 H new ATOM 0 HA ILE A 108 21.303 -4.031 9.215 1.00 0.00 H new ATOM 0 HB ILE A 108 19.501 -1.674 8.600 1.00 0.00 H new ATOM 0 HG12 ILE A 108 20.943 -2.509 11.131 1.00 0.00 H new ATOM 0 HG13 ILE A 108 21.028 -0.964 10.309 1.00 0.00 H new ATOM 0 HG21 ILE A 108 17.924 -2.979 9.977 1.00 0.00 H new ATOM 0 HG22 ILE A 108 18.449 -3.907 8.552 1.00 0.00 H new ATOM 0 HG23 ILE A 108 19.137 -4.269 10.153 1.00 0.00 H new ATOM 0 HD11 ILE A 108 19.702 -0.794 12.359 1.00 0.00 H new ATOM 0 HD12 ILE A 108 18.681 -0.487 10.934 1.00 0.00 H new ATOM 0 HD13 ILE A 108 18.595 -2.057 11.768 1.00 0.00 H new ATOM 1755 N VAL A 109 20.881 -2.915 6.126 1.00 0.00 N ATOM 1756 CA VAL A 109 20.529 -3.276 4.763 1.00 0.00 C ATOM 1757 C VAL A 109 21.733 -3.009 3.856 1.00 0.00 C ATOM 1758 O VAL A 109 22.454 -2.034 4.046 1.00 0.00 O ATOM 1759 CB VAL A 109 19.315 -2.453 4.285 1.00 0.00 C ATOM 1760 CG1 VAL A 109 18.541 -3.257 3.242 1.00 0.00 C ATOM 1761 CG2 VAL A 109 18.306 -2.057 5.380 1.00 0.00 C ATOM 0 H VAL A 109 21.227 -1.959 6.206 1.00 0.00 H new ATOM 0 HA VAL A 109 20.262 -4.332 4.724 1.00 0.00 H new ATOM 0 HB VAL A 109 19.746 -1.530 3.897 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.682 -2.679 2.901 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.191 -3.475 2.395 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.197 -4.192 3.685 1.00 0.00 H new ATOM 0 HG21 VAL A 109 17.494 -1.482 4.935 1.00 0.00 H new ATOM 0 HG22 VAL A 109 17.902 -2.956 5.845 1.00 0.00 H new ATOM 0 HG23 VAL A 109 18.808 -1.452 6.135 1.00 0.00 H new ATOM 1771 N LYS A 110 21.932 -3.848 2.842 1.00 0.00 N ATOM 1772 CA LYS A 110 22.986 -3.675 1.844 1.00 0.00 C ATOM 1773 C LYS A 110 22.726 -2.457 0.970 1.00 0.00 C ATOM 1774 O LYS A 110 21.578 -2.035 0.822 1.00 0.00 O ATOM 1775 CB LYS A 110 23.053 -4.948 1.014 1.00 0.00 C ATOM 1776 CG LYS A 110 23.838 -6.018 1.792 1.00 0.00 C ATOM 1777 CD LYS A 110 25.138 -6.396 1.107 1.00 0.00 C ATOM 1778 CE LYS A 110 26.272 -5.346 1.124 1.00 0.00 C ATOM 1779 NZ LYS A 110 26.682 -4.810 2.442 1.00 0.00 N ATOM 0 H LYS A 110 21.359 -4.678 2.688 1.00 0.00 H new ATOM 0 HA LYS A 110 23.942 -3.501 2.337 1.00 0.00 H new ATOM 0 HB2 LYS A 110 22.047 -5.306 0.794 1.00 0.00 H new ATOM 0 HB3 LYS A 110 23.537 -4.748 0.058 1.00 0.00 H new ATOM 0 HG2 LYS A 110 24.053 -5.649 2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 110 23.219 -6.908 1.906 1.00 0.00 H new ATOM 0 HD2 LYS A 110 25.513 -7.307 1.572 1.00 0.00 H new ATOM 0 HD3 LYS A 110 24.915 -6.637 0.068 1.00 0.00 H new ATOM 0 HE2 LYS A 110 27.149 -5.789 0.653 1.00 0.00 H new ATOM 0 HE3 LYS A 110 25.964 -4.507 0.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 27.447 -4.118 2.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 25.869 -4.346 2.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 27.017 -5.589 3.044 1.00 0.00 H new ATOM 1793 N ILE A 111 23.773 -1.964 0.318 1.00 0.00 N ATOM 1794 CA ILE A 111 23.739 -0.732 -0.453 1.00 0.00 C ATOM 1795 C ILE A 111 24.533 -0.943 -1.749 1.00 0.00 C ATOM 1796 O ILE A 111 25.551 -1.638 -1.735 1.00 0.00 O ATOM 1797 CB ILE A 111 24.252 0.407 0.483 1.00 0.00 C ATOM 1798 CG1 ILE A 111 23.290 1.605 0.552 1.00 0.00 C ATOM 1799 CG2 ILE A 111 25.653 0.938 0.159 1.00 0.00 C ATOM 1800 CD1 ILE A 111 23.104 2.127 1.971 1.00 0.00 C ATOM 0 H ILE A 111 24.685 -2.420 0.312 1.00 0.00 H new ATOM 0 HA ILE A 111 22.741 -0.439 -0.780 1.00 0.00 H new ATOM 0 HB ILE A 111 24.303 -0.093 1.450 1.00 0.00 H new ATOM 0 HG12 ILE A 111 23.670 2.408 -0.080 1.00 0.00 H new ATOM 0 HG13 ILE A 111 22.321 1.312 0.147 1.00 0.00 H new ATOM 0 HG21 ILE A 111 25.916 1.725 0.866 1.00 0.00 H new ATOM 0 HG22 ILE A 111 26.376 0.126 0.234 1.00 0.00 H new ATOM 0 HG23 ILE A 111 25.664 1.341 -0.854 1.00 0.00 H new ATOM 0 HD11 ILE A 111 22.416 2.972 1.961 1.00 0.00 H new ATOM 0 HD12 ILE A 111 22.697 1.335 2.600 1.00 0.00 H new ATOM 0 HD13 ILE A 111 24.066 2.448 2.370 1.00 0.00 H new ATOM 1812 N TYR A 112 24.063 -0.374 -2.863 1.00 0.00 N ATOM 1813 CA TYR A 112 24.649 -0.518 -4.194 1.00 0.00 C ATOM 1814 C TYR A 112 24.466 0.758 -5.013 1.00 0.00 C ATOM 1815 O TYR A 112 23.776 1.673 -4.566 1.00 0.00 O ATOM 1816 CB TYR A 112 23.953 -1.655 -4.936 1.00 0.00 C ATOM 1817 CG TYR A 112 24.054 -3.018 -4.306 1.00 0.00 C ATOM 1818 CD1 TYR A 112 23.109 -3.482 -3.368 1.00 0.00 C ATOM 1819 CD2 TYR A 112 25.123 -3.828 -4.706 1.00 0.00 C ATOM 1820 CE1 TYR A 112 23.307 -4.740 -2.766 1.00 0.00 C ATOM 1821 CE2 TYR A 112 25.320 -5.070 -4.108 1.00 0.00 C ATOM 1822 CZ TYR A 112 24.452 -5.495 -3.092 1.00 0.00 C ATOM 1823 OH TYR A 112 24.744 -6.630 -2.415 1.00 0.00 O ATOM 0 H TYR A 112 23.234 0.220 -2.860 1.00 0.00 H new ATOM 0 HA TYR A 112 25.713 -0.724 -4.072 1.00 0.00 H new ATOM 0 HB2 TYR A 112 22.898 -1.402 -5.039 1.00 0.00 H new ATOM 0 HB3 TYR A 112 24.367 -1.711 -5.943 1.00 0.00 H new ATOM 0 HD1 TYR A 112 22.247 -2.882 -3.115 1.00 0.00 H new ATOM 0 HD2 TYR A 112 25.796 -3.489 -5.480 1.00 0.00 H new ATOM 0 HE1 TYR A 112 22.586 -5.124 -2.059 1.00 0.00 H new ATOM 0 HE2 TYR A 112 26.136 -5.702 -4.425 1.00 0.00 H new ATOM 0 HH TYR A 112 25.568 -7.022 -2.773 1.00 0.00 H new ATOM 1833 N ASP A 113 25.017 0.816 -6.232 1.00 0.00 N ATOM 1834 CA ASP A 113 24.972 2.032 -7.047 1.00 0.00 C ATOM 1835 C ASP A 113 23.937 1.930 -8.157 1.00 0.00 C ATOM 1836 O ASP A 113 23.178 2.877 -8.399 1.00 0.00 O ATOM 1837 CB ASP A 113 26.342 2.359 -7.656 1.00 0.00 C ATOM 1838 CG ASP A 113 26.583 3.874 -7.667 1.00 0.00 C ATOM 1839 OD1 ASP A 113 26.461 4.526 -6.602 1.00 0.00 O ATOM 1840 OD2 ASP A 113 26.887 4.418 -8.752 1.00 0.00 O ATOM 0 H ASP A 113 25.499 0.033 -6.674 1.00 0.00 H new ATOM 0 HA ASP A 113 24.685 2.840 -6.374 1.00 0.00 H new ATOM 0 HB2 ASP A 113 27.127 1.865 -7.084 1.00 0.00 H new ATOM 0 HB3 ASP A 113 26.396 1.970 -8.673 1.00 0.00 H new ATOM 1845 N THR A 114 23.876 0.783 -8.831 1.00 0.00 N ATOM 1846 CA THR A 114 22.993 0.570 -9.966 1.00 0.00 C ATOM 1847 C THR A 114 21.905 -0.384 -9.521 1.00 0.00 C ATOM 1848 O THR A 114 21.643 -0.564 -8.326 1.00 0.00 O ATOM 1849 CB THR A 114 23.847 0.166 -11.188 1.00 0.00 C ATOM 1850 OG1 THR A 114 24.405 -1.124 -11.062 1.00 0.00 O ATOM 1851 CG2 THR A 114 24.964 1.188 -11.426 1.00 0.00 C ATOM 0 H THR A 114 24.446 -0.030 -8.599 1.00 0.00 H new ATOM 0 HA THR A 114 22.465 1.461 -10.305 1.00 0.00 H new ATOM 0 HB THR A 114 23.172 0.149 -12.044 1.00 0.00 H new ATOM 0 HG1 THR A 114 24.934 -1.331 -11.861 1.00 0.00 H new ATOM 0 HG21 THR A 114 25.555 0.886 -12.291 1.00 0.00 H new ATOM 0 HG22 THR A 114 24.526 2.169 -11.610 1.00 0.00 H new ATOM 0 HG23 THR A 114 25.606 1.236 -10.547 1.00 0.00 H new ATOM 1859 N ILE A 115 21.223 -0.979 -10.476 1.00 0.00 N ATOM 1860 CA ILE A 115 20.475 -2.184 -10.209 1.00 0.00 C ATOM 1861 C ILE A 115 21.307 -3.420 -10.480 1.00 0.00 C ATOM 1862 O ILE A 115 21.178 -4.364 -9.713 1.00 0.00 O ATOM 1863 CB ILE A 115 19.185 -2.115 -11.016 1.00 0.00 C ATOM 1864 CG1 ILE A 115 18.277 -0.996 -10.484 1.00 0.00 C ATOM 1865 CG2 ILE A 115 18.450 -3.468 -11.030 1.00 0.00 C ATOM 1866 CD1 ILE A 115 17.926 -1.071 -9.001 1.00 0.00 C ATOM 0 H ILE A 115 21.172 -0.648 -11.440 1.00 0.00 H new ATOM 0 HA ILE A 115 20.214 -2.260 -9.153 1.00 0.00 H new ATOM 0 HB ILE A 115 19.449 -1.882 -12.048 1.00 0.00 H new ATOM 0 HG12 ILE A 115 18.763 -0.039 -10.675 1.00 0.00 H new ATOM 0 HG13 ILE A 115 17.350 -1.003 -11.058 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.535 -3.379 -11.615 1.00 0.00 H new ATOM 0 HG22 ILE A 115 19.093 -4.227 -11.475 1.00 0.00 H new ATOM 0 HG23 ILE A 115 18.201 -3.757 -10.009 1.00 0.00 H new ATOM 0 HD11 ILE A 115 17.282 -0.232 -8.737 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.405 -2.007 -8.797 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.840 -1.028 -8.408 1.00 0.00 H new ATOM 1878 N SER A 116 22.122 -3.479 -11.531 1.00 0.00 N ATOM 1879 CA SER A 116 22.718 -4.747 -11.925 1.00 0.00 C ATOM 1880 C SER A 116 23.734 -5.216 -10.896 1.00 0.00 C ATOM 1881 O SER A 116 23.759 -6.412 -10.618 1.00 0.00 O ATOM 1882 CB SER A 116 23.301 -4.608 -13.326 1.00 0.00 C ATOM 1883 OG SER A 116 23.615 -5.820 -13.988 1.00 0.00 O ATOM 0 H SER A 116 22.379 -2.681 -12.112 1.00 0.00 H new ATOM 0 HA SER A 116 21.955 -5.525 -11.959 1.00 0.00 H new ATOM 0 HB2 SER A 116 22.591 -4.054 -13.941 1.00 0.00 H new ATOM 0 HB3 SER A 116 24.207 -4.005 -13.263 1.00 0.00 H new ATOM 0 HG SER A 116 23.979 -5.623 -14.876 1.00 0.00 H new ATOM 1889 N GLU A 117 24.473 -4.305 -10.255 1.00 0.00 N ATOM 1890 CA GLU A 117 25.412 -4.684 -9.213 1.00 0.00 C ATOM 1891 C GLU A 117 24.698 -5.181 -7.967 1.00 0.00 C ATOM 1892 O GLU A 117 25.322 -5.795 -7.112 1.00 0.00 O ATOM 1893 CB GLU A 117 26.293 -3.484 -8.839 1.00 0.00 C ATOM 1894 CG GLU A 117 27.495 -3.467 -9.743 1.00 0.00 C ATOM 1895 CD GLU A 117 28.467 -2.347 -9.412 1.00 0.00 C ATOM 1896 OE1 GLU A 117 29.083 -2.356 -8.326 1.00 0.00 O ATOM 1897 OE2 GLU A 117 28.652 -1.481 -10.296 1.00 0.00 O ATOM 0 H GLU A 117 24.434 -3.303 -10.444 1.00 0.00 H new ATOM 0 HA GLU A 117 26.026 -5.495 -9.605 1.00 0.00 H new ATOM 0 HB2 GLU A 117 25.730 -2.556 -8.941 1.00 0.00 H new ATOM 0 HB3 GLU A 117 26.605 -3.555 -7.797 1.00 0.00 H new ATOM 0 HG2 GLU A 117 28.012 -4.424 -9.670 1.00 0.00 H new ATOM 0 HG3 GLU A 117 27.165 -3.361 -10.776 1.00 0.00 H new ATOM 1904 N ALA A 118 23.397 -4.919 -7.841 1.00 0.00 N ATOM 1905 CA ALA A 118 22.610 -5.395 -6.736 1.00 0.00 C ATOM 1906 C ALA A 118 22.047 -6.729 -7.180 1.00 0.00 C ATOM 1907 O ALA A 118 22.245 -7.740 -6.519 1.00 0.00 O ATOM 1908 CB ALA A 118 21.538 -4.358 -6.388 1.00 0.00 C ATOM 0 H ALA A 118 22.869 -4.365 -8.515 1.00 0.00 H new ATOM 0 HA ALA A 118 23.185 -5.535 -5.821 1.00 0.00 H new ATOM 0 HB1 ALA A 118 20.941 -4.719 -5.550 1.00 0.00 H new ATOM 0 HB2 ALA A 118 22.017 -3.418 -6.114 1.00 0.00 H new ATOM 0 HB3 ALA A 118 20.892 -4.199 -7.251 1.00 0.00 H new ATOM 1914 N MET A 119 21.373 -6.743 -8.324 1.00 0.00 N ATOM 1915 CA MET A 119 20.496 -7.801 -8.748 1.00 0.00 C ATOM 1916 C MET A 119 21.191 -9.166 -8.726 1.00 0.00 C ATOM 1917 O MET A 119 20.567 -10.155 -8.341 1.00 0.00 O ATOM 1918 CB MET A 119 20.004 -7.495 -10.178 1.00 0.00 C ATOM 1919 CG MET A 119 18.561 -7.969 -10.352 1.00 0.00 C ATOM 1920 SD MET A 119 18.067 -8.457 -12.026 1.00 0.00 S ATOM 1921 CE MET A 119 18.488 -6.974 -12.980 1.00 0.00 C ATOM 0 H MET A 119 21.432 -5.982 -9.001 1.00 0.00 H new ATOM 0 HA MET A 119 19.658 -7.849 -8.053 1.00 0.00 H new ATOM 0 HB2 MET A 119 20.069 -6.424 -10.371 1.00 0.00 H new ATOM 0 HB3 MET A 119 20.647 -7.990 -10.906 1.00 0.00 H new ATOM 0 HG2 MET A 119 18.398 -8.817 -9.687 1.00 0.00 H new ATOM 0 HG3 MET A 119 17.897 -7.171 -10.019 1.00 0.00 H new ATOM 0 HE1 MET A 119 18.204 -7.119 -14.022 1.00 0.00 H new ATOM 0 HE2 MET A 119 17.952 -6.116 -12.574 1.00 0.00 H new ATOM 0 HE3 MET A 119 19.561 -6.794 -12.918 1.00 0.00 H new ATOM 1931 N GLU A 120 22.462 -9.227 -9.132 1.00 0.00 N ATOM 1932 CA GLU A 120 23.252 -10.455 -9.160 1.00 0.00 C ATOM 1933 C GLU A 120 24.075 -10.674 -7.896 1.00 0.00 C ATOM 1934 O GLU A 120 24.644 -11.750 -7.708 1.00 0.00 O ATOM 1935 CB GLU A 120 24.185 -10.413 -10.374 1.00 0.00 C ATOM 1936 CG GLU A 120 25.332 -9.408 -10.148 1.00 0.00 C ATOM 1937 CD GLU A 120 26.212 -9.197 -11.371 1.00 0.00 C ATOM 1938 OE1 GLU A 120 25.684 -9.211 -12.506 1.00 0.00 O ATOM 1939 OE2 GLU A 120 27.441 -9.072 -11.159 1.00 0.00 O ATOM 0 H GLU A 120 22.977 -8.408 -9.456 1.00 0.00 H new ATOM 0 HA GLU A 120 22.552 -11.288 -9.224 1.00 0.00 H new ATOM 0 HB2 GLU A 120 24.596 -11.406 -10.557 1.00 0.00 H new ATOM 0 HB3 GLU A 120 23.620 -10.133 -11.263 1.00 0.00 H new ATOM 0 HG2 GLU A 120 24.909 -8.450 -9.846 1.00 0.00 H new ATOM 0 HG3 GLU A 120 25.951 -9.757 -9.322 1.00 0.00 H new ATOM 1946 N GLU A 121 24.166 -9.672 -7.031 1.00 0.00 N ATOM 1947 CA GLU A 121 24.935 -9.762 -5.817 1.00 0.00 C ATOM 1948 C GLU A 121 24.036 -10.230 -4.709 1.00 0.00 C ATOM 1949 O GLU A 121 24.273 -11.303 -4.187 1.00 0.00 O ATOM 1950 CB GLU A 121 25.639 -8.444 -5.508 1.00 0.00 C ATOM 1951 CG GLU A 121 26.849 -8.643 -4.572 1.00 0.00 C ATOM 1952 CD GLU A 121 28.032 -9.367 -5.241 1.00 0.00 C ATOM 1953 OE1 GLU A 121 28.013 -9.588 -6.473 1.00 0.00 O ATOM 1954 OE2 GLU A 121 29.003 -9.751 -4.542 1.00 0.00 O ATOM 0 H GLU A 121 23.702 -8.773 -7.161 1.00 0.00 H new ATOM 0 HA GLU A 121 25.734 -10.494 -5.933 1.00 0.00 H new ATOM 0 HB2 GLU A 121 25.972 -7.983 -6.438 1.00 0.00 H new ATOM 0 HB3 GLU A 121 24.932 -7.755 -5.046 1.00 0.00 H new ATOM 0 HG2 GLU A 121 27.185 -7.670 -4.214 1.00 0.00 H new ATOM 0 HG3 GLU A 121 26.532 -9.212 -3.698 1.00 0.00 H new ATOM 1961 N VAL A 122 22.954 -9.513 -4.415 1.00 0.00 N ATOM 1962 CA VAL A 122 21.953 -9.768 -3.400 1.00 0.00 C ATOM 1963 C VAL A 122 21.598 -11.242 -3.351 1.00 0.00 C ATOM 1964 O VAL A 122 21.548 -11.839 -2.275 1.00 0.00 O ATOM 1965 CB VAL A 122 20.744 -8.903 -3.779 1.00 0.00 C ATOM 1966 CG1 VAL A 122 19.663 -9.043 -2.740 1.00 0.00 C ATOM 1967 CG2 VAL A 122 21.105 -7.428 -3.927 1.00 0.00 C ATOM 0 H VAL A 122 22.743 -8.661 -4.934 1.00 0.00 H new ATOM 0 HA VAL A 122 22.313 -9.516 -2.403 1.00 0.00 H new ATOM 0 HB VAL A 122 20.391 -9.260 -4.746 1.00 0.00 H new ATOM 0 HG11 VAL A 122 18.809 -8.425 -3.018 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.351 -10.086 -2.677 1.00 0.00 H new ATOM 0 HG13 VAL A 122 20.045 -8.720 -1.772 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.214 -6.861 -4.196 1.00 0.00 H new ATOM 0 HG22 VAL A 122 21.502 -7.054 -2.983 1.00 0.00 H new ATOM 0 HG23 VAL A 122 21.857 -7.314 -4.708 1.00 0.00 H new ATOM 1977 N ARG A 123 21.416 -11.823 -4.536 1.00 0.00 N ATOM 1978 CA ARG A 123 21.066 -13.244 -4.697 1.00 0.00 C ATOM 1979 C ARG A 123 21.973 -14.262 -3.992 1.00 0.00 C ATOM 1980 O ARG A 123 21.570 -15.391 -3.700 1.00 0.00 O ATOM 1981 CB ARG A 123 20.777 -13.544 -6.157 1.00 0.00 C ATOM 1982 CG ARG A 123 22.017 -13.174 -6.911 1.00 0.00 C ATOM 1983 CD ARG A 123 22.290 -13.948 -8.189 1.00 0.00 C ATOM 1984 NE ARG A 123 21.292 -13.594 -9.198 1.00 0.00 N ATOM 1985 CZ ARG A 123 21.493 -13.642 -10.516 1.00 0.00 C ATOM 1986 NH1 ARG A 123 22.617 -14.150 -11.013 1.00 0.00 N ATOM 1987 NH2 ARG A 123 20.590 -13.140 -11.347 1.00 0.00 N ATOM 0 H ARG A 123 21.507 -11.323 -5.420 1.00 0.00 H new ATOM 0 HA ARG A 123 20.147 -13.394 -4.131 1.00 0.00 H new ATOM 0 HB2 ARG A 123 20.535 -14.597 -6.298 1.00 0.00 H new ATOM 0 HB3 ARG A 123 19.920 -12.970 -6.510 1.00 0.00 H new ATOM 0 HG2 ARG A 123 21.962 -12.114 -7.159 1.00 0.00 H new ATOM 0 HG3 ARG A 123 22.871 -13.301 -6.246 1.00 0.00 H new ATOM 0 HD2 ARG A 123 23.291 -13.721 -8.557 1.00 0.00 H new ATOM 0 HD3 ARG A 123 22.258 -15.019 -7.991 1.00 0.00 H new ATOM 0 HE ARG A 123 20.376 -13.288 -8.870 1.00 0.00 H new ATOM 0 HH11 ARG A 123 23.336 -14.508 -10.385 1.00 0.00 H new ATOM 0 HH12 ARG A 123 22.760 -14.182 -12.022 1.00 0.00 H new ATOM 0 HH21 ARG A 123 19.739 -12.715 -10.979 1.00 0.00 H new ATOM 0 HH22 ARG A 123 20.747 -13.178 -12.354 1.00 0.00 H new ATOM 2001 N ARG A 124 23.215 -13.855 -3.785 1.00 0.00 N ATOM 2002 CA ARG A 124 24.308 -14.596 -3.167 1.00 0.00 C ATOM 2003 C ARG A 124 25.349 -13.653 -2.563 1.00 0.00 C ATOM 2004 O ARG A 124 26.554 -13.910 -2.672 1.00 0.00 O ATOM 2005 CB ARG A 124 24.892 -15.674 -4.122 1.00 0.00 C ATOM 2006 CG ARG A 124 24.885 -15.383 -5.631 1.00 0.00 C ATOM 2007 CD ARG A 124 25.593 -14.104 -6.080 1.00 0.00 C ATOM 2008 NE ARG A 124 27.042 -14.122 -5.845 1.00 0.00 N ATOM 2009 CZ ARG A 124 27.884 -13.200 -6.326 1.00 0.00 C ATOM 2010 NH1 ARG A 124 27.420 -12.195 -7.060 1.00 0.00 N ATOM 2011 NH2 ARG A 124 29.185 -13.285 -6.062 1.00 0.00 N ATOM 0 H ARG A 124 23.511 -12.921 -4.068 1.00 0.00 H new ATOM 0 HA ARG A 124 23.906 -15.160 -2.325 1.00 0.00 H new ATOM 0 HB2 ARG A 124 25.923 -15.861 -3.823 1.00 0.00 H new ATOM 0 HB3 ARG A 124 24.340 -16.599 -3.958 1.00 0.00 H new ATOM 0 HG2 ARG A 124 25.346 -16.227 -6.144 1.00 0.00 H new ATOM 0 HG3 ARG A 124 23.849 -15.335 -5.965 1.00 0.00 H new ATOM 0 HD2 ARG A 124 25.407 -13.950 -7.143 1.00 0.00 H new ATOM 0 HD3 ARG A 124 25.158 -13.254 -5.554 1.00 0.00 H new ATOM 0 HE ARG A 124 27.429 -14.880 -5.283 1.00 0.00 H new ATOM 0 HH11 ARG A 124 26.422 -12.126 -7.257 1.00 0.00 H new ATOM 0 HH12 ARG A 124 28.062 -11.492 -7.427 1.00 0.00 H new ATOM 0 HH21 ARG A 124 29.541 -14.053 -5.493 1.00 0.00 H new ATOM 0 HH22 ARG A 124 29.827 -12.582 -6.429 1.00 0.00 H new ATOM 2025 N LYS A 125 24.911 -12.579 -1.900 1.00 0.00 N ATOM 2026 CA LYS A 125 25.792 -11.699 -1.148 1.00 0.00 C ATOM 2027 C LYS A 125 26.408 -12.536 -0.043 1.00 0.00 C ATOM 2028 O LYS A 125 27.484 -12.147 0.452 1.00 0.00 O ATOM 2029 CB LYS A 125 25.012 -10.453 -0.669 1.00 0.00 C ATOM 2030 CG LYS A 125 24.180 -10.722 0.592 1.00 0.00 C ATOM 2031 CD LYS A 125 24.922 -10.417 1.912 1.00 0.00 C ATOM 2032 CE LYS A 125 24.693 -11.477 3.001 1.00 0.00 C ATOM 2033 NZ LYS A 125 25.719 -12.537 2.968 1.00 0.00 N ATOM 0 H LYS A 125 23.930 -12.300 -1.873 1.00 0.00 H new ATOM 0 HA LYS A 125 26.605 -11.294 -1.750 1.00 0.00 H new ATOM 0 HB2 LYS A 125 25.715 -9.644 -0.469 1.00 0.00 H new ATOM 0 HB3 LYS A 125 24.353 -10.113 -1.468 1.00 0.00 H new ATOM 0 HG2 LYS A 125 23.272 -10.121 0.551 1.00 0.00 H new ATOM 0 HG3 LYS A 125 23.871 -11.767 0.594 1.00 0.00 H new ATOM 0 HD2 LYS A 125 25.990 -10.340 1.710 1.00 0.00 H new ATOM 0 HD3 LYS A 125 24.597 -9.446 2.287 1.00 0.00 H new ATOM 0 HE2 LYS A 125 24.699 -10.998 3.980 1.00 0.00 H new ATOM 0 HE3 LYS A 125 23.707 -11.923 2.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 25.886 -12.889 3.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 25.391 -13.319 2.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 26.604 -12.151 2.582 1.00 0.00 H new