USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 877 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 85 THR OG1 : rot -29:sc= 0.464 USER MOD Set 1.2: A 123 GLN : amide:sc= 1.58 K(o=2,f=0.7) USER MOD Set 2.1: A 82 CYS SG : rot -92:sc= -2.9 USER MOD Set 2.2: A 102 THR OG1 : rot -11:sc= 2.04 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -0.0431 X(o=-0.043,f=0) USER MOD Single : A 17 ASN : amide:sc= -0.869 X(o=-0.87,f=-1.1) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -168:sc= -0.012 (180deg=-0.137) USER MOD Single : A 29 THR OG1 : rot 62:sc= 1.3 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -1.98! C(o=-2!,f=-5.1!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 174:sc= 1.22 USER MOD Single : A 41 THR OG1 : rot 160:sc= 1.05 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -1.6! K(o=-1.6!,f=-0.0098) USER MOD Single : A 54 THR OG1 : rot -79:sc= 1.34 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 60 THR OG1 : rot 88:sc= 1 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 152:sc= 1.07 (180deg=0.197) USER MOD Single : A 76 SER OG : rot 95:sc= 0.772 USER MOD Single : A 81 ASN : amide:sc= -1.7 K(o=-1.7,f=-3.3!) USER MOD Single : A 87 LYS NZ :NH3+ 154:sc= -1.09 (180deg=-2.7!) USER MOD Single : A 89 ASN : amide:sc= 0.853 K(o=0.85,f=-1.1) USER MOD Single : A 90 GLN : amide:sc= 0.336 K(o=0.34,f=-0.55) USER MOD Single : A 91 GLN : amide:sc= -2! K(o=-2!,f=-0.78) USER MOD Single : A 94 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 113 GLN : amide:sc= -5.47! C(o=-5.5!,f=-8.4!) USER MOD Single : A 114 MET CE :methyl -164:sc= -0.0635 (180deg=-0.387) USER MOD Single : A 115 GLN : amide:sc= 0.556 K(o=0.56,f=-0.13) USER MOD Single : A 116 TYR OH : rot -96:sc= 0.138 USER MOD Single : A 125 GLN : amide:sc= -1.2! K(o=-1.2!,f=-0.19) USER MOD Single : A 129 THR OG1 : rot -130:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 172:sc=-0.00872 (180deg=-0.0793) USER MOD Single : A 134 LYS NZ :NH3+ -110:sc= 0.209 (180deg=0.032) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.740 9.457 2.961 1.00 0.00 N ATOM 2 CA PRO A 1 4.444 8.784 1.872 1.00 0.00 C ATOM 3 C PRO A 1 5.928 9.124 1.919 1.00 0.00 C ATOM 4 O PRO A 1 6.409 9.621 2.926 1.00 0.00 O ATOM 5 CB PRO A 1 3.826 9.223 0.562 1.00 0.00 C ATOM 6 CG PRO A 1 2.544 9.852 0.988 1.00 0.00 C ATOM 7 CD PRO A 1 2.798 10.407 2.373 1.00 0.00 C ATOM 0 H2 PRO A 1 4.402 9.941 3.568 1.00 0.00 H new ATOM 0 H3 PRO A 1 3.246 8.778 3.540 1.00 0.00 H new ATOM 0 HA PRO A 1 4.351 7.703 1.971 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.465 9.929 0.031 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.658 8.379 -0.108 1.00 0.00 H new ATOM 0 HG2 PRO A 1 2.248 10.642 0.298 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.735 9.121 1.002 1.00 0.00 H new ATOM 0 HD2 PRO A 1 3.217 11.412 2.331 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.878 10.470 2.954 1.00 0.00 H new ATOM 17 N VAL A 2 6.644 8.844 0.844 1.00 0.00 N ATOM 18 CA VAL A 2 8.081 9.094 0.790 1.00 0.00 C ATOM 19 C VAL A 2 8.434 10.058 -0.346 1.00 0.00 C ATOM 20 O VAL A 2 7.869 9.968 -1.439 1.00 0.00 O ATOM 21 CB VAL A 2 8.884 7.763 0.632 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.380 8.013 0.595 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.555 6.808 1.759 1.00 0.00 C ATOM 0 H VAL A 2 6.255 8.442 -0.009 1.00 0.00 H new ATOM 0 HA VAL A 2 8.363 9.556 1.736 1.00 0.00 H new ATOM 0 HB VAL A 2 8.589 7.317 -0.318 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.905 7.064 0.484 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.620 8.661 -0.248 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.692 8.494 1.522 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.123 5.886 1.633 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.815 7.267 2.713 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.489 6.582 1.745 1.00 0.00 H new ATOM 33 N THR A 3 9.336 10.970 -0.069 1.00 0.00 N ATOM 34 CA THR A 3 9.810 11.916 -1.045 1.00 0.00 C ATOM 35 C THR A 3 11.323 11.732 -1.177 1.00 0.00 C ATOM 36 O THR A 3 12.022 11.572 -0.154 1.00 0.00 O ATOM 37 CB THR A 3 9.456 13.383 -0.621 1.00 0.00 C ATOM 38 OG1 THR A 3 9.885 14.332 -1.606 1.00 0.00 O ATOM 39 CG2 THR A 3 10.067 13.751 0.732 1.00 0.00 C ATOM 0 H THR A 3 9.764 11.075 0.851 1.00 0.00 H new ATOM 0 HA THR A 3 9.327 11.739 -2.006 1.00 0.00 H new ATOM 0 HB THR A 3 8.370 13.422 -0.535 1.00 0.00 H new ATOM 0 HG1 THR A 3 9.648 15.237 -1.313 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.797 14.776 0.987 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.688 13.075 1.498 1.00 0.00 H new ATOM 0 HG23 THR A 3 11.152 13.665 0.677 1.00 0.00 H new ATOM 228 N HIS A 16 10.592 10.866 4.845 1.00 0.00 N ATOM 229 CA HIS A 16 9.216 10.483 5.000 1.00 0.00 C ATOM 230 C HIS A 16 8.335 11.699 5.108 1.00 0.00 C ATOM 231 O HIS A 16 8.723 12.718 5.661 1.00 0.00 O ATOM 232 CB HIS A 16 9.020 9.609 6.257 1.00 0.00 C ATOM 233 CG HIS A 16 9.871 8.373 6.299 1.00 0.00 C ATOM 234 ND1 HIS A 16 10.908 8.207 7.183 1.00 0.00 N ATOM 235 CD2 HIS A 16 9.822 7.237 5.571 1.00 0.00 C ATOM 236 CE1 HIS A 16 11.462 7.031 7.000 1.00 0.00 C ATOM 237 NE2 HIS A 16 10.822 6.416 6.026 1.00 0.00 N ATOM 0 HA HIS A 16 8.938 9.907 4.118 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.235 10.212 7.139 1.00 0.00 H new ATOM 0 HB3 HIS A 16 7.972 9.315 6.319 1.00 0.00 H new ATOM 0 HD2 HIS A 16 9.124 7.016 4.777 1.00 0.00 H new ATOM 0 HE1 HIS A 16 12.300 6.635 7.554 1.00 0.00 H new ATOM 0 HE2 HIS A 16 11.035 5.484 5.670 1.00 0.00 H new ATOM 246 N ASN A 17 7.173 11.586 4.560 1.00 0.00 N ATOM 247 CA ASN A 17 6.146 12.583 4.695 1.00 0.00 C ATOM 248 C ASN A 17 5.003 11.969 5.440 1.00 0.00 C ATOM 249 O ASN A 17 4.836 10.733 5.425 1.00 0.00 O ATOM 250 CB ASN A 17 5.647 13.074 3.311 1.00 0.00 C ATOM 251 CG ASN A 17 6.691 13.806 2.465 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.632 13.777 1.230 1.00 0.00 O ATOM 253 ND2 ASN A 17 7.657 14.429 3.100 1.00 0.00 N ATOM 0 H ASN A 17 6.897 10.785 3.993 1.00 0.00 H new ATOM 0 HA ASN A 17 6.552 13.443 5.228 1.00 0.00 H new ATOM 0 HB2 ASN A 17 5.284 12.215 2.748 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.796 13.738 3.464 1.00 0.00 H new ATOM 0 HD21 ASN A 17 8.388 14.908 2.573 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.677 14.434 4.120 1.00 0.00 H new ATOM 260 N GLY A 18 4.229 12.792 6.071 1.00 0.00 N ATOM 261 CA GLY A 18 3.105 12.337 6.819 1.00 0.00 C ATOM 262 C GLY A 18 1.960 11.978 5.927 1.00 0.00 C ATOM 263 O GLY A 18 2.013 12.196 4.711 1.00 0.00 O ATOM 0 H GLY A 18 4.361 13.803 6.081 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.390 11.469 7.414 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.793 13.114 7.518 1.00 0.00 H new ATOM 267 N PHE A 19 0.940 11.441 6.509 1.00 0.00 N ATOM 268 CA PHE A 19 -0.223 10.996 5.783 1.00 0.00 C ATOM 269 C PHE A 19 -0.948 12.224 5.278 1.00 0.00 C ATOM 270 O PHE A 19 -1.329 13.084 6.088 1.00 0.00 O ATOM 271 CB PHE A 19 -1.138 10.212 6.742 1.00 0.00 C ATOM 272 CG PHE A 19 -0.376 9.281 7.653 1.00 0.00 C ATOM 273 CD1 PHE A 19 0.256 8.164 7.155 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.279 9.551 9.011 1.00 0.00 C ATOM 275 CE1 PHE A 19 0.974 7.331 7.986 1.00 0.00 C ATOM 276 CE2 PHE A 19 0.431 8.720 9.849 1.00 0.00 C ATOM 277 CZ PHE A 19 1.061 7.608 9.335 1.00 0.00 C ATOM 0 H PHE A 19 0.881 11.293 7.516 1.00 0.00 H new ATOM 0 HA PHE A 19 0.057 10.353 4.949 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.710 10.916 7.347 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.856 9.635 6.160 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.188 7.938 6.101 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.767 10.425 9.416 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.469 6.461 7.581 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.494 8.939 10.905 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.622 6.954 9.987 1.00 0.00 H new ATOM 287 N ASP A 20 -1.112 12.355 3.969 1.00 0.00 N ATOM 288 CA ASP A 20 -1.784 13.518 3.417 1.00 0.00 C ATOM 289 C ASP A 20 -3.250 13.350 3.680 1.00 0.00 C ATOM 290 O ASP A 20 -3.871 12.423 3.135 1.00 0.00 O ATOM 291 CB ASP A 20 -1.559 13.613 1.907 1.00 0.00 C ATOM 292 CG ASP A 20 -1.988 14.951 1.338 1.00 0.00 C ATOM 293 OD1 ASP A 20 -3.200 15.187 1.148 1.00 0.00 O ATOM 294 OD2 ASP A 20 -1.103 15.804 1.064 1.00 0.00 O ATOM 0 H ASP A 20 -0.792 11.677 3.277 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.392 14.425 3.877 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.503 13.451 1.690 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.112 12.816 1.410 1.00 0.00 H new ATOM 299 N PHE A 21 -3.813 14.211 4.506 1.00 0.00 N ATOM 300 CA PHE A 21 -5.177 14.034 4.924 1.00 0.00 C ATOM 301 C PHE A 21 -6.135 14.179 3.772 1.00 0.00 C ATOM 302 O PHE A 21 -7.064 13.445 3.699 1.00 0.00 O ATOM 303 CB PHE A 21 -5.573 14.952 6.076 1.00 0.00 C ATOM 304 CG PHE A 21 -6.872 14.532 6.723 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.911 13.412 7.538 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.051 15.229 6.494 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.093 12.997 8.116 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.242 14.817 7.069 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.263 13.700 7.881 1.00 0.00 C ATOM 0 H PHE A 21 -3.346 15.031 4.894 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.243 13.012 5.298 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.781 14.954 6.825 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.667 15.974 5.708 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.004 12.856 7.723 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.039 16.103 5.860 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.106 12.124 8.752 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.152 15.368 6.883 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.189 13.376 8.332 1.00 0.00 H new ATOM 319 N ALA A 22 -5.887 15.121 2.881 1.00 0.00 N ATOM 320 CA ALA A 22 -6.728 15.322 1.698 1.00 0.00 C ATOM 321 C ALA A 22 -6.836 14.063 0.858 1.00 0.00 C ATOM 322 O ALA A 22 -7.905 13.724 0.415 1.00 0.00 O ATOM 323 CB ALA A 22 -6.221 16.468 0.849 1.00 0.00 C ATOM 0 H ALA A 22 -5.103 15.770 2.949 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.724 15.571 2.063 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.867 16.590 -0.020 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.226 17.386 1.437 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.205 16.254 0.518 1.00 0.00 H new ATOM 329 N VAL A 23 -5.725 13.380 0.666 1.00 0.00 N ATOM 330 CA VAL A 23 -5.700 12.119 -0.077 1.00 0.00 C ATOM 331 C VAL A 23 -6.590 11.064 0.613 1.00 0.00 C ATOM 332 O VAL A 23 -7.486 10.482 -0.016 1.00 0.00 O ATOM 333 CB VAL A 23 -4.242 11.598 -0.221 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.191 10.213 -0.832 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.418 12.555 -1.062 1.00 0.00 C ATOM 0 H VAL A 23 -4.813 13.675 1.016 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.098 12.301 -1.075 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.823 11.538 0.783 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.153 9.889 -0.914 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.740 9.516 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.643 10.236 -1.824 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.400 12.176 -1.153 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.862 12.643 -2.053 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.399 13.535 -0.585 1.00 0.00 H new ATOM 345 N ILE A 24 -6.305 10.816 1.882 1.00 0.00 N ATOM 346 CA ILE A 24 -7.114 9.906 2.720 1.00 0.00 C ATOM 347 C ILE A 24 -8.600 10.304 2.637 1.00 0.00 C ATOM 348 O ILE A 24 -9.465 9.484 2.376 1.00 0.00 O ATOM 349 CB ILE A 24 -6.679 9.992 4.217 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.173 9.724 4.388 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.501 9.038 5.093 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.713 8.347 3.950 1.00 0.00 C ATOM 0 H ILE A 24 -5.512 11.232 2.371 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.963 8.892 2.351 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.875 11.012 4.548 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.619 10.473 3.821 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.912 9.861 5.437 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.173 9.122 6.129 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.557 9.299 5.024 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.357 8.014 4.749 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.639 8.255 4.109 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.233 7.587 4.533 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.936 8.208 2.892 1.00 0.00 H new ATOM 364 N LYS A 25 -8.836 11.581 2.805 1.00 0.00 N ATOM 365 CA LYS A 25 -10.151 12.198 2.822 1.00 0.00 C ATOM 366 C LYS A 25 -10.867 11.988 1.489 1.00 0.00 C ATOM 367 O LYS A 25 -12.052 11.703 1.462 1.00 0.00 O ATOM 368 CB LYS A 25 -9.961 13.689 3.098 1.00 0.00 C ATOM 369 CG LYS A 25 -11.209 14.501 3.332 1.00 0.00 C ATOM 370 CD LYS A 25 -10.837 15.956 3.593 1.00 0.00 C ATOM 371 CE LYS A 25 -10.424 16.666 2.319 1.00 0.00 C ATOM 372 NZ LYS A 25 -10.070 18.075 2.571 1.00 0.00 N ATOM 0 H LYS A 25 -8.084 12.257 2.941 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.768 11.743 3.597 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.319 13.794 3.972 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.425 14.125 2.255 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.865 14.434 2.464 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.761 14.099 4.182 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.686 16.474 4.040 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.021 15.999 4.315 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.573 16.151 1.875 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.238 16.619 1.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.793 18.529 1.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.890 18.573 2.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.277 18.119 3.242 1.00 0.00 H new ATOM 386 N GLU A 26 -10.129 12.123 0.406 1.00 0.00 N ATOM 387 CA GLU A 26 -10.626 11.945 -0.949 1.00 0.00 C ATOM 388 C GLU A 26 -11.138 10.528 -1.128 1.00 0.00 C ATOM 389 O GLU A 26 -12.308 10.314 -1.482 1.00 0.00 O ATOM 390 CB GLU A 26 -9.489 12.226 -1.946 1.00 0.00 C ATOM 391 CG GLU A 26 -9.878 12.146 -3.412 1.00 0.00 C ATOM 392 CD GLU A 26 -10.956 13.130 -3.766 1.00 0.00 C ATOM 393 OE1 GLU A 26 -10.685 14.354 -3.783 1.00 0.00 O ATOM 394 OE2 GLU A 26 -12.084 12.702 -4.054 1.00 0.00 O ATOM 0 H GLU A 26 -9.139 12.366 0.442 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.446 12.639 -1.132 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.090 13.221 -1.746 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.682 11.516 -1.762 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.000 12.333 -4.030 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.220 11.137 -3.641 1.00 0.00 H new ATOM 401 N LEU A 27 -10.270 9.566 -0.858 1.00 0.00 N ATOM 402 CA LEU A 27 -10.643 8.169 -0.998 1.00 0.00 C ATOM 403 C LEU A 27 -11.777 7.825 -0.028 1.00 0.00 C ATOM 404 O LEU A 27 -12.665 7.055 -0.356 1.00 0.00 O ATOM 405 CB LEU A 27 -9.446 7.221 -0.805 1.00 0.00 C ATOM 406 CG LEU A 27 -9.734 5.740 -1.078 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.336 5.573 -2.450 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.458 4.930 -0.979 1.00 0.00 C ATOM 0 H LEU A 27 -9.313 9.725 -0.544 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.994 8.024 -2.020 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.638 7.544 -1.461 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.085 7.322 0.219 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.441 5.381 -0.331 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.536 4.517 -2.633 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.268 6.135 -2.509 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.639 5.946 -3.201 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.677 3.880 -1.175 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.738 5.294 -1.713 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.039 5.032 0.022 1.00 0.00 H new ATOM 420 N LYS A 28 -11.746 8.444 1.137 1.00 0.00 N ATOM 421 CA LYS A 28 -12.777 8.289 2.156 1.00 0.00 C ATOM 422 C LYS A 28 -14.129 8.840 1.648 1.00 0.00 C ATOM 423 O LYS A 28 -15.207 8.307 1.973 1.00 0.00 O ATOM 424 CB LYS A 28 -12.337 9.013 3.438 1.00 0.00 C ATOM 425 CG LYS A 28 -13.322 8.934 4.578 1.00 0.00 C ATOM 426 CD LYS A 28 -12.801 9.639 5.814 1.00 0.00 C ATOM 427 CE LYS A 28 -13.815 9.576 6.942 1.00 0.00 C ATOM 428 NZ LYS A 28 -15.032 10.361 6.647 1.00 0.00 N ATOM 0 H LYS A 28 -10.995 9.078 1.410 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.912 7.230 2.375 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.387 8.593 3.768 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.158 10.062 3.203 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.268 9.382 4.274 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.525 7.889 4.813 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.866 9.178 6.134 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.579 10.679 5.577 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -14.090 8.537 7.122 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -13.359 9.948 7.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -15.601 10.458 7.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -14.762 11.305 6.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -15.591 9.874 5.918 1.00 0.00 H new ATOM 442 N THR A 29 -14.067 9.877 0.824 1.00 0.00 N ATOM 443 CA THR A 29 -15.243 10.461 0.244 1.00 0.00 C ATOM 444 C THR A 29 -15.801 9.514 -0.830 1.00 0.00 C ATOM 445 O THR A 29 -16.999 9.227 -0.848 1.00 0.00 O ATOM 446 CB THR A 29 -14.953 11.862 -0.368 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.330 12.714 0.619 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.239 12.520 -0.817 1.00 0.00 C ATOM 0 H THR A 29 -13.195 10.328 0.546 1.00 0.00 H new ATOM 0 HA THR A 29 -15.981 10.602 1.034 1.00 0.00 H new ATOM 0 HB THR A 29 -14.290 11.726 -1.222 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.472 12.327 0.890 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.018 13.499 -1.242 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.722 11.898 -1.570 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.905 12.638 0.038 1.00 0.00 H new ATOM 456 N ALA A 30 -14.919 8.998 -1.694 1.00 0.00 N ATOM 457 CA ALA A 30 -15.289 8.080 -2.724 1.00 0.00 C ATOM 458 C ALA A 30 -15.872 6.829 -2.113 1.00 0.00 C ATOM 459 O ALA A 30 -16.856 6.344 -2.569 1.00 0.00 O ATOM 460 CB ALA A 30 -14.096 7.744 -3.571 1.00 0.00 C ATOM 0 H ALA A 30 -13.924 9.222 -1.680 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.044 8.544 -3.359 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.390 7.044 -4.353 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.706 8.654 -4.027 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.324 7.290 -2.949 1.00 0.00 H new ATOM 466 N ALA A 31 -15.253 6.339 -1.082 1.00 0.00 N ATOM 467 CA ALA A 31 -15.750 5.226 -0.301 1.00 0.00 C ATOM 468 C ALA A 31 -17.218 5.450 0.089 1.00 0.00 C ATOM 469 O ALA A 31 -18.067 4.600 -0.153 1.00 0.00 O ATOM 470 CB ALA A 31 -14.919 5.132 0.953 1.00 0.00 C ATOM 0 H ALA A 31 -14.363 6.706 -0.744 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.684 4.310 -0.888 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.272 4.300 1.562 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.875 4.969 0.686 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.008 6.059 1.519 1.00 0.00 H new ATOM 476 N SER A 32 -17.484 6.614 0.642 1.00 0.00 N ATOM 477 CA SER A 32 -18.800 7.005 1.090 1.00 0.00 C ATOM 478 C SER A 32 -19.833 7.099 -0.066 1.00 0.00 C ATOM 479 O SER A 32 -20.949 6.593 0.060 1.00 0.00 O ATOM 480 CB SER A 32 -18.688 8.342 1.842 1.00 0.00 C ATOM 481 OG SER A 32 -19.934 8.795 2.337 1.00 0.00 O ATOM 0 H SER A 32 -16.774 7.330 0.795 1.00 0.00 H new ATOM 0 HA SER A 32 -19.176 6.229 1.756 1.00 0.00 H new ATOM 0 HB2 SER A 32 -17.991 8.230 2.672 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.271 9.096 1.175 1.00 0.00 H new ATOM 0 HG SER A 32 -19.809 9.646 2.807 1.00 0.00 H new ATOM 487 N GLN A 33 -19.453 7.692 -1.192 1.00 0.00 N ATOM 488 CA GLN A 33 -20.425 7.954 -2.267 1.00 0.00 C ATOM 489 C GLN A 33 -20.504 6.774 -3.219 1.00 0.00 C ATOM 490 O GLN A 33 -21.573 6.250 -3.539 1.00 0.00 O ATOM 491 CB GLN A 33 -19.984 9.131 -3.144 1.00 0.00 C ATOM 492 CG GLN A 33 -19.422 10.347 -2.450 1.00 0.00 C ATOM 493 CD GLN A 33 -19.211 11.521 -3.409 1.00 0.00 C ATOM 494 OE1 GLN A 33 -18.311 12.337 -3.226 1.00 0.00 O ATOM 495 NE2 GLN A 33 -20.029 11.622 -4.433 1.00 0.00 N ATOM 0 H GLN A 33 -18.500 7.998 -1.390 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.374 8.152 -1.770 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.232 8.766 -3.843 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.842 9.449 -3.736 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -20.098 10.651 -1.651 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -18.472 10.088 -1.982 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.769 10.932 -4.565 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -19.924 12.390 -5.096 1.00 0.00 H new ATOM 504 N TYR A 34 -19.347 6.377 -3.615 1.00 0.00 N ATOM 505 CA TYR A 34 -19.083 5.472 -4.694 1.00 0.00 C ATOM 506 C TYR A 34 -18.871 4.041 -4.211 1.00 0.00 C ATOM 507 O TYR A 34 -19.364 3.096 -4.816 1.00 0.00 O ATOM 508 CB TYR A 34 -17.812 6.008 -5.398 1.00 0.00 C ATOM 509 CG TYR A 34 -18.013 7.250 -6.235 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.516 7.178 -7.521 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.698 8.499 -5.729 1.00 0.00 C ATOM 512 CE1 TYR A 34 -18.694 8.321 -8.274 1.00 0.00 C ATOM 513 CE2 TYR A 34 -17.872 9.640 -6.467 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.371 9.551 -7.736 1.00 0.00 C ATOM 515 OH TYR A 34 -18.548 10.701 -8.474 1.00 0.00 O ATOM 0 H TYR A 34 -18.490 6.697 -3.163 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.936 5.429 -5.371 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -17.058 6.219 -4.640 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.411 5.221 -6.036 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -18.772 6.217 -7.941 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.305 8.576 -4.726 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -19.084 8.254 -9.279 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -17.617 10.603 -6.049 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.271 11.477 -7.943 1.00 0.00 H new ATOM 525 N GLY A 35 -18.162 3.888 -3.119 1.00 0.00 N ATOM 526 CA GLY A 35 -17.846 2.564 -2.629 1.00 0.00 C ATOM 527 C GLY A 35 -16.654 1.983 -3.355 1.00 0.00 C ATOM 528 O GLY A 35 -16.259 2.485 -4.425 1.00 0.00 O ATOM 0 H GLY A 35 -17.795 4.655 -2.555 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.638 2.609 -1.560 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.708 1.910 -2.758 1.00 0.00 H new ATOM 532 N ALA A 36 -16.089 0.926 -2.830 1.00 0.00 N ATOM 533 CA ALA A 36 -14.920 0.346 -3.442 1.00 0.00 C ATOM 534 C ALA A 36 -15.346 -0.737 -4.415 1.00 0.00 C ATOM 535 O ALA A 36 -15.363 -1.907 -4.105 1.00 0.00 O ATOM 536 CB ALA A 36 -13.954 -0.177 -2.405 1.00 0.00 C ATOM 0 H ALA A 36 -16.415 0.452 -1.988 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.388 1.120 -3.995 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -13.084 -0.607 -2.902 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.635 0.641 -1.759 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.445 -0.943 -1.804 1.00 0.00 H new ATOM 542 N THR A 37 -15.638 -0.299 -5.599 1.00 0.00 N ATOM 543 CA THR A 37 -16.211 -1.091 -6.676 1.00 0.00 C ATOM 544 C THR A 37 -16.442 -0.159 -7.842 1.00 0.00 C ATOM 545 O THR A 37 -16.206 -0.514 -9.004 1.00 0.00 O ATOM 546 CB THR A 37 -17.534 -1.846 -6.270 1.00 0.00 C ATOM 547 OG1 THR A 37 -18.195 -2.387 -7.412 1.00 0.00 O ATOM 548 CG2 THR A 37 -18.486 -0.972 -5.486 1.00 0.00 C ATOM 0 H THR A 37 -15.480 0.672 -5.869 1.00 0.00 H new ATOM 0 HA THR A 37 -15.514 -1.886 -6.939 1.00 0.00 H new ATOM 0 HB THR A 37 -17.227 -2.664 -5.618 1.00 0.00 H new ATOM 0 HG1 THR A 37 -19.011 -2.850 -7.129 1.00 0.00 H new ATOM 0 HG21 THR A 37 -19.379 -1.543 -5.233 1.00 0.00 H new ATOM 0 HG22 THR A 37 -18.000 -0.634 -4.571 1.00 0.00 H new ATOM 0 HG23 THR A 37 -18.766 -0.108 -6.088 1.00 0.00 H new ATOM 556 N ALA A 38 -16.841 1.063 -7.518 1.00 0.00 N ATOM 557 CA ALA A 38 -16.968 2.090 -8.500 1.00 0.00 C ATOM 558 C ALA A 38 -15.562 2.513 -8.897 1.00 0.00 C ATOM 559 O ALA A 38 -14.714 2.724 -8.000 1.00 0.00 O ATOM 560 CB ALA A 38 -17.743 3.263 -7.935 1.00 0.00 C ATOM 0 H ALA A 38 -17.080 1.353 -6.570 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.514 1.728 -9.371 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.833 4.040 -8.695 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.737 2.932 -7.636 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.217 3.663 -7.068 1.00 0.00 H new ATOM 566 N PRO A 39 -15.294 2.601 -10.226 1.00 0.00 N ATOM 567 CA PRO A 39 -13.978 2.927 -10.796 1.00 0.00 C ATOM 568 C PRO A 39 -13.208 3.999 -10.042 1.00 0.00 C ATOM 569 O PRO A 39 -12.038 3.801 -9.751 1.00 0.00 O ATOM 570 CB PRO A 39 -14.333 3.405 -12.191 1.00 0.00 C ATOM 571 CG PRO A 39 -15.478 2.552 -12.569 1.00 0.00 C ATOM 572 CD PRO A 39 -16.284 2.368 -11.309 1.00 0.00 C ATOM 0 HA PRO A 39 -13.309 2.068 -10.757 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.601 4.462 -12.197 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.498 3.284 -12.881 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.075 3.022 -13.350 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.139 1.593 -12.960 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.112 3.075 -11.255 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.715 1.368 -11.251 1.00 0.00 H new ATOM 580 N TYR A 40 -13.893 5.095 -9.685 1.00 0.00 N ATOM 581 CA TYR A 40 -13.287 6.240 -8.993 1.00 0.00 C ATOM 582 C TYR A 40 -12.443 5.794 -7.814 1.00 0.00 C ATOM 583 O TYR A 40 -11.219 5.924 -7.842 1.00 0.00 O ATOM 584 CB TYR A 40 -14.370 7.229 -8.514 1.00 0.00 C ATOM 585 CG TYR A 40 -13.832 8.560 -8.003 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.108 9.402 -8.832 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.037 8.960 -6.694 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.602 10.607 -8.369 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.538 10.163 -6.217 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.821 10.984 -7.062 1.00 0.00 C ATOM 591 OH TYR A 40 -12.311 12.187 -6.600 1.00 0.00 O ATOM 0 H TYR A 40 -14.889 5.212 -9.870 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.638 6.743 -9.710 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.057 7.422 -9.338 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.949 6.757 -7.720 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -12.935 9.114 -9.858 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.598 8.321 -6.029 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.038 11.248 -9.031 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.710 10.455 -5.191 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.634 12.351 -5.689 1.00 0.00 H new ATOM 601 N THR A 41 -13.098 5.256 -6.792 1.00 0.00 N ATOM 602 CA THR A 41 -12.512 4.791 -5.578 1.00 0.00 C ATOM 603 C THR A 41 -11.274 3.881 -5.815 1.00 0.00 C ATOM 604 O THR A 41 -10.188 4.186 -5.330 1.00 0.00 O ATOM 605 CB THR A 41 -13.612 4.043 -4.833 1.00 0.00 C ATOM 606 OG1 THR A 41 -14.842 4.748 -5.027 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.341 3.960 -3.364 1.00 0.00 C ATOM 0 H THR A 41 -14.111 5.134 -6.807 1.00 0.00 H new ATOM 0 HA THR A 41 -12.134 5.634 -4.999 1.00 0.00 H new ATOM 0 HB THR A 41 -13.659 3.027 -5.225 1.00 0.00 H new ATOM 0 HG1 THR A 41 -15.595 4.146 -4.853 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.151 3.419 -2.875 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.401 3.435 -3.197 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.274 4.966 -2.949 1.00 0.00 H new ATOM 615 N LEU A 42 -11.401 2.807 -6.596 1.00 0.00 N ATOM 616 CA LEU A 42 -10.230 1.937 -6.785 1.00 0.00 C ATOM 617 C LEU A 42 -9.150 2.512 -7.692 1.00 0.00 C ATOM 618 O LEU A 42 -7.991 2.132 -7.574 1.00 0.00 O ATOM 619 CB LEU A 42 -10.489 0.399 -6.983 1.00 0.00 C ATOM 620 CG LEU A 42 -11.572 -0.092 -7.961 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.942 0.117 -7.387 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.439 0.544 -9.341 1.00 0.00 C ATOM 0 H LEU A 42 -12.250 2.525 -7.085 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.804 1.953 -5.782 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.546 -0.048 -7.297 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.728 -0.016 -6.004 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.422 -1.163 -8.099 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.691 -0.237 -8.095 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -13.034 -0.438 -6.454 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.098 1.179 -7.195 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.226 0.165 -9.994 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.531 1.627 -9.253 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.466 0.295 -9.764 1.00 0.00 H new ATOM 634 N ALA A 43 -9.525 3.456 -8.564 1.00 0.00 N ATOM 635 CA ALA A 43 -8.551 4.176 -9.388 1.00 0.00 C ATOM 636 C ALA A 43 -7.630 4.980 -8.486 1.00 0.00 C ATOM 637 O ALA A 43 -6.446 5.174 -8.782 1.00 0.00 O ATOM 638 CB ALA A 43 -9.228 5.090 -10.409 1.00 0.00 C ATOM 0 H ALA A 43 -10.494 3.737 -8.716 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.973 3.443 -9.951 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.468 5.604 -10.998 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.857 4.494 -11.070 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.842 5.825 -9.889 1.00 0.00 H new ATOM 644 N ILE A 44 -8.180 5.395 -7.370 1.00 0.00 N ATOM 645 CA ILE A 44 -7.460 6.131 -6.361 1.00 0.00 C ATOM 646 C ILE A 44 -6.601 5.166 -5.544 1.00 0.00 C ATOM 647 O ILE A 44 -5.446 5.455 -5.272 1.00 0.00 O ATOM 648 CB ILE A 44 -8.436 6.890 -5.449 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.260 7.859 -6.287 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.681 7.652 -4.355 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.445 8.425 -5.566 1.00 0.00 C ATOM 0 H ILE A 44 -9.158 5.227 -7.134 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.813 6.863 -6.845 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.097 6.170 -4.965 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.619 8.678 -6.613 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.604 7.346 -7.185 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.394 8.181 -3.722 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.111 6.948 -3.749 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.001 8.369 -4.814 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.982 9.106 -6.227 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.108 7.614 -5.264 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.108 8.967 -4.682 1.00 0.00 H new ATOM 663 N VAL A 45 -7.167 3.999 -5.205 1.00 0.00 N ATOM 664 CA VAL A 45 -6.448 2.943 -4.451 1.00 0.00 C ATOM 665 C VAL A 45 -5.113 2.616 -5.153 1.00 0.00 C ATOM 666 O VAL A 45 -4.026 2.736 -4.557 1.00 0.00 O ATOM 667 CB VAL A 45 -7.314 1.625 -4.324 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.551 0.515 -3.626 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.612 1.871 -3.571 1.00 0.00 C ATOM 0 H VAL A 45 -8.129 3.754 -5.440 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.258 3.322 -3.447 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.543 1.318 -5.344 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.180 -0.372 -3.559 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.651 0.279 -4.194 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.273 0.839 -2.623 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.177 0.941 -3.506 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.388 2.230 -2.567 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.203 2.618 -4.100 1.00 0.00 H new ATOM 679 N GLU A 46 -5.203 2.275 -6.433 1.00 0.00 N ATOM 680 CA GLU A 46 -4.031 1.959 -7.228 1.00 0.00 C ATOM 681 C GLU A 46 -3.130 3.171 -7.431 1.00 0.00 C ATOM 682 O GLU A 46 -1.924 3.023 -7.471 1.00 0.00 O ATOM 683 CB GLU A 46 -4.408 1.332 -8.569 1.00 0.00 C ATOM 684 CG GLU A 46 -5.472 2.098 -9.313 1.00 0.00 C ATOM 685 CD GLU A 46 -5.704 1.593 -10.693 1.00 0.00 C ATOM 686 OE1 GLU A 46 -6.374 0.559 -10.851 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.246 2.240 -11.659 1.00 0.00 O ATOM 0 H GLU A 46 -6.084 2.211 -6.942 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.464 1.221 -6.661 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -3.517 1.265 -9.193 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -4.756 0.313 -8.400 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -6.406 2.047 -8.753 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.187 3.149 -9.361 1.00 0.00 H new ATOM 694 N SER A 47 -3.724 4.362 -7.532 1.00 0.00 N ATOM 695 CA SER A 47 -2.972 5.588 -7.712 1.00 0.00 C ATOM 696 C SER A 47 -2.101 5.867 -6.487 1.00 0.00 C ATOM 697 O SER A 47 -0.917 6.154 -6.613 1.00 0.00 O ATOM 698 CB SER A 47 -3.927 6.763 -7.963 1.00 0.00 C ATOM 699 OG SER A 47 -3.226 7.974 -8.230 1.00 0.00 O ATOM 0 H SER A 47 -4.734 4.495 -7.491 1.00 0.00 H new ATOM 0 HA SER A 47 -2.322 5.472 -8.579 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.578 6.528 -8.805 1.00 0.00 H new ATOM 0 HB3 SER A 47 -4.569 6.900 -7.093 1.00 0.00 H new ATOM 0 HG SER A 47 -3.869 8.697 -8.386 1.00 0.00 H new ATOM 705 N VAL A 48 -2.676 5.744 -5.310 1.00 0.00 N ATOM 706 CA VAL A 48 -1.948 6.026 -4.094 1.00 0.00 C ATOM 707 C VAL A 48 -0.897 4.935 -3.827 1.00 0.00 C ATOM 708 O VAL A 48 0.225 5.228 -3.424 1.00 0.00 O ATOM 709 CB VAL A 48 -2.892 6.212 -2.868 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.099 6.623 -1.644 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.962 7.256 -3.157 1.00 0.00 C ATOM 0 H VAL A 48 -3.643 5.451 -5.170 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.432 6.976 -4.238 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.379 5.256 -2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.775 6.748 -0.798 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.364 5.852 -1.411 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.587 7.565 -1.842 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.607 7.367 -2.286 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.487 8.211 -3.380 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.559 6.938 -4.012 1.00 0.00 H new ATOM 721 N ALA A 49 -1.231 3.681 -4.144 1.00 0.00 N ATOM 722 CA ALA A 49 -0.289 2.578 -3.961 1.00 0.00 C ATOM 723 C ALA A 49 0.750 2.563 -5.074 1.00 0.00 C ATOM 724 O ALA A 49 1.616 1.714 -5.101 1.00 0.00 O ATOM 725 CB ALA A 49 -1.008 1.233 -3.902 1.00 0.00 C ATOM 0 H ALA A 49 -2.137 3.408 -4.524 1.00 0.00 H new ATOM 0 HA ALA A 49 0.216 2.737 -3.008 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.278 0.436 -3.765 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.708 1.231 -3.066 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.553 1.071 -4.832 1.00 0.00 H new ATOM 731 N ASP A 50 0.616 3.488 -6.012 1.00 0.00 N ATOM 732 CA ASP A 50 1.559 3.652 -7.137 1.00 0.00 C ATOM 733 C ASP A 50 2.696 4.564 -6.694 1.00 0.00 C ATOM 734 O ASP A 50 3.625 4.860 -7.431 1.00 0.00 O ATOM 735 CB ASP A 50 0.804 4.226 -8.358 1.00 0.00 C ATOM 736 CG ASP A 50 1.647 4.490 -9.585 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.215 3.539 -10.166 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.723 5.661 -10.017 1.00 0.00 O ATOM 0 H ASP A 50 -0.153 4.158 -6.025 1.00 0.00 H new ATOM 0 HA ASP A 50 1.984 2.692 -7.431 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.008 3.532 -8.629 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.326 5.159 -8.061 1.00 0.00 H new ATOM 743 N ASN A 51 2.603 4.989 -5.458 1.00 0.00 N ATOM 744 CA ASN A 51 3.623 5.832 -4.841 1.00 0.00 C ATOM 745 C ASN A 51 4.603 4.917 -4.104 1.00 0.00 C ATOM 746 O ASN A 51 4.413 3.712 -4.082 1.00 0.00 O ATOM 747 CB ASN A 51 3.014 6.855 -3.830 1.00 0.00 C ATOM 748 CG ASN A 51 2.076 7.931 -4.415 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.026 9.056 -3.910 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.308 7.608 -5.416 1.00 0.00 N ATOM 0 H ASN A 51 1.821 4.765 -4.843 1.00 0.00 H new ATOM 0 HA ASN A 51 4.119 6.408 -5.623 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.463 6.298 -3.073 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.835 7.360 -3.320 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.651 8.290 -5.796 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.363 6.673 -5.820 1.00 0.00 H new ATOM 757 N TRP A 52 5.622 5.480 -3.478 1.00 0.00 N ATOM 758 CA TRP A 52 6.610 4.665 -2.738 1.00 0.00 C ATOM 759 C TRP A 52 6.282 4.668 -1.246 1.00 0.00 C ATOM 760 O TRP A 52 7.088 4.264 -0.443 1.00 0.00 O ATOM 761 CB TRP A 52 8.046 5.203 -2.937 1.00 0.00 C ATOM 762 CG TRP A 52 8.565 5.154 -4.350 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.110 4.378 -5.372 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.677 5.889 -4.876 1.00 0.00 C ATOM 765 NE1 TRP A 52 8.842 4.611 -6.507 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.814 5.528 -6.229 1.00 0.00 C ATOM 767 CE3 TRP A 52 10.558 6.827 -4.337 1.00 0.00 C ATOM 768 CZ2 TRP A 52 10.798 6.070 -7.048 1.00 0.00 C ATOM 769 CZ3 TRP A 52 11.534 7.360 -5.150 1.00 0.00 C ATOM 770 CH2 TRP A 52 11.646 6.983 -6.492 1.00 0.00 C ATOM 0 H TRP A 52 5.799 6.484 -3.458 1.00 0.00 H new ATOM 0 HA TRP A 52 6.558 3.649 -3.130 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.080 6.236 -2.591 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.721 4.632 -2.300 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.290 3.679 -5.299 1.00 0.00 H new ATOM 0 HE1 TRP A 52 8.686 4.170 -7.413 1.00 0.00 H new ATOM 0 HE3 TRP A 52 10.476 7.129 -3.303 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 10.888 5.780 -8.084 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 12.226 8.083 -4.743 1.00 0.00 H new ATOM 0 HH2 TRP A 52 12.421 7.424 -7.102 1.00 0.00 H new ATOM 781 N LEU A 53 5.110 5.210 -0.947 1.00 0.00 N ATOM 782 CA LEU A 53 4.523 5.342 0.411 1.00 0.00 C ATOM 783 C LEU A 53 4.814 4.149 1.351 1.00 0.00 C ATOM 784 O LEU A 53 4.894 2.990 0.929 1.00 0.00 O ATOM 785 CB LEU A 53 2.994 5.578 0.342 1.00 0.00 C ATOM 786 CG LEU A 53 2.084 4.375 -0.026 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.633 4.797 0.015 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.414 3.784 -1.393 1.00 0.00 C ATOM 0 H LEU A 53 4.500 5.593 -1.669 1.00 0.00 H new ATOM 0 HA LEU A 53 5.019 6.212 0.842 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.671 5.956 1.312 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.811 6.369 -0.385 1.00 0.00 H new ATOM 0 HG LEU A 53 2.268 3.595 0.713 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.000 3.948 -0.244 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.383 5.143 1.018 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.468 5.604 -0.699 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.747 2.947 -1.598 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.284 4.547 -2.160 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.447 3.435 -1.399 1.00 0.00 H new ATOM 800 N THR A 54 4.872 4.455 2.624 1.00 0.00 N ATOM 801 CA THR A 54 5.267 3.510 3.625 1.00 0.00 C ATOM 802 C THR A 54 4.131 2.529 3.952 1.00 0.00 C ATOM 803 O THR A 54 2.952 2.810 3.687 1.00 0.00 O ATOM 804 CB THR A 54 5.678 4.253 4.936 1.00 0.00 C ATOM 805 OG1 THR A 54 4.561 4.969 5.472 1.00 0.00 O ATOM 806 CG2 THR A 54 6.804 5.238 4.687 1.00 0.00 C ATOM 0 H THR A 54 4.643 5.378 2.992 1.00 0.00 H new ATOM 0 HA THR A 54 6.114 2.951 3.227 1.00 0.00 H new ATOM 0 HB THR A 54 6.017 3.495 5.643 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.441 5.806 4.976 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.064 5.737 5.621 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.675 4.706 4.305 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.483 5.980 3.956 1.00 0.00 H new ATOM 814 N PRO A 55 4.462 1.359 4.548 1.00 0.00 N ATOM 815 CA PRO A 55 3.455 0.429 5.060 1.00 0.00 C ATOM 816 C PRO A 55 2.657 1.100 6.196 1.00 0.00 C ATOM 817 O PRO A 55 1.524 0.709 6.513 1.00 0.00 O ATOM 818 CB PRO A 55 4.284 -0.746 5.604 1.00 0.00 C ATOM 819 CG PRO A 55 5.603 -0.632 4.920 1.00 0.00 C ATOM 820 CD PRO A 55 5.828 0.831 4.706 1.00 0.00 C ATOM 0 HA PRO A 55 2.732 0.117 4.306 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.394 -0.685 6.687 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.807 -1.701 5.386 1.00 0.00 H new ATOM 0 HG2 PRO A 55 6.397 -1.065 5.528 1.00 0.00 H new ATOM 0 HG3 PRO A 55 5.599 -1.170 3.972 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.342 1.288 5.552 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.438 1.020 3.823 1.00 0.00 H new ATOM 828 N THR A 56 3.263 2.125 6.789 1.00 0.00 N ATOM 829 CA THR A 56 2.630 2.932 7.793 1.00 0.00 C ATOM 830 C THR A 56 1.486 3.743 7.138 1.00 0.00 C ATOM 831 O THR A 56 0.353 3.812 7.684 1.00 0.00 O ATOM 832 CB THR A 56 3.658 3.902 8.409 1.00 0.00 C ATOM 833 OG1 THR A 56 4.877 3.182 8.731 1.00 0.00 O ATOM 834 CG2 THR A 56 3.098 4.526 9.676 1.00 0.00 C ATOM 0 H THR A 56 4.218 2.411 6.574 1.00 0.00 H new ATOM 0 HA THR A 56 2.230 2.291 8.578 1.00 0.00 H new ATOM 0 HB THR A 56 3.874 4.689 7.686 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.529 3.801 9.121 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.834 5.209 10.101 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.187 5.076 9.439 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.871 3.742 10.398 1.00 0.00 H new ATOM 842 N ASP A 57 1.791 4.351 5.960 1.00 0.00 N ATOM 843 CA ASP A 57 0.795 5.081 5.156 1.00 0.00 C ATOM 844 C ASP A 57 -0.312 4.144 4.817 1.00 0.00 C ATOM 845 O ASP A 57 -1.480 4.476 4.984 1.00 0.00 O ATOM 846 CB ASP A 57 1.365 5.662 3.832 1.00 0.00 C ATOM 847 CG ASP A 57 2.345 6.811 3.983 1.00 0.00 C ATOM 848 OD1 ASP A 57 1.928 7.941 4.257 1.00 0.00 O ATOM 849 OD2 ASP A 57 3.566 6.619 3.742 1.00 0.00 O ATOM 0 H ASP A 57 2.726 4.345 5.552 1.00 0.00 H new ATOM 0 HA ASP A 57 0.458 5.926 5.757 1.00 0.00 H new ATOM 0 HB2 ASP A 57 1.859 4.857 3.287 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.531 5.999 3.216 1.00 0.00 H new ATOM 854 N TRP A 58 0.076 2.949 4.363 1.00 0.00 N ATOM 855 CA TRP A 58 -0.852 1.875 4.053 1.00 0.00 C ATOM 856 C TRP A 58 -1.835 1.611 5.189 1.00 0.00 C ATOM 857 O TRP A 58 -3.046 1.710 4.985 1.00 0.00 O ATOM 858 CB TRP A 58 -0.113 0.577 3.720 1.00 0.00 C ATOM 859 CG TRP A 58 0.426 0.479 2.325 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.338 1.402 1.317 1.00 0.00 C ATOM 861 CD2 TRP A 58 1.114 -0.640 1.779 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.927 0.904 0.175 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.410 -0.347 0.439 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.504 -1.866 2.301 1.00 0.00 C ATOM 865 CZ2 TRP A 58 2.079 -1.247 -0.384 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.163 -2.753 1.491 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.444 -2.449 0.164 1.00 0.00 C ATOM 0 H TRP A 58 1.053 2.705 4.201 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.414 2.207 3.180 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.715 0.462 4.419 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -0.791 -0.260 3.888 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.124 2.374 1.404 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.992 1.389 -0.720 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.291 -2.117 3.330 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.302 -1.008 -1.413 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.470 -3.708 1.892 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.960 -3.174 -0.447 1.00 0.00 H new ATOM 878 N ASN A 59 -1.326 1.294 6.387 1.00 0.00 N ATOM 879 CA ASN A 59 -2.210 0.965 7.527 1.00 0.00 C ATOM 880 C ASN A 59 -3.232 2.070 7.747 1.00 0.00 C ATOM 881 O ASN A 59 -4.432 1.828 7.700 1.00 0.00 O ATOM 882 CB ASN A 59 -1.441 0.754 8.839 1.00 0.00 C ATOM 883 CG ASN A 59 -2.371 0.236 9.939 1.00 0.00 C ATOM 884 OD1 ASN A 59 -3.306 -0.520 9.666 1.00 0.00 O ATOM 885 ND2 ASN A 59 -2.159 0.656 11.162 1.00 0.00 N ATOM 0 H ASN A 59 -0.328 1.257 6.596 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.702 0.029 7.263 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.629 0.044 8.679 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.986 1.693 9.154 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.776 0.358 11.918 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.377 1.281 11.358 1.00 0.00 H new ATOM 892 N THR A 60 -2.725 3.284 7.844 1.00 0.00 N ATOM 893 CA THR A 60 -3.517 4.471 8.115 1.00 0.00 C ATOM 894 C THR A 60 -4.595 4.671 7.027 1.00 0.00 C ATOM 895 O THR A 60 -5.781 4.951 7.324 1.00 0.00 O ATOM 896 CB THR A 60 -2.571 5.692 8.159 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.499 5.399 9.080 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.295 6.954 8.626 1.00 0.00 C ATOM 0 H THR A 60 -1.730 3.478 7.734 1.00 0.00 H new ATOM 0 HA THR A 60 -4.027 4.357 9.072 1.00 0.00 H new ATOM 0 HB THR A 60 -2.194 5.876 7.153 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.776 4.939 8.605 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.595 7.790 8.643 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.112 7.179 7.941 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.695 6.795 9.628 1.00 0.00 H new ATOM 906 N LEU A 61 -4.193 4.419 5.801 1.00 0.00 N ATOM 907 CA LEU A 61 -5.015 4.632 4.651 1.00 0.00 C ATOM 908 C LEU A 61 -6.255 3.750 4.725 1.00 0.00 C ATOM 909 O LEU A 61 -7.357 4.270 4.823 1.00 0.00 O ATOM 910 CB LEU A 61 -4.168 4.366 3.379 1.00 0.00 C ATOM 911 CG LEU A 61 -4.689 4.838 2.004 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.623 4.635 0.955 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.948 4.123 1.574 1.00 0.00 C ATOM 0 H LEU A 61 -3.266 4.054 5.581 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.367 5.663 4.613 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.193 4.827 3.534 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.005 3.290 3.314 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.932 5.895 2.107 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.996 4.970 -0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.737 5.211 1.221 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.365 3.577 0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -6.265 4.498 0.601 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.753 3.053 1.505 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.736 4.302 2.306 1.00 0.00 H new ATOM 925 N VAL A 62 -6.056 2.438 4.822 1.00 0.00 N ATOM 926 CA VAL A 62 -7.163 1.481 4.705 1.00 0.00 C ATOM 927 C VAL A 62 -8.128 1.605 5.852 1.00 0.00 C ATOM 928 O VAL A 62 -9.339 1.707 5.661 1.00 0.00 O ATOM 929 CB VAL A 62 -6.676 -0.007 4.542 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.777 -0.473 5.686 1.00 0.00 C ATOM 931 CG2 VAL A 62 -7.855 -0.947 4.389 1.00 0.00 C ATOM 0 H VAL A 62 -5.144 2.010 4.981 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.688 1.743 3.786 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.073 -0.031 3.634 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.476 -1.506 5.514 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.891 0.160 5.734 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.322 -0.406 6.628 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.493 -1.969 4.278 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.490 -0.881 5.272 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.431 -0.668 3.506 1.00 0.00 H new ATOM 941 N ARG A 63 -7.564 1.695 7.019 1.00 0.00 N ATOM 942 CA ARG A 63 -8.354 1.733 8.256 1.00 0.00 C ATOM 943 C ARG A 63 -9.201 2.997 8.396 1.00 0.00 C ATOM 944 O ARG A 63 -10.176 3.023 9.142 1.00 0.00 O ATOM 945 CB ARG A 63 -7.517 1.434 9.533 1.00 0.00 C ATOM 946 CG ARG A 63 -6.336 2.366 9.857 1.00 0.00 C ATOM 947 CD ARG A 63 -6.753 3.788 10.132 1.00 0.00 C ATOM 948 NE ARG A 63 -5.726 4.603 10.781 1.00 0.00 N ATOM 949 CZ ARG A 63 -5.893 5.883 11.135 1.00 0.00 C ATOM 950 NH1 ARG A 63 -7.064 6.493 10.933 1.00 0.00 N ATOM 951 NH2 ARG A 63 -4.903 6.542 11.715 1.00 0.00 N ATOM 0 H ARG A 63 -6.555 1.745 7.162 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.060 0.908 8.161 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -8.195 1.445 10.387 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.128 0.419 9.447 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.804 1.977 10.725 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -5.635 2.356 9.022 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.033 4.260 9.191 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.643 3.778 10.761 1.00 0.00 H new ATOM 0 HE ARG A 63 -4.824 4.168 10.976 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -7.838 5.983 10.507 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -7.184 7.469 11.205 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.014 6.075 11.892 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -5.029 7.517 11.985 1.00 0.00 H new ATOM 965 N ALA A 64 -8.810 4.046 7.710 1.00 0.00 N ATOM 966 CA ALA A 64 -9.567 5.278 7.755 1.00 0.00 C ATOM 967 C ALA A 64 -10.551 5.388 6.597 1.00 0.00 C ATOM 968 O ALA A 64 -11.749 5.567 6.822 1.00 0.00 O ATOM 969 CB ALA A 64 -8.639 6.484 7.772 1.00 0.00 C ATOM 0 H ALA A 64 -7.979 4.073 7.118 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.144 5.263 8.679 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.231 7.398 7.806 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.996 6.436 8.651 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.024 6.483 6.872 1.00 0.00 H new ATOM 975 N VAL A 65 -10.007 5.339 5.404 1.00 0.00 N ATOM 976 CA VAL A 65 -10.800 5.518 4.154 1.00 0.00 C ATOM 977 C VAL A 65 -12.113 4.703 4.103 1.00 0.00 C ATOM 978 O VAL A 65 -13.166 5.256 3.795 1.00 0.00 O ATOM 979 CB VAL A 65 -9.984 5.325 2.842 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.833 6.307 2.786 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.477 3.900 2.679 1.00 0.00 C ATOM 0 H VAL A 65 -9.013 5.177 5.245 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.082 6.570 4.205 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.662 5.520 2.011 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.273 6.159 1.863 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.222 7.325 2.815 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.175 6.145 3.640 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.914 3.818 1.749 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.830 3.646 3.518 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.323 3.213 2.653 1.00 0.00 H new ATOM 991 N LEU A 66 -12.066 3.436 4.460 1.00 0.00 N ATOM 992 CA LEU A 66 -13.256 2.592 4.450 1.00 0.00 C ATOM 993 C LEU A 66 -13.583 2.124 5.864 1.00 0.00 C ATOM 994 O LEU A 66 -12.801 2.350 6.807 1.00 0.00 O ATOM 995 CB LEU A 66 -13.072 1.372 3.526 1.00 0.00 C ATOM 996 CG LEU A 66 -13.416 1.495 2.018 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.901 1.706 1.794 1.00 0.00 C ATOM 998 CD2 LEU A 66 -12.612 2.576 1.331 1.00 0.00 C ATOM 0 H LEU A 66 -11.216 2.961 4.763 1.00 0.00 H new ATOM 0 HA LEU A 66 -14.083 3.189 4.066 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.030 1.062 3.599 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.675 0.560 3.933 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.139 0.544 1.564 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -15.100 1.787 0.725 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.454 0.861 2.203 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -15.218 2.622 2.293 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.889 2.622 0.278 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.817 3.537 1.803 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.549 2.349 1.417 1.00 0.00 H new ATOM 1010 N SER A 67 -14.711 1.504 6.014 1.00 0.00 N ATOM 1011 CA SER A 67 -15.097 0.989 7.307 1.00 0.00 C ATOM 1012 C SER A 67 -15.683 -0.423 7.193 1.00 0.00 C ATOM 1013 O SER A 67 -16.721 -0.623 6.549 1.00 0.00 O ATOM 1014 CB SER A 67 -16.121 1.926 7.957 1.00 0.00 C ATOM 1015 OG SER A 67 -15.626 3.259 8.038 1.00 0.00 O ATOM 0 H SER A 67 -15.384 1.338 5.266 1.00 0.00 H new ATOM 0 HA SER A 67 -14.204 0.936 7.929 1.00 0.00 H new ATOM 0 HB2 SER A 67 -17.046 1.914 7.380 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.364 1.565 8.956 1.00 0.00 H new ATOM 0 HG SER A 67 -16.301 3.834 8.455 1.00 0.00 H new ATOM 1021 N GLY A 68 -14.998 -1.388 7.777 1.00 0.00 N ATOM 1022 CA GLY A 68 -15.514 -2.736 7.881 1.00 0.00 C ATOM 1023 C GLY A 68 -15.219 -3.598 6.671 1.00 0.00 C ATOM 1024 O GLY A 68 -14.401 -4.531 6.750 1.00 0.00 O ATOM 0 H GLY A 68 -14.074 -1.259 8.190 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.089 -3.210 8.766 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -16.593 -2.692 8.030 1.00 0.00 H new ATOM 1028 N GLY A 69 -15.882 -3.285 5.558 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.727 -4.038 4.320 1.00 0.00 C ATOM 1030 C GLY A 69 -14.284 -4.130 3.870 1.00 0.00 C ATOM 1031 O GLY A 69 -13.827 -5.196 3.444 1.00 0.00 O ATOM 0 H GLY A 69 -16.537 -2.506 5.492 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.125 -5.043 4.458 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.319 -3.566 3.536 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.572 -3.013 3.973 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.150 -2.915 3.603 1.00 0.00 C ATOM 1037 C ASP A 70 -11.342 -4.037 4.174 1.00 0.00 C ATOM 1038 O ASP A 70 -10.631 -4.717 3.443 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.550 -1.582 4.051 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.704 -1.323 5.543 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.798 -0.957 5.970 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.740 -1.510 6.309 1.00 0.00 O ATOM 0 H ASP A 70 -13.963 -2.137 4.319 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.111 -2.980 2.516 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.491 -1.563 3.794 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.027 -0.773 3.498 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.520 -4.286 5.453 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.758 -5.279 6.145 1.00 0.00 C ATOM 1049 C HIS A 71 -10.952 -6.637 5.482 1.00 0.00 C ATOM 1050 O HIS A 71 -9.977 -7.278 5.075 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.165 -5.338 7.623 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.290 -6.228 8.460 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.716 -7.412 9.005 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.005 -6.081 8.851 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.738 -7.958 9.692 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -8.683 -7.171 9.615 1.00 0.00 N ATOM 0 H HIS A 71 -12.201 -3.799 6.036 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.703 -5.011 6.094 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.142 -4.330 8.037 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.195 -5.688 7.693 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.352 -5.256 8.606 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.790 -8.894 10.229 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -7.778 -7.345 10.052 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.208 -7.017 5.288 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.503 -8.308 4.738 1.00 0.00 C ATOM 1067 C LEU A 72 -11.922 -8.525 3.349 1.00 0.00 C ATOM 1068 O LEU A 72 -11.094 -9.396 3.189 1.00 0.00 O ATOM 1069 CB LEU A 72 -13.994 -8.757 4.921 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.130 -7.822 4.456 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.386 -7.931 2.964 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.401 -8.104 5.236 1.00 0.00 C ATOM 0 H LEU A 72 -13.025 -6.446 5.505 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.956 -9.017 5.359 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.116 -9.705 4.398 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.148 -8.956 5.982 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.810 -6.799 4.655 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.194 -7.255 2.683 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.481 -7.662 2.419 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.667 -8.955 2.717 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.192 -7.436 4.896 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.705 -9.138 5.075 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.220 -7.940 6.298 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.258 -7.714 2.379 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.720 -7.976 1.066 1.00 0.00 C ATOM 1086 C LEU A 73 -10.400 -7.354 0.737 1.00 0.00 C ATOM 1087 O LEU A 73 -9.500 -8.070 0.343 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.733 -8.013 -0.059 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.498 -9.358 -0.127 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -14.664 -9.315 -1.080 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -12.553 -10.484 -0.533 1.00 0.00 C ATOM 0 H LEU A 73 -12.872 -6.903 2.462 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.429 -9.022 1.163 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.447 -7.200 0.073 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.224 -7.840 -1.007 1.00 0.00 H new ATOM 0 HG LEU A 73 -13.895 -9.543 0.871 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -15.164 -10.284 -1.088 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -15.368 -8.546 -0.760 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.306 -9.084 -2.083 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.104 -11.423 -0.577 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.128 -10.267 -1.513 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -11.751 -10.568 0.200 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.253 -6.047 0.918 1.00 0.00 N ATOM 1104 CA TRP A 74 -8.978 -5.400 0.697 1.00 0.00 C ATOM 1105 C TRP A 74 -7.872 -6.096 1.527 1.00 0.00 C ATOM 1106 O TRP A 74 -6.810 -6.413 1.055 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.022 -3.919 1.135 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.818 -2.880 0.319 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.804 -3.031 -0.617 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.577 -1.494 0.383 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.239 -1.788 -1.063 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.500 -0.832 -0.442 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.679 -0.776 1.092 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.535 0.552 -0.558 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.683 0.610 0.992 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.623 1.263 0.179 1.00 0.00 C ATOM 0 H TRP A 74 -11.002 -5.422 1.216 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.764 -5.468 -0.370 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.414 -3.897 2.152 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -7.991 -3.568 1.183 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.189 -3.980 -0.960 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.984 -1.622 -1.740 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.965 -1.274 1.731 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.249 1.046 -1.200 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.958 1.189 1.544 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.628 2.342 0.133 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.153 -6.338 2.746 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.138 -6.793 3.649 1.00 0.00 C ATOM 1129 C LYS A 75 -6.894 -8.273 3.721 1.00 0.00 C ATOM 1130 O LYS A 75 -5.723 -8.682 3.737 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.186 -6.076 4.949 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.090 -4.584 4.722 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.733 -4.136 4.151 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.659 -4.190 5.252 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.399 -3.510 4.903 1.00 0.00 N ATOM 0 H LYS A 75 -9.080 -6.232 3.158 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.203 -6.493 3.175 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.113 -6.314 5.470 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.367 -6.408 5.587 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.882 -4.277 4.039 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.266 -4.069 5.666 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.447 -4.781 3.320 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.811 -3.123 3.756 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.062 -3.740 6.159 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.444 -5.233 5.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.936 -3.171 5.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.769 -4.176 4.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.601 -2.702 4.280 1.00 0.00 H new ATOM 1149 N SER A 76 -7.947 -9.101 3.737 1.00 0.00 N ATOM 1150 CA SER A 76 -7.714 -10.535 3.757 1.00 0.00 C ATOM 1151 C SER A 76 -7.015 -10.931 2.473 1.00 0.00 C ATOM 1152 O SER A 76 -6.127 -11.789 2.478 1.00 0.00 O ATOM 1153 CB SER A 76 -9.005 -11.316 3.937 1.00 0.00 C ATOM 1154 OG SER A 76 -9.727 -10.808 5.050 1.00 0.00 O ATOM 0 H SER A 76 -8.925 -8.812 3.736 1.00 0.00 H new ATOM 0 HA SER A 76 -7.083 -10.778 4.612 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.613 -11.244 3.035 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.783 -12.372 4.088 1.00 0.00 H new ATOM 0 HG SER A 76 -10.384 -10.150 4.741 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.356 -10.229 1.388 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.715 -10.454 0.127 1.00 0.00 C ATOM 1162 C GLU A 77 -5.299 -9.978 0.130 1.00 0.00 C ATOM 1163 O GLU A 77 -4.480 -10.564 -0.563 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.472 -9.835 -1.026 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.696 -10.601 -1.443 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.343 -11.886 -2.121 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -8.008 -12.856 -1.462 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.362 -11.908 -3.378 1.00 0.00 O ATOM 0 H GLU A 77 -8.074 -9.505 1.376 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.715 -11.534 -0.019 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.767 -8.823 -0.750 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.802 -9.749 -1.881 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.310 -10.809 -0.567 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.297 -9.988 -2.115 1.00 0.00 H new ATOM 1175 N PHE A 78 -4.980 -8.911 0.905 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.598 -8.452 0.950 1.00 0.00 C ATOM 1177 C PHE A 78 -2.720 -9.562 1.424 1.00 0.00 C ATOM 1178 O PHE A 78 -1.751 -9.909 0.770 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.404 -7.201 1.821 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.005 -6.668 1.725 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.616 -5.918 0.629 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.070 -6.945 2.705 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.325 -5.459 0.516 1.00 0.00 C ATOM 1184 CE2 PHE A 78 0.218 -6.481 2.597 1.00 0.00 C ATOM 1185 CZ PHE A 78 0.592 -5.742 1.502 1.00 0.00 C ATOM 0 H PHE A 78 -5.638 -8.383 1.478 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.320 -8.162 -0.063 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.109 -6.430 1.512 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -3.631 -7.442 2.860 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.334 -5.691 -0.145 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -1.356 -7.533 3.565 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.031 -4.877 -0.345 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.937 -6.697 3.373 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.607 -5.383 1.415 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.110 -10.145 2.523 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.411 -11.264 3.099 1.00 0.00 C ATOM 1197 C PHE A 79 -2.300 -12.422 2.111 1.00 0.00 C ATOM 1198 O PHE A 79 -1.230 -13.001 1.937 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.108 -11.690 4.379 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.947 -10.690 5.492 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -1.710 -10.480 6.075 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.025 -9.944 5.936 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.552 -9.540 7.076 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -3.878 -9.006 6.938 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.640 -8.800 7.509 1.00 0.00 C ATOM 0 H PHE A 79 -3.932 -9.854 3.052 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.392 -10.958 3.338 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.169 -11.835 4.178 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.710 -12.652 4.701 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.859 -11.057 5.744 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.997 -10.098 5.491 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.580 -9.383 7.520 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.731 -8.435 7.274 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.519 -8.065 8.291 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.377 -12.695 1.422 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.411 -13.779 0.467 1.00 0.00 C ATOM 1217 C GLU A 80 -2.466 -13.548 -0.714 1.00 0.00 C ATOM 1218 O GLU A 80 -1.551 -14.343 -0.936 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.829 -14.024 -0.032 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.793 -14.473 1.044 1.00 0.00 C ATOM 1221 CD GLU A 80 -5.420 -15.791 1.651 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -5.848 -16.833 1.131 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.709 -15.814 2.676 1.00 0.00 O ATOM 0 H GLU A 80 -4.252 -12.177 1.504 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.063 -14.668 0.994 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.207 -13.107 -0.484 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.801 -14.779 -0.818 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.832 -13.716 1.828 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.795 -14.545 0.620 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.651 -12.458 -1.452 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.851 -12.245 -2.651 1.00 0.00 C ATOM 1232 C ASN A 81 -0.408 -11.855 -2.366 1.00 0.00 C ATOM 1233 O ASN A 81 0.475 -12.167 -3.183 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.476 -11.305 -3.709 1.00 0.00 C ATOM 1235 CG ASN A 81 -2.565 -9.843 -3.308 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -1.585 -9.134 -3.377 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -3.746 -9.363 -3.038 1.00 0.00 N ATOM 0 H ASN A 81 -3.331 -11.725 -1.248 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.844 -13.237 -3.102 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.891 -11.378 -4.626 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -3.479 -11.663 -3.941 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -3.866 -8.363 -2.877 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.551 -9.987 -2.987 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.131 -11.200 -1.228 1.00 0.00 N ATOM 1245 CA CYS A 82 1.260 -10.872 -0.913 1.00 0.00 C ATOM 1246 C CYS A 82 2.020 -12.163 -0.678 1.00 0.00 C ATOM 1247 O CYS A 82 3.073 -12.386 -1.249 1.00 0.00 O ATOM 1248 CB CYS A 82 1.405 -9.912 0.296 1.00 0.00 C ATOM 1249 SG CYS A 82 0.808 -10.542 1.869 1.00 0.00 S ATOM 0 H CYS A 82 -0.821 -10.899 -0.540 1.00 0.00 H new ATOM 0 HA CYS A 82 1.680 -10.333 -1.762 1.00 0.00 H new ATOM 0 HB2 CYS A 82 2.458 -9.653 0.406 1.00 0.00 H new ATOM 0 HB3 CYS A 82 0.871 -8.989 0.069 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.431 -10.186 2.037 1.00 0.00 H new ATOM 1255 N ARG A 83 1.411 -13.057 0.081 1.00 0.00 N ATOM 1256 CA ARG A 83 2.005 -14.330 0.393 1.00 0.00 C ATOM 1257 C ARG A 83 1.978 -15.292 -0.791 1.00 0.00 C ATOM 1258 O ARG A 83 2.782 -16.196 -0.870 1.00 0.00 O ATOM 1259 CB ARG A 83 1.377 -14.925 1.649 1.00 0.00 C ATOM 1260 CG ARG A 83 1.693 -14.111 2.897 1.00 0.00 C ATOM 1261 CD ARG A 83 3.162 -14.237 3.259 1.00 0.00 C ATOM 1262 NE ARG A 83 3.592 -13.283 4.279 1.00 0.00 N ATOM 1263 CZ ARG A 83 3.715 -13.538 5.587 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.121 -14.605 6.130 1.00 0.00 N ATOM 1265 NH2 ARG A 83 4.393 -12.700 6.355 1.00 0.00 N ATOM 0 H ARG A 83 0.490 -12.914 0.495 1.00 0.00 H new ATOM 0 HA ARG A 83 3.060 -14.160 0.605 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.296 -14.982 1.520 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.736 -15.945 1.783 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.443 -13.064 2.728 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.077 -14.455 3.728 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.356 -15.249 3.614 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.763 -14.094 2.361 1.00 0.00 H new ATOM 0 HE ARG A 83 3.819 -12.339 3.966 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.568 -15.233 5.546 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.220 -14.791 7.128 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.818 -11.866 5.949 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.491 -12.888 7.353 1.00 0.00 H new ATOM 1279 N ASP A 84 1.058 -15.087 -1.702 1.00 0.00 N ATOM 1280 CA ASP A 84 0.951 -15.911 -2.916 1.00 0.00 C ATOM 1281 C ASP A 84 2.176 -15.739 -3.787 1.00 0.00 C ATOM 1282 O ASP A 84 2.919 -16.725 -4.106 1.00 0.00 O ATOM 1283 CB ASP A 84 -0.289 -15.523 -3.716 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.483 -16.377 -4.945 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.759 -17.583 -4.803 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.377 -15.853 -6.078 1.00 0.00 O ATOM 0 H ASP A 84 0.356 -14.350 -1.638 1.00 0.00 H new ATOM 0 HA ASP A 84 0.873 -16.953 -2.607 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -1.169 -15.608 -3.078 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.211 -14.478 -4.014 1.00 0.00 H new ATOM 1291 N THR A 85 2.432 -14.504 -4.132 1.00 0.00 N ATOM 1292 CA THR A 85 3.543 -14.197 -4.963 1.00 0.00 C ATOM 1293 C THR A 85 4.837 -14.369 -4.139 1.00 0.00 C ATOM 1294 O THR A 85 5.894 -14.699 -4.681 1.00 0.00 O ATOM 1295 CB THR A 85 3.398 -12.773 -5.607 1.00 0.00 C ATOM 1296 OG1 THR A 85 4.333 -12.585 -6.683 1.00 0.00 O ATOM 1297 CG2 THR A 85 3.605 -11.677 -4.590 1.00 0.00 C ATOM 0 H THR A 85 1.877 -13.698 -3.844 1.00 0.00 H new ATOM 0 HA THR A 85 3.586 -14.887 -5.806 1.00 0.00 H new ATOM 0 HB THR A 85 2.381 -12.715 -5.995 1.00 0.00 H new ATOM 0 HG1 THR A 85 5.137 -13.120 -6.515 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.497 -10.706 -5.074 1.00 0.00 H new ATOM 0 HG22 THR A 85 2.863 -11.772 -3.797 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.605 -11.760 -4.164 1.00 0.00 H new ATOM 1305 N ALA A 86 4.717 -14.217 -2.803 1.00 0.00 N ATOM 1306 CA ALA A 86 5.817 -14.494 -1.911 1.00 0.00 C ATOM 1307 C ALA A 86 6.204 -15.950 -2.003 1.00 0.00 C ATOM 1308 O ALA A 86 7.370 -16.242 -2.062 1.00 0.00 O ATOM 1309 CB ALA A 86 5.504 -14.128 -0.474 1.00 0.00 C ATOM 0 H ALA A 86 3.865 -13.904 -2.338 1.00 0.00 H new ATOM 0 HA ALA A 86 6.653 -13.870 -2.227 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.364 -14.356 0.155 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.280 -13.063 -0.410 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.642 -14.701 -0.132 1.00 0.00 H new ATOM 1315 N LYS A 87 5.206 -16.868 -2.032 1.00 0.00 N ATOM 1316 CA LYS A 87 5.476 -18.316 -2.187 1.00 0.00 C ATOM 1317 C LYS A 87 6.341 -18.553 -3.400 1.00 0.00 C ATOM 1318 O LYS A 87 7.366 -19.243 -3.320 1.00 0.00 O ATOM 1319 CB LYS A 87 4.186 -19.183 -2.316 1.00 0.00 C ATOM 1320 CG LYS A 87 3.275 -19.224 -1.084 1.00 0.00 C ATOM 1321 CD LYS A 87 2.211 -20.339 -1.193 1.00 0.00 C ATOM 1322 CE LYS A 87 1.168 -20.107 -2.300 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.122 -19.111 -1.924 1.00 0.00 N ATOM 0 H LYS A 87 4.217 -16.633 -1.951 1.00 0.00 H new ATOM 0 HA LYS A 87 5.985 -18.625 -1.274 1.00 0.00 H new ATOM 0 HB2 LYS A 87 3.605 -18.810 -3.160 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.482 -20.204 -2.558 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.879 -19.384 -0.191 1.00 0.00 H new ATOM 0 HG3 LYS A 87 2.780 -18.260 -0.966 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.713 -21.289 -1.376 1.00 0.00 H new ATOM 0 HD3 LYS A 87 1.696 -20.429 -0.237 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.676 -19.768 -3.203 1.00 0.00 H new ATOM 0 HE3 LYS A 87 0.687 -21.055 -2.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -0.264 -18.671 -2.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -0.643 -19.589 -1.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.543 -18.377 -1.319 1.00 0.00 H new ATOM 1337 N ARG A 88 5.979 -17.905 -4.511 1.00 0.00 N ATOM 1338 CA ARG A 88 6.753 -18.088 -5.752 1.00 0.00 C ATOM 1339 C ARG A 88 8.133 -17.470 -5.681 1.00 0.00 C ATOM 1340 O ARG A 88 9.079 -18.006 -6.249 1.00 0.00 O ATOM 1341 CB ARG A 88 6.044 -17.582 -7.000 1.00 0.00 C ATOM 1342 CG ARG A 88 5.039 -18.530 -7.598 1.00 0.00 C ATOM 1343 CD ARG A 88 3.921 -18.815 -6.657 1.00 0.00 C ATOM 1344 NE ARG A 88 2.932 -19.710 -7.228 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.660 -19.692 -6.895 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.240 -18.780 -6.035 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.815 -20.554 -7.424 1.00 0.00 N ATOM 0 H ARG A 88 5.184 -17.270 -4.583 1.00 0.00 H new ATOM 0 HA ARG A 88 6.852 -19.170 -5.838 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.538 -16.648 -6.757 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.795 -17.350 -7.756 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.640 -18.104 -8.518 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.534 -19.463 -7.867 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.322 -19.256 -5.744 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.440 -17.879 -6.375 1.00 0.00 H new ATOM 0 HE ARG A 88 3.240 -20.389 -7.924 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.899 -18.107 -5.643 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.257 -18.749 -5.764 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.146 -21.244 -8.099 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.170 -20.531 -7.159 1.00 0.00 H new ATOM 1361 N ASN A 89 8.253 -16.383 -4.981 1.00 0.00 N ATOM 1362 CA ASN A 89 9.517 -15.684 -4.890 1.00 0.00 C ATOM 1363 C ASN A 89 10.449 -16.310 -3.870 1.00 0.00 C ATOM 1364 O ASN A 89 11.664 -16.227 -4.020 1.00 0.00 O ATOM 1365 CB ASN A 89 9.302 -14.181 -4.657 1.00 0.00 C ATOM 1366 CG ASN A 89 8.975 -13.417 -5.956 1.00 0.00 C ATOM 1367 OD1 ASN A 89 8.533 -14.004 -6.942 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.119 -12.108 -5.939 1.00 0.00 N ATOM 0 H ASN A 89 7.491 -15.952 -4.458 1.00 0.00 H new ATOM 0 HA ASN A 89 10.021 -15.789 -5.851 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.490 -14.041 -3.944 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.199 -13.756 -4.206 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.861 -11.556 -6.757 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.488 -11.646 -5.108 1.00 0.00 H new ATOM 1375 N GLN A 90 9.902 -16.948 -2.816 1.00 0.00 N ATOM 1376 CA GLN A 90 10.729 -17.642 -1.843 1.00 0.00 C ATOM 1377 C GLN A 90 11.312 -18.886 -2.457 1.00 0.00 C ATOM 1378 O GLN A 90 12.486 -19.163 -2.284 1.00 0.00 O ATOM 1379 CB GLN A 90 9.975 -18.036 -0.557 1.00 0.00 C ATOM 1380 CG GLN A 90 9.266 -16.915 0.186 1.00 0.00 C ATOM 1381 CD GLN A 90 10.041 -15.630 0.184 1.00 0.00 C ATOM 1382 OE1 GLN A 90 10.891 -15.388 1.036 1.00 0.00 O ATOM 1383 NE2 GLN A 90 9.708 -14.771 -0.731 1.00 0.00 N ATOM 0 H GLN A 90 8.900 -16.990 -2.629 1.00 0.00 H new ATOM 0 HA GLN A 90 11.511 -16.937 -1.559 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.236 -18.795 -0.814 1.00 0.00 H new ATOM 0 HB3 GLN A 90 10.686 -18.501 0.126 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.290 -16.745 -0.269 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.088 -17.224 1.216 1.00 0.00 H new ATOM 0 HE21 GLN A 90 8.997 -15.011 -1.421 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.158 -13.856 -0.760 1.00 0.00 H new ATOM 1392 N GLN A 91 10.486 -19.643 -3.174 1.00 0.00 N ATOM 1393 CA GLN A 91 10.948 -20.869 -3.827 1.00 0.00 C ATOM 1394 C GLN A 91 11.937 -20.547 -4.949 1.00 0.00 C ATOM 1395 O GLN A 91 12.791 -21.362 -5.300 1.00 0.00 O ATOM 1396 CB GLN A 91 9.751 -21.671 -4.352 1.00 0.00 C ATOM 1397 CG GLN A 91 9.027 -21.039 -5.534 1.00 0.00 C ATOM 1398 CD GLN A 91 7.660 -21.638 -5.801 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.217 -21.713 -6.943 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.950 -21.974 -4.757 1.00 0.00 N ATOM 0 H GLN A 91 9.498 -19.433 -3.318 1.00 0.00 H new ATOM 0 HA GLN A 91 11.472 -21.481 -3.093 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.096 -22.663 -4.644 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.038 -21.808 -3.539 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.916 -19.970 -5.352 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.643 -21.148 -6.427 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.351 -21.899 -3.822 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.995 -22.312 -4.877 1.00 0.00 H new ATOM 1409 N ALA A 92 11.815 -19.347 -5.492 1.00 0.00 N ATOM 1410 CA ALA A 92 12.720 -18.873 -6.512 1.00 0.00 C ATOM 1411 C ALA A 92 13.970 -18.294 -5.862 1.00 0.00 C ATOM 1412 O ALA A 92 14.999 -18.108 -6.507 1.00 0.00 O ATOM 1413 CB ALA A 92 12.030 -17.838 -7.376 1.00 0.00 C ATOM 0 H ALA A 92 11.087 -18.680 -5.236 1.00 0.00 H new ATOM 0 HA ALA A 92 13.017 -19.706 -7.150 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.720 -17.486 -8.143 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.157 -18.285 -7.851 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.716 -16.998 -6.757 1.00 0.00 H new ATOM 1419 N GLY A 93 13.871 -18.035 -4.570 1.00 0.00 N ATOM 1420 CA GLY A 93 14.973 -17.517 -3.821 1.00 0.00 C ATOM 1421 C GLY A 93 15.325 -16.107 -4.210 1.00 0.00 C ATOM 1422 O GLY A 93 16.481 -15.806 -4.531 1.00 0.00 O ATOM 0 H GLY A 93 13.022 -18.181 -4.024 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.732 -17.547 -2.758 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.842 -18.158 -3.969 1.00 0.00 H new ATOM 1426 N ASN A 94 14.342 -15.243 -4.212 1.00 0.00 N ATOM 1427 CA ASN A 94 14.562 -13.856 -4.604 1.00 0.00 C ATOM 1428 C ASN A 94 15.241 -13.052 -3.507 1.00 0.00 C ATOM 1429 O ASN A 94 16.099 -12.213 -3.783 1.00 0.00 O ATOM 1430 CB ASN A 94 13.264 -13.162 -5.035 1.00 0.00 C ATOM 1431 CG ASN A 94 12.777 -13.558 -6.423 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.006 -14.671 -6.903 1.00 0.00 O ATOM 1433 ND2 ASN A 94 12.095 -12.654 -7.082 1.00 0.00 N ATOM 0 H ASN A 94 13.382 -15.465 -3.949 1.00 0.00 H new ATOM 0 HA ASN A 94 15.230 -13.893 -5.465 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.484 -13.391 -4.309 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.416 -12.083 -5.009 1.00 0.00 H new ATOM 0 HD21 ASN A 94 11.739 -12.863 -8.015 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.920 -11.741 -6.662 1.00 0.00 H new ATOM 1440 N GLY A 95 14.891 -13.336 -2.271 1.00 0.00 N ATOM 1441 CA GLY A 95 15.425 -12.585 -1.154 1.00 0.00 C ATOM 1442 C GLY A 95 14.521 -11.422 -0.808 1.00 0.00 C ATOM 1443 O GLY A 95 14.941 -10.455 -0.190 1.00 0.00 O ATOM 0 H GLY A 95 14.241 -14.079 -2.014 1.00 0.00 H new ATOM 0 HA2 GLY A 95 15.532 -13.239 -0.288 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.421 -12.217 -1.400 1.00 0.00 H new ATOM 1447 N TRP A 96 13.294 -11.537 -1.211 1.00 0.00 N ATOM 1448 CA TRP A 96 12.274 -10.524 -1.031 1.00 0.00 C ATOM 1449 C TRP A 96 10.974 -11.198 -0.730 1.00 0.00 C ATOM 1450 O TRP A 96 10.927 -12.420 -0.607 1.00 0.00 O ATOM 1451 CB TRP A 96 12.039 -9.697 -2.304 1.00 0.00 C ATOM 1452 CG TRP A 96 13.096 -8.745 -2.689 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.564 -7.710 -1.956 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.763 -8.690 -3.936 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.506 -7.031 -2.653 1.00 0.00 N ATOM 1456 CE2 TRP A 96 14.652 -7.612 -3.883 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.701 -9.460 -5.089 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 15.480 -7.279 -4.944 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 14.515 -9.139 -6.145 1.00 0.00 C ATOM 1460 CH2 TRP A 96 15.398 -8.058 -6.071 1.00 0.00 C ATOM 0 H TRP A 96 12.952 -12.367 -1.694 1.00 0.00 H new ATOM 0 HA TRP A 96 12.614 -9.870 -0.228 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.887 -10.388 -3.133 1.00 0.00 H new ATOM 0 HB3 TRP A 96 11.111 -9.140 -2.179 1.00 0.00 H new ATOM 0 HD1 TRP A 96 13.234 -7.461 -0.958 1.00 0.00 H new ATOM 0 HE1 TRP A 96 15.023 -6.219 -2.316 1.00 0.00 H new ATOM 0 HE3 TRP A 96 13.023 -10.298 -5.154 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 16.160 -6.442 -4.886 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 14.473 -9.731 -7.048 1.00 0.00 H new ATOM 0 HH2 TRP A 96 16.029 -7.831 -6.918 1.00 0.00 H new ATOM 1471 N ASP A 97 9.969 -10.380 -0.498 1.00 0.00 N ATOM 1472 CA ASP A 97 8.558 -10.776 -0.515 1.00 0.00 C ATOM 1473 C ASP A 97 7.959 -11.214 0.791 1.00 0.00 C ATOM 1474 O ASP A 97 7.237 -10.463 1.368 1.00 0.00 O ATOM 1475 CB ASP A 97 8.194 -11.734 -1.660 1.00 0.00 C ATOM 1476 CG ASP A 97 8.428 -11.136 -3.028 1.00 0.00 C ATOM 1477 OD1 ASP A 97 9.573 -11.217 -3.529 1.00 0.00 O ATOM 1478 OD2 ASP A 97 7.485 -10.607 -3.627 1.00 0.00 O ATOM 0 H ASP A 97 10.104 -9.392 -0.285 1.00 0.00 H new ATOM 0 HA ASP A 97 8.073 -9.821 -0.716 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.782 -12.647 -1.563 1.00 0.00 H new ATOM 0 HB3 ASP A 97 7.146 -12.019 -1.569 1.00 0.00 H new ATOM 1483 N PHE A 98 8.294 -12.395 1.270 1.00 0.00 N ATOM 1484 CA PHE A 98 7.624 -12.987 2.456 1.00 0.00 C ATOM 1485 C PHE A 98 7.457 -12.024 3.661 1.00 0.00 C ATOM 1486 O PHE A 98 6.378 -11.916 4.219 1.00 0.00 O ATOM 1487 CB PHE A 98 8.275 -14.325 2.848 1.00 0.00 C ATOM 1488 CG PHE A 98 7.770 -14.913 4.135 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.508 -15.469 4.202 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.551 -14.896 5.275 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.033 -16.001 5.380 1.00 0.00 C ATOM 1492 CE2 PHE A 98 8.084 -15.428 6.462 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.820 -15.980 6.516 1.00 0.00 C ATOM 0 H PHE A 98 9.026 -12.981 0.869 1.00 0.00 H new ATOM 0 HA PHE A 98 6.599 -13.187 2.145 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.109 -15.044 2.046 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.352 -14.180 2.928 1.00 0.00 H new ATOM 0 HD1 PHE A 98 5.886 -15.487 3.320 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.539 -14.461 5.238 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.045 -16.435 5.416 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.706 -15.412 7.345 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.448 -16.394 7.442 1.00 0.00 H new ATOM 1503 N ASP A 99 8.505 -11.379 4.050 1.00 0.00 N ATOM 1504 CA ASP A 99 8.452 -10.366 5.107 1.00 0.00 C ATOM 1505 C ASP A 99 8.136 -8.991 4.524 1.00 0.00 C ATOM 1506 O ASP A 99 7.140 -8.335 4.899 1.00 0.00 O ATOM 1507 CB ASP A 99 9.792 -10.334 5.828 1.00 0.00 C ATOM 1508 CG ASP A 99 10.046 -9.047 6.580 1.00 0.00 C ATOM 1509 OD1 ASP A 99 9.338 -8.763 7.543 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.994 -8.326 6.232 1.00 0.00 O ATOM 0 H ASP A 99 9.435 -11.523 3.657 1.00 0.00 H new ATOM 0 HA ASP A 99 7.660 -10.623 5.810 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.838 -11.169 6.528 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.590 -10.483 5.101 1.00 0.00 H new ATOM 1515 N MET A 100 8.993 -8.581 3.580 1.00 0.00 N ATOM 1516 CA MET A 100 8.943 -7.251 2.960 1.00 0.00 C ATOM 1517 C MET A 100 7.571 -6.949 2.369 1.00 0.00 C ATOM 1518 O MET A 100 6.910 -5.991 2.773 1.00 0.00 O ATOM 1519 CB MET A 100 10.042 -7.100 1.896 1.00 0.00 C ATOM 1520 CG MET A 100 11.446 -7.321 2.422 1.00 0.00 C ATOM 1521 SD MET A 100 12.680 -7.175 1.130 1.00 0.00 S ATOM 1522 CE MET A 100 14.189 -7.550 2.017 1.00 0.00 C ATOM 0 H MET A 100 9.747 -9.168 3.222 1.00 0.00 H new ATOM 0 HA MET A 100 9.124 -6.520 3.748 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.852 -7.808 1.089 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.980 -6.101 1.464 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.657 -6.596 3.208 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.511 -8.310 2.875 1.00 0.00 H new ATOM 0 HE1 MET A 100 15.036 -7.495 1.333 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.326 -6.829 2.823 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.125 -8.554 2.436 1.00 0.00 H new ATOM 1532 N LEU A 101 7.121 -7.794 1.483 1.00 0.00 N ATOM 1533 CA LEU A 101 5.835 -7.637 0.869 1.00 0.00 C ATOM 1534 C LEU A 101 4.819 -8.429 1.666 1.00 0.00 C ATOM 1535 O LEU A 101 4.502 -9.548 1.329 1.00 0.00 O ATOM 1536 CB LEU A 101 5.870 -8.189 -0.561 1.00 0.00 C ATOM 1537 CG LEU A 101 4.521 -8.363 -1.243 1.00 0.00 C ATOM 1538 CD1 LEU A 101 3.848 -7.076 -1.542 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.619 -9.273 -2.425 1.00 0.00 C ATOM 0 H LEU A 101 7.639 -8.614 1.166 1.00 0.00 H new ATOM 0 HA LEU A 101 5.570 -6.580 0.846 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.480 -7.523 -1.171 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.373 -9.156 -0.544 1.00 0.00 H new ATOM 0 HG LEU A 101 3.864 -8.855 -0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.892 -7.270 -2.028 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.680 -6.529 -0.614 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.477 -6.482 -2.204 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.638 -9.375 -2.888 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.320 -8.856 -3.148 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.971 -10.253 -2.102 1.00 0.00 H new ATOM 1551 N THR A 102 4.345 -7.828 2.710 1.00 0.00 N ATOM 1552 CA THR A 102 3.321 -8.341 3.619 1.00 0.00 C ATOM 1553 C THR A 102 3.233 -7.314 4.715 1.00 0.00 C ATOM 1554 O THR A 102 2.159 -6.820 5.068 1.00 0.00 O ATOM 1555 CB THR A 102 3.651 -9.727 4.325 1.00 0.00 C ATOM 1556 OG1 THR A 102 3.943 -10.776 3.405 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.469 -10.185 5.129 1.00 0.00 C ATOM 0 H THR A 102 4.673 -6.902 2.985 1.00 0.00 H new ATOM 0 HA THR A 102 2.418 -8.513 3.033 1.00 0.00 H new ATOM 0 HB THR A 102 4.530 -9.539 4.941 1.00 0.00 H new ATOM 0 HG1 THR A 102 3.713 -10.488 2.497 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.702 -11.135 5.610 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.236 -9.440 5.890 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.609 -10.313 4.471 1.00 0.00 H new ATOM 1661 N ASP A 111 11.864 0.538 6.292 1.00 0.00 N ATOM 1662 CA ASP A 111 13.265 0.244 5.957 1.00 0.00 C ATOM 1663 C ASP A 111 13.356 -0.546 4.656 1.00 0.00 C ATOM 1664 O ASP A 111 13.936 -0.078 3.676 1.00 0.00 O ATOM 1665 CB ASP A 111 13.961 -0.533 7.088 1.00 0.00 C ATOM 1666 CG ASP A 111 13.998 0.226 8.394 1.00 0.00 C ATOM 1667 OD1 ASP A 111 14.953 1.006 8.624 1.00 0.00 O ATOM 1668 OD2 ASP A 111 13.074 0.056 9.218 1.00 0.00 O ATOM 0 HA ASP A 111 13.776 1.198 5.830 1.00 0.00 H new ATOM 0 HB2 ASP A 111 13.445 -1.481 7.240 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.980 -0.770 6.784 1.00 0.00 H new ATOM 1673 N ALA A 112 12.736 -1.715 4.628 1.00 0.00 N ATOM 1674 CA ALA A 112 12.719 -2.578 3.428 1.00 0.00 C ATOM 1675 C ALA A 112 12.043 -1.868 2.262 1.00 0.00 C ATOM 1676 O ALA A 112 12.402 -2.055 1.130 1.00 0.00 O ATOM 1677 CB ALA A 112 12.014 -3.892 3.719 1.00 0.00 C ATOM 0 H ALA A 112 12.230 -2.102 5.424 1.00 0.00 H new ATOM 0 HA ALA A 112 13.752 -2.791 3.154 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.013 -4.511 2.822 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.536 -4.415 4.520 1.00 0.00 H new ATOM 0 HB3 ALA A 112 10.986 -3.694 4.024 1.00 0.00 H new ATOM 1683 N GLN A 113 11.084 -1.042 2.581 1.00 0.00 N ATOM 1684 CA GLN A 113 10.381 -0.218 1.602 1.00 0.00 C ATOM 1685 C GLN A 113 11.296 0.849 1.021 1.00 0.00 C ATOM 1686 O GLN A 113 11.107 1.294 -0.075 1.00 0.00 O ATOM 1687 CB GLN A 113 9.145 0.360 2.291 1.00 0.00 C ATOM 1688 CG GLN A 113 8.381 1.517 1.627 1.00 0.00 C ATOM 1689 CD GLN A 113 8.792 2.934 2.107 1.00 0.00 C ATOM 1690 OE1 GLN A 113 7.989 3.806 2.170 1.00 0.00 O ATOM 1691 NE2 GLN A 113 10.030 3.162 2.455 1.00 0.00 N ATOM 0 H GLN A 113 10.755 -0.912 3.538 1.00 0.00 H new ATOM 0 HA GLN A 113 10.063 -0.814 0.747 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.439 -0.458 2.435 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.450 0.696 3.282 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.528 1.458 0.549 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.315 1.382 1.811 1.00 0.00 H new ATOM 0 HE21 GLN A 113 10.721 2.414 2.401 1.00 0.00 H new ATOM 0 HE22 GLN A 113 10.306 4.088 2.780 1.00 0.00 H new ATOM 1700 N MET A 114 12.258 1.301 1.801 1.00 0.00 N ATOM 1701 CA MET A 114 13.240 2.242 1.304 1.00 0.00 C ATOM 1702 C MET A 114 14.203 1.519 0.378 1.00 0.00 C ATOM 1703 O MET A 114 14.785 2.111 -0.523 1.00 0.00 O ATOM 1704 CB MET A 114 13.974 2.935 2.456 1.00 0.00 C ATOM 1705 CG MET A 114 15.012 3.945 2.004 1.00 0.00 C ATOM 1706 SD MET A 114 15.844 4.794 3.365 1.00 0.00 S ATOM 1707 CE MET A 114 14.485 5.706 4.115 1.00 0.00 C ATOM 0 H MET A 114 12.380 1.033 2.778 1.00 0.00 H new ATOM 0 HA MET A 114 12.734 3.025 0.739 1.00 0.00 H new ATOM 0 HB2 MET A 114 13.243 3.438 3.089 1.00 0.00 H new ATOM 0 HB3 MET A 114 14.461 2.178 3.071 1.00 0.00 H new ATOM 0 HG2 MET A 114 15.759 3.436 1.394 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.531 4.686 1.366 1.00 0.00 H new ATOM 0 HE1 MET A 114 14.884 6.480 4.770 1.00 0.00 H new ATOM 0 HE2 MET A 114 13.882 6.168 3.333 1.00 0.00 H new ATOM 0 HE3 MET A 114 13.865 5.023 4.696 1.00 0.00 H new ATOM 1717 N GLN A 115 14.324 0.216 0.589 1.00 0.00 N ATOM 1718 CA GLN A 115 15.118 -0.634 -0.285 1.00 0.00 C ATOM 1719 C GLN A 115 14.126 -1.234 -1.303 1.00 0.00 C ATOM 1720 O GLN A 115 14.318 -2.363 -1.769 1.00 0.00 O ATOM 1721 CB GLN A 115 15.772 -1.834 0.474 1.00 0.00 C ATOM 1722 CG GLN A 115 16.276 -1.642 1.922 1.00 0.00 C ATOM 1723 CD GLN A 115 17.061 -0.380 2.210 1.00 0.00 C ATOM 1724 OE1 GLN A 115 18.268 -0.318 2.008 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.406 0.568 2.817 1.00 0.00 N ATOM 0 H GLN A 115 13.879 -0.277 1.363 1.00 0.00 H new ATOM 0 HA GLN A 115 15.918 -0.040 -0.728 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.045 -2.646 0.488 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.618 -2.174 -0.123 1.00 0.00 H new ATOM 0 HG2 GLN A 115 15.413 -1.665 2.588 1.00 0.00 H new ATOM 0 HG3 GLN A 115 16.901 -2.497 2.180 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.401 0.479 2.966 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.898 1.400 3.143 1.00 0.00 H new ATOM 1734 N TYR A 116 13.095 -0.414 -1.651 1.00 0.00 N ATOM 1735 CA TYR A 116 11.922 -0.774 -2.445 1.00 0.00 C ATOM 1736 C TYR A 116 12.185 -1.684 -3.614 1.00 0.00 C ATOM 1737 O TYR A 116 11.418 -2.571 -3.833 1.00 0.00 O ATOM 1738 CB TYR A 116 11.126 0.480 -2.918 1.00 0.00 C ATOM 1739 CG TYR A 116 11.930 1.577 -3.622 1.00 0.00 C ATOM 1740 CD1 TYR A 116 12.514 2.611 -2.897 1.00 0.00 C ATOM 1741 CD2 TYR A 116 12.082 1.591 -5.006 1.00 0.00 C ATOM 1742 CE1 TYR A 116 13.227 3.618 -3.524 1.00 0.00 C ATOM 1743 CE2 TYR A 116 12.795 2.602 -5.641 1.00 0.00 C ATOM 1744 CZ TYR A 116 13.363 3.608 -4.891 1.00 0.00 C ATOM 1745 OH TYR A 116 14.079 4.615 -5.517 1.00 0.00 O ATOM 0 H TYR A 116 13.075 0.564 -1.362 1.00 0.00 H new ATOM 0 HA TYR A 116 11.316 -1.353 -1.748 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.338 0.148 -3.594 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.637 0.920 -2.049 1.00 0.00 H new ATOM 0 HD1 TYR A 116 12.409 2.628 -1.822 1.00 0.00 H new ATOM 0 HD2 TYR A 116 11.638 0.803 -5.597 1.00 0.00 H new ATOM 0 HE1 TYR A 116 13.675 4.409 -2.941 1.00 0.00 H new ATOM 0 HE2 TYR A 116 12.903 2.598 -6.716 1.00 0.00 H new ATOM 0 HH TYR A 116 13.462 5.307 -5.833 1.00 0.00 H new ATOM 1755 N ASP A 117 13.280 -1.438 -4.345 1.00 0.00 N ATOM 1756 CA ASP A 117 13.672 -2.195 -5.561 1.00 0.00 C ATOM 1757 C ASP A 117 12.597 -2.172 -6.672 1.00 0.00 C ATOM 1758 O ASP A 117 11.433 -2.315 -6.420 1.00 0.00 O ATOM 1759 CB ASP A 117 14.076 -3.647 -5.235 1.00 0.00 C ATOM 1760 CG ASP A 117 14.371 -4.463 -6.479 1.00 0.00 C ATOM 1761 OD1 ASP A 117 15.470 -4.303 -7.076 1.00 0.00 O ATOM 1762 OD2 ASP A 117 13.508 -5.255 -6.905 1.00 0.00 O ATOM 0 H ASP A 117 13.937 -0.694 -4.111 1.00 0.00 H new ATOM 0 HA ASP A 117 14.545 -1.673 -5.951 1.00 0.00 H new ATOM 0 HB2 ASP A 117 14.956 -3.640 -4.592 1.00 0.00 H new ATOM 0 HB3 ASP A 117 13.275 -4.126 -4.672 1.00 0.00 H new ATOM 1767 N PRO A 118 12.983 -1.941 -7.920 1.00 0.00 N ATOM 1768 CA PRO A 118 12.053 -1.996 -9.065 1.00 0.00 C ATOM 1769 C PRO A 118 11.123 -3.260 -9.089 1.00 0.00 C ATOM 1770 O PRO A 118 9.935 -3.164 -9.449 1.00 0.00 O ATOM 1771 CB PRO A 118 13.000 -1.988 -10.254 1.00 0.00 C ATOM 1772 CG PRO A 118 14.142 -1.157 -9.784 1.00 0.00 C ATOM 1773 CD PRO A 118 14.336 -1.519 -8.343 1.00 0.00 C ATOM 0 HA PRO A 118 11.340 -1.172 -9.041 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.320 -2.996 -10.519 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.529 -1.560 -11.139 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.041 -1.362 -10.364 1.00 0.00 H new ATOM 0 HG3 PRO A 118 13.926 -0.094 -9.896 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.065 -2.321 -8.223 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.695 -0.672 -7.759 1.00 0.00 H new ATOM 1781 N GLY A 119 11.613 -4.391 -8.604 1.00 0.00 N ATOM 1782 CA GLY A 119 10.837 -5.607 -8.650 1.00 0.00 C ATOM 1783 C GLY A 119 9.948 -5.692 -7.432 1.00 0.00 C ATOM 1784 O GLY A 119 8.741 -5.878 -7.550 1.00 0.00 O ATOM 0 H GLY A 119 12.536 -4.486 -8.179 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.231 -5.629 -9.556 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.500 -6.471 -8.689 1.00 0.00 H new ATOM 1788 N LEU A 120 10.556 -5.539 -6.278 1.00 0.00 N ATOM 1789 CA LEU A 120 9.817 -5.529 -5.009 1.00 0.00 C ATOM 1790 C LEU A 120 8.745 -4.404 -4.999 1.00 0.00 C ATOM 1791 O LEU A 120 7.632 -4.604 -4.497 1.00 0.00 O ATOM 1792 CB LEU A 120 10.774 -5.381 -3.823 1.00 0.00 C ATOM 1793 CG LEU A 120 10.132 -5.352 -2.431 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.407 -6.656 -2.128 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.176 -5.043 -1.372 1.00 0.00 C ATOM 0 H LEU A 120 11.564 -5.418 -6.178 1.00 0.00 H new ATOM 0 HA LEU A 120 9.302 -6.485 -4.911 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.487 -6.205 -3.854 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.344 -4.461 -3.956 1.00 0.00 H new ATOM 0 HG LEU A 120 9.387 -4.557 -2.417 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.963 -6.603 -1.134 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.623 -6.817 -2.868 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.116 -7.483 -2.165 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.704 -5.026 -0.390 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.950 -5.810 -1.389 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.624 -4.071 -1.576 1.00 0.00 H new ATOM 1807 N PHE A 121 9.080 -3.234 -5.550 1.00 0.00 N ATOM 1808 CA PHE A 121 8.105 -2.159 -5.723 1.00 0.00 C ATOM 1809 C PHE A 121 6.926 -2.628 -6.577 1.00 0.00 C ATOM 1810 O PHE A 121 5.768 -2.420 -6.210 1.00 0.00 O ATOM 1811 CB PHE A 121 8.728 -0.883 -6.335 1.00 0.00 C ATOM 1812 CG PHE A 121 7.701 0.167 -6.670 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.037 0.848 -5.669 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.382 0.448 -7.993 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.073 1.784 -5.976 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.423 1.387 -8.303 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.766 2.054 -7.294 1.00 0.00 C ATOM 0 H PHE A 121 10.018 -3.009 -5.883 1.00 0.00 H new ATOM 0 HA PHE A 121 7.748 -1.900 -4.726 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.452 -0.466 -5.635 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.276 -1.150 -7.239 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.275 0.645 -4.635 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.892 -0.076 -8.788 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.557 2.307 -5.184 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.187 1.599 -9.335 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.011 2.788 -7.534 1.00 0.00 H new ATOM 1827 N ALA A 122 7.222 -3.280 -7.703 1.00 0.00 N ATOM 1828 CA ALA A 122 6.175 -3.810 -8.573 1.00 0.00 C ATOM 1829 C ALA A 122 5.278 -4.784 -7.799 1.00 0.00 C ATOM 1830 O ALA A 122 4.044 -4.799 -7.983 1.00 0.00 O ATOM 1831 CB ALA A 122 6.785 -4.491 -9.773 1.00 0.00 C ATOM 0 H ALA A 122 8.172 -3.452 -8.031 1.00 0.00 H new ATOM 0 HA ALA A 122 5.560 -2.980 -8.922 1.00 0.00 H new ATOM 0 HB1 ALA A 122 5.993 -4.881 -10.412 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.383 -3.773 -10.334 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.421 -5.312 -9.441 1.00 0.00 H new ATOM 1837 N GLN A 123 5.902 -5.596 -6.965 1.00 0.00 N ATOM 1838 CA GLN A 123 5.211 -6.498 -6.068 1.00 0.00 C ATOM 1839 C GLN A 123 4.267 -5.741 -5.118 1.00 0.00 C ATOM 1840 O GLN A 123 3.068 -5.977 -5.135 1.00 0.00 O ATOM 1841 CB GLN A 123 6.226 -7.296 -5.261 1.00 0.00 C ATOM 1842 CG GLN A 123 7.110 -8.202 -6.096 1.00 0.00 C ATOM 1843 CD GLN A 123 6.344 -9.352 -6.699 1.00 0.00 C ATOM 1844 OE1 GLN A 123 5.794 -9.254 -7.796 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.310 -10.444 -6.008 1.00 0.00 N ATOM 0 H GLN A 123 6.918 -5.646 -6.892 1.00 0.00 H new ATOM 0 HA GLN A 123 4.605 -7.174 -6.671 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.857 -6.603 -4.705 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.695 -7.902 -4.527 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.574 -7.620 -6.892 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.917 -8.592 -5.475 1.00 0.00 H new ATOM 0 HE21 GLN A 123 6.777 -10.489 -5.102 1.00 0.00 H new ATOM 0 HE22 GLN A 123 5.816 -11.260 -6.368 1.00 0.00 H new ATOM 1854 N ILE A 124 4.805 -4.806 -4.324 1.00 0.00 N ATOM 1855 CA ILE A 124 4.003 -4.079 -3.316 1.00 0.00 C ATOM 1856 C ILE A 124 2.876 -3.240 -3.926 1.00 0.00 C ATOM 1857 O ILE A 124 1.767 -3.217 -3.389 1.00 0.00 O ATOM 1858 CB ILE A 124 4.864 -3.219 -2.322 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.815 -2.285 -3.065 1.00 0.00 C ATOM 1860 CG2 ILE A 124 5.639 -4.109 -1.359 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.609 -1.351 -2.174 1.00 0.00 C ATOM 0 H ILE A 124 5.787 -4.532 -4.355 1.00 0.00 H new ATOM 0 HA ILE A 124 3.538 -4.871 -2.729 1.00 0.00 H new ATOM 0 HB ILE A 124 4.173 -2.604 -1.745 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.511 -2.887 -3.649 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.238 -1.688 -3.772 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.226 -3.488 -0.682 1.00 0.00 H new ATOM 0 HG22 ILE A 124 4.941 -4.715 -0.782 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.305 -4.762 -1.923 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.257 -0.726 -2.788 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.925 -0.719 -1.608 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.217 -1.936 -1.484 1.00 0.00 H new ATOM 1873 N GLN A 125 3.162 -2.594 -5.042 1.00 0.00 N ATOM 1874 CA GLN A 125 2.200 -1.766 -5.766 1.00 0.00 C ATOM 1875 C GLN A 125 0.966 -2.627 -6.123 1.00 0.00 C ATOM 1876 O GLN A 125 -0.203 -2.319 -5.719 1.00 0.00 O ATOM 1877 CB GLN A 125 2.899 -1.267 -7.063 1.00 0.00 C ATOM 1878 CG GLN A 125 2.376 0.004 -7.710 1.00 0.00 C ATOM 1879 CD GLN A 125 0.936 -0.025 -8.085 1.00 0.00 C ATOM 1880 OE1 GLN A 125 0.560 -0.415 -9.188 1.00 0.00 O ATOM 1881 NE2 GLN A 125 0.133 0.405 -7.194 1.00 0.00 N ATOM 0 H GLN A 125 4.082 -2.627 -5.482 1.00 0.00 H new ATOM 0 HA GLN A 125 1.873 -0.918 -5.165 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.955 -1.117 -6.837 1.00 0.00 H new ATOM 0 HB3 GLN A 125 2.842 -2.066 -7.802 1.00 0.00 H new ATOM 0 HG2 GLN A 125 2.540 0.836 -7.025 1.00 0.00 H new ATOM 0 HG3 GLN A 125 2.965 0.206 -8.605 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.492 0.718 -6.292 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -0.869 0.436 -7.382 1.00 0.00 H new ATOM 1890 N ALA A 126 1.242 -3.728 -6.819 1.00 0.00 N ATOM 1891 CA ALA A 126 0.216 -4.620 -7.292 1.00 0.00 C ATOM 1892 C ALA A 126 -0.503 -5.271 -6.144 1.00 0.00 C ATOM 1893 O ALA A 126 -1.729 -5.287 -6.123 1.00 0.00 O ATOM 1894 CB ALA A 126 0.797 -5.679 -8.220 1.00 0.00 C ATOM 0 H ALA A 126 2.189 -4.017 -7.065 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.503 -4.026 -7.856 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.000 -6.339 -8.563 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.261 -5.195 -9.079 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.546 -6.262 -7.683 1.00 0.00 H new ATOM 1900 N ALA A 127 0.264 -5.755 -5.163 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.289 -6.462 -4.027 1.00 0.00 C ATOM 1902 C ALA A 127 -1.282 -5.622 -3.288 1.00 0.00 C ATOM 1903 O ALA A 127 -2.376 -6.098 -2.954 1.00 0.00 O ATOM 1904 CB ALA A 127 0.794 -6.909 -3.080 1.00 0.00 C ATOM 0 H ALA A 127 1.280 -5.663 -5.143 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.799 -7.341 -4.421 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.346 -7.437 -2.238 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.481 -7.575 -3.602 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.339 -6.039 -2.714 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.920 -4.363 -3.052 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.778 -3.483 -2.337 1.00 0.00 C ATOM 1912 C ALA A 128 -3.099 -3.304 -3.049 1.00 0.00 C ATOM 1913 O ALA A 128 -4.076 -3.713 -2.548 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.108 -2.144 -2.071 1.00 0.00 C ATOM 0 H ALA A 128 -0.037 -3.951 -3.353 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.984 -3.943 -1.370 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.793 -1.497 -1.523 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.205 -2.300 -1.481 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.845 -1.674 -3.019 1.00 0.00 H new ATOM 1920 N THR A 129 -3.111 -2.775 -4.231 1.00 0.00 N ATOM 1921 CA THR A 129 -4.431 -2.549 -4.875 1.00 0.00 C ATOM 1922 C THR A 129 -5.250 -3.887 -5.136 1.00 0.00 C ATOM 1923 O THR A 129 -6.541 -3.935 -4.983 1.00 0.00 O ATOM 1924 CB THR A 129 -4.323 -1.665 -6.156 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.612 -1.460 -6.738 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.381 -2.263 -7.187 1.00 0.00 C ATOM 0 H THR A 129 -2.292 -2.495 -4.770 1.00 0.00 H new ATOM 0 HA THR A 129 -5.015 -1.986 -4.147 1.00 0.00 H new ATOM 0 HB THR A 129 -3.910 -0.705 -5.845 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.575 -1.666 -7.695 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.338 -1.613 -8.061 1.00 0.00 H new ATOM 0 HG22 THR A 129 -2.384 -2.359 -6.757 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.744 -3.247 -7.484 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.499 -4.992 -5.364 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.087 -6.294 -5.734 1.00 0.00 C ATOM 1936 C LYS A 130 -5.859 -6.817 -4.569 1.00 0.00 C ATOM 1937 O LYS A 130 -6.763 -7.601 -4.696 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.998 -7.301 -6.165 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.522 -8.682 -6.562 1.00 0.00 C ATOM 1940 CD LYS A 130 -3.388 -9.611 -6.967 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.894 -11.026 -7.249 1.00 0.00 C ATOM 1942 NZ LYS A 130 -4.904 -11.068 -8.333 1.00 0.00 N ATOM 0 H LYS A 130 -3.481 -5.003 -5.297 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.752 -6.158 -6.587 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.447 -6.881 -7.007 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.288 -7.419 -5.347 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.071 -9.118 -5.727 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.225 -8.582 -7.389 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.893 -9.217 -7.855 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -2.641 -9.642 -6.174 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.051 -11.662 -7.519 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -4.327 -11.441 -6.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -5.112 -12.058 -8.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -5.776 -10.599 -8.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -4.534 -10.577 -9.172 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.443 -6.391 -3.445 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.083 -6.605 -2.221 1.00 0.00 C ATOM 1958 C ALA A 131 -7.146 -5.552 -2.041 1.00 0.00 C ATOM 1959 O ALA A 131 -8.348 -5.858 -2.087 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.011 -6.470 -1.212 1.00 0.00 C ATOM 0 H ALA A 131 -4.586 -5.846 -3.353 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.574 -7.575 -2.145 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.427 -6.624 -0.216 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.238 -7.214 -1.401 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.577 -5.472 -1.274 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.690 -4.306 -2.003 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.447 -3.119 -1.631 1.00 0.00 C ATOM 1968 C TRP A 132 -8.537 -2.697 -2.644 1.00 0.00 C ATOM 1969 O TRP A 132 -8.837 -1.521 -2.788 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.543 -1.905 -1.284 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.563 -2.152 -0.174 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.004 -3.315 0.091 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.029 -1.236 0.808 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.093 -3.225 1.026 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.083 -1.974 1.525 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.209 0.121 1.148 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.322 -1.427 2.527 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.453 0.632 2.154 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.521 -0.139 2.821 1.00 0.00 C ATOM 0 H TRP A 132 -5.724 -4.085 -2.246 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.969 -3.434 -0.728 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.993 -1.611 -2.178 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.178 -1.063 -1.009 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.267 -4.237 -0.406 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.484 -3.985 1.330 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.926 0.735 0.624 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.589 -2.016 3.059 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.584 1.665 2.439 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.934 0.314 3.606 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.088 -3.618 -3.369 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.243 -3.310 -4.150 1.00 0.00 C ATOM 1992 C ARG A 133 -11.575 -4.028 -3.754 1.00 0.00 C ATOM 1993 O ARG A 133 -12.594 -3.360 -3.620 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.938 -3.424 -5.657 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.132 -3.178 -6.609 1.00 0.00 C ATOM 1996 CD ARG A 133 -12.072 -4.365 -6.651 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.525 -4.031 -6.360 1.00 0.00 N ATOM 1998 CZ ARG A 133 -14.563 -4.831 -6.662 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -14.414 -5.784 -7.559 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.756 -4.644 -6.078 1.00 0.00 N ATOM 0 H ARG A 133 -8.760 -4.582 -3.437 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.458 -2.270 -3.904 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.150 -2.713 -5.903 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.541 -4.420 -5.853 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.679 -2.293 -6.285 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.760 -2.973 -7.613 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -12.009 -4.827 -7.636 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.732 -5.107 -5.929 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.727 -3.141 -5.905 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -13.514 -5.913 -8.021 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -15.199 -6.393 -7.791 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.880 -3.892 -5.401 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -16.539 -5.254 -6.311 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.537 -5.358 -3.547 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.755 -6.281 -3.735 1.00 0.00 C ATOM 2016 C LYS A 134 -14.080 -6.077 -2.971 1.00 0.00 C ATOM 2017 O LYS A 134 -14.902 -6.969 -2.992 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.403 -7.766 -3.700 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.841 -8.300 -4.999 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.511 -7.717 -5.296 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.497 -8.225 -4.330 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.973 -9.560 -4.735 1.00 0.00 N ATOM 0 H LYS A 134 -10.695 -5.850 -3.250 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.008 -5.907 -4.727 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.677 -7.937 -2.905 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.297 -8.334 -3.443 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.759 -9.385 -4.942 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.529 -8.074 -5.814 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.214 -7.971 -6.313 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.563 -6.630 -5.242 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.672 -7.516 -4.261 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.942 -8.294 -3.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -9.320 -10.284 -4.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.300 -9.784 -5.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -7.933 -9.545 -4.718 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.337 -4.941 -2.452 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.565 -4.702 -1.679 1.00 0.00 C ATOM 2038 C LEU A 135 -16.844 -4.743 -2.535 1.00 0.00 C ATOM 2039 O LEU A 135 -16.971 -4.008 -3.517 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.462 -3.370 -0.949 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.823 -3.384 0.442 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.592 -4.246 0.464 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.452 -1.972 0.837 1.00 0.00 C ATOM 0 H LEU A 135 -13.725 -4.129 -2.531 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.651 -5.519 -0.962 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -14.892 -2.684 -1.576 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.466 -2.957 -0.856 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.544 -3.796 1.148 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.159 -4.237 1.464 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.858 -5.268 0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.864 -3.859 -0.249 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -13.997 -1.979 1.827 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.744 -1.566 0.115 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.348 -1.352 0.854 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.792 -5.626 -2.202 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.080 -5.653 -2.847 1.00 0.00 C ATOM 2057 C PRO A 136 -19.980 -4.603 -2.197 1.00 0.00 C ATOM 2058 O PRO A 136 -20.599 -4.860 -1.148 1.00 0.00 O ATOM 2059 CB PRO A 136 -19.617 -7.077 -2.585 1.00 0.00 C ATOM 2060 CG PRO A 136 -18.594 -7.748 -1.713 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.690 -6.673 -1.181 1.00 0.00 C ATOM 0 HA PRO A 136 -19.036 -5.432 -3.913 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.589 -7.044 -2.092 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -19.752 -7.622 -3.519 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -19.077 -8.284 -0.896 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -18.025 -8.482 -2.283 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.016 -6.318 -0.204 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -16.665 -7.027 -1.066 1.00 0.00 H new