USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=27 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 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 115 GLN :FLIP amide:sc= -0.31 F(o=-1.2,f=-0.31) USER MOD Set 2.1: A 89 ASN : amide:sc= 0.702 K(o=0.44,f=-1.3!) USER MOD Set 2.2: A 94 ASN : amide:sc= -0.267 K(o=0.44,f=-0.68) USER MOD Set 3.1: A 81 ASN : amide:sc= -0.0597 K(o=-0.048,f=-6!) USER MOD Set 3.2: A 82 CYS SG : rot 31:sc= 0.0118 USER MOD Set 4.1: A 59 ASN : amide:sc= -0.183 K(o=0.71,f=-4.7) USER MOD Set 4.2: A 75 LYS NZ :NH3+ 142:sc= 0.891 (180deg=-1.55) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= 0.819 K(o=0.82,f=-3.7!) USER MOD Single : A 17 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 25 LYS NZ :NH3+ -159:sc= 0.233 (180deg=-0.886!) USER MOD Single : A 28 LYS NZ :NH3+ -166:sc= -0.0232 (180deg=-0.205) USER MOD Single : A 29 THR OG1 : rot 56:sc= 0.826 USER MOD Single : A 32 SER OG : rot 75:sc= 0.125 USER MOD Single : A 33 GLN : amide:sc= -0.12 K(o=-0.12,f=-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 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.0108 USER MOD Single : A 47 SER OG : rot 67:sc= 1.03 USER MOD Single : A 51 ASN : amide:sc= 0.16 X(o=0.16,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0643 USER MOD Single : A 60 THR OG1 : rot 76:sc= 1.08 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HE2:sc= 1.13 K(o=1.1,f=-6!) USER MOD Single : A 76 SER OG : rot -108:sc= 1.22 USER MOD Single : A 85 THR OG1 : rot 91:sc= 1.22 USER MOD Single : A 87 LYS NZ :NH3+ 177:sc= 0.361 (180deg=0.358) USER MOD Single : A 90 GLN : amide:sc= 1.55 K(o=1.6,f=-0.18) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN :FLIP amide:sc= -1.58 F(o=-4.6!,f=-1.6) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 125 GLN : amide:sc= 1.15 K(o=1.1,f=-0.81) USER MOD Single : A 129 THR OG1 : rot -160:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -172:sc= -0.0209 (180deg=-0.103) USER MOD Single : A 134 LYS NZ :NH3+ 149:sc= 0.781 (180deg=0.313) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 2.934 8.819 2.216 1.00 0.00 N ATOM 2 CA PRO A 1 3.623 8.361 1.035 1.00 0.00 C ATOM 3 C PRO A 1 5.136 8.430 1.254 1.00 0.00 C ATOM 4 O PRO A 1 5.585 8.891 2.296 1.00 0.00 O ATOM 5 CB PRO A 1 3.209 9.229 -0.135 1.00 0.00 C ATOM 6 CG PRO A 1 1.938 9.857 0.338 1.00 0.00 C ATOM 7 CD PRO A 1 1.981 9.867 1.867 1.00 0.00 C ATOM 0 H2 PRO A 1 3.607 9.174 2.895 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.447 8.040 2.658 1.00 0.00 H new ATOM 0 HA PRO A 1 3.360 7.324 0.825 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.966 9.978 -0.368 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.055 8.640 -1.039 1.00 0.00 H new ATOM 0 HG2 PRO A 1 1.842 10.871 -0.051 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.075 9.295 -0.019 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.301 10.837 2.248 1.00 0.00 H new ATOM 0 HD3 PRO A 1 0.998 9.666 2.292 1.00 0.00 H new ATOM 17 N VAL A 2 5.897 7.942 0.280 1.00 0.00 N ATOM 18 CA VAL A 2 7.370 7.961 0.298 1.00 0.00 C ATOM 19 C VAL A 2 7.908 8.583 -0.978 1.00 0.00 C ATOM 20 O VAL A 2 7.409 8.305 -2.061 1.00 0.00 O ATOM 21 CB VAL A 2 7.991 6.520 0.492 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.523 6.525 0.353 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.602 5.953 1.846 1.00 0.00 C ATOM 0 H VAL A 2 5.509 7.514 -0.561 1.00 0.00 H new ATOM 0 HA VAL A 2 7.667 8.565 1.155 1.00 0.00 H new ATOM 0 HB VAL A 2 7.586 5.889 -0.299 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.904 5.514 0.494 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.797 6.881 -0.640 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.955 7.184 1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.037 4.961 1.964 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.973 6.608 2.635 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.516 5.883 1.913 1.00 0.00 H new ATOM 33 N THR A 3 8.907 9.409 -0.839 1.00 0.00 N ATOM 34 CA THR A 3 9.547 10.054 -1.947 1.00 0.00 C ATOM 35 C THR A 3 11.056 9.949 -1.755 1.00 0.00 C ATOM 36 O THR A 3 11.536 9.705 -0.613 1.00 0.00 O ATOM 37 CB THR A 3 9.094 11.552 -2.058 1.00 0.00 C ATOM 38 OG1 THR A 3 9.747 12.218 -3.141 1.00 0.00 O ATOM 39 CG2 THR A 3 9.341 12.332 -0.762 1.00 0.00 C ATOM 0 H THR A 3 9.306 9.656 0.067 1.00 0.00 H new ATOM 0 HA THR A 3 9.261 9.564 -2.878 1.00 0.00 H new ATOM 0 HB THR A 3 8.021 11.528 -2.246 1.00 0.00 H new ATOM 0 HG1 THR A 3 9.442 13.148 -3.184 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.011 13.363 -0.889 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.783 11.870 0.053 1.00 0.00 H new ATOM 0 HG23 THR A 3 10.405 12.318 -0.526 1.00 0.00 H new ATOM 228 N HIS A 16 9.979 10.232 4.042 1.00 0.00 N ATOM 229 CA HIS A 16 8.654 9.743 4.214 1.00 0.00 C ATOM 230 C HIS A 16 7.771 10.945 4.374 1.00 0.00 C ATOM 231 O HIS A 16 8.139 11.896 5.061 1.00 0.00 O ATOM 232 CB HIS A 16 8.556 8.833 5.451 1.00 0.00 C ATOM 233 CG HIS A 16 7.149 8.324 5.748 1.00 0.00 C ATOM 234 ND1 HIS A 16 6.423 8.690 6.852 1.00 0.00 N ATOM 235 CD2 HIS A 16 6.354 7.474 5.066 1.00 0.00 C ATOM 236 CE1 HIS A 16 5.245 8.087 6.828 1.00 0.00 C ATOM 237 NE2 HIS A 16 5.184 7.349 5.752 1.00 0.00 N ATOM 0 HA HIS A 16 8.351 9.142 3.357 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.217 7.978 5.311 1.00 0.00 H new ATOM 0 HB3 HIS A 16 8.922 9.380 6.320 1.00 0.00 H new ATOM 0 HD2 HIS A 16 6.602 6.979 4.139 1.00 0.00 H new ATOM 0 HE1 HIS A 16 4.467 8.188 7.571 1.00 0.00 H new ATOM 0 HE2 HIS A 16 4.390 6.773 5.471 1.00 0.00 H new ATOM 246 N ASN A 17 6.638 10.921 3.778 1.00 0.00 N ATOM 247 CA ASN A 17 5.720 12.003 3.873 1.00 0.00 C ATOM 248 C ASN A 17 4.513 11.593 4.607 1.00 0.00 C ATOM 249 O ASN A 17 4.123 10.411 4.579 1.00 0.00 O ATOM 250 CB ASN A 17 5.285 12.475 2.479 1.00 0.00 C ATOM 251 CG ASN A 17 6.362 13.166 1.676 1.00 0.00 C ATOM 252 OD1 ASN A 17 7.301 13.726 2.216 1.00 0.00 O ATOM 253 ND2 ASN A 17 6.204 13.172 0.392 1.00 0.00 N ATOM 0 H ASN A 17 6.314 10.143 3.203 1.00 0.00 H new ATOM 0 HA ASN A 17 6.227 12.812 4.399 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.928 11.613 1.915 1.00 0.00 H new ATOM 0 HB3 ASN A 17 4.441 13.156 2.589 1.00 0.00 H new ATOM 0 HD21 ASN A 17 6.877 13.656 -0.202 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.406 12.693 -0.026 1.00 0.00 H new ATOM 260 N GLY A 18 3.911 12.551 5.250 1.00 0.00 N ATOM 261 CA GLY A 18 2.653 12.351 5.875 1.00 0.00 C ATOM 262 C GLY A 18 1.596 12.331 4.807 1.00 0.00 C ATOM 263 O GLY A 18 1.868 12.702 3.638 1.00 0.00 O ATOM 0 H GLY A 18 4.287 13.494 5.351 1.00 0.00 H new ATOM 0 HA2 GLY A 18 2.650 11.413 6.431 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.454 13.147 6.592 1.00 0.00 H new ATOM 267 N PHE A 19 0.433 11.945 5.159 1.00 0.00 N ATOM 268 CA PHE A 19 -0.635 11.799 4.203 1.00 0.00 C ATOM 269 C PHE A 19 -1.184 13.119 3.847 1.00 0.00 C ATOM 270 O PHE A 19 -1.487 13.931 4.744 1.00 0.00 O ATOM 271 CB PHE A 19 -1.733 10.905 4.767 1.00 0.00 C ATOM 272 CG PHE A 19 -1.258 9.517 4.939 1.00 0.00 C ATOM 273 CD1 PHE A 19 -0.641 9.125 6.108 1.00 0.00 C ATOM 274 CD2 PHE A 19 -1.403 8.606 3.917 1.00 0.00 C ATOM 275 CE1 PHE A 19 -0.161 7.857 6.256 1.00 0.00 C ATOM 276 CE2 PHE A 19 -0.941 7.339 4.052 1.00 0.00 C ATOM 277 CZ PHE A 19 -0.320 6.957 5.230 1.00 0.00 C ATOM 0 H PHE A 19 0.175 11.716 6.119 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.235 11.332 3.303 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.069 11.299 5.726 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.594 10.917 4.099 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.536 9.832 6.918 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.889 8.904 3.000 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.338 7.564 7.168 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -1.056 6.631 3.245 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.041 5.946 5.343 1.00 0.00 H new ATOM 287 N ASP A 20 -1.298 13.376 2.579 1.00 0.00 N ATOM 288 CA ASP A 20 -1.877 14.595 2.127 1.00 0.00 C ATOM 289 C ASP A 20 -3.334 14.446 2.309 1.00 0.00 C ATOM 290 O ASP A 20 -3.911 13.445 1.876 1.00 0.00 O ATOM 291 CB ASP A 20 -1.503 14.891 0.664 1.00 0.00 C ATOM 292 CG ASP A 20 -0.017 15.148 0.504 1.00 0.00 C ATOM 293 OD1 ASP A 20 0.413 16.311 0.644 1.00 0.00 O ATOM 294 OD2 ASP A 20 0.751 14.196 0.281 1.00 0.00 O ATOM 0 H ASP A 20 -0.993 12.748 1.836 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.502 15.447 2.694 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.796 14.049 0.036 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.062 15.759 0.314 1.00 0.00 H new ATOM 299 N PHE A 21 -3.926 15.385 2.995 1.00 0.00 N ATOM 300 CA PHE A 21 -5.301 15.265 3.399 1.00 0.00 C ATOM 301 C PHE A 21 -6.230 15.137 2.226 1.00 0.00 C ATOM 302 O PHE A 21 -7.127 14.344 2.273 1.00 0.00 O ATOM 303 CB PHE A 21 -5.737 16.401 4.309 1.00 0.00 C ATOM 304 CG PHE A 21 -7.090 16.165 4.903 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.295 15.071 5.711 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.153 17.012 4.638 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.526 14.815 6.247 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.388 16.763 5.171 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.572 15.661 5.978 1.00 0.00 C ATOM 0 H PHE A 21 -3.473 16.250 3.289 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.364 14.341 3.973 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.007 16.523 5.110 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.748 17.333 3.743 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.472 14.405 5.925 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.006 17.875 4.006 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.674 13.952 6.879 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.214 17.426 4.961 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.546 15.462 6.401 1.00 0.00 H new ATOM 319 N ALA A 22 -5.960 15.883 1.169 1.00 0.00 N ATOM 320 CA ALA A 22 -6.767 15.888 -0.041 1.00 0.00 C ATOM 321 C ALA A 22 -7.022 14.465 -0.579 1.00 0.00 C ATOM 322 O ALA A 22 -8.156 14.116 -0.973 1.00 0.00 O ATOM 323 CB ALA A 22 -6.082 16.740 -1.095 1.00 0.00 C ATOM 0 H ALA A 22 -5.160 16.514 1.126 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.741 16.311 0.203 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.683 16.747 -2.004 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.973 17.759 -0.724 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.098 16.326 -1.314 1.00 0.00 H new ATOM 329 N VAL A 23 -5.989 13.632 -0.522 1.00 0.00 N ATOM 330 CA VAL A 23 -6.063 12.277 -1.042 1.00 0.00 C ATOM 331 C VAL A 23 -6.910 11.386 -0.108 1.00 0.00 C ATOM 332 O VAL A 23 -7.821 10.700 -0.568 1.00 0.00 O ATOM 333 CB VAL A 23 -4.649 11.666 -1.195 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.714 10.280 -1.835 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.738 12.591 -1.988 1.00 0.00 C ATOM 0 H VAL A 23 -5.085 13.876 -0.117 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.535 12.322 -2.023 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.225 11.553 -0.197 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.706 9.875 -1.930 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.313 9.618 -1.210 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.169 10.356 -2.823 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.751 12.138 -2.081 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.158 12.752 -2.981 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.651 13.547 -1.471 1.00 0.00 H new ATOM 345 N ILE A 24 -6.606 11.435 1.209 1.00 0.00 N ATOM 346 CA ILE A 24 -7.328 10.647 2.240 1.00 0.00 C ATOM 347 C ILE A 24 -8.797 11.017 2.180 1.00 0.00 C ATOM 348 O ILE A 24 -9.674 10.158 2.027 1.00 0.00 O ATOM 349 CB ILE A 24 -6.812 10.976 3.688 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.339 10.621 3.864 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.646 10.274 4.754 1.00 0.00 C ATOM 352 CD1 ILE A 24 -5.029 9.135 3.696 1.00 0.00 C ATOM 0 H ILE A 24 -5.859 12.017 1.588 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.162 9.589 2.039 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.920 12.053 3.815 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.751 11.187 3.141 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -5.016 10.938 4.856 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.260 10.525 5.742 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.684 10.599 4.677 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.592 9.195 4.607 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.961 8.968 3.837 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.587 8.561 4.436 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.318 8.814 2.695 1.00 0.00 H new ATOM 364 N LYS A 25 -9.016 12.328 2.249 1.00 0.00 N ATOM 365 CA LYS A 25 -10.306 12.978 2.230 1.00 0.00 C ATOM 366 C LYS A 25 -11.209 12.398 1.146 1.00 0.00 C ATOM 367 O LYS A 25 -12.301 11.911 1.437 1.00 0.00 O ATOM 368 CB LYS A 25 -10.061 14.461 1.974 1.00 0.00 C ATOM 369 CG LYS A 25 -11.268 15.357 1.929 1.00 0.00 C ATOM 370 CD LYS A 25 -10.865 16.778 1.527 1.00 0.00 C ATOM 371 CE LYS A 25 -10.485 16.892 0.038 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.641 16.787 -0.892 1.00 0.00 N ATOM 0 H LYS A 25 -8.248 12.995 2.324 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.814 12.821 3.182 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.393 14.832 2.751 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.532 14.558 1.026 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.994 14.963 1.218 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.754 15.372 2.905 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.689 17.459 1.740 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.021 17.098 2.138 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.985 17.847 -0.127 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.766 16.110 -0.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.302 16.517 -1.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.303 16.065 -0.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.127 17.705 -0.947 1.00 0.00 H new ATOM 386 N GLU A 26 -10.722 12.364 -0.082 1.00 0.00 N ATOM 387 CA GLU A 26 -11.557 11.907 -1.168 1.00 0.00 C ATOM 388 C GLU A 26 -11.743 10.400 -1.275 1.00 0.00 C ATOM 389 O GLU A 26 -12.784 9.959 -1.763 1.00 0.00 O ATOM 390 CB GLU A 26 -11.237 12.582 -2.482 1.00 0.00 C ATOM 391 CG GLU A 26 -11.823 13.969 -2.547 1.00 0.00 C ATOM 392 CD GLU A 26 -11.308 14.823 -3.640 1.00 0.00 C ATOM 393 OE1 GLU A 26 -11.521 14.495 -4.827 1.00 0.00 O ATOM 394 OE2 GLU A 26 -10.723 15.874 -3.333 1.00 0.00 O ATOM 0 H GLU A 26 -9.776 12.641 -0.344 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.554 12.246 -0.888 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.156 12.636 -2.611 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.626 11.982 -3.305 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -12.904 13.884 -2.654 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.635 14.470 -1.597 1.00 0.00 H new ATOM 401 N LEU A 27 -10.778 9.598 -0.831 1.00 0.00 N ATOM 402 CA LEU A 27 -10.997 8.145 -0.830 1.00 0.00 C ATOM 403 C LEU A 27 -11.963 7.807 0.319 1.00 0.00 C ATOM 404 O LEU A 27 -12.603 6.791 0.310 1.00 0.00 O ATOM 405 CB LEU A 27 -9.686 7.328 -0.752 1.00 0.00 C ATOM 406 CG LEU A 27 -9.827 5.821 -1.040 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.646 5.574 -2.279 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.472 5.190 -1.213 1.00 0.00 C ATOM 0 H LEU A 27 -9.871 9.907 -0.480 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.439 7.856 -1.784 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.972 7.750 -1.459 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.260 7.452 0.243 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.336 5.373 -0.187 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.726 4.501 -2.454 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.642 5.996 -2.147 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.163 6.046 -3.135 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.590 4.125 -1.416 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.954 5.663 -2.047 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.889 5.324 -0.301 1.00 0.00 H new ATOM 420 N LYS A 28 -12.044 8.711 1.308 1.00 0.00 N ATOM 421 CA LYS A 28 -13.011 8.598 2.418 1.00 0.00 C ATOM 422 C LYS A 28 -14.410 9.080 1.963 1.00 0.00 C ATOM 423 O LYS A 28 -15.449 8.497 2.348 1.00 0.00 O ATOM 424 CB LYS A 28 -12.518 9.417 3.611 1.00 0.00 C ATOM 425 CG LYS A 28 -13.407 9.407 4.859 1.00 0.00 C ATOM 426 CD LYS A 28 -13.575 8.019 5.456 1.00 0.00 C ATOM 427 CE LYS A 28 -14.384 8.060 6.757 1.00 0.00 C ATOM 428 NZ LYS A 28 -13.693 8.834 7.831 1.00 0.00 N ATOM 0 H LYS A 28 -11.447 9.536 1.364 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.094 7.553 2.718 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.531 9.051 3.892 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.394 10.451 3.288 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -12.977 10.070 5.610 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -14.388 9.808 4.603 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -14.075 7.371 4.736 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.594 7.584 5.650 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.359 8.506 6.562 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.562 7.042 7.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.148 8.641 8.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -12.693 8.550 7.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -13.756 9.851 7.621 1.00 0.00 H new ATOM 442 N THR A 29 -14.438 10.138 1.160 1.00 0.00 N ATOM 443 CA THR A 29 -15.674 10.603 0.558 1.00 0.00 C ATOM 444 C THR A 29 -16.276 9.449 -0.241 1.00 0.00 C ATOM 445 O THR A 29 -17.441 9.055 -0.054 1.00 0.00 O ATOM 446 CB THR A 29 -15.400 11.818 -0.372 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.696 12.852 0.348 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.691 12.417 -0.925 1.00 0.00 C ATOM 0 H THR A 29 -13.615 10.688 0.913 1.00 0.00 H new ATOM 0 HA THR A 29 -16.369 10.926 1.333 1.00 0.00 H new ATOM 0 HB THR A 29 -14.797 11.449 -1.202 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.873 12.482 0.730 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.453 13.263 -1.569 1.00 0.00 H new ATOM 0 HG22 THR A 29 -17.225 11.661 -1.501 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.318 12.755 -0.100 1.00 0.00 H new ATOM 456 N ALA A 30 -15.434 8.847 -1.062 1.00 0.00 N ATOM 457 CA ALA A 30 -15.820 7.733 -1.847 1.00 0.00 C ATOM 458 C ALA A 30 -16.044 6.535 -0.994 1.00 0.00 C ATOM 459 O ALA A 30 -16.863 5.774 -1.297 1.00 0.00 O ATOM 460 CB ALA A 30 -14.796 7.424 -2.916 1.00 0.00 C ATOM 0 H ALA A 30 -14.463 9.133 -1.189 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.756 7.994 -2.340 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -15.126 6.564 -3.498 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -14.685 8.286 -3.574 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.838 7.199 -2.448 1.00 0.00 H new ATOM 466 N ALA A 31 -15.337 6.396 0.103 1.00 0.00 N ATOM 467 CA ALA A 31 -15.507 5.229 1.010 1.00 0.00 C ATOM 468 C ALA A 31 -16.971 5.081 1.389 1.00 0.00 C ATOM 469 O ALA A 31 -17.535 3.974 1.441 1.00 0.00 O ATOM 470 CB ALA A 31 -14.685 5.450 2.275 1.00 0.00 C ATOM 0 H ALA A 31 -14.631 7.065 0.410 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.170 4.326 0.501 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.807 4.597 2.942 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.633 5.557 2.011 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.027 6.355 2.777 1.00 0.00 H new ATOM 476 N SER A 32 -17.578 6.211 1.610 1.00 0.00 N ATOM 477 CA SER A 32 -18.956 6.297 1.965 1.00 0.00 C ATOM 478 C SER A 32 -19.892 6.034 0.758 1.00 0.00 C ATOM 479 O SER A 32 -20.749 5.143 0.816 1.00 0.00 O ATOM 480 CB SER A 32 -19.212 7.664 2.576 1.00 0.00 C ATOM 481 OG SER A 32 -18.297 7.906 3.651 1.00 0.00 O ATOM 0 H SER A 32 -17.113 7.117 1.546 1.00 0.00 H new ATOM 0 HA SER A 32 -19.182 5.518 2.693 1.00 0.00 H new ATOM 0 HB2 SER A 32 -19.102 8.437 1.815 1.00 0.00 H new ATOM 0 HB3 SER A 32 -20.237 7.720 2.942 1.00 0.00 H new ATOM 0 HG SER A 32 -17.410 8.106 3.286 1.00 0.00 H new ATOM 487 N GLN A 33 -19.698 6.771 -0.339 1.00 0.00 N ATOM 488 CA GLN A 33 -20.648 6.717 -1.487 1.00 0.00 C ATOM 489 C GLN A 33 -20.340 5.610 -2.501 1.00 0.00 C ATOM 490 O GLN A 33 -21.227 4.926 -2.987 1.00 0.00 O ATOM 491 CB GLN A 33 -20.567 8.016 -2.263 1.00 0.00 C ATOM 492 CG GLN A 33 -20.286 9.242 -1.442 1.00 0.00 C ATOM 493 CD GLN A 33 -20.236 10.481 -2.288 1.00 0.00 C ATOM 494 OE1 GLN A 33 -19.174 10.865 -2.767 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.373 11.086 -2.523 1.00 0.00 N ATOM 0 H GLN A 33 -18.911 7.406 -0.470 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.626 6.529 -1.044 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.788 7.920 -3.019 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -21.508 8.162 -2.792 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -21.057 9.353 -0.680 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.337 9.120 -0.920 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -22.234 10.734 -2.105 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -21.398 11.909 -3.124 1.00 0.00 H new ATOM 504 N TYR A 34 -19.076 5.471 -2.776 1.00 0.00 N ATOM 505 CA TYR A 34 -18.514 4.699 -3.878 1.00 0.00 C ATOM 506 C TYR A 34 -17.454 3.711 -3.350 1.00 0.00 C ATOM 507 O TYR A 34 -16.546 3.402 -4.061 1.00 0.00 O ATOM 508 CB TYR A 34 -17.749 5.681 -4.799 1.00 0.00 C ATOM 509 CG TYR A 34 -18.516 6.814 -5.410 1.00 0.00 C ATOM 510 CD1 TYR A 34 -19.392 6.623 -6.466 1.00 0.00 C ATOM 511 CD2 TYR A 34 -18.335 8.092 -4.924 1.00 0.00 C ATOM 512 CE1 TYR A 34 -20.083 7.688 -7.022 1.00 0.00 C ATOM 513 CE2 TYR A 34 -19.004 9.167 -5.458 1.00 0.00 C ATOM 514 CZ TYR A 34 -19.877 8.972 -6.510 1.00 0.00 C ATOM 515 OH TYR A 34 -20.544 10.051 -7.050 1.00 0.00 O ATOM 0 H TYR A 34 -18.354 5.916 -2.209 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.319 4.170 -4.387 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.926 6.106 -4.224 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.306 5.102 -5.609 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -19.539 5.629 -6.862 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.651 8.252 -4.104 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -20.771 7.528 -7.839 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.848 10.158 -5.058 1.00 0.00 H new ATOM 0 HH TYR A 34 -20.285 10.868 -6.574 1.00 0.00 H new ATOM 525 N GLY A 35 -17.578 3.241 -2.101 1.00 0.00 N ATOM 526 CA GLY A 35 -16.507 2.393 -1.529 1.00 0.00 C ATOM 527 C GLY A 35 -16.340 1.083 -2.252 1.00 0.00 C ATOM 528 O GLY A 35 -15.218 0.596 -2.485 1.00 0.00 O ATOM 0 H GLY A 35 -18.371 3.419 -1.485 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -15.565 2.940 -1.558 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -16.729 2.196 -0.480 1.00 0.00 H new ATOM 532 N ALA A 36 -17.463 0.504 -2.538 1.00 0.00 N ATOM 533 CA ALA A 36 -17.565 -0.664 -3.350 1.00 0.00 C ATOM 534 C ALA A 36 -17.197 -0.284 -4.759 1.00 0.00 C ATOM 535 O ALA A 36 -17.289 0.870 -5.114 1.00 0.00 O ATOM 536 CB ALA A 36 -18.948 -1.275 -3.252 1.00 0.00 C ATOM 0 H ALA A 36 -18.364 0.844 -2.201 1.00 0.00 H new ATOM 0 HA ALA A 36 -16.877 -1.434 -3.002 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -18.998 -2.164 -3.881 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -19.152 -1.550 -2.217 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -19.690 -0.551 -3.587 1.00 0.00 H new ATOM 542 N THR A 37 -16.835 -1.254 -5.529 1.00 0.00 N ATOM 543 CA THR A 37 -16.151 -1.090 -6.801 1.00 0.00 C ATOM 544 C THR A 37 -16.786 -0.114 -7.824 1.00 0.00 C ATOM 545 O THR A 37 -17.547 -0.484 -8.725 1.00 0.00 O ATOM 546 CB THR A 37 -15.815 -2.464 -7.430 1.00 0.00 C ATOM 547 OG1 THR A 37 -15.021 -2.311 -8.595 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.065 -3.291 -7.739 1.00 0.00 C ATOM 0 H THR A 37 -17.008 -2.231 -5.294 1.00 0.00 H new ATOM 0 HA THR A 37 -15.228 -0.574 -6.535 1.00 0.00 H new ATOM 0 HB THR A 37 -15.242 -3.014 -6.684 1.00 0.00 H new ATOM 0 HG1 THR A 37 -14.821 -3.193 -8.973 1.00 0.00 H new ATOM 0 HG21 THR A 37 -16.771 -4.244 -8.178 1.00 0.00 H new ATOM 0 HG22 THR A 37 -17.619 -3.471 -6.818 1.00 0.00 H new ATOM 0 HG23 THR A 37 -17.697 -2.747 -8.441 1.00 0.00 H new ATOM 556 N ALA A 38 -16.511 1.123 -7.603 1.00 0.00 N ATOM 557 CA ALA A 38 -16.815 2.148 -8.504 1.00 0.00 C ATOM 558 C ALA A 38 -15.524 2.608 -9.072 1.00 0.00 C ATOM 559 O ALA A 38 -14.543 2.706 -8.330 1.00 0.00 O ATOM 560 CB ALA A 38 -17.514 3.301 -7.807 1.00 0.00 C ATOM 0 H ALA A 38 -16.050 1.448 -6.753 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.490 1.786 -9.280 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.738 4.083 -8.533 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.442 2.946 -7.358 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.865 3.703 -7.029 1.00 0.00 H new ATOM 566 N PRO A 39 -15.469 2.880 -10.379 1.00 0.00 N ATOM 567 CA PRO A 39 -14.242 3.353 -11.074 1.00 0.00 C ATOM 568 C PRO A 39 -13.476 4.440 -10.292 1.00 0.00 C ATOM 569 O PRO A 39 -12.246 4.516 -10.349 1.00 0.00 O ATOM 570 CB PRO A 39 -14.812 3.933 -12.373 1.00 0.00 C ATOM 571 CG PRO A 39 -15.977 3.053 -12.661 1.00 0.00 C ATOM 572 CD PRO A 39 -16.593 2.721 -11.335 1.00 0.00 C ATOM 0 HA PRO A 39 -13.511 2.555 -11.206 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -15.115 4.973 -12.250 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.080 3.907 -13.180 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.695 3.558 -13.307 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.662 2.148 -13.180 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.419 3.391 -11.098 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.991 1.706 -11.321 1.00 0.00 H new ATOM 580 N TYR A 40 -14.213 5.253 -9.559 1.00 0.00 N ATOM 581 CA TYR A 40 -13.643 6.322 -8.794 1.00 0.00 C ATOM 582 C TYR A 40 -12.735 5.794 -7.647 1.00 0.00 C ATOM 583 O TYR A 40 -11.513 6.002 -7.675 1.00 0.00 O ATOM 584 CB TYR A 40 -14.760 7.225 -8.240 1.00 0.00 C ATOM 585 CG TYR A 40 -14.294 8.501 -7.573 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.606 9.477 -8.294 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.569 8.750 -6.236 1.00 0.00 C ATOM 588 CE1 TYR A 40 -13.210 10.645 -7.706 1.00 0.00 C ATOM 589 CE2 TYR A 40 -14.164 9.933 -5.634 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.484 10.868 -6.379 1.00 0.00 C ATOM 591 OH TYR A 40 -13.089 12.041 -5.794 1.00 0.00 O ATOM 0 H TYR A 40 -15.228 5.182 -9.484 1.00 0.00 H new ATOM 0 HA TYR A 40 -13.008 6.909 -9.457 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.431 7.487 -9.058 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.344 6.651 -7.520 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.382 9.306 -9.337 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -15.105 8.013 -5.656 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.683 11.391 -8.283 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.380 10.117 -4.592 1.00 0.00 H new ATOM 0 HH TYR A 40 -13.359 12.044 -4.852 1.00 0.00 H new ATOM 601 N THR A 41 -13.338 5.136 -6.621 1.00 0.00 N ATOM 602 CA THR A 41 -12.609 4.633 -5.427 1.00 0.00 C ATOM 603 C THR A 41 -11.300 3.900 -5.760 1.00 0.00 C ATOM 604 O THR A 41 -10.227 4.284 -5.280 1.00 0.00 O ATOM 605 CB THR A 41 -13.517 3.732 -4.499 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.824 3.363 -3.309 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.994 2.449 -5.194 1.00 0.00 C ATOM 0 H THR A 41 -14.339 4.940 -6.599 1.00 0.00 H new ATOM 0 HA THR A 41 -12.338 5.534 -4.877 1.00 0.00 H new ATOM 0 HB THR A 41 -14.389 4.342 -4.260 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.406 2.807 -2.750 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.613 1.872 -4.507 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.577 2.709 -6.077 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.131 1.854 -5.492 1.00 0.00 H new ATOM 615 N LEU A 42 -11.356 2.890 -6.614 1.00 0.00 N ATOM 616 CA LEU A 42 -10.173 2.133 -6.895 1.00 0.00 C ATOM 617 C LEU A 42 -9.146 2.873 -7.733 1.00 0.00 C ATOM 618 O LEU A 42 -7.977 2.578 -7.658 1.00 0.00 O ATOM 619 CB LEU A 42 -10.381 0.639 -7.275 1.00 0.00 C ATOM 620 CG LEU A 42 -11.463 0.212 -8.298 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.828 0.219 -7.654 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.445 1.071 -9.562 1.00 0.00 C ATOM 0 H LEU A 42 -12.195 2.589 -7.110 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.710 2.042 -5.913 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.426 0.271 -7.650 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.589 0.102 -6.350 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.229 -0.805 -8.612 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.577 -0.083 -8.386 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.838 -0.477 -6.815 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.056 1.223 -7.295 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.223 0.729 -10.245 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.627 2.112 -9.297 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.473 0.985 -10.047 1.00 0.00 H new ATOM 634 N ALA A 43 -9.574 3.888 -8.479 1.00 0.00 N ATOM 635 CA ALA A 43 -8.631 4.706 -9.212 1.00 0.00 C ATOM 636 C ALA A 43 -7.737 5.431 -8.222 1.00 0.00 C ATOM 637 O ALA A 43 -6.530 5.571 -8.430 1.00 0.00 O ATOM 638 CB ALA A 43 -9.346 5.707 -10.115 1.00 0.00 C ATOM 0 H ALA A 43 -10.552 4.155 -8.587 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.030 4.062 -9.854 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.609 6.305 -10.651 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.968 5.171 -10.832 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.972 6.361 -9.509 1.00 0.00 H new ATOM 644 N ILE A 44 -8.334 5.827 -7.128 1.00 0.00 N ATOM 645 CA ILE A 44 -7.632 6.514 -6.061 1.00 0.00 C ATOM 646 C ILE A 44 -6.732 5.514 -5.295 1.00 0.00 C ATOM 647 O ILE A 44 -5.602 5.854 -4.886 1.00 0.00 O ATOM 648 CB ILE A 44 -8.646 7.169 -5.125 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.587 8.063 -5.940 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.939 7.996 -4.071 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.795 8.550 -5.182 1.00 0.00 C ATOM 0 H ILE A 44 -9.327 5.684 -6.946 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.994 7.292 -6.480 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.221 6.389 -4.625 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -9.027 8.926 -6.300 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.922 7.511 -6.818 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.677 8.455 -3.413 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.281 7.354 -3.486 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.350 8.775 -4.555 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.406 9.175 -5.833 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.382 7.696 -4.845 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.473 9.132 -4.319 1.00 0.00 H new ATOM 663 N VAL A 45 -7.199 4.271 -5.155 1.00 0.00 N ATOM 664 CA VAL A 45 -6.376 3.218 -4.534 1.00 0.00 C ATOM 665 C VAL A 45 -5.106 3.000 -5.413 1.00 0.00 C ATOM 666 O VAL A 45 -4.017 2.726 -4.917 1.00 0.00 O ATOM 667 CB VAL A 45 -7.170 1.851 -4.390 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.323 0.753 -3.741 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.449 2.020 -3.565 1.00 0.00 C ATOM 0 H VAL A 45 -8.125 3.967 -5.456 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.101 3.540 -3.529 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.425 1.554 -5.407 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.910 -0.162 -3.665 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.439 0.567 -4.351 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.016 1.071 -2.745 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.963 1.062 -3.490 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.194 2.374 -2.566 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.102 2.745 -4.051 1.00 0.00 H new ATOM 679 N GLU A 46 -5.252 3.173 -6.703 1.00 0.00 N ATOM 680 CA GLU A 46 -4.127 3.049 -7.620 1.00 0.00 C ATOM 681 C GLU A 46 -3.242 4.293 -7.509 1.00 0.00 C ATOM 682 O GLU A 46 -2.032 4.217 -7.669 1.00 0.00 O ATOM 683 CB GLU A 46 -4.607 2.908 -9.069 1.00 0.00 C ATOM 684 CG GLU A 46 -5.587 1.788 -9.284 1.00 0.00 C ATOM 685 CD GLU A 46 -5.944 1.576 -10.735 1.00 0.00 C ATOM 686 OE1 GLU A 46 -6.699 2.382 -11.294 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.466 0.593 -11.351 1.00 0.00 O ATOM 0 H GLU A 46 -6.139 3.401 -7.151 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.564 2.155 -7.350 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.068 3.845 -9.381 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.742 2.749 -9.713 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.168 0.866 -8.882 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.496 1.997 -8.720 1.00 0.00 H new ATOM 694 N SER A 47 -3.861 5.433 -7.243 1.00 0.00 N ATOM 695 CA SER A 47 -3.147 6.703 -7.084 1.00 0.00 C ATOM 696 C SER A 47 -2.223 6.683 -5.865 1.00 0.00 C ATOM 697 O SER A 47 -1.125 7.257 -5.907 1.00 0.00 O ATOM 698 CB SER A 47 -4.132 7.863 -7.021 1.00 0.00 C ATOM 699 OG SER A 47 -4.936 7.879 -8.186 1.00 0.00 O ATOM 0 H SER A 47 -4.872 5.510 -7.130 1.00 0.00 H new ATOM 0 HA SER A 47 -2.512 6.844 -7.959 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.761 7.769 -6.136 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.592 8.805 -6.929 1.00 0.00 H new ATOM 0 HG SER A 47 -5.515 7.089 -8.195 1.00 0.00 H new ATOM 705 N VAL A 48 -2.641 6.003 -4.791 1.00 0.00 N ATOM 706 CA VAL A 48 -1.763 5.834 -3.662 1.00 0.00 C ATOM 707 C VAL A 48 -0.666 4.827 -3.977 1.00 0.00 C ATOM 708 O VAL A 48 0.486 5.068 -3.644 1.00 0.00 O ATOM 709 CB VAL A 48 -2.461 5.528 -2.304 1.00 0.00 C ATOM 710 CG1 VAL A 48 -3.316 6.702 -1.876 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.290 4.258 -2.366 1.00 0.00 C ATOM 0 H VAL A 48 -3.562 5.576 -4.694 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.316 6.816 -3.505 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.680 5.369 -1.561 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.798 6.474 -0.925 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.689 7.586 -1.762 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -4.078 6.892 -2.632 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.759 4.082 -1.398 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.061 4.364 -3.129 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.646 3.415 -2.615 1.00 0.00 H new ATOM 721 N ALA A 49 -1.013 3.758 -4.720 1.00 0.00 N ATOM 722 CA ALA A 49 -0.061 2.713 -5.125 1.00 0.00 C ATOM 723 C ALA A 49 0.930 3.273 -6.172 1.00 0.00 C ATOM 724 O ALA A 49 1.942 2.665 -6.503 1.00 0.00 O ATOM 725 CB ALA A 49 -0.831 1.491 -5.678 1.00 0.00 C ATOM 0 H ALA A 49 -1.963 3.597 -5.055 1.00 0.00 H new ATOM 0 HA ALA A 49 0.515 2.390 -4.258 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.122 0.719 -5.977 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.492 1.097 -4.906 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.423 1.794 -6.542 1.00 0.00 H new ATOM 731 N ASP A 50 0.632 4.446 -6.653 1.00 0.00 N ATOM 732 CA ASP A 50 1.436 5.149 -7.614 1.00 0.00 C ATOM 733 C ASP A 50 2.579 5.895 -6.900 1.00 0.00 C ATOM 734 O ASP A 50 3.228 6.769 -7.450 1.00 0.00 O ATOM 735 CB ASP A 50 0.526 6.090 -8.409 1.00 0.00 C ATOM 736 CG ASP A 50 1.175 6.807 -9.572 1.00 0.00 C ATOM 737 OD1 ASP A 50 1.393 6.167 -10.639 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.402 8.040 -9.477 1.00 0.00 O ATOM 0 H ASP A 50 -0.206 4.958 -6.378 1.00 0.00 H new ATOM 0 HA ASP A 50 1.905 4.455 -8.312 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.319 5.514 -8.787 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.122 6.837 -7.726 1.00 0.00 H new ATOM 743 N ASN A 51 2.828 5.489 -5.667 1.00 0.00 N ATOM 744 CA ASN A 51 3.867 6.027 -4.821 1.00 0.00 C ATOM 745 C ASN A 51 4.677 4.871 -4.305 1.00 0.00 C ATOM 746 O ASN A 51 4.218 3.742 -4.327 1.00 0.00 O ATOM 747 CB ASN A 51 3.304 6.759 -3.587 1.00 0.00 C ATOM 748 CG ASN A 51 2.644 8.083 -3.835 1.00 0.00 C ATOM 749 OD1 ASN A 51 3.308 9.135 -3.818 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.358 8.071 -4.024 1.00 0.00 N ATOM 0 H ASN A 51 2.290 4.749 -5.216 1.00 0.00 H new ATOM 0 HA ASN A 51 4.447 6.735 -5.413 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.581 6.103 -3.102 1.00 0.00 H new ATOM 0 HB3 ASN A 51 4.119 6.912 -2.880 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.855 8.947 -4.166 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.852 7.186 -4.031 1.00 0.00 H new ATOM 757 N TRP A 52 5.849 5.142 -3.787 1.00 0.00 N ATOM 758 CA TRP A 52 6.714 4.079 -3.230 1.00 0.00 C ATOM 759 C TRP A 52 6.361 3.794 -1.760 1.00 0.00 C ATOM 760 O TRP A 52 7.151 3.182 -1.029 1.00 0.00 O ATOM 761 CB TRP A 52 8.201 4.485 -3.321 1.00 0.00 C ATOM 762 CG TRP A 52 8.650 4.806 -4.710 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.483 4.040 -5.816 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.366 5.971 -5.142 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.040 4.649 -6.915 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.587 5.837 -6.529 1.00 0.00 C ATOM 767 CE3 TRP A 52 9.848 7.098 -4.496 1.00 0.00 C ATOM 768 CZ2 TRP A 52 10.239 6.807 -7.271 1.00 0.00 C ATOM 769 CZ3 TRP A 52 10.493 8.054 -5.234 1.00 0.00 C ATOM 770 CH2 TRP A 52 10.690 7.895 -6.604 1.00 0.00 C ATOM 0 H TRP A 52 6.244 6.081 -3.730 1.00 0.00 H new ATOM 0 HA TRP A 52 6.545 3.177 -3.819 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.372 5.352 -2.683 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.815 3.675 -2.928 1.00 0.00 H new ATOM 0 HD1 TRP A 52 7.982 3.084 -5.831 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.044 4.274 -7.864 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.717 7.220 -3.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 10.382 6.700 -8.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 10.855 8.947 -4.746 1.00 0.00 H new ATOM 0 HH2 TRP A 52 11.218 8.663 -7.150 1.00 0.00 H new ATOM 781 N LEU A 53 5.201 4.303 -1.364 1.00 0.00 N ATOM 782 CA LEU A 53 4.661 4.198 0.001 1.00 0.00 C ATOM 783 C LEU A 53 4.799 2.757 0.589 1.00 0.00 C ATOM 784 O LEU A 53 4.456 1.742 -0.044 1.00 0.00 O ATOM 785 CB LEU A 53 3.199 4.707 0.075 1.00 0.00 C ATOM 786 CG LEU A 53 2.068 3.781 -0.412 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.715 4.441 -0.207 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.236 3.363 -1.856 1.00 0.00 C ATOM 0 H LEU A 53 4.586 4.816 -1.996 1.00 0.00 H new ATOM 0 HA LEU A 53 5.269 4.849 0.629 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.991 4.965 1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.141 5.631 -0.501 1.00 0.00 H new ATOM 0 HG LEU A 53 2.122 2.874 0.190 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.072 3.773 -0.556 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.569 4.651 0.853 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.676 5.374 -0.770 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.411 2.712 -2.145 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.240 4.248 -2.493 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.178 2.828 -1.973 1.00 0.00 H new ATOM 800 N THR A 54 5.339 2.705 1.770 1.00 0.00 N ATOM 801 CA THR A 54 5.585 1.483 2.502 1.00 0.00 C ATOM 802 C THR A 54 4.287 0.900 3.068 1.00 0.00 C ATOM 803 O THR A 54 3.330 1.634 3.231 1.00 0.00 O ATOM 804 CB THR A 54 6.486 1.854 3.646 1.00 0.00 C ATOM 805 OG1 THR A 54 5.899 3.020 4.253 1.00 0.00 O ATOM 806 CG2 THR A 54 7.879 2.202 3.147 1.00 0.00 C ATOM 0 H THR A 54 5.634 3.540 2.275 1.00 0.00 H new ATOM 0 HA THR A 54 6.025 0.734 1.844 1.00 0.00 H new ATOM 0 HB THR A 54 6.581 1.024 4.346 1.00 0.00 H new ATOM 0 HG1 THR A 54 6.449 3.306 5.012 1.00 0.00 H new ATOM 0 HG21 THR A 54 8.513 2.467 3.993 1.00 0.00 H new ATOM 0 HG22 THR A 54 8.305 1.343 2.629 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.819 3.046 2.460 1.00 0.00 H new ATOM 814 N PRO A 55 4.252 -0.419 3.381 1.00 0.00 N ATOM 815 CA PRO A 55 3.077 -1.076 3.984 1.00 0.00 C ATOM 816 C PRO A 55 2.520 -0.348 5.222 1.00 0.00 C ATOM 817 O PRO A 55 1.325 -0.360 5.449 1.00 0.00 O ATOM 818 CB PRO A 55 3.589 -2.453 4.381 1.00 0.00 C ATOM 819 CG PRO A 55 4.685 -2.735 3.397 1.00 0.00 C ATOM 820 CD PRO A 55 5.324 -1.400 3.086 1.00 0.00 C ATOM 0 HA PRO A 55 2.247 -1.090 3.278 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.962 -2.459 5.405 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.800 -3.203 4.324 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.415 -3.428 3.815 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.288 -3.197 2.493 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.207 -1.226 3.701 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.644 -1.342 2.046 1.00 0.00 H new ATOM 828 N THR A 56 3.387 0.267 6.004 1.00 0.00 N ATOM 829 CA THR A 56 2.992 1.067 7.156 1.00 0.00 C ATOM 830 C THR A 56 2.073 2.227 6.704 1.00 0.00 C ATOM 831 O THR A 56 0.994 2.486 7.277 1.00 0.00 O ATOM 832 CB THR A 56 4.241 1.651 7.769 1.00 0.00 C ATOM 833 OG1 THR A 56 5.296 0.670 7.673 1.00 0.00 O ATOM 834 CG2 THR A 56 4.004 2.016 9.223 1.00 0.00 C ATOM 0 H THR A 56 4.396 0.227 5.859 1.00 0.00 H new ATOM 0 HA THR A 56 2.457 0.444 7.873 1.00 0.00 H new ATOM 0 HB THR A 56 4.520 2.560 7.235 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.117 1.033 8.065 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.917 2.435 9.646 1.00 0.00 H new ATOM 0 HG22 THR A 56 3.203 2.752 9.287 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.722 1.123 9.781 1.00 0.00 H new ATOM 842 N ASP A 57 2.507 2.873 5.643 1.00 0.00 N ATOM 843 CA ASP A 57 1.796 3.981 5.008 1.00 0.00 C ATOM 844 C ASP A 57 0.458 3.458 4.458 1.00 0.00 C ATOM 845 O ASP A 57 -0.599 4.008 4.734 1.00 0.00 O ATOM 846 CB ASP A 57 2.699 4.542 3.872 1.00 0.00 C ATOM 847 CG ASP A 57 2.506 6.008 3.522 1.00 0.00 C ATOM 848 OD1 ASP A 57 3.151 6.872 4.163 1.00 0.00 O ATOM 849 OD2 ASP A 57 1.828 6.331 2.557 1.00 0.00 O ATOM 0 H ASP A 57 3.386 2.642 5.180 1.00 0.00 H new ATOM 0 HA ASP A 57 1.582 4.781 5.717 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.740 4.392 4.157 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.526 3.950 2.973 1.00 0.00 H new ATOM 854 N TRP A 58 0.531 2.333 3.737 1.00 0.00 N ATOM 855 CA TRP A 58 -0.665 1.641 3.219 1.00 0.00 C ATOM 856 C TRP A 58 -1.678 1.366 4.318 1.00 0.00 C ATOM 857 O TRP A 58 -2.832 1.728 4.206 1.00 0.00 O ATOM 858 CB TRP A 58 -0.332 0.287 2.557 1.00 0.00 C ATOM 859 CG TRP A 58 0.346 0.336 1.232 1.00 0.00 C ATOM 860 CD1 TRP A 58 1.659 0.567 0.993 1.00 0.00 C ATOM 861 CD2 TRP A 58 -0.247 0.062 -0.055 1.00 0.00 C ATOM 862 NE1 TRP A 58 1.920 0.481 -0.343 1.00 0.00 N ATOM 863 CE2 TRP A 58 0.775 0.177 -1.010 1.00 0.00 C ATOM 864 CE3 TRP A 58 -1.537 -0.243 -0.492 1.00 0.00 C ATOM 865 CZ2 TRP A 58 0.563 -0.031 -2.360 1.00 0.00 C ATOM 866 CZ3 TRP A 58 -1.743 -0.455 -1.838 1.00 0.00 C ATOM 867 CH2 TRP A 58 -0.695 -0.338 -2.761 1.00 0.00 C ATOM 0 H TRP A 58 1.410 1.876 3.495 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.080 2.321 2.475 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.300 -0.279 3.241 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.260 -0.273 2.443 1.00 0.00 H new ATOM 0 HD1 TRP A 58 2.395 0.788 1.752 1.00 0.00 H new ATOM 0 HE1 TRP A 58 2.833 0.623 -0.775 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -2.356 -0.311 0.209 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 1.372 0.048 -3.071 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -2.731 -0.716 -2.188 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -0.893 -0.495 -3.811 1.00 0.00 H new ATOM 878 N ASN A 59 -1.245 0.693 5.370 1.00 0.00 N ATOM 879 CA ASN A 59 -2.149 0.295 6.454 1.00 0.00 C ATOM 880 C ASN A 59 -2.864 1.498 7.053 1.00 0.00 C ATOM 881 O ASN A 59 -4.070 1.440 7.335 1.00 0.00 O ATOM 882 CB ASN A 59 -1.455 -0.560 7.538 1.00 0.00 C ATOM 883 CG ASN A 59 -1.030 -1.940 7.048 1.00 0.00 C ATOM 884 OD1 ASN A 59 -1.649 -2.523 6.138 1.00 0.00 O ATOM 885 ND2 ASN A 59 0.015 -2.478 7.638 1.00 0.00 N ATOM 0 H ASN A 59 -0.275 0.407 5.504 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.904 -0.349 6.003 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.577 -0.027 7.902 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.131 -0.677 8.385 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.342 -3.401 7.353 1.00 0.00 H new ATOM 0 HD22 ASN A 59 0.498 -1.972 8.380 1.00 0.00 H new ATOM 892 N THR A 60 -2.165 2.609 7.130 1.00 0.00 N ATOM 893 CA THR A 60 -2.735 3.821 7.641 1.00 0.00 C ATOM 894 C THR A 60 -3.770 4.376 6.638 1.00 0.00 C ATOM 895 O THR A 60 -4.780 4.931 7.035 1.00 0.00 O ATOM 896 CB THR A 60 -1.617 4.860 7.911 1.00 0.00 C ATOM 897 OG1 THR A 60 -0.620 4.256 8.737 1.00 0.00 O ATOM 898 CG2 THR A 60 -2.166 6.062 8.661 1.00 0.00 C ATOM 0 H THR A 60 -1.191 2.691 6.840 1.00 0.00 H new ATOM 0 HA THR A 60 -3.243 3.612 8.583 1.00 0.00 H new ATOM 0 HB THR A 60 -1.207 5.182 6.954 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.076 3.644 8.199 1.00 0.00 H new ATOM 0 HG21 THR A 60 -1.363 6.777 8.839 1.00 0.00 H new ATOM 0 HG22 THR A 60 -2.948 6.535 8.067 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.581 5.737 9.615 1.00 0.00 H new ATOM 906 N LEU A 61 -3.523 4.144 5.351 1.00 0.00 N ATOM 907 CA LEU A 61 -4.411 4.544 4.273 1.00 0.00 C ATOM 908 C LEU A 61 -5.744 3.790 4.382 1.00 0.00 C ATOM 909 O LEU A 61 -6.779 4.421 4.554 1.00 0.00 O ATOM 910 CB LEU A 61 -3.684 4.330 2.901 1.00 0.00 C ATOM 911 CG LEU A 61 -4.366 4.779 1.580 1.00 0.00 C ATOM 912 CD1 LEU A 61 -5.558 3.937 1.187 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.739 6.228 1.640 1.00 0.00 C ATOM 0 H LEU A 61 -2.684 3.664 5.027 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.654 5.604 4.346 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.724 4.843 2.960 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.472 3.265 2.810 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.623 4.628 0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.978 4.314 0.255 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.244 2.902 1.051 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.313 3.987 1.972 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.215 6.520 0.704 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.431 6.392 2.466 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.842 6.828 1.794 1.00 0.00 H new ATOM 925 N VAL A 62 -5.698 2.451 4.375 1.00 0.00 N ATOM 926 CA VAL A 62 -6.925 1.628 4.394 1.00 0.00 C ATOM 927 C VAL A 62 -7.808 1.979 5.563 1.00 0.00 C ATOM 928 O VAL A 62 -9.024 2.137 5.413 1.00 0.00 O ATOM 929 CB VAL A 62 -6.671 0.078 4.345 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.870 -0.435 5.504 1.00 0.00 C ATOM 931 CG2 VAL A 62 -7.956 -0.686 4.262 1.00 0.00 C ATOM 0 H VAL A 62 -4.832 1.913 4.356 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.440 1.877 3.466 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.084 -0.084 3.441 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.734 -1.512 5.404 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.896 0.054 5.518 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.397 -0.221 6.434 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.743 -1.754 4.230 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.568 -0.464 5.136 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.494 -0.396 3.359 1.00 0.00 H new ATOM 941 N ARG A 63 -7.188 2.185 6.686 1.00 0.00 N ATOM 942 CA ARG A 63 -7.938 2.515 7.878 1.00 0.00 C ATOM 943 C ARG A 63 -8.380 3.999 7.921 1.00 0.00 C ATOM 944 O ARG A 63 -9.327 4.359 8.644 1.00 0.00 O ATOM 945 CB ARG A 63 -7.184 2.119 9.122 1.00 0.00 C ATOM 946 CG ARG A 63 -5.925 2.921 9.373 1.00 0.00 C ATOM 947 CD ARG A 63 -5.171 2.349 10.537 1.00 0.00 C ATOM 948 NE ARG A 63 -3.951 3.095 10.857 1.00 0.00 N ATOM 949 CZ ARG A 63 -2.893 2.573 11.472 1.00 0.00 C ATOM 950 NH1 ARG A 63 -2.946 1.316 11.923 1.00 0.00 N ATOM 951 NH2 ARG A 63 -1.791 3.307 11.657 1.00 0.00 N ATOM 0 H ARG A 63 -6.177 2.133 6.810 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.857 1.930 7.842 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.845 2.225 9.982 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.920 1.064 9.051 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.296 2.912 8.483 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.181 3.962 9.572 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -5.821 2.336 11.412 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.909 1.314 10.319 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.910 4.079 10.591 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.794 0.763 11.795 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.139 0.909 12.395 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -1.759 4.271 11.326 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -0.982 2.903 12.129 1.00 0.00 H new ATOM 965 N ALA A 64 -7.704 4.855 7.181 1.00 0.00 N ATOM 966 CA ALA A 64 -8.081 6.269 7.093 1.00 0.00 C ATOM 967 C ALA A 64 -9.047 6.512 5.941 1.00 0.00 C ATOM 968 O ALA A 64 -9.531 7.631 5.760 1.00 0.00 O ATOM 969 CB ALA A 64 -6.847 7.175 6.947 1.00 0.00 C ATOM 0 H ALA A 64 -6.886 4.604 6.626 1.00 0.00 H new ATOM 0 HA ALA A 64 -8.583 6.524 8.027 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.165 8.216 6.885 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -6.196 7.046 7.812 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -6.304 6.907 6.041 1.00 0.00 H new ATOM 975 N VAL A 65 -9.386 5.453 5.236 1.00 0.00 N ATOM 976 CA VAL A 65 -10.279 5.580 4.098 1.00 0.00 C ATOM 977 C VAL A 65 -11.564 4.775 4.235 1.00 0.00 C ATOM 978 O VAL A 65 -12.554 5.316 4.643 1.00 0.00 O ATOM 979 CB VAL A 65 -9.595 5.452 2.684 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.525 6.531 2.522 1.00 0.00 C ATOM 981 CG2 VAL A 65 -8.996 4.070 2.394 1.00 0.00 C ATOM 0 H VAL A 65 -9.063 4.504 5.426 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.586 6.625 4.133 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.392 5.590 1.953 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.057 6.435 1.542 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.985 7.515 2.610 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.769 6.413 3.298 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.546 4.070 1.401 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.233 3.841 3.138 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.782 3.316 2.436 1.00 0.00 H new ATOM 991 N LEU A 66 -11.543 3.498 3.982 1.00 0.00 N ATOM 992 CA LEU A 66 -12.759 2.698 4.056 1.00 0.00 C ATOM 993 C LEU A 66 -13.042 2.254 5.475 1.00 0.00 C ATOM 994 O LEU A 66 -12.308 2.615 6.407 1.00 0.00 O ATOM 995 CB LEU A 66 -12.710 1.476 3.095 1.00 0.00 C ATOM 996 CG LEU A 66 -13.332 1.602 1.685 1.00 0.00 C ATOM 997 CD1 LEU A 66 -14.803 1.851 1.794 1.00 0.00 C ATOM 998 CD2 LEU A 66 -12.677 2.715 0.889 1.00 0.00 C ATOM 0 H LEU A 66 -10.705 2.978 3.722 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.579 3.338 3.731 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.663 1.199 2.969 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.202 0.643 3.598 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.161 0.664 1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -15.232 1.938 0.796 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -15.274 1.021 2.320 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -14.976 2.775 2.345 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -13.137 2.777 -0.097 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.810 3.662 1.411 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.613 2.507 0.780 1.00 0.00 H new ATOM 1010 N SER A 67 -14.102 1.503 5.629 1.00 0.00 N ATOM 1011 CA SER A 67 -14.460 0.978 6.919 1.00 0.00 C ATOM 1012 C SER A 67 -15.341 -0.246 6.728 1.00 0.00 C ATOM 1013 O SER A 67 -16.222 -0.259 5.825 1.00 0.00 O ATOM 1014 CB SER A 67 -15.156 2.051 7.776 1.00 0.00 C ATOM 1015 OG SER A 67 -15.350 1.607 9.105 1.00 0.00 O ATOM 0 H SER A 67 -14.734 1.241 4.873 1.00 0.00 H new ATOM 0 HA SER A 67 -13.559 0.682 7.456 1.00 0.00 H new ATOM 0 HB2 SER A 67 -14.556 2.961 7.779 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.118 2.305 7.332 1.00 0.00 H new ATOM 0 HG SER A 67 -15.792 2.311 9.624 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.032 -1.307 7.489 1.00 0.00 N ATOM 1022 CA GLY A 68 -15.788 -2.537 7.471 1.00 0.00 C ATOM 1023 C GLY A 68 -15.472 -3.422 6.276 1.00 0.00 C ATOM 1024 O GLY A 68 -14.880 -4.514 6.404 1.00 0.00 O ATOM 0 H GLY A 68 -14.242 -1.321 8.134 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.587 -3.092 8.388 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -16.852 -2.301 7.468 1.00 0.00 H new ATOM 1028 N GLY A 69 -15.829 -2.930 5.114 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.704 -3.694 3.884 1.00 0.00 C ATOM 1030 C GLY A 69 -14.279 -3.880 3.436 1.00 0.00 C ATOM 1031 O GLY A 69 -13.918 -4.945 2.940 1.00 0.00 O ATOM 0 H GLY A 69 -16.213 -1.994 4.988 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.163 -4.673 4.025 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.262 -3.191 3.095 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.490 -2.826 3.601 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.059 -2.785 3.227 1.00 0.00 C ATOM 1037 C ASP A 70 -11.353 -3.991 3.727 1.00 0.00 C ATOM 1038 O ASP A 70 -10.728 -4.724 2.976 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.364 -1.527 3.797 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.446 -1.409 5.313 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.530 -1.167 5.837 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.449 -1.666 5.995 1.00 0.00 O ATOM 0 H ASP A 70 -13.822 -1.951 4.006 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.011 -2.755 2.138 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.315 -1.537 3.500 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -11.814 -0.641 3.349 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.542 -4.221 4.978 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.942 -5.276 5.698 1.00 0.00 C ATOM 1049 C HIS A 71 -11.248 -6.611 5.069 1.00 0.00 C ATOM 1050 O HIS A 71 -10.321 -7.347 4.718 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.409 -5.205 7.147 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.400 -4.591 8.066 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -9.942 -3.300 7.939 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.741 -5.110 9.119 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.045 -3.053 8.874 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -8.906 -4.140 9.601 1.00 0.00 N ATOM 0 H HIS A 71 -12.154 -3.643 5.554 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.858 -5.170 5.671 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -12.333 -4.628 7.196 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.643 -6.211 7.496 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -10.249 -2.635 7.230 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -9.852 -6.110 9.512 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -8.517 -2.122 9.017 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.530 -6.844 4.810 1.00 0.00 N ATOM 1066 CA LEU A 72 -13.008 -8.127 4.294 1.00 0.00 C ATOM 1067 C LEU A 72 -12.252 -8.477 3.023 1.00 0.00 C ATOM 1068 O LEU A 72 -11.470 -9.418 2.986 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.486 -8.010 3.851 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.496 -7.379 4.774 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -16.765 -7.069 3.971 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -15.800 -8.312 5.919 1.00 0.00 C ATOM 0 H LEU A 72 -13.267 -6.153 4.950 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.874 -8.867 5.083 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.502 -7.447 2.918 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.838 -9.016 3.623 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.099 -6.454 5.191 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -17.507 -6.611 4.625 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -16.524 -6.382 3.160 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -17.168 -7.993 3.556 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -16.531 -7.849 6.582 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.204 -9.246 5.530 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -14.885 -8.516 6.475 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.401 -7.631 2.039 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.896 -7.918 0.720 1.00 0.00 C ATOM 1086 C LEU A 73 -10.461 -7.446 0.479 1.00 0.00 C ATOM 1087 O LEU A 73 -9.554 -8.293 0.234 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.832 -7.336 -0.320 1.00 0.00 C ATOM 1089 CG LEU A 73 -14.100 -8.131 -0.704 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.770 -9.569 -1.060 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -15.182 -8.070 0.370 1.00 0.00 C ATOM 0 H LEU A 73 -12.872 -6.730 2.126 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.859 -9.004 0.633 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.151 -6.356 0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.255 -7.174 -1.230 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.506 -7.645 -1.591 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.686 -10.098 -1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.084 -9.586 -1.907 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -13.303 -10.058 -0.205 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -16.049 -8.646 0.046 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.796 -8.488 1.300 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.475 -7.033 0.532 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.239 -6.104 0.566 1.00 0.00 N ATOM 1104 CA TRP A 74 -8.922 -5.522 0.385 1.00 0.00 C ATOM 1105 C TRP A 74 -7.918 -6.220 1.295 1.00 0.00 C ATOM 1106 O TRP A 74 -6.805 -6.507 0.938 1.00 0.00 O ATOM 1107 CB TRP A 74 -8.895 -4.029 0.800 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.692 -2.959 0.022 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.632 -3.086 -0.973 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.474 -1.563 0.167 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.075 -1.817 -1.363 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.375 -0.873 -0.643 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.617 -0.871 0.949 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.424 0.527 -0.677 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.635 0.532 0.933 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.557 1.213 0.130 1.00 0.00 C ATOM 0 H TRP A 74 -10.972 -5.422 0.762 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.675 -5.633 -0.671 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.231 -3.982 1.836 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -7.851 -3.716 0.789 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -10.976 -4.021 -1.390 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.793 -1.624 -2.061 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.920 -1.396 1.585 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.121 1.047 -1.317 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.936 1.087 1.541 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.585 2.293 0.147 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.324 -6.456 2.475 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.424 -6.921 3.477 1.00 0.00 C ATOM 1129 C LYS A 75 -7.209 -8.391 3.592 1.00 0.00 C ATOM 1130 O LYS A 75 -6.069 -8.789 3.837 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.611 -6.203 4.759 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.628 -4.712 4.521 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.268 -4.168 4.083 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.358 -4.095 5.322 1.00 0.00 C ATOM 1135 NZ LYS A 75 -4.085 -3.388 5.116 1.00 0.00 N ATOM 0 H LYS A 75 -9.288 -6.336 2.787 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.443 -6.640 3.094 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.545 -6.515 5.227 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.807 -6.460 5.449 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.371 -4.479 3.758 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.940 -4.206 5.435 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.826 -4.814 3.324 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.380 -3.181 3.635 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.904 -3.603 6.127 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.143 -5.110 5.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.854 -2.834 5.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.329 -4.079 4.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.171 -2.749 4.300 1.00 0.00 H new ATOM 1149 N SER A 76 -8.262 -9.233 3.440 1.00 0.00 N ATOM 1150 CA SER A 76 -7.986 -10.666 3.479 1.00 0.00 C ATOM 1151 C SER A 76 -7.017 -11.002 2.361 1.00 0.00 C ATOM 1152 O SER A 76 -6.003 -11.667 2.571 1.00 0.00 O ATOM 1153 CB SER A 76 -9.238 -11.516 3.351 1.00 0.00 C ATOM 1154 OG SER A 76 -9.939 -11.288 2.121 1.00 0.00 O ATOM 0 H SER A 76 -9.235 -8.961 3.300 1.00 0.00 H new ATOM 0 HA SER A 76 -7.555 -10.896 4.453 1.00 0.00 H new ATOM 0 HB2 SER A 76 -8.966 -12.569 3.419 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.903 -11.304 4.188 1.00 0.00 H new ATOM 0 HG SER A 76 -10.763 -10.790 2.302 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.268 -10.419 1.211 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.441 -10.647 0.073 1.00 0.00 C ATOM 1162 C GLU A 77 -5.084 -9.990 0.209 1.00 0.00 C ATOM 1163 O GLU A 77 -4.138 -10.479 -0.371 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.132 -10.184 -1.178 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.288 -11.041 -1.630 1.00 0.00 C ATOM 1166 CD GLU A 77 -7.823 -12.202 -2.441 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -7.669 -12.034 -3.652 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -7.610 -13.296 -1.902 1.00 0.00 O ATOM 0 H GLU A 77 -8.047 -9.781 1.050 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.270 -11.721 0.007 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.494 -9.168 -1.019 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.398 -10.138 -1.983 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.838 -11.400 -0.760 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.980 -10.439 -2.218 1.00 0.00 H new ATOM 1175 N PHE A 78 -4.973 -8.889 0.960 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.666 -8.258 1.155 1.00 0.00 C ATOM 1177 C PHE A 78 -2.736 -9.255 1.811 1.00 0.00 C ATOM 1178 O PHE A 78 -1.615 -9.469 1.361 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.812 -6.986 2.015 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.533 -6.293 2.376 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.776 -5.652 1.418 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.096 -6.279 3.690 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.602 -5.011 1.753 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.920 -5.637 4.037 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.169 -5.000 3.058 1.00 0.00 C ATOM 0 H PHE A 78 -5.751 -8.427 1.431 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.248 -7.961 0.193 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.448 -6.280 1.481 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.333 -7.250 2.936 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.108 -5.652 0.390 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.679 -6.774 4.452 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.021 -4.516 0.989 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.588 -5.631 5.065 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.751 -4.498 3.320 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.236 -9.910 2.818 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.458 -10.889 3.502 1.00 0.00 C ATOM 1197 C PHE A 79 -2.198 -12.094 2.613 1.00 0.00 C ATOM 1198 O PHE A 79 -1.045 -12.522 2.459 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.133 -11.303 4.809 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.082 -10.223 5.868 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -1.900 -9.929 6.540 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.205 -9.492 6.175 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.843 -8.927 7.486 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.161 -8.492 7.122 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.985 -8.208 7.777 1.00 0.00 C ATOM 0 H PHE A 79 -4.181 -9.781 3.181 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.494 -10.444 3.749 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.173 -11.559 4.609 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.651 -12.203 5.192 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.009 -10.497 6.316 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.134 -9.704 5.667 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.915 -8.707 7.993 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.054 -7.929 7.351 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.955 -7.423 8.518 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.248 -12.576 1.958 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.152 -13.782 1.148 1.00 0.00 C ATOM 1217 C GLU A 80 -2.244 -13.628 -0.064 1.00 0.00 C ATOM 1218 O GLU A 80 -1.307 -14.415 -0.218 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.516 -14.315 0.724 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.413 -14.607 1.895 1.00 0.00 C ATOM 1221 CD GLU A 80 -6.443 -15.649 1.591 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -6.073 -16.830 1.519 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -7.632 -15.317 1.453 1.00 0.00 O ATOM 0 H GLU A 80 -4.174 -12.150 1.973 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.690 -14.518 1.806 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.000 -13.587 0.073 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.381 -15.225 0.139 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -4.806 -14.938 2.738 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.912 -13.688 2.202 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.473 -12.603 -0.891 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.733 -12.456 -2.130 1.00 0.00 C ATOM 1232 C ASN A 81 -0.314 -11.975 -1.926 1.00 0.00 C ATOM 1233 O ASN A 81 0.584 -12.397 -2.651 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.478 -11.642 -3.244 1.00 0.00 C ATOM 1235 CG ASN A 81 -2.698 -10.148 -2.988 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -1.935 -9.487 -2.300 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -3.735 -9.609 -3.580 1.00 0.00 N ATOM 0 H ASN A 81 -3.162 -11.871 -0.719 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.668 -13.474 -2.515 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.916 -11.747 -4.172 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -3.452 -12.104 -3.407 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -3.923 -8.612 -3.472 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.355 -10.186 -4.148 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.085 -11.139 -0.936 1.00 0.00 N ATOM 1245 CA CYS A 82 1.277 -10.673 -0.676 1.00 0.00 C ATOM 1246 C CYS A 82 2.162 -11.832 -0.175 1.00 0.00 C ATOM 1247 O CYS A 82 3.317 -11.975 -0.584 1.00 0.00 O ATOM 1248 CB CYS A 82 1.268 -9.489 0.256 1.00 0.00 C ATOM 1249 SG CYS A 82 0.368 -8.059 -0.399 1.00 0.00 S ATOM 0 H CYS A 82 -0.799 -10.771 -0.307 1.00 0.00 H new ATOM 0 HA CYS A 82 1.720 -10.326 -1.610 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.820 -9.787 1.204 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.296 -9.195 0.467 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.599 -8.469 -1.165 1.00 0.00 H new ATOM 1255 N ARG A 83 1.584 -12.725 0.611 1.00 0.00 N ATOM 1256 CA ARG A 83 2.307 -13.913 1.074 1.00 0.00 C ATOM 1257 C ARG A 83 2.407 -14.956 -0.026 1.00 0.00 C ATOM 1258 O ARG A 83 3.323 -15.759 -0.060 1.00 0.00 O ATOM 1259 CB ARG A 83 1.646 -14.489 2.314 1.00 0.00 C ATOM 1260 CG ARG A 83 1.790 -13.602 3.564 1.00 0.00 C ATOM 1261 CD ARG A 83 3.238 -13.494 3.978 1.00 0.00 C ATOM 1262 NE ARG A 83 3.438 -12.604 5.127 1.00 0.00 N ATOM 1263 CZ ARG A 83 3.386 -12.995 6.415 1.00 0.00 C ATOM 1264 NH1 ARG A 83 2.849 -14.178 6.754 1.00 0.00 N ATOM 1265 NH2 ARG A 83 3.796 -12.177 7.368 1.00 0.00 N ATOM 0 H ARG A 83 0.622 -12.657 0.944 1.00 0.00 H new ATOM 0 HA ARG A 83 3.321 -13.613 1.337 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.587 -14.645 2.110 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.078 -15.468 2.523 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.390 -12.609 3.359 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.203 -14.020 4.382 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.616 -14.487 4.224 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.825 -13.129 3.135 1.00 0.00 H new ATOM 0 HE ARG A 83 3.630 -11.620 4.937 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.474 -14.793 6.032 1.00 0.00 H new ATOM 0 HH12 ARG A 83 2.816 -14.461 7.733 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.151 -11.251 7.128 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.757 -12.471 8.344 1.00 0.00 H new ATOM 1279 N ASP A 84 1.494 -14.898 -0.941 1.00 0.00 N ATOM 1280 CA ASP A 84 1.431 -15.865 -2.047 1.00 0.00 C ATOM 1281 C ASP A 84 2.521 -15.519 -3.041 1.00 0.00 C ATOM 1282 O ASP A 84 3.332 -16.368 -3.471 1.00 0.00 O ATOM 1283 CB ASP A 84 0.063 -15.759 -2.705 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.388 -17.034 -3.380 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.158 -18.159 -2.828 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.984 -16.962 -4.454 1.00 0.00 O ATOM 0 H ASP A 84 0.761 -14.189 -0.964 1.00 0.00 H new ATOM 0 HA ASP A 84 1.577 -16.884 -1.688 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.672 -15.478 -1.951 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.086 -14.957 -3.442 1.00 0.00 H new ATOM 1291 N THR A 85 2.576 -14.240 -3.327 1.00 0.00 N ATOM 1292 CA THR A 85 3.543 -13.643 -4.183 1.00 0.00 C ATOM 1293 C THR A 85 4.955 -13.730 -3.542 1.00 0.00 C ATOM 1294 O THR A 85 5.971 -13.811 -4.237 1.00 0.00 O ATOM 1295 CB THR A 85 3.126 -12.182 -4.410 1.00 0.00 C ATOM 1296 OG1 THR A 85 1.830 -12.168 -5.023 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.127 -11.390 -5.264 1.00 0.00 C ATOM 0 H THR A 85 1.912 -13.566 -2.946 1.00 0.00 H new ATOM 0 HA THR A 85 3.589 -14.167 -5.138 1.00 0.00 H new ATOM 0 HB THR A 85 3.104 -11.688 -3.439 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.140 -12.133 -4.328 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.772 -10.367 -5.385 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.099 -11.381 -4.771 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.222 -11.860 -6.243 1.00 0.00 H new ATOM 1305 N ALA A 86 4.974 -13.798 -2.223 1.00 0.00 N ATOM 1306 CA ALA A 86 6.186 -13.944 -1.483 1.00 0.00 C ATOM 1307 C ALA A 86 6.785 -15.294 -1.761 1.00 0.00 C ATOM 1308 O ALA A 86 8.007 -15.423 -1.923 1.00 0.00 O ATOM 1309 CB ALA A 86 5.905 -13.814 -0.027 1.00 0.00 C ATOM 0 H ALA A 86 4.136 -13.752 -1.644 1.00 0.00 H new ATOM 0 HA ALA A 86 6.888 -13.166 -1.785 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.833 -13.926 0.534 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.475 -12.833 0.174 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.201 -14.588 0.278 1.00 0.00 H new ATOM 1315 N LYS A 87 5.913 -16.312 -1.826 1.00 0.00 N ATOM 1316 CA LYS A 87 6.327 -17.650 -2.143 1.00 0.00 C ATOM 1317 C LYS A 87 6.935 -17.685 -3.548 1.00 0.00 C ATOM 1318 O LYS A 87 7.946 -18.337 -3.763 1.00 0.00 O ATOM 1319 CB LYS A 87 5.163 -18.629 -2.034 1.00 0.00 C ATOM 1320 CG LYS A 87 4.560 -18.723 -0.645 1.00 0.00 C ATOM 1321 CD LYS A 87 3.468 -19.783 -0.579 1.00 0.00 C ATOM 1322 CE LYS A 87 2.257 -19.327 -1.349 1.00 0.00 C ATOM 1323 NZ LYS A 87 1.236 -20.360 -1.494 1.00 0.00 N ATOM 0 H LYS A 87 4.912 -16.212 -1.658 1.00 0.00 H new ATOM 0 HA LYS A 87 7.083 -17.958 -1.421 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.385 -18.331 -2.737 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.505 -19.618 -2.338 1.00 0.00 H new ATOM 0 HG2 LYS A 87 5.342 -18.960 0.077 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.146 -17.755 -0.361 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.837 -20.723 -0.990 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.198 -19.974 0.460 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.820 -18.464 -0.846 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.570 -18.995 -2.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.411 -19.965 -1.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.621 -21.154 -2.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.947 -20.697 -0.554 1.00 0.00 H new ATOM 1337 N ARG A 88 6.324 -16.941 -4.494 1.00 0.00 N ATOM 1338 CA ARG A 88 6.870 -16.820 -5.856 1.00 0.00 C ATOM 1339 C ARG A 88 8.255 -16.208 -5.800 1.00 0.00 C ATOM 1340 O ARG A 88 9.161 -16.635 -6.515 1.00 0.00 O ATOM 1341 CB ARG A 88 5.969 -15.980 -6.796 1.00 0.00 C ATOM 1342 CG ARG A 88 4.791 -16.715 -7.461 1.00 0.00 C ATOM 1343 CD ARG A 88 3.786 -17.262 -6.468 1.00 0.00 C ATOM 1344 NE ARG A 88 2.508 -17.614 -7.113 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.409 -17.972 -6.460 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.489 -18.396 -5.205 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.250 -17.997 -7.098 1.00 0.00 N ATOM 0 H ARG A 88 5.460 -16.421 -4.339 1.00 0.00 H new ATOM 0 HA ARG A 88 6.915 -17.827 -6.270 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.569 -15.142 -6.225 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.596 -15.560 -7.582 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.283 -16.031 -8.141 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.178 -17.536 -8.064 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.201 -18.144 -5.981 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.607 -16.522 -5.688 1.00 0.00 H new ATOM 0 HE ARG A 88 2.465 -17.580 -8.132 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.396 -18.447 -4.741 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.644 -18.671 -4.705 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.205 -17.742 -8.085 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.599 -18.271 -6.603 1.00 0.00 H new ATOM 1361 N ASN A 89 8.429 -15.224 -4.913 1.00 0.00 N ATOM 1362 CA ASN A 89 9.728 -14.577 -4.738 1.00 0.00 C ATOM 1363 C ASN A 89 10.762 -15.542 -4.248 1.00 0.00 C ATOM 1364 O ASN A 89 11.883 -15.552 -4.730 1.00 0.00 O ATOM 1365 CB ASN A 89 9.695 -13.333 -3.807 1.00 0.00 C ATOM 1366 CG ASN A 89 9.080 -12.118 -4.453 1.00 0.00 C ATOM 1367 OD1 ASN A 89 9.121 -11.966 -5.653 1.00 0.00 O ATOM 1368 ND2 ASN A 89 8.567 -11.218 -3.665 1.00 0.00 N ATOM 0 H ASN A 89 7.691 -14.861 -4.310 1.00 0.00 H new ATOM 0 HA ASN A 89 9.998 -14.223 -5.733 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.135 -13.578 -2.905 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.712 -13.094 -3.496 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.185 -10.356 -4.055 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.547 -11.374 -2.657 1.00 0.00 H new ATOM 1375 N GLN A 90 10.377 -16.400 -3.321 1.00 0.00 N ATOM 1376 CA GLN A 90 11.344 -17.311 -2.719 1.00 0.00 C ATOM 1377 C GLN A 90 11.754 -18.375 -3.714 1.00 0.00 C ATOM 1378 O GLN A 90 12.940 -18.644 -3.882 1.00 0.00 O ATOM 1379 CB GLN A 90 10.834 -17.971 -1.419 1.00 0.00 C ATOM 1380 CG GLN A 90 10.287 -17.025 -0.345 1.00 0.00 C ATOM 1381 CD GLN A 90 11.091 -15.748 -0.154 1.00 0.00 C ATOM 1382 OE1 GLN A 90 12.069 -15.714 0.578 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.615 -14.679 -0.716 1.00 0.00 N ATOM 0 H GLN A 90 9.423 -16.488 -2.971 1.00 0.00 H new ATOM 0 HA GLN A 90 12.208 -16.706 -2.445 1.00 0.00 H new ATOM 0 HB2 GLN A 90 10.049 -18.681 -1.681 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.652 -18.546 -0.984 1.00 0.00 H new ATOM 0 HG2 GLN A 90 9.262 -16.758 -0.603 1.00 0.00 H new ATOM 0 HG3 GLN A 90 10.248 -17.559 0.604 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.797 -14.742 -1.322 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.059 -13.776 -0.552 1.00 0.00 H new ATOM 1392 N GLN A 91 10.800 -18.943 -4.424 1.00 0.00 N ATOM 1393 CA GLN A 91 11.112 -20.001 -5.392 1.00 0.00 C ATOM 1394 C GLN A 91 11.902 -19.462 -6.579 1.00 0.00 C ATOM 1395 O GLN A 91 12.785 -20.123 -7.077 1.00 0.00 O ATOM 1396 CB GLN A 91 9.834 -20.755 -5.846 1.00 0.00 C ATOM 1397 CG GLN A 91 8.744 -19.875 -6.410 1.00 0.00 C ATOM 1398 CD GLN A 91 7.528 -20.659 -6.838 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.438 -21.088 -7.972 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.587 -20.842 -5.948 1.00 0.00 N ATOM 0 H GLN A 91 9.811 -18.701 -4.358 1.00 0.00 H new ATOM 0 HA GLN A 91 11.750 -20.726 -4.885 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.113 -21.492 -6.600 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.433 -21.305 -4.995 1.00 0.00 H new ATOM 0 HG2 GLN A 91 8.452 -19.139 -5.661 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.134 -19.322 -7.264 1.00 0.00 H new ATOM 0 HE21 GLN A 91 6.697 -20.468 -5.006 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.744 -21.359 -6.196 1.00 0.00 H new ATOM 1409 N ALA A 92 11.610 -18.239 -6.997 1.00 0.00 N ATOM 1410 CA ALA A 92 12.362 -17.617 -8.068 1.00 0.00 C ATOM 1411 C ALA A 92 13.725 -17.190 -7.553 1.00 0.00 C ATOM 1412 O ALA A 92 14.637 -16.923 -8.326 1.00 0.00 O ATOM 1413 CB ALA A 92 11.634 -16.406 -8.618 1.00 0.00 C ATOM 0 H ALA A 92 10.861 -17.663 -6.611 1.00 0.00 H new ATOM 0 HA ALA A 92 12.476 -18.346 -8.870 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.223 -15.961 -9.420 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.663 -16.711 -9.007 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.492 -15.674 -7.823 1.00 0.00 H new ATOM 1419 N GLY A 93 13.835 -17.110 -6.244 1.00 0.00 N ATOM 1420 CA GLY A 93 15.067 -16.731 -5.604 1.00 0.00 C ATOM 1421 C GLY A 93 15.302 -15.253 -5.713 1.00 0.00 C ATOM 1422 O GLY A 93 16.382 -14.790 -6.126 1.00 0.00 O ATOM 0 H GLY A 93 13.071 -17.307 -5.598 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.039 -17.021 -4.554 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.898 -17.269 -6.061 1.00 0.00 H new ATOM 1426 N ASN A 94 14.280 -14.513 -5.402 1.00 0.00 N ATOM 1427 CA ASN A 94 14.347 -13.098 -5.397 1.00 0.00 C ATOM 1428 C ASN A 94 14.638 -12.714 -3.994 1.00 0.00 C ATOM 1429 O ASN A 94 14.004 -13.250 -3.073 1.00 0.00 O ATOM 1430 CB ASN A 94 13.012 -12.475 -5.812 1.00 0.00 C ATOM 1431 CG ASN A 94 12.512 -12.945 -7.157 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.291 -13.312 -8.042 1.00 0.00 O ATOM 1433 ND2 ASN A 94 11.210 -12.922 -7.343 1.00 0.00 N ATOM 0 H ASN A 94 13.368 -14.889 -5.142 1.00 0.00 H new ATOM 0 HA ASN A 94 15.104 -12.749 -6.099 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.263 -12.707 -5.055 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.119 -11.390 -5.833 1.00 0.00 H new ATOM 0 HD21 ASN A 94 10.818 -13.213 -8.238 1.00 0.00 H new ATOM 0 HD22 ASN A 94 10.593 -12.614 -6.592 1.00 0.00 H new ATOM 1440 N GLY A 95 15.558 -11.797 -3.809 1.00 0.00 N ATOM 1441 CA GLY A 95 15.948 -11.396 -2.480 1.00 0.00 C ATOM 1442 C GLY A 95 14.955 -10.467 -1.830 1.00 0.00 C ATOM 1443 O GLY A 95 15.291 -9.334 -1.486 1.00 0.00 O ATOM 0 H GLY A 95 16.050 -11.315 -4.562 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.067 -12.284 -1.859 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.920 -10.906 -2.525 1.00 0.00 H new ATOM 1447 N TRP A 96 13.743 -10.937 -1.663 1.00 0.00 N ATOM 1448 CA TRP A 96 12.698 -10.198 -1.028 1.00 0.00 C ATOM 1449 C TRP A 96 11.987 -11.111 -0.140 1.00 0.00 C ATOM 1450 O TRP A 96 11.837 -12.305 -0.453 1.00 0.00 O ATOM 1451 CB TRP A 96 11.768 -9.506 -2.015 1.00 0.00 C ATOM 1452 CG TRP A 96 12.455 -8.374 -2.643 1.00 0.00 C ATOM 1453 CD1 TRP A 96 12.901 -7.263 -2.005 1.00 0.00 C ATOM 1454 CD2 TRP A 96 12.808 -8.234 -4.004 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.515 -6.445 -2.875 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.493 -7.024 -4.126 1.00 0.00 C ATOM 1457 CE3 TRP A 96 12.629 -9.026 -5.119 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 13.988 -6.581 -5.335 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.112 -8.597 -6.325 1.00 0.00 C ATOM 1460 CH2 TRP A 96 13.798 -7.396 -6.431 1.00 0.00 C ATOM 0 H TRP A 96 13.457 -11.865 -1.974 1.00 0.00 H new ATOM 0 HA TRP A 96 13.134 -9.380 -0.453 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.443 -10.213 -2.778 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.872 -9.158 -1.501 1.00 0.00 H new ATOM 0 HD1 TRP A 96 12.780 -7.065 -0.950 1.00 0.00 H new ATOM 0 HE1 TRP A 96 13.930 -5.542 -2.647 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.114 -9.972 -5.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 14.503 -5.635 -5.420 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 12.957 -9.202 -7.206 1.00 0.00 H new ATOM 0 HH2 TRP A 96 14.191 -7.093 -7.390 1.00 0.00 H new ATOM 1471 N ASP A 97 11.495 -10.592 0.909 1.00 0.00 N ATOM 1472 CA ASP A 97 11.028 -11.435 1.973 1.00 0.00 C ATOM 1473 C ASP A 97 9.542 -11.321 2.140 1.00 0.00 C ATOM 1474 O ASP A 97 8.968 -10.261 1.870 1.00 0.00 O ATOM 1475 CB ASP A 97 11.781 -11.125 3.253 1.00 0.00 C ATOM 1476 CG ASP A 97 11.337 -11.967 4.423 1.00 0.00 C ATOM 1477 OD1 ASP A 97 11.833 -13.090 4.573 1.00 0.00 O ATOM 1478 OD2 ASP A 97 10.471 -11.524 5.193 1.00 0.00 O ATOM 0 H ASP A 97 11.397 -9.590 1.073 1.00 0.00 H new ATOM 0 HA ASP A 97 11.231 -12.475 1.717 1.00 0.00 H new ATOM 0 HB2 ASP A 97 12.847 -11.280 3.086 1.00 0.00 H new ATOM 0 HB3 ASP A 97 11.647 -10.072 3.500 1.00 0.00 H new ATOM 1483 N PHE A 98 8.916 -12.414 2.589 1.00 0.00 N ATOM 1484 CA PHE A 98 7.490 -12.496 2.711 1.00 0.00 C ATOM 1485 C PHE A 98 6.948 -11.511 3.744 1.00 0.00 C ATOM 1486 O PHE A 98 5.782 -11.152 3.710 1.00 0.00 O ATOM 1487 CB PHE A 98 7.043 -13.942 2.999 1.00 0.00 C ATOM 1488 CG PHE A 98 7.276 -14.409 4.368 1.00 0.00 C ATOM 1489 CD1 PHE A 98 8.516 -14.733 4.808 1.00 0.00 C ATOM 1490 CD2 PHE A 98 6.233 -14.503 5.203 1.00 0.00 C ATOM 1491 CE1 PHE A 98 8.699 -15.151 6.083 1.00 0.00 C ATOM 1492 CE2 PHE A 98 6.377 -14.916 6.469 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.621 -15.246 6.923 1.00 0.00 C ATOM 0 H PHE A 98 9.404 -13.263 2.875 1.00 0.00 H new ATOM 0 HA PHE A 98 7.060 -12.205 1.753 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.978 -14.026 2.780 1.00 0.00 H new ATOM 0 HB3 PHE A 98 7.563 -14.609 2.312 1.00 0.00 H new ATOM 0 HD1 PHE A 98 9.361 -14.658 4.140 1.00 0.00 H new ATOM 0 HD2 PHE A 98 5.249 -14.239 4.846 1.00 0.00 H new ATOM 0 HE1 PHE A 98 9.687 -15.408 6.435 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.520 -14.987 7.122 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.755 -15.581 7.941 1.00 0.00 H new ATOM 1503 N ASP A 99 7.776 -11.098 4.658 1.00 0.00 N ATOM 1504 CA ASP A 99 7.370 -10.080 5.619 1.00 0.00 C ATOM 1505 C ASP A 99 7.517 -8.677 5.079 1.00 0.00 C ATOM 1506 O ASP A 99 6.958 -7.739 5.640 1.00 0.00 O ATOM 1507 CB ASP A 99 8.088 -10.200 6.944 1.00 0.00 C ATOM 1508 CG ASP A 99 7.429 -11.150 7.922 1.00 0.00 C ATOM 1509 OD1 ASP A 99 6.378 -10.770 8.477 1.00 0.00 O ATOM 1510 OD2 ASP A 99 7.987 -12.232 8.219 1.00 0.00 O ATOM 0 H ASP A 99 8.731 -11.438 4.769 1.00 0.00 H new ATOM 0 HA ASP A 99 6.311 -10.268 5.794 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.110 -10.534 6.762 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.152 -9.212 7.401 1.00 0.00 H new ATOM 1515 N MET A 100 8.262 -8.530 4.000 1.00 0.00 N ATOM 1516 CA MET A 100 8.478 -7.219 3.405 1.00 0.00 C ATOM 1517 C MET A 100 7.295 -6.831 2.546 1.00 0.00 C ATOM 1518 O MET A 100 6.854 -5.692 2.575 1.00 0.00 O ATOM 1519 CB MET A 100 9.758 -7.164 2.555 1.00 0.00 C ATOM 1520 CG MET A 100 11.036 -7.405 3.314 1.00 0.00 C ATOM 1521 SD MET A 100 12.469 -7.466 2.210 1.00 0.00 S ATOM 1522 CE MET A 100 13.784 -7.815 3.388 1.00 0.00 C ATOM 0 H MET A 100 8.728 -9.298 3.517 1.00 0.00 H new ATOM 0 HA MET A 100 8.591 -6.515 4.229 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.680 -7.905 1.759 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.816 -6.187 2.076 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.177 -6.613 4.050 1.00 0.00 H new ATOM 0 HG3 MET A 100 10.961 -8.343 3.865 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.736 -7.883 2.861 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.834 -7.014 4.125 1.00 0.00 H new ATOM 0 HE3 MET A 100 13.580 -8.760 3.892 1.00 0.00 H new ATOM 1532 N LEU A 101 6.776 -7.770 1.760 1.00 0.00 N ATOM 1533 CA LEU A 101 5.632 -7.434 0.981 1.00 0.00 C ATOM 1534 C LEU A 101 4.386 -7.899 1.699 1.00 0.00 C ATOM 1535 O LEU A 101 3.928 -9.002 1.512 1.00 0.00 O ATOM 1536 CB LEU A 101 5.690 -7.949 -0.504 1.00 0.00 C ATOM 1537 CG LEU A 101 5.477 -9.449 -0.792 1.00 0.00 C ATOM 1538 CD1 LEU A 101 5.425 -9.702 -2.273 1.00 0.00 C ATOM 1539 CD2 LEU A 101 6.540 -10.313 -0.163 1.00 0.00 C ATOM 0 H LEU A 101 7.124 -8.724 1.659 1.00 0.00 H new ATOM 0 HA LEU A 101 5.612 -6.349 0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.941 -7.397 -1.072 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.664 -7.673 -0.909 1.00 0.00 H new ATOM 0 HG LEU A 101 4.522 -9.722 -0.342 1.00 0.00 H new ATOM 0 HD11 LEU A 101 5.274 -10.766 -2.455 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.600 -9.139 -2.710 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.363 -9.385 -2.729 1.00 0.00 H new ATOM 0 HD21 LEU A 101 6.343 -11.359 -0.396 1.00 0.00 H new ATOM 0 HD22 LEU A 101 7.517 -10.031 -0.555 1.00 0.00 H new ATOM 0 HD23 LEU A 101 6.529 -10.174 0.918 1.00 0.00 H new ATOM 1551 N THR A 102 3.939 -7.068 2.598 1.00 0.00 N ATOM 1552 CA THR A 102 2.729 -7.214 3.375 1.00 0.00 C ATOM 1553 C THR A 102 2.932 -6.337 4.621 1.00 0.00 C ATOM 1554 O THR A 102 3.937 -5.602 4.708 1.00 0.00 O ATOM 1555 CB THR A 102 2.413 -8.702 3.816 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.116 -8.789 4.422 1.00 0.00 O ATOM 1557 CG2 THR A 102 3.460 -9.252 4.768 1.00 0.00 C ATOM 0 H THR A 102 4.441 -6.210 2.827 1.00 0.00 H new ATOM 0 HA THR A 102 1.876 -6.917 2.764 1.00 0.00 H new ATOM 0 HB THR A 102 2.431 -9.309 2.911 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.940 -9.716 4.686 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.201 -10.275 5.043 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.435 -9.243 4.281 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.497 -8.634 5.665 1.00 0.00 H new ATOM 1661 N ASP A 111 11.031 2.237 7.468 1.00 0.00 N ATOM 1662 CA ASP A 111 12.416 2.307 7.042 1.00 0.00 C ATOM 1663 C ASP A 111 12.780 1.213 6.013 1.00 0.00 C ATOM 1664 O ASP A 111 13.112 1.525 4.859 1.00 0.00 O ATOM 1665 CB ASP A 111 13.282 2.126 8.287 1.00 0.00 C ATOM 1666 CG ASP A 111 14.780 2.013 7.981 1.00 0.00 C ATOM 1667 OD1 ASP A 111 15.445 3.039 7.702 1.00 0.00 O ATOM 1668 OD2 ASP A 111 15.314 0.885 8.055 1.00 0.00 O ATOM 0 HA ASP A 111 12.583 3.268 6.555 1.00 0.00 H new ATOM 0 HB2 ASP A 111 13.119 2.969 8.958 1.00 0.00 H new ATOM 0 HB3 ASP A 111 12.959 1.230 8.817 1.00 0.00 H new ATOM 1673 N ALA A 112 12.584 -0.045 6.397 1.00 0.00 N ATOM 1674 CA ALA A 112 13.072 -1.214 5.669 1.00 0.00 C ATOM 1675 C ALA A 112 12.685 -1.198 4.198 1.00 0.00 C ATOM 1676 O ALA A 112 13.528 -1.335 3.311 1.00 0.00 O ATOM 1677 CB ALA A 112 12.542 -2.485 6.321 1.00 0.00 C ATOM 0 H ALA A 112 12.069 -0.287 7.244 1.00 0.00 H new ATOM 0 HA ALA A 112 14.161 -1.187 5.716 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.908 -3.354 5.775 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.886 -2.534 7.354 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.452 -2.477 6.301 1.00 0.00 H new ATOM 1683 N GLN A 113 11.422 -1.004 3.951 1.00 0.00 N ATOM 1684 CA GLN A 113 10.909 -1.005 2.585 1.00 0.00 C ATOM 1685 C GLN A 113 11.078 0.367 1.961 1.00 0.00 C ATOM 1686 O GLN A 113 11.072 0.488 0.736 1.00 0.00 O ATOM 1687 CB GLN A 113 9.409 -1.432 2.491 1.00 0.00 C ATOM 1688 CG GLN A 113 8.950 -2.466 3.519 1.00 0.00 C ATOM 1689 CD GLN A 113 8.352 -1.809 4.764 1.00 0.00 C ATOM 1690 OE1 GLN A 113 8.681 -0.553 4.992 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 7.503 -2.390 5.453 1.00 0.00 N flip ATOM 0 H GLN A 113 10.716 -0.842 4.669 1.00 0.00 H new ATOM 0 HA GLN A 113 11.492 -1.747 2.040 1.00 0.00 H new ATOM 0 HB2 GLN A 113 8.789 -0.542 2.597 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.226 -1.832 1.494 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.209 -3.124 3.065 1.00 0.00 H new ATOM 0 HG3 GLN A 113 9.796 -3.089 3.809 1.00 0.00 H new ATOM 0 HE21 GLN A 113 7.265 -3.362 5.257 1.00 0.00 H new ATOM 0 HE22 GLN A 113 7.041 -1.896 6.217 1.00 0.00 H new ATOM 1700 N MET A 114 11.275 1.425 2.792 1.00 0.00 N ATOM 1701 CA MET A 114 11.318 2.782 2.246 1.00 0.00 C ATOM 1702 C MET A 114 12.588 2.999 1.436 1.00 0.00 C ATOM 1703 O MET A 114 12.649 3.899 0.593 1.00 0.00 O ATOM 1704 CB MET A 114 11.163 3.873 3.330 1.00 0.00 C ATOM 1705 CG MET A 114 12.429 4.413 3.971 1.00 0.00 C ATOM 1706 SD MET A 114 12.070 5.757 5.122 1.00 0.00 S ATOM 1707 CE MET A 114 13.715 6.071 5.759 1.00 0.00 C ATOM 0 H MET A 114 11.401 1.358 3.802 1.00 0.00 H new ATOM 0 HA MET A 114 10.457 2.878 1.584 1.00 0.00 H new ATOM 0 HB2 MET A 114 10.626 4.712 2.887 1.00 0.00 H new ATOM 0 HB3 MET A 114 10.530 3.472 4.122 1.00 0.00 H new ATOM 0 HG2 MET A 114 12.942 3.609 4.498 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.107 4.769 3.195 1.00 0.00 H new ATOM 0 HE1 MET A 114 13.674 6.880 6.489 1.00 0.00 H new ATOM 0 HE2 MET A 114 14.098 5.170 6.237 1.00 0.00 H new ATOM 0 HE3 MET A 114 14.375 6.355 4.939 1.00 0.00 H new ATOM 1717 N GLN A 115 13.600 2.152 1.694 1.00 0.00 N ATOM 1718 CA GLN A 115 14.843 2.156 0.887 1.00 0.00 C ATOM 1719 C GLN A 115 14.563 1.868 -0.612 1.00 0.00 C ATOM 1720 O GLN A 115 15.416 2.139 -1.477 1.00 0.00 O ATOM 1721 CB GLN A 115 15.902 1.196 1.463 1.00 0.00 C ATOM 1722 CG GLN A 115 16.794 1.810 2.538 1.00 0.00 C ATOM 1723 CD GLN A 115 16.018 2.383 3.684 1.00 0.00 C ATOM 1724 OE1 GLN A 115 15.765 1.597 4.668 1.00 0.00 O flip ATOM 1725 NE2 GLN A 115 15.654 3.563 3.684 1.00 0.00 N flip ATOM 0 H GLN A 115 13.587 1.462 2.445 1.00 0.00 H new ATOM 0 HA GLN A 115 15.255 3.163 0.946 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.396 0.326 1.882 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.531 0.837 0.648 1.00 0.00 H new ATOM 0 HG2 GLN A 115 17.478 1.049 2.914 1.00 0.00 H new ATOM 0 HG3 GLN A 115 17.405 2.595 2.091 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.870 4.163 2.888 1.00 0.00 H new ATOM 0 HE22 GLN A 115 15.138 3.937 4.480 1.00 0.00 H new ATOM 1734 N TYR A 116 13.389 1.288 -0.896 1.00 0.00 N ATOM 1735 CA TYR A 116 12.869 1.137 -2.237 1.00 0.00 C ATOM 1736 C TYR A 116 13.688 0.281 -3.185 1.00 0.00 C ATOM 1737 O TYR A 116 14.666 0.730 -3.825 1.00 0.00 O ATOM 1738 CB TYR A 116 12.470 2.500 -2.847 1.00 0.00 C ATOM 1739 CG TYR A 116 12.124 2.485 -4.321 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.182 1.626 -4.838 1.00 0.00 C ATOM 1741 CD2 TYR A 116 12.779 3.329 -5.200 1.00 0.00 C ATOM 1742 CE1 TYR A 116 10.900 1.612 -6.191 1.00 0.00 C ATOM 1743 CE2 TYR A 116 12.493 3.325 -6.542 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.559 2.451 -7.029 1.00 0.00 C ATOM 1745 OH TYR A 116 11.281 2.416 -8.364 1.00 0.00 O ATOM 0 H TYR A 116 12.772 0.908 -0.178 1.00 0.00 H new ATOM 0 HA TYR A 116 11.965 0.542 -2.107 1.00 0.00 H new ATOM 0 HB2 TYR A 116 11.613 2.887 -2.296 1.00 0.00 H new ATOM 0 HB3 TYR A 116 13.291 3.200 -2.693 1.00 0.00 H new ATOM 0 HD1 TYR A 116 10.655 0.953 -4.177 1.00 0.00 H new ATOM 0 HD2 TYR A 116 13.531 4.005 -4.822 1.00 0.00 H new ATOM 0 HE1 TYR A 116 10.156 0.934 -6.581 1.00 0.00 H new ATOM 0 HE2 TYR A 116 13.001 4.006 -7.209 1.00 0.00 H new ATOM 0 HH TYR A 116 11.834 3.077 -8.831 1.00 0.00 H new ATOM 1755 N ASP A 117 13.301 -0.954 -3.254 1.00 0.00 N ATOM 1756 CA ASP A 117 13.779 -1.842 -4.279 1.00 0.00 C ATOM 1757 C ASP A 117 12.682 -1.916 -5.302 1.00 0.00 C ATOM 1758 O ASP A 117 11.544 -2.219 -4.936 1.00 0.00 O ATOM 1759 CB ASP A 117 14.064 -3.248 -3.750 1.00 0.00 C ATOM 1760 CG ASP A 117 15.200 -3.313 -2.790 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.353 -3.162 -3.208 1.00 0.00 O ATOM 1762 OD2 ASP A 117 14.969 -3.572 -1.613 1.00 0.00 O ATOM 0 H ASP A 117 12.643 -1.381 -2.602 1.00 0.00 H new ATOM 0 HA ASP A 117 14.718 -1.466 -4.684 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.167 -3.631 -3.263 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.275 -3.907 -4.592 1.00 0.00 H new ATOM 1767 N PRO A 118 12.965 -1.572 -6.569 1.00 0.00 N ATOM 1768 CA PRO A 118 11.981 -1.607 -7.667 1.00 0.00 C ATOM 1769 C PRO A 118 11.171 -2.923 -7.789 1.00 0.00 C ATOM 1770 O PRO A 118 10.071 -2.924 -8.329 1.00 0.00 O ATOM 1771 CB PRO A 118 12.830 -1.408 -8.922 1.00 0.00 C ATOM 1772 CG PRO A 118 14.032 -0.648 -8.463 1.00 0.00 C ATOM 1773 CD PRO A 118 14.273 -1.049 -7.034 1.00 0.00 C ATOM 0 HA PRO A 118 11.217 -0.848 -7.497 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.113 -2.364 -9.362 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.282 -0.855 -9.685 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.898 -0.881 -9.082 1.00 0.00 H new ATOM 0 HG3 PRO A 118 13.865 0.426 -8.541 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.052 -1.807 -6.961 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.597 -0.200 -6.433 1.00 0.00 H new ATOM 1781 N GLY A 119 11.696 -4.011 -7.283 1.00 0.00 N ATOM 1782 CA GLY A 119 11.006 -5.275 -7.374 1.00 0.00 C ATOM 1783 C GLY A 119 10.062 -5.405 -6.211 1.00 0.00 C ATOM 1784 O GLY A 119 8.867 -5.583 -6.404 1.00 0.00 O ATOM 0 H GLY A 119 12.596 -4.048 -6.805 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.456 -5.337 -8.313 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.723 -6.096 -7.370 1.00 0.00 H new ATOM 1788 N LEU A 120 10.617 -5.237 -5.014 1.00 0.00 N ATOM 1789 CA LEU A 120 9.829 -5.201 -3.764 1.00 0.00 C ATOM 1790 C LEU A 120 8.602 -4.280 -3.957 1.00 0.00 C ATOM 1791 O LEU A 120 7.477 -4.686 -3.730 1.00 0.00 O ATOM 1792 CB LEU A 120 10.697 -4.656 -2.619 1.00 0.00 C ATOM 1793 CG LEU A 120 10.037 -4.546 -1.244 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.539 -5.916 -0.789 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.027 -3.997 -0.247 1.00 0.00 C ATOM 0 H LEU A 120 11.621 -5.122 -4.872 1.00 0.00 H new ATOM 0 HA LEU A 120 9.497 -6.210 -3.518 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.574 -5.296 -2.524 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.053 -3.666 -2.905 1.00 0.00 H new ATOM 0 HG LEU A 120 9.185 -3.869 -1.311 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.071 -5.826 0.191 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.810 -6.295 -1.506 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.380 -6.607 -0.727 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.553 -3.920 0.732 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.886 -4.664 -0.183 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.358 -3.009 -0.569 1.00 0.00 H new ATOM 1807 N PHE A 121 8.863 -3.052 -4.452 1.00 0.00 N ATOM 1808 CA PHE A 121 7.836 -2.051 -4.762 1.00 0.00 C ATOM 1809 C PHE A 121 6.772 -2.577 -5.730 1.00 0.00 C ATOM 1810 O PHE A 121 5.571 -2.446 -5.468 1.00 0.00 O ATOM 1811 CB PHE A 121 8.507 -0.793 -5.343 1.00 0.00 C ATOM 1812 CG PHE A 121 7.567 0.181 -6.008 1.00 0.00 C ATOM 1813 CD1 PHE A 121 6.636 0.874 -5.278 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.636 0.401 -7.379 1.00 0.00 C ATOM 1815 CE1 PHE A 121 5.793 1.761 -5.892 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.793 1.293 -7.998 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.861 1.976 -7.250 1.00 0.00 C ATOM 0 H PHE A 121 9.810 -2.729 -4.649 1.00 0.00 H new ATOM 0 HA PHE A 121 7.322 -1.808 -3.832 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.033 -0.277 -4.540 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.259 -1.103 -6.069 1.00 0.00 H new ATOM 0 HD1 PHE A 121 6.567 0.719 -4.211 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.364 -0.138 -7.967 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.065 2.299 -5.303 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.861 1.457 -9.063 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.188 2.675 -7.725 1.00 0.00 H new ATOM 1827 N ALA A 122 7.232 -3.150 -6.846 1.00 0.00 N ATOM 1828 CA ALA A 122 6.348 -3.672 -7.885 1.00 0.00 C ATOM 1829 C ALA A 122 5.421 -4.730 -7.309 1.00 0.00 C ATOM 1830 O ALA A 122 4.199 -4.670 -7.504 1.00 0.00 O ATOM 1831 CB ALA A 122 7.157 -4.252 -9.044 1.00 0.00 C ATOM 0 H ALA A 122 8.225 -3.263 -7.052 1.00 0.00 H new ATOM 0 HA ALA A 122 5.745 -2.847 -8.266 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.478 -4.635 -9.806 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.784 -3.472 -9.476 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.786 -5.063 -8.678 1.00 0.00 H new ATOM 1837 N GLN A 123 6.001 -5.680 -6.568 1.00 0.00 N ATOM 1838 CA GLN A 123 5.228 -6.734 -5.947 1.00 0.00 C ATOM 1839 C GLN A 123 4.265 -6.184 -4.904 1.00 0.00 C ATOM 1840 O GLN A 123 3.103 -6.576 -4.874 1.00 0.00 O ATOM 1841 CB GLN A 123 6.105 -7.855 -5.332 1.00 0.00 C ATOM 1842 CG GLN A 123 6.680 -8.893 -6.316 1.00 0.00 C ATOM 1843 CD GLN A 123 7.723 -8.366 -7.277 1.00 0.00 C ATOM 1844 OE1 GLN A 123 8.900 -8.415 -6.983 1.00 0.00 O ATOM 1845 NE2 GLN A 123 7.305 -7.855 -8.417 1.00 0.00 N ATOM 0 H GLN A 123 7.004 -5.731 -6.390 1.00 0.00 H new ATOM 0 HA GLN A 123 4.651 -7.187 -6.753 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.936 -7.388 -4.804 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.511 -8.383 -4.587 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.118 -9.709 -5.742 1.00 0.00 H new ATOM 0 HG3 GLN A 123 5.858 -9.315 -6.894 1.00 0.00 H new ATOM 0 HE21 GLN A 123 6.308 -7.831 -8.630 1.00 0.00 H new ATOM 0 HE22 GLN A 123 7.979 -7.484 -9.087 1.00 0.00 H new ATOM 1854 N ILE A 124 4.740 -5.274 -4.055 1.00 0.00 N ATOM 1855 CA ILE A 124 3.893 -4.692 -3.008 1.00 0.00 C ATOM 1856 C ILE A 124 2.716 -3.945 -3.608 1.00 0.00 C ATOM 1857 O ILE A 124 1.565 -4.314 -3.389 1.00 0.00 O ATOM 1858 CB ILE A 124 4.657 -3.696 -2.049 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.747 -4.414 -1.256 1.00 0.00 C ATOM 1860 CG2 ILE A 124 3.670 -2.997 -1.088 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.535 -3.510 -0.330 1.00 0.00 C ATOM 0 H ILE A 124 5.698 -4.924 -4.068 1.00 0.00 H new ATOM 0 HA ILE A 124 3.558 -5.545 -2.418 1.00 0.00 H new ATOM 0 HB ILE A 124 5.134 -2.940 -2.672 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.289 -5.209 -0.667 1.00 0.00 H new ATOM 0 HG13 ILE A 124 6.435 -4.890 -1.954 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.217 -2.316 -0.437 1.00 0.00 H new ATOM 0 HG22 ILE A 124 2.936 -2.435 -1.666 1.00 0.00 H new ATOM 0 HG23 ILE A 124 3.159 -3.746 -0.483 1.00 0.00 H new ATOM 0 HD11 ILE A 124 7.289 -4.096 0.196 1.00 0.00 H new ATOM 0 HD12 ILE A 124 7.024 -2.729 -0.913 1.00 0.00 H new ATOM 0 HD13 ILE A 124 5.860 -3.053 0.394 1.00 0.00 H new ATOM 1873 N GLN A 125 2.999 -2.938 -4.429 1.00 0.00 N ATOM 1874 CA GLN A 125 1.947 -2.048 -4.860 1.00 0.00 C ATOM 1875 C GLN A 125 0.893 -2.689 -5.726 1.00 0.00 C ATOM 1876 O GLN A 125 -0.274 -2.350 -5.622 1.00 0.00 O ATOM 1877 CB GLN A 125 2.461 -0.690 -5.370 1.00 0.00 C ATOM 1878 CG GLN A 125 3.186 -0.611 -6.713 1.00 0.00 C ATOM 1879 CD GLN A 125 2.283 -0.580 -7.939 1.00 0.00 C ATOM 1880 OE1 GLN A 125 1.973 -1.598 -8.554 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.830 0.603 -8.265 1.00 0.00 N ATOM 0 H GLN A 125 3.927 -2.727 -4.797 1.00 0.00 H new ATOM 0 HA GLN A 125 1.401 -1.809 -3.947 1.00 0.00 H new ATOM 0 HB2 GLN A 125 1.606 -0.017 -5.422 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.135 -0.291 -4.612 1.00 0.00 H new ATOM 0 HG2 GLN A 125 3.809 0.283 -6.719 1.00 0.00 H new ATOM 0 HG3 GLN A 125 3.856 -1.467 -6.797 1.00 0.00 H new ATOM 0 HE21 GLN A 125 2.112 1.423 -7.728 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.194 0.706 -9.056 1.00 0.00 H new ATOM 1890 N ALA A 126 1.286 -3.637 -6.545 1.00 0.00 N ATOM 1891 CA ALA A 126 0.343 -4.293 -7.405 1.00 0.00 C ATOM 1892 C ALA A 126 -0.501 -5.288 -6.632 1.00 0.00 C ATOM 1893 O ALA A 126 -1.720 -5.382 -6.841 1.00 0.00 O ATOM 1894 CB ALA A 126 1.047 -4.960 -8.561 1.00 0.00 C ATOM 0 H ALA A 126 2.248 -3.966 -6.630 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.327 -3.535 -7.810 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.313 -5.451 -9.200 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.588 -4.211 -9.139 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.750 -5.701 -8.180 1.00 0.00 H new ATOM 1900 N ALA A 127 0.119 -5.959 -5.687 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.570 -6.998 -4.939 1.00 0.00 C ATOM 1902 C ALA A 127 -1.504 -6.379 -3.946 1.00 0.00 C ATOM 1903 O ALA A 127 -2.639 -6.861 -3.714 1.00 0.00 O ATOM 1904 CB ALA A 127 0.420 -7.929 -4.254 1.00 0.00 C ATOM 0 H ALA A 127 1.091 -5.809 -5.416 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.153 -7.599 -5.636 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -0.124 -8.696 -3.702 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.053 -8.402 -5.004 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.040 -7.357 -3.564 1.00 0.00 H new ATOM 1910 N ALA A 128 -1.064 -5.280 -3.402 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.820 -4.580 -2.468 1.00 0.00 C ATOM 1912 C ALA A 128 -3.056 -3.982 -3.106 1.00 0.00 C ATOM 1913 O ALA A 128 -4.080 -4.289 -2.678 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.985 -3.593 -1.696 1.00 0.00 C ATOM 0 H ALA A 128 -0.158 -4.861 -3.613 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.183 -5.285 -1.720 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.614 -3.068 -0.977 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.193 -4.122 -1.166 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.542 -2.873 -2.385 1.00 0.00 H new ATOM 1920 N THR A 129 -2.975 -3.211 -4.201 1.00 0.00 N ATOM 1921 CA THR A 129 -4.228 -2.649 -4.817 1.00 0.00 C ATOM 1922 C THR A 129 -5.175 -3.805 -5.323 1.00 0.00 C ATOM 1923 O THR A 129 -6.467 -3.699 -5.312 1.00 0.00 O ATOM 1924 CB THR A 129 -3.911 -1.628 -5.959 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.115 -1.101 -6.541 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.031 -2.239 -7.042 1.00 0.00 C ATOM 0 H THR A 129 -2.107 -2.960 -4.674 1.00 0.00 H new ATOM 0 HA THR A 129 -4.756 -2.099 -4.038 1.00 0.00 H new ATOM 0 HB THR A 129 -3.359 -0.808 -5.499 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.916 -0.731 -7.426 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.836 -1.495 -7.815 1.00 0.00 H new ATOM 0 HG22 THR A 129 -2.087 -2.563 -6.604 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.540 -3.096 -7.483 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.522 -4.960 -5.598 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.183 -6.157 -6.108 1.00 0.00 C ATOM 1936 C LYS A 130 -6.130 -6.654 -5.065 1.00 0.00 C ATOM 1937 O LYS A 130 -7.165 -7.208 -5.365 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.148 -7.222 -6.422 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.684 -8.463 -7.098 1.00 0.00 C ATOM 1940 CD LYS A 130 -3.575 -9.506 -7.338 1.00 0.00 C ATOM 1941 CE LYS A 130 -2.480 -9.004 -8.293 1.00 0.00 C ATOM 1942 NZ LYS A 130 -3.009 -8.583 -9.612 1.00 0.00 N ATOM 0 H LYS A 130 -3.517 -5.074 -5.467 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.728 -5.924 -7.023 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.381 -6.783 -7.060 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.660 -7.516 -5.493 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.469 -8.902 -6.483 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.140 -8.191 -8.050 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -3.123 -9.774 -6.383 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.019 -10.414 -7.747 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -1.960 -8.164 -7.831 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.743 -9.794 -8.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -2.217 -8.384 -10.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -3.596 -9.344 -10.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -3.586 -7.725 -9.497 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.728 -6.465 -3.849 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.488 -6.711 -2.684 1.00 0.00 C ATOM 1958 C ALA A 131 -7.379 -5.498 -2.428 1.00 0.00 C ATOM 1959 O ALA A 131 -8.590 -5.615 -2.451 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.457 -6.917 -1.583 1.00 0.00 C ATOM 0 H ALA A 131 -4.795 -6.110 -3.639 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.145 -7.578 -2.753 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.966 -7.115 -0.640 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.819 -7.764 -1.835 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.846 -6.020 -1.484 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.763 -4.315 -2.362 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.387 -3.051 -1.952 1.00 0.00 C ATOM 1968 C TRP A 132 -8.405 -2.466 -2.950 1.00 0.00 C ATOM 1969 O TRP A 132 -8.633 -1.271 -2.988 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.378 -1.950 -1.522 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.482 -2.352 -0.396 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.024 -3.580 -0.177 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.950 -1.554 0.666 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.192 -3.629 0.834 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.128 -2.416 1.410 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.048 -0.220 1.068 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.428 -2.001 2.498 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.360 0.152 2.144 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.557 -0.740 2.845 1.00 0.00 C ATOM 0 H TRP A 132 -5.778 -4.205 -2.602 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.948 -3.359 -1.070 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.765 -1.678 -2.381 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.932 -1.058 -1.231 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.306 -4.440 -0.766 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.676 -4.455 1.136 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.660 0.484 0.525 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.794 -2.677 3.053 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.427 1.175 2.482 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.017 -0.382 3.710 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.980 -3.280 -3.746 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.108 -2.874 -4.545 1.00 0.00 C ATOM 1992 C ARG A 133 -11.472 -3.579 -4.287 1.00 0.00 C ATOM 1993 O ARG A 133 -12.520 -2.931 -4.260 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.722 -2.832 -6.019 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.863 -2.853 -7.065 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.428 -4.249 -7.259 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.912 -4.338 -7.015 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.708 -5.260 -7.632 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.291 -5.878 -8.743 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.913 -5.533 -7.158 1.00 0.00 N ATOM 0 H ARG A 133 -8.696 -4.251 -3.875 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.336 -1.868 -4.194 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.132 -1.931 -6.185 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.069 -3.682 -6.219 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.659 -2.180 -6.747 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.489 -2.477 -8.017 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.215 -4.580 -8.275 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -10.916 -4.936 -6.586 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.340 -3.682 -6.362 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -12.374 -5.661 -9.134 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.890 -6.566 -9.199 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.254 -5.053 -6.325 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.501 -6.223 -7.626 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.428 -4.872 -4.110 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.571 -5.788 -4.416 1.00 0.00 C ATOM 2016 C LYS A 134 -13.850 -5.762 -3.556 1.00 0.00 C ATOM 2017 O LYS A 134 -14.465 -6.784 -3.395 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.060 -7.189 -4.592 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.503 -7.762 -3.338 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.783 -9.011 -3.592 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.484 -8.714 -4.254 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.855 -9.926 -4.834 1.00 0.00 N ATOM 0 H LYS A 134 -10.606 -5.355 -3.748 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.962 -5.354 -5.336 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -12.871 -7.825 -4.947 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -11.289 -7.195 -5.363 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -10.830 -7.041 -2.875 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.311 -7.944 -2.630 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.612 -9.541 -2.655 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.383 -9.666 -4.224 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.641 -7.977 -5.042 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -8.804 -8.266 -3.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.302 -9.662 -5.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -8.227 -10.362 -4.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.595 -10.605 -5.105 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.288 -4.618 -3.109 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.550 -4.516 -2.333 1.00 0.00 C ATOM 2038 C LEU A 135 -16.787 -4.572 -3.243 1.00 0.00 C ATOM 2039 O LEU A 135 -16.954 -3.711 -4.111 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.582 -3.218 -1.487 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.898 -3.242 -0.097 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.597 -3.963 -0.156 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.612 -1.834 0.327 1.00 0.00 C ATOM 0 H LEU A 135 -13.810 -3.729 -3.254 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.578 -5.377 -1.665 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.119 -2.425 -2.074 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.626 -2.939 -1.341 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.565 -3.746 0.602 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.137 -3.966 0.832 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.765 -4.990 -0.481 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.935 -3.462 -0.863 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.130 -1.839 1.305 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.952 -1.362 -0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.546 -1.275 0.386 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.600 -5.639 -3.145 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.887 -5.716 -3.800 1.00 0.00 C ATOM 2057 C PRO A 136 -20.017 -5.464 -2.776 1.00 0.00 C ATOM 2058 O PRO A 136 -20.262 -6.310 -1.893 1.00 0.00 O ATOM 2059 CB PRO A 136 -18.928 -7.182 -4.302 1.00 0.00 C ATOM 2060 CG PRO A 136 -17.854 -7.912 -3.500 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.315 -6.918 -2.483 1.00 0.00 C ATOM 0 HA PRO A 136 -19.020 -4.983 -4.596 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -19.910 -7.626 -4.140 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -18.726 -7.237 -5.372 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -18.271 -8.787 -3.002 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -17.057 -8.267 -4.154 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.818 -7.003 -1.520 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -16.250 -7.056 -2.299 1.00 0.00 H new