USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=22 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 Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= -0.0381 X(o=-0.038,f=-0.068) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 69:sc= 1.24 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -1 X(o=-1,f=-1.4) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 131:sc= 0.999 USER MOD Single : A 40 TYR OH : rot -96:sc= 1.28 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 87:sc= 1.19 USER MOD Single : A 51 ASN : amide:sc= -0.19 X(o=-0.19,f=0) USER MOD Single : A 54 THR OG1 : rot -94:sc= 0.85 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.55 X(o=-0.55,f=-0.38) USER MOD Single : A 60 THR OG1 : rot 88:sc= 1.19 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 148:sc= 1.12 (180deg=0.349) USER MOD Single : A 76 SER OG : rot -92:sc= 1.23 USER MOD Single : A 81 ASN : amide:sc= -1.86! C(o=-1.9!,f=-2.9!) USER MOD Single : A 82 CYS SG : rot 94:sc= 0.184 USER MOD Single : A 85 THR OG1 : rot 89:sc= 0.758 USER MOD Single : A 87 LYS NZ :NH3+ -113:sc= 0.00336 (180deg=-5.1!) USER MOD Single : A 89 ASN : amide:sc= 1.26 K(o=1.3,f=-1.4) USER MOD Single : A 90 GLN : amide:sc= 1.52 K(o=1.5,f=-0.5) USER MOD Single : A 91 GLN : amide:sc= -0.0244 X(o=-0.024,f=-0.0037) USER MOD Single : A 94 ASN : amide:sc= 0.17 X(o=0.17,f=-0.14) USER MOD Single : A 100 MET CE :methyl -172:sc= -0.0351 (180deg=-0.0967) USER MOD Single : A 102 THR OG1 : rot 180:sc= -1.41! USER MOD Single : A 113 GLN : amide:sc= -5.19! C(o=-5.2!,f=-3.9!) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -0.878 K(o=-0.88,f=-0.2) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc=-0.00506 X(o=-0.0051,f=-0.0051) USER MOD Single : A 125 GLN : amide:sc= -0.69! X(o=-0.69!,f=-0.29) USER MOD Single : A 129 THR OG1 : rot -100:sc= -0.549 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -171:sc= 1.41 (180deg=0.656!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.003 8.770 3.308 1.00 0.00 N ATOM 2 CA PRO A 1 3.763 8.089 2.288 1.00 0.00 C ATOM 3 C PRO A 1 5.201 8.485 2.452 1.00 0.00 C ATOM 4 O PRO A 1 5.542 9.112 3.434 1.00 0.00 O ATOM 5 CB PRO A 1 3.258 8.512 0.928 1.00 0.00 C ATOM 6 CG PRO A 1 1.970 9.213 1.236 1.00 0.00 C ATOM 7 CD PRO A 1 2.076 9.691 2.673 1.00 0.00 C ATOM 0 H2 PRO A 1 3.629 9.276 3.934 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.494 8.094 3.878 1.00 0.00 H new ATOM 0 HA PRO A 1 3.659 7.008 2.377 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.964 9.173 0.425 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.102 7.655 0.273 1.00 0.00 H new ATOM 0 HG2 PRO A 1 1.813 10.052 0.558 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.122 8.540 1.112 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.443 10.716 2.722 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.104 9.676 3.167 1.00 0.00 H new ATOM 17 N VAL A 2 6.024 8.106 1.529 1.00 0.00 N ATOM 18 CA VAL A 2 7.421 8.456 1.534 1.00 0.00 C ATOM 19 C VAL A 2 7.748 9.208 0.259 1.00 0.00 C ATOM 20 O VAL A 2 7.165 8.935 -0.781 1.00 0.00 O ATOM 21 CB VAL A 2 8.292 7.169 1.679 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.783 7.455 1.543 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.004 6.517 3.026 1.00 0.00 C ATOM 0 H VAL A 2 5.746 7.533 0.732 1.00 0.00 H new ATOM 0 HA VAL A 2 7.643 9.102 2.383 1.00 0.00 H new ATOM 0 HB VAL A 2 8.025 6.493 0.867 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.343 6.526 1.652 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.983 7.886 0.562 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.091 8.157 2.318 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.610 5.617 3.132 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.247 7.215 3.827 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.948 6.252 3.084 1.00 0.00 H new ATOM 33 N THR A 3 8.598 10.206 0.375 1.00 0.00 N ATOM 34 CA THR A 3 9.052 10.995 -0.763 1.00 0.00 C ATOM 35 C THR A 3 10.553 10.723 -0.987 1.00 0.00 C ATOM 36 O THR A 3 11.272 10.440 -0.019 1.00 0.00 O ATOM 37 CB THR A 3 8.748 12.518 -0.536 1.00 0.00 C ATOM 38 OG1 THR A 3 9.249 13.323 -1.613 1.00 0.00 O ATOM 39 CG2 THR A 3 9.307 13.005 0.795 1.00 0.00 C ATOM 0 H THR A 3 8.999 10.499 1.266 1.00 0.00 H new ATOM 0 HA THR A 3 8.511 10.704 -1.664 1.00 0.00 H new ATOM 0 HB THR A 3 7.664 12.625 -0.510 1.00 0.00 H new ATOM 0 HG1 THR A 3 9.042 14.265 -1.441 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.079 14.063 0.920 1.00 0.00 H new ATOM 0 HG22 THR A 3 8.855 12.438 1.609 1.00 0.00 H new ATOM 0 HG23 THR A 3 10.388 12.863 0.810 1.00 0.00 H new ATOM 228 N HIS A 16 10.864 10.247 5.196 1.00 0.00 N ATOM 229 CA HIS A 16 9.718 9.491 5.582 1.00 0.00 C ATOM 230 C HIS A 16 8.671 10.555 5.862 1.00 0.00 C ATOM 231 O HIS A 16 8.938 11.480 6.618 1.00 0.00 O ATOM 232 CB HIS A 16 10.006 8.742 6.898 1.00 0.00 C ATOM 233 CG HIS A 16 11.238 7.857 6.883 1.00 0.00 C ATOM 234 ND1 HIS A 16 12.485 8.304 7.257 1.00 0.00 N ATOM 235 CD2 HIS A 16 11.403 6.554 6.548 1.00 0.00 C ATOM 236 CE1 HIS A 16 13.360 7.333 7.143 1.00 0.00 C ATOM 237 NE2 HIS A 16 12.737 6.256 6.718 1.00 0.00 N ATOM 0 HA HIS A 16 9.423 8.760 4.829 1.00 0.00 H new ATOM 0 HB2 HIS A 16 10.115 9.475 7.698 1.00 0.00 H new ATOM 0 HB3 HIS A 16 9.140 8.127 7.144 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.633 5.876 6.211 1.00 0.00 H new ATOM 0 HE1 HIS A 16 14.415 7.406 7.362 1.00 0.00 H new ATOM 0 HE2 HIS A 16 13.170 5.349 6.543 1.00 0.00 H new ATOM 246 N ASN A 17 7.539 10.482 5.221 1.00 0.00 N ATOM 247 CA ASN A 17 6.562 11.550 5.342 1.00 0.00 C ATOM 248 C ASN A 17 5.331 11.112 6.116 1.00 0.00 C ATOM 249 O ASN A 17 5.054 9.906 6.257 1.00 0.00 O ATOM 250 CB ASN A 17 6.181 11.994 3.925 1.00 0.00 C ATOM 251 CG ASN A 17 5.576 13.354 3.852 1.00 0.00 C ATOM 252 OD1 ASN A 17 4.376 13.526 3.948 1.00 0.00 O ATOM 253 ND2 ASN A 17 6.412 14.325 3.665 1.00 0.00 N ATOM 0 H ASN A 17 7.263 9.709 4.615 1.00 0.00 H new ATOM 0 HA ASN A 17 6.997 12.377 5.903 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.072 11.971 3.297 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.478 11.273 3.507 1.00 0.00 H new ATOM 0 HD21 ASN A 17 6.072 15.284 3.592 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.411 14.131 3.591 1.00 0.00 H new ATOM 260 N GLY A 18 4.607 12.091 6.614 1.00 0.00 N ATOM 261 CA GLY A 18 3.431 11.848 7.373 1.00 0.00 C ATOM 262 C GLY A 18 2.225 11.553 6.508 1.00 0.00 C ATOM 263 O GLY A 18 2.343 11.320 5.293 1.00 0.00 O ATOM 0 H GLY A 18 4.831 13.079 6.495 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.605 11.007 8.045 1.00 0.00 H new ATOM 0 HA3 GLY A 18 3.221 12.717 7.997 1.00 0.00 H new ATOM 267 N PHE A 19 1.077 11.629 7.112 1.00 0.00 N ATOM 268 CA PHE A 19 -0.165 11.266 6.470 1.00 0.00 C ATOM 269 C PHE A 19 -0.911 12.541 6.085 1.00 0.00 C ATOM 270 O PHE A 19 -1.176 13.387 6.953 1.00 0.00 O ATOM 271 CB PHE A 19 -1.045 10.461 7.459 1.00 0.00 C ATOM 272 CG PHE A 19 -0.344 9.309 8.164 1.00 0.00 C ATOM 273 CD1 PHE A 19 0.424 9.540 9.304 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.446 8.011 7.692 1.00 0.00 C ATOM 275 CE1 PHE A 19 1.070 8.504 9.949 1.00 0.00 C ATOM 276 CE2 PHE A 19 0.201 6.973 8.332 1.00 0.00 C ATOM 277 CZ PHE A 19 0.962 7.220 9.458 1.00 0.00 C ATOM 0 H PHE A 19 0.968 11.947 8.075 1.00 0.00 H new ATOM 0 HA PHE A 19 0.044 10.663 5.587 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.433 11.145 8.214 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.903 10.065 6.916 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.515 10.545 9.689 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.039 7.808 6.812 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.657 8.699 10.834 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.112 5.966 7.952 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.472 6.408 9.954 1.00 0.00 H new ATOM 287 N ASP A 20 -1.232 12.709 4.816 1.00 0.00 N ATOM 288 CA ASP A 20 -2.032 13.869 4.375 1.00 0.00 C ATOM 289 C ASP A 20 -3.475 13.566 4.678 1.00 0.00 C ATOM 290 O ASP A 20 -3.926 12.440 4.413 1.00 0.00 O ATOM 291 CB ASP A 20 -1.891 14.069 2.854 1.00 0.00 C ATOM 292 CG ASP A 20 -2.541 15.345 2.330 1.00 0.00 C ATOM 293 OD1 ASP A 20 -3.745 15.346 2.031 1.00 0.00 O ATOM 294 OD2 ASP A 20 -1.830 16.351 2.165 1.00 0.00 O ATOM 0 H ASP A 20 -0.961 12.071 4.068 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.690 14.769 4.887 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.832 14.082 2.597 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.333 13.213 2.344 1.00 0.00 H new ATOM 299 N PHE A 21 -4.207 14.507 5.239 1.00 0.00 N ATOM 300 CA PHE A 21 -5.584 14.223 5.561 1.00 0.00 C ATOM 301 C PHE A 21 -6.481 14.286 4.332 1.00 0.00 C ATOM 302 O PHE A 21 -7.306 13.428 4.153 1.00 0.00 O ATOM 303 CB PHE A 21 -6.138 15.110 6.679 1.00 0.00 C ATOM 304 CG PHE A 21 -7.429 14.579 7.189 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.447 13.369 7.850 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.618 15.257 6.997 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.618 12.837 8.316 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.799 14.727 7.465 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.800 13.516 8.125 1.00 0.00 C ATOM 0 H PHE A 21 -3.883 15.445 5.474 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.589 13.200 5.936 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.417 15.167 7.494 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -6.279 16.125 6.307 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.522 12.833 8.002 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.620 16.205 6.479 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.615 11.888 8.832 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.726 15.260 7.315 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.727 13.101 8.492 1.00 0.00 H new ATOM 319 N ALA A 22 -6.282 15.282 3.485 1.00 0.00 N ATOM 320 CA ALA A 22 -7.106 15.480 2.286 1.00 0.00 C ATOM 321 C ALA A 22 -7.087 14.274 1.357 1.00 0.00 C ATOM 322 O ALA A 22 -8.108 13.935 0.779 1.00 0.00 O ATOM 323 CB ALA A 22 -6.696 16.718 1.529 1.00 0.00 C ATOM 0 H ALA A 22 -5.547 15.980 3.602 1.00 0.00 H new ATOM 0 HA ALA A 22 -8.128 15.608 2.643 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.328 16.832 0.648 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.808 17.591 2.172 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.655 16.627 1.219 1.00 0.00 H new ATOM 329 N VAL A 23 -5.933 13.647 1.216 1.00 0.00 N ATOM 330 CA VAL A 23 -5.798 12.415 0.427 1.00 0.00 C ATOM 331 C VAL A 23 -6.722 11.304 0.994 1.00 0.00 C ATOM 332 O VAL A 23 -7.638 10.814 0.303 1.00 0.00 O ATOM 333 CB VAL A 23 -4.292 11.970 0.388 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.094 10.599 -0.226 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.488 12.994 -0.395 1.00 0.00 C ATOM 0 H VAL A 23 -5.062 13.967 1.639 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.115 12.603 -0.599 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.948 11.910 1.420 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.033 10.349 -0.224 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.643 9.858 0.355 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.464 10.603 -1.251 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.442 12.690 -0.425 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.876 13.061 -1.412 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.569 13.967 0.089 1.00 0.00 H new ATOM 345 N ILE A 24 -6.481 10.946 2.252 1.00 0.00 N ATOM 346 CA ILE A 24 -7.319 9.991 3.018 1.00 0.00 C ATOM 347 C ILE A 24 -8.810 10.375 2.937 1.00 0.00 C ATOM 348 O ILE A 24 -9.672 9.540 2.701 1.00 0.00 O ATOM 349 CB ILE A 24 -6.892 9.977 4.517 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.441 9.493 4.696 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.842 9.146 5.370 1.00 0.00 C ATOM 352 CD1 ILE A 24 -5.155 8.103 4.140 1.00 0.00 C ATOM 0 H ILE A 24 -5.691 11.308 2.787 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.176 9.004 2.579 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.946 11.009 4.863 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.773 10.206 4.213 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -5.200 9.500 5.759 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.508 9.163 6.408 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.847 9.562 5.305 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.851 8.118 5.008 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.109 7.850 4.313 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.792 7.373 4.640 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.359 8.090 3.069 1.00 0.00 H new ATOM 364 N LYS A 25 -9.058 11.643 3.082 1.00 0.00 N ATOM 365 CA LYS A 25 -10.377 12.224 3.080 1.00 0.00 C ATOM 366 C LYS A 25 -11.061 12.015 1.733 1.00 0.00 C ATOM 367 O LYS A 25 -12.192 11.541 1.684 1.00 0.00 O ATOM 368 CB LYS A 25 -10.244 13.707 3.379 1.00 0.00 C ATOM 369 CG LYS A 25 -11.534 14.481 3.449 1.00 0.00 C ATOM 370 CD LYS A 25 -11.259 15.981 3.333 1.00 0.00 C ATOM 371 CE LYS A 25 -10.774 16.341 1.920 1.00 0.00 C ATOM 372 NZ LYS A 25 -10.549 17.783 1.746 1.00 0.00 N ATOM 0 H LYS A 25 -8.318 12.334 3.211 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.991 11.740 3.839 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.722 13.821 4.329 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.613 14.158 2.613 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.201 14.163 2.647 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -12.043 14.269 4.389 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -12.166 16.540 3.564 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.508 16.275 4.066 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.848 15.805 1.711 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.510 16.002 1.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.223 17.969 0.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.437 18.296 1.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.827 18.106 2.421 1.00 0.00 H new ATOM 386 N GLU A 26 -10.367 12.337 0.643 1.00 0.00 N ATOM 387 CA GLU A 26 -10.916 12.161 -0.691 1.00 0.00 C ATOM 388 C GLU A 26 -11.243 10.702 -0.941 1.00 0.00 C ATOM 389 O GLU A 26 -12.349 10.376 -1.421 1.00 0.00 O ATOM 390 CB GLU A 26 -9.939 12.667 -1.750 1.00 0.00 C ATOM 391 CG GLU A 26 -10.459 12.475 -3.174 1.00 0.00 C ATOM 392 CD GLU A 26 -9.519 12.954 -4.234 1.00 0.00 C ATOM 393 OE1 GLU A 26 -8.348 13.279 -3.928 1.00 0.00 O ATOM 394 OE2 GLU A 26 -9.918 12.994 -5.413 1.00 0.00 O ATOM 0 H GLU A 26 -9.422 12.721 0.662 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.834 12.745 -0.759 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.741 13.725 -1.580 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.989 12.144 -1.641 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.664 11.417 -3.336 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.407 13.003 -3.278 1.00 0.00 H new ATOM 401 N LEU A 27 -10.301 9.828 -0.606 1.00 0.00 N ATOM 402 CA LEU A 27 -10.527 8.414 -0.795 1.00 0.00 C ATOM 403 C LEU A 27 -11.704 7.958 0.041 1.00 0.00 C ATOM 404 O LEU A 27 -12.551 7.238 -0.449 1.00 0.00 O ATOM 405 CB LEU A 27 -9.272 7.551 -0.511 1.00 0.00 C ATOM 406 CG LEU A 27 -9.390 6.078 -0.882 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.893 5.950 -2.285 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.047 5.394 -0.772 1.00 0.00 C ATOM 0 H LEU A 27 -9.393 10.074 -0.210 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.757 8.267 -1.850 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.429 7.978 -1.054 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.036 7.622 0.551 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.088 5.603 -0.193 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.976 4.895 -2.547 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.872 6.422 -2.365 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.198 6.439 -2.967 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.151 4.343 -1.041 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.338 5.873 -1.448 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.682 5.472 0.252 1.00 0.00 H new ATOM 420 N LYS A 28 -11.798 8.477 1.254 1.00 0.00 N ATOM 421 CA LYS A 28 -12.888 8.150 2.156 1.00 0.00 C ATOM 422 C LYS A 28 -14.242 8.611 1.587 1.00 0.00 C ATOM 423 O LYS A 28 -15.279 7.956 1.796 1.00 0.00 O ATOM 424 CB LYS A 28 -12.652 8.758 3.552 1.00 0.00 C ATOM 425 CG LYS A 28 -13.717 8.362 4.579 1.00 0.00 C ATOM 426 CD LYS A 28 -13.393 8.829 5.980 1.00 0.00 C ATOM 427 CE LYS A 28 -14.487 8.408 6.950 1.00 0.00 C ATOM 428 NZ LYS A 28 -14.156 8.756 8.347 1.00 0.00 N ATOM 0 H LYS A 28 -11.122 9.136 1.640 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.917 7.065 2.256 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.674 8.444 3.916 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.627 9.844 3.467 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.678 8.779 4.277 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.826 7.278 4.580 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.438 8.411 6.297 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -13.286 9.914 5.992 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -15.424 8.889 6.670 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.645 7.332 6.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.928 8.451 8.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -13.276 8.277 8.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -14.031 9.785 8.428 1.00 0.00 H new ATOM 442 N THR A 29 -14.207 9.698 0.826 1.00 0.00 N ATOM 443 CA THR A 29 -15.393 10.274 0.258 1.00 0.00 C ATOM 444 C THR A 29 -15.955 9.356 -0.839 1.00 0.00 C ATOM 445 O THR A 29 -17.148 9.043 -0.843 1.00 0.00 O ATOM 446 CB THR A 29 -15.115 11.700 -0.300 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.455 12.503 0.705 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.412 12.379 -0.689 1.00 0.00 C ATOM 0 H THR A 29 -13.348 10.197 0.592 1.00 0.00 H new ATOM 0 HA THR A 29 -16.139 10.370 1.047 1.00 0.00 H new ATOM 0 HB THR A 29 -14.477 11.604 -1.179 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.545 12.168 0.845 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.199 13.375 -1.077 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.915 11.790 -1.456 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.057 12.461 0.186 1.00 0.00 H new ATOM 456 N ALA A 30 -15.095 8.849 -1.716 1.00 0.00 N ATOM 457 CA ALA A 30 -15.555 8.021 -2.765 1.00 0.00 C ATOM 458 C ALA A 30 -15.775 6.617 -2.256 1.00 0.00 C ATOM 459 O ALA A 30 -16.603 5.893 -2.760 1.00 0.00 O ATOM 460 CB ALA A 30 -14.611 8.026 -3.924 1.00 0.00 C ATOM 0 H ALA A 30 -14.088 9.010 -1.701 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.505 8.420 -3.121 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.998 7.378 -4.711 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -14.510 9.042 -4.307 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.636 7.662 -3.601 1.00 0.00 H new ATOM 466 N ALA A 31 -15.052 6.250 -1.239 1.00 0.00 N ATOM 467 CA ALA A 31 -15.227 4.992 -0.613 1.00 0.00 C ATOM 468 C ALA A 31 -16.631 4.917 -0.014 1.00 0.00 C ATOM 469 O ALA A 31 -17.239 3.868 0.015 1.00 0.00 O ATOM 470 CB ALA A 31 -14.174 4.828 0.444 1.00 0.00 C ATOM 0 H ALA A 31 -14.320 6.827 -0.824 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.123 4.184 -1.337 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.298 3.862 0.934 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.187 4.878 -0.015 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.272 5.624 1.182 1.00 0.00 H new ATOM 476 N SER A 32 -17.147 6.062 0.405 1.00 0.00 N ATOM 477 CA SER A 32 -18.460 6.148 0.988 1.00 0.00 C ATOM 478 C SER A 32 -19.585 6.248 -0.088 1.00 0.00 C ATOM 479 O SER A 32 -20.688 5.741 0.120 1.00 0.00 O ATOM 480 CB SER A 32 -18.494 7.344 1.974 1.00 0.00 C ATOM 481 OG SER A 32 -19.687 7.370 2.756 1.00 0.00 O ATOM 0 H SER A 32 -16.659 6.956 0.346 1.00 0.00 H new ATOM 0 HA SER A 32 -18.661 5.226 1.533 1.00 0.00 H new ATOM 0 HB2 SER A 32 -17.630 7.290 2.636 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.409 8.275 1.414 1.00 0.00 H new ATOM 0 HG SER A 32 -19.663 8.139 3.363 1.00 0.00 H new ATOM 487 N GLN A 33 -19.327 6.912 -1.225 1.00 0.00 N ATOM 488 CA GLN A 33 -20.378 7.087 -2.264 1.00 0.00 C ATOM 489 C GLN A 33 -20.305 5.984 -3.316 1.00 0.00 C ATOM 490 O GLN A 33 -21.276 5.304 -3.625 1.00 0.00 O ATOM 491 CB GLN A 33 -20.223 8.423 -3.011 1.00 0.00 C ATOM 492 CG GLN A 33 -19.957 9.632 -2.145 1.00 0.00 C ATOM 493 CD GLN A 33 -19.912 10.941 -2.936 1.00 0.00 C ATOM 494 OE1 GLN A 33 -19.209 11.870 -2.562 1.00 0.00 O ATOM 495 NE2 GLN A 33 -20.638 11.022 -4.026 1.00 0.00 N ATOM 0 H GLN A 33 -18.426 7.331 -1.454 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.330 7.056 -1.733 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.407 8.325 -3.727 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -21.131 8.604 -3.586 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -20.732 9.702 -1.382 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.009 9.497 -1.624 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.215 10.232 -4.314 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -20.625 11.875 -4.585 1.00 0.00 H new ATOM 504 N TYR A 34 -19.128 5.831 -3.836 1.00 0.00 N ATOM 505 CA TYR A 34 -18.834 5.040 -4.986 1.00 0.00 C ATOM 506 C TYR A 34 -18.732 3.551 -4.666 1.00 0.00 C ATOM 507 O TYR A 34 -19.385 2.728 -5.313 1.00 0.00 O ATOM 508 CB TYR A 34 -17.526 5.626 -5.584 1.00 0.00 C ATOM 509 CG TYR A 34 -17.731 6.948 -6.306 1.00 0.00 C ATOM 510 CD1 TYR A 34 -17.727 8.134 -5.608 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.925 7.006 -7.676 1.00 0.00 C ATOM 512 CE1 TYR A 34 -17.912 9.335 -6.229 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.116 8.213 -8.309 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.103 9.376 -7.573 1.00 0.00 C ATOM 515 OH TYR A 34 -18.279 10.587 -8.193 1.00 0.00 O ATOM 0 H TYR A 34 -18.300 6.281 -3.446 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.644 5.090 -5.713 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.800 5.767 -4.783 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.098 4.904 -6.279 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.573 8.114 -4.539 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.926 6.094 -8.254 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -17.907 10.249 -5.654 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.275 8.247 -9.377 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.402 10.447 -9.155 1.00 0.00 H new ATOM 525 N GLY A 35 -18.070 3.234 -3.575 1.00 0.00 N ATOM 526 CA GLY A 35 -17.826 1.846 -3.270 1.00 0.00 C ATOM 527 C GLY A 35 -16.644 1.368 -4.046 1.00 0.00 C ATOM 528 O GLY A 35 -16.380 1.867 -5.148 1.00 0.00 O ATOM 0 H GLY A 35 -17.699 3.903 -2.900 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.647 1.723 -2.202 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.703 1.248 -3.517 1.00 0.00 H new ATOM 532 N ALA A 36 -15.939 0.400 -3.544 1.00 0.00 N ATOM 533 CA ALA A 36 -14.721 0.041 -4.184 1.00 0.00 C ATOM 534 C ALA A 36 -14.943 -0.915 -5.358 1.00 0.00 C ATOM 535 O ALA A 36 -14.916 -2.132 -5.223 1.00 0.00 O ATOM 536 CB ALA A 36 -13.702 -0.458 -3.212 1.00 0.00 C ATOM 0 H ALA A 36 -16.181 -0.141 -2.714 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.308 0.953 -4.615 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.788 -0.720 -3.745 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.485 0.321 -2.481 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.089 -1.339 -2.700 1.00 0.00 H new ATOM 542 N THR A 37 -15.134 -0.334 -6.507 1.00 0.00 N ATOM 543 CA THR A 37 -15.455 -1.025 -7.719 1.00 0.00 C ATOM 544 C THR A 37 -15.752 0.043 -8.773 1.00 0.00 C ATOM 545 O THR A 37 -15.456 -0.120 -9.958 1.00 0.00 O ATOM 546 CB THR A 37 -16.638 -2.039 -7.552 1.00 0.00 C ATOM 547 OG1 THR A 37 -16.755 -2.838 -8.716 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.954 -1.338 -7.290 1.00 0.00 C ATOM 0 H THR A 37 -15.067 0.677 -6.628 1.00 0.00 H new ATOM 0 HA THR A 37 -14.613 -1.645 -8.026 1.00 0.00 H new ATOM 0 HB THR A 37 -16.413 -2.664 -6.688 1.00 0.00 H new ATOM 0 HG1 THR A 37 -16.810 -3.782 -8.460 1.00 0.00 H new ATOM 0 HG21 THR A 37 -18.746 -2.079 -7.181 1.00 0.00 H new ATOM 0 HG22 THR A 37 -17.878 -0.751 -6.375 1.00 0.00 H new ATOM 0 HG23 THR A 37 -18.187 -0.678 -8.126 1.00 0.00 H new ATOM 556 N ALA A 38 -16.296 1.164 -8.306 1.00 0.00 N ATOM 557 CA ALA A 38 -16.482 2.308 -9.139 1.00 0.00 C ATOM 558 C ALA A 38 -15.100 2.885 -9.431 1.00 0.00 C ATOM 559 O ALA A 38 -14.335 3.132 -8.489 1.00 0.00 O ATOM 560 CB ALA A 38 -17.346 3.324 -8.431 1.00 0.00 C ATOM 0 H ALA A 38 -16.612 1.287 -7.344 1.00 0.00 H new ATOM 0 HA ALA A 38 -16.983 2.039 -10.069 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.484 4.194 -9.072 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.317 2.882 -8.205 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.862 3.630 -7.503 1.00 0.00 H new ATOM 566 N PRO A 39 -14.762 3.077 -10.736 1.00 0.00 N ATOM 567 CA PRO A 39 -13.425 3.508 -11.210 1.00 0.00 C ATOM 568 C PRO A 39 -12.741 4.553 -10.345 1.00 0.00 C ATOM 569 O PRO A 39 -11.573 4.393 -9.997 1.00 0.00 O ATOM 570 CB PRO A 39 -13.730 4.096 -12.573 1.00 0.00 C ATOM 571 CG PRO A 39 -14.845 3.253 -13.081 1.00 0.00 C ATOM 572 CD PRO A 39 -15.680 2.890 -11.884 1.00 0.00 C ATOM 0 HA PRO A 39 -12.728 2.670 -11.199 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.021 5.144 -12.501 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -12.862 4.051 -13.231 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -15.437 3.795 -13.818 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -14.463 2.359 -13.574 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -16.558 3.530 -11.801 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.039 1.863 -11.945 1.00 0.00 H new ATOM 580 N TYR A 40 -13.484 5.597 -9.981 1.00 0.00 N ATOM 581 CA TYR A 40 -12.956 6.732 -9.233 1.00 0.00 C ATOM 582 C TYR A 40 -12.161 6.304 -7.986 1.00 0.00 C ATOM 583 O TYR A 40 -10.944 6.462 -7.951 1.00 0.00 O ATOM 584 CB TYR A 40 -14.083 7.721 -8.851 1.00 0.00 C ATOM 585 CG TYR A 40 -13.598 9.034 -8.257 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.100 10.047 -9.065 1.00 0.00 C ATOM 587 CD2 TYR A 40 -13.641 9.251 -6.896 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.657 11.239 -8.524 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.202 10.436 -6.344 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.708 11.429 -7.162 1.00 0.00 C ATOM 591 OH TYR A 40 -12.259 12.617 -6.616 1.00 0.00 O ATOM 0 H TYR A 40 -14.477 5.678 -10.200 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.256 7.241 -9.896 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.676 7.936 -9.740 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.747 7.236 -8.135 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.058 9.901 -10.134 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.026 8.477 -6.249 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.273 12.017 -9.167 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.245 10.585 -5.275 1.00 0.00 H new ATOM 0 HH TYR A 40 -11.331 12.511 -6.321 1.00 0.00 H new ATOM 601 N THR A 41 -12.842 5.761 -6.957 1.00 0.00 N ATOM 602 CA THR A 41 -12.226 5.391 -5.699 1.00 0.00 C ATOM 603 C THR A 41 -10.993 4.467 -5.837 1.00 0.00 C ATOM 604 O THR A 41 -9.990 4.692 -5.177 1.00 0.00 O ATOM 605 CB THR A 41 -13.267 4.807 -4.699 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.702 4.671 -3.398 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.788 3.464 -5.146 1.00 0.00 C ATOM 0 H THR A 41 -13.844 5.571 -6.992 1.00 0.00 H new ATOM 0 HA THR A 41 -11.840 6.324 -5.289 1.00 0.00 H new ATOM 0 HB THR A 41 -14.098 5.512 -4.670 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.374 4.304 -2.786 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.511 3.094 -4.419 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.270 3.566 -6.118 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.960 2.760 -5.224 1.00 0.00 H new ATOM 615 N LEU A 42 -11.031 3.469 -6.704 1.00 0.00 N ATOM 616 CA LEU A 42 -9.861 2.600 -6.801 1.00 0.00 C ATOM 617 C LEU A 42 -8.763 3.177 -7.613 1.00 0.00 C ATOM 618 O LEU A 42 -7.624 2.820 -7.424 1.00 0.00 O ATOM 619 CB LEU A 42 -10.080 1.067 -7.024 1.00 0.00 C ATOM 620 CG LEU A 42 -11.065 0.592 -8.084 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.457 0.822 -7.611 1.00 0.00 C ATOM 622 CD2 LEU A 42 -10.818 1.261 -9.429 1.00 0.00 C ATOM 0 H LEU A 42 -11.811 3.244 -7.322 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.528 2.593 -5.763 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.110 0.631 -7.262 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.396 0.641 -6.072 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.916 -0.477 -8.238 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.160 0.482 -8.371 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.624 0.267 -6.688 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.608 1.886 -7.428 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.542 0.894 -10.156 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.925 2.341 -9.323 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.810 1.028 -9.772 1.00 0.00 H new ATOM 634 N ALA A 43 -9.097 4.112 -8.483 1.00 0.00 N ATOM 635 CA ALA A 43 -8.092 4.836 -9.233 1.00 0.00 C ATOM 636 C ALA A 43 -7.247 5.625 -8.250 1.00 0.00 C ATOM 637 O ALA A 43 -6.049 5.798 -8.427 1.00 0.00 O ATOM 638 CB ALA A 43 -8.730 5.758 -10.263 1.00 0.00 C ATOM 0 H ALA A 43 -10.058 4.387 -8.687 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.467 4.133 -9.783 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.950 6.288 -10.810 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.325 5.168 -10.960 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.372 6.479 -9.757 1.00 0.00 H new ATOM 644 N ILE A 44 -7.890 6.041 -7.183 1.00 0.00 N ATOM 645 CA ILE A 44 -7.245 6.724 -6.088 1.00 0.00 C ATOM 646 C ILE A 44 -6.418 5.708 -5.270 1.00 0.00 C ATOM 647 O ILE A 44 -5.289 5.994 -4.886 1.00 0.00 O ATOM 648 CB ILE A 44 -8.303 7.396 -5.197 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.153 8.344 -6.050 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.636 8.153 -4.054 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.404 8.828 -5.376 1.00 0.00 C ATOM 0 H ILE A 44 -8.893 5.911 -7.051 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.579 7.495 -6.477 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.947 6.632 -4.762 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.547 9.206 -6.327 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.426 7.836 -6.975 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.400 8.622 -3.434 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.053 7.459 -3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.977 8.920 -4.461 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.946 9.493 -6.049 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.034 7.975 -5.123 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.142 9.367 -4.466 1.00 0.00 H new ATOM 663 N VAL A 45 -6.978 4.498 -5.067 1.00 0.00 N ATOM 664 CA VAL A 45 -6.298 3.398 -4.350 1.00 0.00 C ATOM 665 C VAL A 45 -4.971 3.065 -5.066 1.00 0.00 C ATOM 666 O VAL A 45 -3.913 2.956 -4.431 1.00 0.00 O ATOM 667 CB VAL A 45 -7.210 2.092 -4.260 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.476 0.914 -3.616 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.482 2.340 -3.460 1.00 0.00 C ATOM 0 H VAL A 45 -7.913 4.255 -5.395 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.101 3.730 -3.331 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.461 1.847 -5.292 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.139 0.049 -3.578 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.593 0.669 -4.206 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.172 1.184 -2.604 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.073 1.425 -3.424 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.221 2.644 -2.446 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.063 3.129 -3.937 1.00 0.00 H new ATOM 679 N GLU A 46 -5.042 2.951 -6.391 1.00 0.00 N ATOM 680 CA GLU A 46 -3.880 2.679 -7.217 1.00 0.00 C ATOM 681 C GLU A 46 -2.894 3.836 -7.161 1.00 0.00 C ATOM 682 O GLU A 46 -1.697 3.616 -7.134 1.00 0.00 O ATOM 683 CB GLU A 46 -4.284 2.437 -8.667 1.00 0.00 C ATOM 684 CG GLU A 46 -5.381 1.411 -8.815 1.00 0.00 C ATOM 685 CD GLU A 46 -5.679 1.060 -10.244 1.00 0.00 C ATOM 686 OE1 GLU A 46 -6.257 1.892 -10.970 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.323 -0.063 -10.674 1.00 0.00 O ATOM 0 H GLU A 46 -5.911 3.046 -6.917 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.405 1.780 -6.824 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.614 3.378 -9.108 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.411 2.110 -9.231 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.097 0.506 -8.278 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.288 1.790 -8.345 1.00 0.00 H new ATOM 694 N SER A 47 -3.414 5.057 -7.118 1.00 0.00 N ATOM 695 CA SER A 47 -2.581 6.245 -7.099 1.00 0.00 C ATOM 696 C SER A 47 -1.852 6.446 -5.756 1.00 0.00 C ATOM 697 O SER A 47 -0.698 6.847 -5.738 1.00 0.00 O ATOM 698 CB SER A 47 -3.387 7.494 -7.470 1.00 0.00 C ATOM 699 OG SER A 47 -3.968 7.363 -8.757 1.00 0.00 O ATOM 0 H SER A 47 -4.416 5.247 -7.096 1.00 0.00 H new ATOM 0 HA SER A 47 -1.811 6.089 -7.855 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.170 7.659 -6.729 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.738 8.369 -7.448 1.00 0.00 H new ATOM 0 HG SER A 47 -4.839 6.920 -8.679 1.00 0.00 H new ATOM 705 N VAL A 48 -2.509 6.167 -4.637 1.00 0.00 N ATOM 706 CA VAL A 48 -1.871 6.342 -3.347 1.00 0.00 C ATOM 707 C VAL A 48 -0.812 5.257 -3.150 1.00 0.00 C ATOM 708 O VAL A 48 0.293 5.535 -2.682 1.00 0.00 O ATOM 709 CB VAL A 48 -2.870 6.375 -2.156 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.139 6.678 -0.857 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.960 7.408 -2.386 1.00 0.00 C ATOM 0 H VAL A 48 -3.469 5.824 -4.600 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.398 7.324 -3.353 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.335 5.392 -2.083 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.853 6.697 -0.034 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.392 5.906 -0.671 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.647 7.648 -0.934 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.645 7.410 -1.538 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.510 8.395 -2.491 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.509 7.161 -3.295 1.00 0.00 H new ATOM 721 N ALA A 49 -1.127 4.039 -3.594 1.00 0.00 N ATOM 722 CA ALA A 49 -0.183 2.919 -3.543 1.00 0.00 C ATOM 723 C ALA A 49 0.883 3.092 -4.617 1.00 0.00 C ATOM 724 O ALA A 49 1.848 2.379 -4.646 1.00 0.00 O ATOM 725 CB ALA A 49 -0.899 1.580 -3.723 1.00 0.00 C ATOM 0 H ALA A 49 -2.034 3.801 -3.995 1.00 0.00 H new ATOM 0 HA ALA A 49 0.289 2.917 -2.561 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.171 0.770 -3.680 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.633 1.450 -2.928 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.403 1.564 -4.689 1.00 0.00 H new ATOM 731 N ASP A 50 0.688 4.057 -5.504 1.00 0.00 N ATOM 732 CA ASP A 50 1.667 4.369 -6.558 1.00 0.00 C ATOM 733 C ASP A 50 2.768 5.232 -5.968 1.00 0.00 C ATOM 734 O ASP A 50 3.779 5.533 -6.594 1.00 0.00 O ATOM 735 CB ASP A 50 0.983 5.054 -7.758 1.00 0.00 C ATOM 736 CG ASP A 50 1.914 5.412 -8.899 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.571 4.516 -9.474 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.983 6.618 -9.262 1.00 0.00 O ATOM 0 H ASP A 50 -0.144 4.647 -5.522 1.00 0.00 H new ATOM 0 HA ASP A 50 2.109 3.446 -6.934 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.202 4.396 -8.138 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.492 5.963 -7.409 1.00 0.00 H new ATOM 743 N ASN A 51 2.579 5.594 -4.742 1.00 0.00 N ATOM 744 CA ASN A 51 3.563 6.320 -4.001 1.00 0.00 C ATOM 745 C ASN A 51 4.259 5.336 -3.126 1.00 0.00 C ATOM 746 O ASN A 51 3.747 4.243 -2.894 1.00 0.00 O ATOM 747 CB ASN A 51 2.934 7.386 -3.084 1.00 0.00 C ATOM 748 CG ASN A 51 2.326 8.560 -3.802 1.00 0.00 C ATOM 749 OD1 ASN A 51 3.001 9.560 -4.070 1.00 0.00 O ATOM 750 ND2 ASN A 51 1.058 8.471 -4.090 1.00 0.00 N ATOM 0 H ASN A 51 1.727 5.393 -4.218 1.00 0.00 H new ATOM 0 HA ASN A 51 4.228 6.823 -4.703 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.164 6.912 -2.476 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.699 7.753 -2.400 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.585 9.246 -4.555 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.539 7.626 -3.851 1.00 0.00 H new ATOM 757 N TRP A 52 5.410 5.701 -2.651 1.00 0.00 N ATOM 758 CA TRP A 52 6.116 4.889 -1.722 1.00 0.00 C ATOM 759 C TRP A 52 5.321 4.939 -0.434 1.00 0.00 C ATOM 760 O TRP A 52 5.001 6.033 0.062 1.00 0.00 O ATOM 761 CB TRP A 52 7.544 5.419 -1.591 1.00 0.00 C ATOM 762 CG TRP A 52 8.197 5.479 -2.945 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.778 4.457 -3.634 1.00 0.00 C ATOM 764 CD2 TRP A 52 8.272 6.624 -3.795 1.00 0.00 C ATOM 765 NE1 TRP A 52 9.197 4.902 -4.869 1.00 0.00 N ATOM 766 CE2 TRP A 52 8.908 6.225 -4.983 1.00 0.00 C ATOM 767 CE3 TRP A 52 7.863 7.957 -3.657 1.00 0.00 C ATOM 768 CZ2 TRP A 52 9.141 7.102 -6.022 1.00 0.00 C ATOM 769 CZ3 TRP A 52 8.099 8.825 -4.688 1.00 0.00 C ATOM 770 CH2 TRP A 52 8.730 8.397 -5.864 1.00 0.00 C ATOM 0 H TRP A 52 5.882 6.570 -2.899 1.00 0.00 H new ATOM 0 HA TRP A 52 6.212 3.848 -2.031 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.532 6.411 -1.139 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.121 4.774 -0.928 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.893 3.448 -3.267 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.651 4.331 -5.582 1.00 0.00 H new ATOM 0 HE3 TRP A 52 7.372 8.292 -2.756 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 9.631 6.778 -6.928 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 7.794 9.857 -4.594 1.00 0.00 H new ATOM 0 HH2 TRP A 52 8.895 9.105 -6.663 1.00 0.00 H new ATOM 781 N LEU A 53 4.941 3.796 0.047 1.00 0.00 N ATOM 782 CA LEU A 53 3.975 3.714 1.102 1.00 0.00 C ATOM 783 C LEU A 53 4.341 2.557 2.027 1.00 0.00 C ATOM 784 O LEU A 53 4.573 1.439 1.560 1.00 0.00 O ATOM 785 CB LEU A 53 2.616 3.446 0.382 1.00 0.00 C ATOM 786 CG LEU A 53 1.298 3.947 1.027 1.00 0.00 C ATOM 787 CD1 LEU A 53 1.304 5.451 1.147 1.00 0.00 C ATOM 788 CD2 LEU A 53 0.115 3.554 0.164 1.00 0.00 C ATOM 0 H LEU A 53 5.290 2.895 -0.279 1.00 0.00 H new ATOM 0 HA LEU A 53 3.930 4.616 1.713 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.681 3.887 -0.613 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.525 2.368 0.248 1.00 0.00 H new ATOM 0 HG LEU A 53 1.218 3.495 2.015 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.371 5.783 1.602 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.143 5.763 1.770 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.403 5.895 0.156 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.806 3.910 0.625 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.222 4.000 -0.825 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.078 2.469 0.070 1.00 0.00 H new ATOM 800 N THR A 54 4.432 2.819 3.311 1.00 0.00 N ATOM 801 CA THR A 54 4.833 1.791 4.266 1.00 0.00 C ATOM 802 C THR A 54 3.603 0.979 4.716 1.00 0.00 C ATOM 803 O THR A 54 2.462 1.414 4.486 1.00 0.00 O ATOM 804 CB THR A 54 5.479 2.444 5.521 1.00 0.00 C ATOM 805 OG1 THR A 54 4.503 3.236 6.201 1.00 0.00 O ATOM 806 CG2 THR A 54 6.644 3.326 5.122 1.00 0.00 C ATOM 0 H THR A 54 4.236 3.730 3.725 1.00 0.00 H new ATOM 0 HA THR A 54 5.555 1.136 3.778 1.00 0.00 H new ATOM 0 HB THR A 54 5.842 1.653 6.177 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.565 4.165 5.895 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.083 3.774 6.013 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.396 2.726 4.610 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.293 4.114 4.456 1.00 0.00 H new ATOM 814 N PRO A 55 3.792 -0.207 5.373 1.00 0.00 N ATOM 815 CA PRO A 55 2.682 -0.959 5.979 1.00 0.00 C ATOM 816 C PRO A 55 1.964 -0.094 7.037 1.00 0.00 C ATOM 817 O PRO A 55 0.770 -0.281 7.323 1.00 0.00 O ATOM 818 CB PRO A 55 3.372 -2.158 6.648 1.00 0.00 C ATOM 819 CG PRO A 55 4.655 -2.313 5.898 1.00 0.00 C ATOM 820 CD PRO A 55 5.072 -0.926 5.514 1.00 0.00 C ATOM 0 HA PRO A 55 1.926 -1.257 5.253 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.551 -1.974 7.707 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.760 -3.058 6.580 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.414 -2.793 6.516 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.520 -2.939 5.016 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.705 -0.472 6.276 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.640 -0.921 4.583 1.00 0.00 H new ATOM 828 N THR A 56 2.703 0.873 7.588 1.00 0.00 N ATOM 829 CA THR A 56 2.179 1.843 8.528 1.00 0.00 C ATOM 830 C THR A 56 1.180 2.763 7.803 1.00 0.00 C ATOM 831 O THR A 56 0.035 2.970 8.262 1.00 0.00 O ATOM 832 CB THR A 56 3.336 2.692 9.075 1.00 0.00 C ATOM 833 OG1 THR A 56 4.385 1.817 9.521 1.00 0.00 O ATOM 834 CG2 THR A 56 2.870 3.545 10.231 1.00 0.00 C ATOM 0 H THR A 56 3.695 0.998 7.385 1.00 0.00 H new ATOM 0 HA THR A 56 1.679 1.327 9.347 1.00 0.00 H new ATOM 0 HB THR A 56 3.701 3.348 8.284 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.129 2.350 9.871 1.00 0.00 H new ATOM 0 HG21 THR A 56 3.704 4.139 10.604 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.073 4.209 9.895 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.496 2.904 11.029 1.00 0.00 H new ATOM 842 N ASP A 57 1.625 3.293 6.669 1.00 0.00 N ATOM 843 CA ASP A 57 0.799 4.136 5.806 1.00 0.00 C ATOM 844 C ASP A 57 -0.420 3.377 5.364 1.00 0.00 C ATOM 845 O ASP A 57 -1.533 3.892 5.408 1.00 0.00 O ATOM 846 CB ASP A 57 1.575 4.627 4.565 1.00 0.00 C ATOM 847 CG ASP A 57 2.606 5.691 4.847 1.00 0.00 C ATOM 848 OD1 ASP A 57 2.231 6.870 4.938 1.00 0.00 O ATOM 849 OD2 ASP A 57 3.811 5.376 4.931 1.00 0.00 O ATOM 0 H ASP A 57 2.573 3.151 6.319 1.00 0.00 H new ATOM 0 HA ASP A 57 0.506 5.010 6.387 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.071 3.774 4.102 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.862 5.015 3.837 1.00 0.00 H new ATOM 854 N TRP A 58 -0.196 2.133 4.974 1.00 0.00 N ATOM 855 CA TRP A 58 -1.237 1.225 4.553 1.00 0.00 C ATOM 856 C TRP A 58 -2.312 1.053 5.614 1.00 0.00 C ATOM 857 O TRP A 58 -3.487 1.331 5.360 1.00 0.00 O ATOM 858 CB TRP A 58 -0.651 -0.147 4.160 1.00 0.00 C ATOM 859 CG TRP A 58 0.054 -0.174 2.831 1.00 0.00 C ATOM 860 CD1 TRP A 58 -0.030 0.751 1.843 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.898 -1.214 2.315 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.729 0.365 0.761 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.291 -0.821 1.020 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.371 -2.432 2.816 1.00 0.00 C ATOM 865 CZ2 TRP A 58 2.110 -1.582 0.223 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.189 -3.202 2.015 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.550 -2.769 0.726 1.00 0.00 C ATOM 0 H TRP A 58 0.737 1.722 4.943 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.707 1.671 3.676 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.049 -0.462 4.933 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.458 -0.880 4.143 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.610 1.661 1.897 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.844 0.898 -0.101 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.102 -2.762 3.808 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.395 -1.252 -0.765 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.557 -4.149 2.382 1.00 0.00 H new ATOM 0 HH2 TRP A 58 3.191 -3.393 0.121 1.00 0.00 H new ATOM 878 N ASN A 59 -1.915 0.623 6.793 1.00 0.00 N ATOM 879 CA ASN A 59 -2.876 0.333 7.871 1.00 0.00 C ATOM 880 C ASN A 59 -3.766 1.513 8.150 1.00 0.00 C ATOM 881 O ASN A 59 -4.988 1.374 8.183 1.00 0.00 O ATOM 882 CB ASN A 59 -2.184 -0.108 9.158 1.00 0.00 C ATOM 883 CG ASN A 59 -3.173 -0.434 10.285 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.894 -0.191 11.447 1.00 0.00 O ATOM 885 ND2 ASN A 59 -4.299 -1.025 9.959 1.00 0.00 N ATOM 0 H ASN A 59 -0.939 0.462 7.043 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.490 -0.495 7.516 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.572 -0.986 8.953 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.509 0.681 9.490 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -4.964 -1.292 10.685 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -4.509 -1.217 8.980 1.00 0.00 H new ATOM 892 N THR A 60 -3.157 2.667 8.235 1.00 0.00 N ATOM 893 CA THR A 60 -3.848 3.891 8.543 1.00 0.00 C ATOM 894 C THR A 60 -4.847 4.234 7.397 1.00 0.00 C ATOM 895 O THR A 60 -6.026 4.559 7.638 1.00 0.00 O ATOM 896 CB THR A 60 -2.799 5.014 8.704 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.773 4.558 9.624 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.429 6.309 9.249 1.00 0.00 C ATOM 0 H THR A 60 -2.154 2.784 8.090 1.00 0.00 H new ATOM 0 HA THR A 60 -4.415 3.786 9.468 1.00 0.00 H new ATOM 0 HB THR A 60 -2.376 5.236 7.724 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.080 4.074 9.128 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.659 7.074 9.348 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.200 6.656 8.561 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.875 6.114 10.224 1.00 0.00 H new ATOM 906 N LEU A 61 -4.375 4.040 6.172 1.00 0.00 N ATOM 907 CA LEU A 61 -5.094 4.371 4.958 1.00 0.00 C ATOM 908 C LEU A 61 -6.392 3.573 4.884 1.00 0.00 C ATOM 909 O LEU A 61 -7.464 4.158 4.943 1.00 0.00 O ATOM 910 CB LEU A 61 -4.175 4.064 3.764 1.00 0.00 C ATOM 911 CG LEU A 61 -4.460 4.654 2.367 1.00 0.00 C ATOM 912 CD1 LEU A 61 -3.302 4.333 1.462 1.00 0.00 C ATOM 913 CD2 LEU A 61 -5.731 4.121 1.744 1.00 0.00 C ATOM 0 H LEU A 61 -3.455 3.636 5.996 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.364 5.427 4.944 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.171 4.381 4.045 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.148 2.980 3.653 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.589 5.729 2.490 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.490 4.744 0.470 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.390 4.770 1.869 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.185 3.252 1.390 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.874 4.575 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.657 3.039 1.636 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.579 4.364 2.383 1.00 0.00 H new ATOM 925 N VAL A 62 -6.283 2.242 4.838 1.00 0.00 N ATOM 926 CA VAL A 62 -7.458 1.367 4.681 1.00 0.00 C ATOM 927 C VAL A 62 -8.478 1.578 5.789 1.00 0.00 C ATOM 928 O VAL A 62 -9.654 1.804 5.522 1.00 0.00 O ATOM 929 CB VAL A 62 -7.072 -0.166 4.571 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.239 -0.649 5.752 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.314 -1.040 4.415 1.00 0.00 C ATOM 0 H VAL A 62 -5.396 1.743 4.907 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.915 1.657 3.735 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.457 -0.260 3.676 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.004 -1.706 5.623 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.314 -0.075 5.804 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.803 -0.512 6.675 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.016 -2.086 4.342 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.963 -0.907 5.280 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.851 -0.752 3.511 1.00 0.00 H new ATOM 941 N ARG A 63 -7.986 1.582 7.014 1.00 0.00 N ATOM 942 CA ARG A 63 -8.856 1.664 8.211 1.00 0.00 C ATOM 943 C ARG A 63 -9.611 3.002 8.317 1.00 0.00 C ATOM 944 O ARG A 63 -10.605 3.103 9.054 1.00 0.00 O ATOM 945 CB ARG A 63 -8.070 1.407 9.506 1.00 0.00 C ATOM 946 CG ARG A 63 -7.197 2.558 9.954 1.00 0.00 C ATOM 947 CD ARG A 63 -6.328 2.163 11.132 1.00 0.00 C ATOM 948 NE ARG A 63 -5.540 3.312 11.650 1.00 0.00 N ATOM 949 CZ ARG A 63 -4.463 3.237 12.477 1.00 0.00 C ATOM 950 NH1 ARG A 63 -4.026 2.074 12.925 1.00 0.00 N ATOM 951 NH2 ARG A 63 -3.817 4.345 12.845 1.00 0.00 N ATOM 0 H ARG A 63 -6.989 1.530 7.224 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.598 0.876 8.084 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -8.776 1.172 10.303 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.443 0.526 9.366 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.566 2.883 9.126 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.823 3.407 10.229 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.956 1.765 11.929 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.650 1.364 10.831 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.835 4.244 11.358 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.498 1.212 12.651 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.217 2.038 13.545 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -4.130 5.254 12.506 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.010 4.282 13.466 1.00 0.00 H new ATOM 965 N ALA A 64 -9.138 4.024 7.638 1.00 0.00 N ATOM 966 CA ALA A 64 -9.835 5.277 7.666 1.00 0.00 C ATOM 967 C ALA A 64 -10.681 5.466 6.416 1.00 0.00 C ATOM 968 O ALA A 64 -11.879 5.742 6.508 1.00 0.00 O ATOM 969 CB ALA A 64 -8.856 6.432 7.856 1.00 0.00 C ATOM 0 H ALA A 64 -8.290 4.008 7.072 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.514 5.268 8.518 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.404 7.374 7.875 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.321 6.305 8.797 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.143 6.443 7.032 1.00 0.00 H new ATOM 975 N VAL A 65 -10.049 5.318 5.289 1.00 0.00 N ATOM 976 CA VAL A 65 -10.716 5.573 4.004 1.00 0.00 C ATOM 977 C VAL A 65 -12.057 4.814 3.751 1.00 0.00 C ATOM 978 O VAL A 65 -13.055 5.437 3.416 1.00 0.00 O ATOM 979 CB VAL A 65 -9.792 5.462 2.778 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.597 6.386 2.939 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.360 4.023 2.511 1.00 0.00 C ATOM 0 H VAL A 65 -9.075 5.024 5.212 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.995 6.620 4.125 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.358 5.778 1.902 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.950 6.299 2.066 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.943 7.415 3.034 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.039 6.107 3.833 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.709 3.995 1.637 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.821 3.638 3.377 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.240 3.407 2.328 1.00 0.00 H new ATOM 991 N LEU A 66 -12.121 3.522 3.953 1.00 0.00 N ATOM 992 CA LEU A 66 -13.340 2.816 3.588 1.00 0.00 C ATOM 993 C LEU A 66 -13.913 2.124 4.830 1.00 0.00 C ATOM 994 O LEU A 66 -13.183 1.845 5.779 1.00 0.00 O ATOM 995 CB LEU A 66 -13.049 1.869 2.364 1.00 0.00 C ATOM 996 CG LEU A 66 -14.252 1.430 1.448 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.748 0.984 0.104 1.00 0.00 C ATOM 998 CD2 LEU A 66 -15.074 0.322 2.076 1.00 0.00 C ATOM 0 H LEU A 66 -11.378 2.948 4.352 1.00 0.00 H new ATOM 0 HA LEU A 66 -14.119 3.498 3.247 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.314 2.364 1.730 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -12.579 0.964 2.750 1.00 0.00 H new ATOM 0 HG LEU A 66 -14.899 2.299 1.330 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.590 0.683 -0.519 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -13.217 1.806 -0.376 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -13.071 0.139 0.231 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.892 0.053 1.408 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -14.441 -0.549 2.245 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.480 0.665 3.027 1.00 0.00 H new ATOM 1010 N SER A 67 -15.208 1.949 4.867 1.00 0.00 N ATOM 1011 CA SER A 67 -15.852 1.358 6.015 1.00 0.00 C ATOM 1012 C SER A 67 -16.688 0.136 5.624 1.00 0.00 C ATOM 1013 O SER A 67 -17.275 0.096 4.523 1.00 0.00 O ATOM 1014 CB SER A 67 -16.735 2.407 6.700 1.00 0.00 C ATOM 1015 OG SER A 67 -15.983 3.583 7.012 1.00 0.00 O ATOM 0 H SER A 67 -15.842 2.208 4.112 1.00 0.00 H new ATOM 0 HA SER A 67 -15.080 1.020 6.706 1.00 0.00 H new ATOM 0 HB2 SER A 67 -17.570 2.667 6.049 1.00 0.00 H new ATOM 0 HB3 SER A 67 -17.160 1.990 7.613 1.00 0.00 H new ATOM 0 HG SER A 67 -16.567 4.239 7.447 1.00 0.00 H new ATOM 1021 N GLY A 68 -16.703 -0.861 6.496 1.00 0.00 N ATOM 1022 CA GLY A 68 -17.537 -2.026 6.317 1.00 0.00 C ATOM 1023 C GLY A 68 -16.839 -3.134 5.588 1.00 0.00 C ATOM 1024 O GLY A 68 -16.133 -3.947 6.194 1.00 0.00 O ATOM 0 H GLY A 68 -16.136 -0.879 7.344 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -17.862 -2.388 7.292 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -18.434 -1.744 5.766 1.00 0.00 H new ATOM 1028 N GLY A 69 -17.020 -3.151 4.296 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.481 -4.192 3.442 1.00 0.00 C ATOM 1030 C GLY A 69 -14.973 -4.169 3.306 1.00 0.00 C ATOM 1031 O GLY A 69 -14.379 -5.176 2.931 1.00 0.00 O ATOM 0 H GLY A 69 -17.550 -2.439 3.794 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.784 -5.162 3.836 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.925 -4.098 2.451 1.00 0.00 H new ATOM 1035 N ASP A 70 -14.374 -3.014 3.612 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.925 -2.731 3.402 1.00 0.00 C ATOM 1037 C ASP A 70 -12.019 -3.899 3.797 1.00 0.00 C ATOM 1038 O ASP A 70 -11.331 -4.472 2.921 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.507 -1.431 4.181 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.717 -1.498 5.698 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.858 -1.351 6.151 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -11.749 -1.755 6.448 1.00 0.00 O ATOM 0 H ASP A 70 -14.879 -2.227 4.020 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.789 -2.580 2.331 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.455 -1.227 3.982 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.075 -0.589 3.786 1.00 0.00 H new ATOM 1047 N HIS A 71 -12.082 -4.295 5.054 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.238 -5.328 5.594 1.00 0.00 C ATOM 1049 C HIS A 71 -11.436 -6.631 4.853 1.00 0.00 C ATOM 1050 O HIS A 71 -10.462 -7.248 4.420 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.483 -5.513 7.104 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.504 -6.442 7.797 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.889 -7.599 8.433 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -9.156 -6.361 7.963 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.834 -8.192 8.956 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -8.767 -7.462 8.687 1.00 0.00 N ATOM 0 H HIS A 71 -12.732 -3.899 5.733 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.202 -5.016 5.459 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -11.440 -4.537 7.587 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.493 -5.897 7.250 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -8.511 -5.577 7.594 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.841 -9.119 9.511 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -7.812 -7.680 8.970 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.680 -7.019 4.643 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.945 -8.284 4.010 1.00 0.00 C ATOM 1067 C LEU A 72 -12.368 -8.447 2.610 1.00 0.00 C ATOM 1068 O LEU A 72 -11.530 -9.307 2.423 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.373 -8.880 4.252 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.616 -8.016 3.991 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.912 -7.866 2.523 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.811 -8.617 4.709 1.00 0.00 C ATOM 0 H LEU A 72 -13.508 -6.481 4.899 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.329 -8.976 4.584 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.462 -9.773 3.633 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.417 -9.207 5.291 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.413 -7.017 4.378 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.800 -7.247 2.392 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.064 -7.394 2.027 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.087 -8.849 2.085 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.693 -8.004 4.524 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.987 -9.627 4.339 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.612 -8.652 5.780 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.694 -7.609 1.653 1.00 0.00 N ATOM 1085 CA LEU A 73 -12.090 -7.836 0.331 1.00 0.00 C ATOM 1086 C LEU A 73 -10.668 -7.339 0.203 1.00 0.00 C ATOM 1087 O LEU A 73 -9.750 -8.166 -0.036 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.961 -7.464 -0.880 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.894 -8.574 -1.447 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.112 -9.823 -1.806 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -15.002 -8.930 -0.500 1.00 0.00 C ATOM 0 H LEU A 73 -13.327 -6.813 1.736 1.00 0.00 H new ATOM 0 HA LEU A 73 -12.035 -8.924 0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.580 -6.610 -0.603 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.302 -7.133 -1.682 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.342 -8.160 -2.350 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.793 -10.578 -2.199 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.365 -9.580 -2.562 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.616 -10.210 -0.916 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.623 -9.708 -0.943 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.578 -9.293 0.436 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.611 -8.047 -0.304 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.465 -6.017 0.412 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.159 -5.387 0.292 1.00 0.00 C ATOM 1105 C TRP A 74 -8.103 -6.192 1.070 1.00 0.00 C ATOM 1106 O TRP A 74 -7.049 -6.549 0.587 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.185 -3.919 0.866 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.864 -2.755 0.074 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.806 -2.774 -0.929 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.554 -1.369 0.249 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.130 -1.488 -1.315 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.383 -0.614 -0.593 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.673 -0.722 1.056 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.348 0.781 -0.631 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.614 0.679 1.032 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.461 1.417 0.196 1.00 0.00 C ATOM 0 H TRP A 74 -11.211 -5.370 0.668 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.905 -5.359 -0.768 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.670 -3.966 1.841 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.149 -3.626 1.039 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.233 -3.670 -1.355 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.817 -1.236 -2.025 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -8.023 -1.283 1.711 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.997 1.339 -1.289 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.907 1.195 1.665 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.414 2.496 0.204 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.431 -6.506 2.236 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.469 -7.064 3.133 1.00 0.00 C ATOM 1129 C LYS A 75 -7.295 -8.552 3.085 1.00 0.00 C ATOM 1130 O LYS A 75 -6.170 -9.026 3.345 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.597 -6.484 4.502 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.587 -4.963 4.443 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.222 -4.406 4.018 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.260 -4.496 5.197 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.929 -3.876 4.979 1.00 0.00 N ATOM 0 H LYS A 75 -9.368 -6.395 2.624 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.502 -6.743 2.746 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.522 -6.829 4.964 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.777 -6.834 5.129 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.350 -4.624 3.742 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.852 -4.562 5.421 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.833 -4.970 3.171 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.323 -3.371 3.693 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.726 -4.023 6.061 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.116 -5.547 5.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.571 -3.498 5.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.268 -4.592 4.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.015 -3.103 4.288 1.00 0.00 H new ATOM 1149 N SER A 76 -8.337 -9.306 2.729 1.00 0.00 N ATOM 1150 CA SER A 76 -8.156 -10.736 2.632 1.00 0.00 C ATOM 1151 C SER A 76 -7.130 -10.999 1.558 1.00 0.00 C ATOM 1152 O SER A 76 -6.171 -11.777 1.756 1.00 0.00 O ATOM 1153 CB SER A 76 -9.477 -11.474 2.351 1.00 0.00 C ATOM 1154 OG SER A 76 -10.045 -11.065 1.121 1.00 0.00 O ATOM 0 H SER A 76 -9.272 -8.960 2.514 1.00 0.00 H new ATOM 0 HA SER A 76 -7.805 -11.124 3.588 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.298 -12.549 2.331 1.00 0.00 H new ATOM 0 HB3 SER A 76 -10.182 -11.283 3.160 1.00 0.00 H new ATOM 0 HG SER A 76 -10.664 -10.322 1.278 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.270 -10.274 0.453 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.324 -10.406 -0.596 1.00 0.00 C ATOM 1162 C GLU A 77 -5.027 -9.716 -0.312 1.00 0.00 C ATOM 1163 O GLU A 77 -4.063 -9.972 -1.009 1.00 0.00 O ATOM 1164 CB GLU A 77 -6.832 -10.021 -1.951 1.00 0.00 C ATOM 1165 CG GLU A 77 -7.862 -10.941 -2.490 1.00 0.00 C ATOM 1166 CD GLU A 77 -7.887 -10.978 -3.997 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -6.817 -10.914 -4.628 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.997 -11.075 -4.590 1.00 0.00 O ATOM 0 H GLU A 77 -8.022 -9.607 0.282 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.140 -11.480 -0.628 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.248 -9.015 -1.900 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -5.993 -9.984 -2.646 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -7.678 -11.946 -2.110 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.842 -10.636 -2.123 1.00 0.00 H new ATOM 1175 N PHE A 78 -4.984 -8.808 0.669 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.721 -8.206 1.042 1.00 0.00 C ATOM 1177 C PHE A 78 -2.789 -9.292 1.471 1.00 0.00 C ATOM 1178 O PHE A 78 -1.697 -9.403 0.968 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.889 -7.183 2.177 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.595 -6.586 2.658 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.971 -5.595 1.932 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.006 -7.016 3.836 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.789 -5.043 2.366 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.821 -6.469 4.276 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.214 -5.485 3.545 1.00 0.00 C ATOM 0 H PHE A 78 -5.793 -8.487 1.201 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.320 -7.671 0.181 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.543 -6.381 1.835 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.389 -7.666 3.017 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.416 -5.248 1.011 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.483 -7.791 4.418 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.310 -4.266 1.788 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.373 -6.816 5.195 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.714 -5.053 3.888 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.267 -10.136 2.347 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.458 -11.212 2.847 1.00 0.00 C ATOM 1197 C PHE A 79 -2.158 -12.236 1.750 1.00 0.00 C ATOM 1198 O PHE A 79 -1.015 -12.692 1.608 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.116 -11.828 4.069 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.164 -10.858 5.233 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.011 -10.546 5.939 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.344 -10.228 5.585 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.035 -9.638 6.980 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.372 -9.310 6.625 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.219 -9.019 7.319 1.00 0.00 C ATOM 0 H PHE A 79 -4.212 -10.098 2.728 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.491 -10.819 3.161 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.129 -12.143 3.816 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.568 -12.723 4.364 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.079 -11.021 5.670 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.252 -10.453 5.045 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.130 -9.414 7.526 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.299 -8.823 6.890 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.242 -8.305 8.129 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.158 -12.519 0.929 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.014 -13.471 -0.163 1.00 0.00 C ATOM 1217 C GLU A 80 -1.998 -13.036 -1.208 1.00 0.00 C ATOM 1218 O GLU A 80 -1.032 -13.748 -1.450 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.340 -13.763 -0.822 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.303 -14.463 0.089 1.00 0.00 C ATOM 1221 CD GLU A 80 -6.592 -14.804 -0.580 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -6.570 -15.511 -1.607 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -7.651 -14.367 -0.100 1.00 0.00 O ATOM 0 H GLU A 80 -4.085 -12.099 0.999 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.635 -14.385 0.294 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.784 -12.828 -1.163 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.173 -14.377 -1.707 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -4.842 -15.376 0.464 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.504 -13.829 0.953 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.190 -11.860 -1.794 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.310 -11.397 -2.880 1.00 0.00 C ATOM 1232 C ASN A 81 0.086 -11.127 -2.394 1.00 0.00 C ATOM 1233 O ASN A 81 1.069 -11.410 -3.109 1.00 0.00 O ATOM 1234 CB ASN A 81 -1.837 -10.152 -3.618 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.129 -10.374 -4.378 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.129 -10.910 -5.483 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.218 -9.910 -3.834 1.00 0.00 N ATOM 0 H ASN A 81 -2.936 -11.210 -1.545 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.297 -12.222 -3.592 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -1.989 -9.352 -2.893 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.074 -9.808 -4.316 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.107 -9.986 -4.328 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.181 -9.471 -2.914 1.00 0.00 H new ATOM 1244 N CYS A 82 0.189 -10.606 -1.187 1.00 0.00 N ATOM 1245 CA CYS A 82 1.475 -10.294 -0.606 1.00 0.00 C ATOM 1246 C CYS A 82 2.300 -11.540 -0.391 1.00 0.00 C ATOM 1247 O CYS A 82 3.442 -11.619 -0.847 1.00 0.00 O ATOM 1248 CB CYS A 82 1.330 -9.510 0.684 1.00 0.00 C ATOM 1249 SG CYS A 82 0.680 -7.844 0.460 1.00 0.00 S ATOM 0 H CYS A 82 -0.608 -10.390 -0.589 1.00 0.00 H new ATOM 0 HA CYS A 82 2.004 -9.662 -1.319 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.672 -10.058 1.358 1.00 0.00 H new ATOM 0 HB3 CYS A 82 2.304 -9.447 1.170 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.611 -7.858 0.611 1.00 0.00 H new ATOM 1255 N ARG A 83 1.717 -12.535 0.233 1.00 0.00 N ATOM 1256 CA ARG A 83 2.419 -13.779 0.478 1.00 0.00 C ATOM 1257 C ARG A 83 2.609 -14.596 -0.774 1.00 0.00 C ATOM 1258 O ARG A 83 3.524 -15.399 -0.848 1.00 0.00 O ATOM 1259 CB ARG A 83 1.787 -14.589 1.598 1.00 0.00 C ATOM 1260 CG ARG A 83 2.064 -14.028 2.962 1.00 0.00 C ATOM 1261 CD ARG A 83 3.527 -14.200 3.317 1.00 0.00 C ATOM 1262 NE ARG A 83 3.841 -13.630 4.631 1.00 0.00 N ATOM 1263 CZ ARG A 83 3.660 -14.255 5.801 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.245 -15.509 5.841 1.00 0.00 N ATOM 1265 NH2 ARG A 83 3.940 -13.633 6.911 1.00 0.00 N ATOM 0 H ARG A 83 0.759 -12.511 0.582 1.00 0.00 H new ATOM 0 HA ARG A 83 3.417 -13.500 0.817 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.709 -14.633 1.442 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.158 -15.613 1.551 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.799 -12.971 2.988 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.442 -14.531 3.702 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.780 -15.260 3.311 1.00 0.00 H new ATOM 0 HD3 ARG A 83 4.144 -13.721 2.557 1.00 0.00 H new ATOM 0 HE ARG A 83 4.226 -12.686 4.655 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.059 -16.012 4.974 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.111 -15.973 6.739 1.00 0.00 H new ATOM 0 HH21 ARG A 83 4.294 -12.677 6.884 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.805 -14.102 7.807 1.00 0.00 H new ATOM 1279 N ASP A 84 1.756 -14.387 -1.759 1.00 0.00 N ATOM 1280 CA ASP A 84 1.890 -15.101 -3.036 1.00 0.00 C ATOM 1281 C ASP A 84 3.120 -14.628 -3.704 1.00 0.00 C ATOM 1282 O ASP A 84 3.980 -15.405 -4.074 1.00 0.00 O ATOM 1283 CB ASP A 84 0.733 -14.841 -3.970 1.00 0.00 C ATOM 1284 CG ASP A 84 0.727 -15.865 -5.089 1.00 0.00 C ATOM 1285 OD1 ASP A 84 0.339 -17.016 -4.837 1.00 0.00 O ATOM 1286 OD2 ASP A 84 1.143 -15.556 -6.221 1.00 0.00 O ATOM 0 H ASP A 84 0.969 -13.739 -1.712 1.00 0.00 H new ATOM 0 HA ASP A 84 1.917 -16.168 -2.816 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.207 -14.887 -3.419 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.810 -13.836 -4.386 1.00 0.00 H new ATOM 1291 N THR A 85 3.215 -13.337 -3.787 1.00 0.00 N ATOM 1292 CA THR A 85 4.341 -12.669 -4.341 1.00 0.00 C ATOM 1293 C THR A 85 5.603 -13.044 -3.538 1.00 0.00 C ATOM 1294 O THR A 85 6.648 -13.335 -4.103 1.00 0.00 O ATOM 1295 CB THR A 85 4.043 -11.172 -4.273 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.942 -10.853 -5.149 1.00 0.00 O ATOM 1297 CG2 THR A 85 5.236 -10.301 -4.578 1.00 0.00 C ATOM 0 H THR A 85 2.486 -12.704 -3.459 1.00 0.00 H new ATOM 0 HA THR A 85 4.524 -12.958 -5.376 1.00 0.00 H new ATOM 0 HB THR A 85 3.773 -10.953 -3.240 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.097 -10.954 -4.663 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.947 -9.252 -4.510 1.00 0.00 H new ATOM 0 HG22 THR A 85 6.030 -10.506 -3.859 1.00 0.00 H new ATOM 0 HG23 THR A 85 5.594 -10.514 -5.585 1.00 0.00 H new ATOM 1305 N ALA A 86 5.444 -13.107 -2.225 1.00 0.00 N ATOM 1306 CA ALA A 86 6.496 -13.517 -1.346 1.00 0.00 C ATOM 1307 C ALA A 86 6.994 -14.913 -1.703 1.00 0.00 C ATOM 1308 O ALA A 86 8.157 -15.078 -2.003 1.00 0.00 O ATOM 1309 CB ALA A 86 6.022 -13.472 0.083 1.00 0.00 C ATOM 0 H ALA A 86 4.573 -12.871 -1.750 1.00 0.00 H new ATOM 0 HA ALA A 86 7.331 -12.825 -1.462 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.830 -13.786 0.744 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.721 -12.455 0.335 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.172 -14.143 0.206 1.00 0.00 H new ATOM 1315 N LYS A 87 6.099 -15.908 -1.726 1.00 0.00 N ATOM 1316 CA LYS A 87 6.509 -17.292 -2.028 1.00 0.00 C ATOM 1317 C LYS A 87 7.092 -17.427 -3.429 1.00 0.00 C ATOM 1318 O LYS A 87 8.051 -18.169 -3.635 1.00 0.00 O ATOM 1319 CB LYS A 87 5.413 -18.360 -1.778 1.00 0.00 C ATOM 1320 CG LYS A 87 4.123 -18.211 -2.580 1.00 0.00 C ATOM 1321 CD LYS A 87 3.219 -19.432 -2.409 1.00 0.00 C ATOM 1322 CE LYS A 87 1.910 -19.300 -3.188 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.964 -18.325 -2.593 1.00 0.00 N ATOM 0 H LYS A 87 5.103 -15.789 -1.543 1.00 0.00 H new ATOM 0 HA LYS A 87 7.296 -17.503 -1.304 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.837 -19.341 -1.993 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.159 -18.347 -0.718 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.593 -17.315 -2.257 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.362 -18.077 -3.635 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.750 -20.324 -2.743 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.997 -19.571 -1.351 1.00 0.00 H new ATOM 0 HE2 LYS A 87 2.134 -18.999 -4.211 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.428 -20.276 -3.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.128 -18.828 -2.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.429 -17.823 -1.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.671 -17.639 -3.318 1.00 0.00 H new ATOM 1337 N ARG A 88 6.540 -16.681 -4.382 1.00 0.00 N ATOM 1338 CA ARG A 88 7.057 -16.648 -5.758 1.00 0.00 C ATOM 1339 C ARG A 88 8.496 -16.107 -5.760 1.00 0.00 C ATOM 1340 O ARG A 88 9.363 -16.589 -6.481 1.00 0.00 O ATOM 1341 CB ARG A 88 6.153 -15.773 -6.668 1.00 0.00 C ATOM 1342 CG ARG A 88 4.931 -16.461 -7.312 1.00 0.00 C ATOM 1343 CD ARG A 88 4.111 -17.305 -6.341 1.00 0.00 C ATOM 1344 NE ARG A 88 2.848 -17.771 -6.920 1.00 0.00 N ATOM 1345 CZ ARG A 88 2.702 -18.856 -7.710 1.00 0.00 C ATOM 1346 NH1 ARG A 88 3.760 -19.448 -8.252 1.00 0.00 N ATOM 1347 NH2 ARG A 88 1.490 -19.299 -8.019 1.00 0.00 N ATOM 0 H ARG A 88 5.727 -16.084 -4.230 1.00 0.00 H new ATOM 0 HA ARG A 88 7.054 -17.663 -6.154 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.795 -14.929 -6.078 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.771 -15.364 -7.467 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.286 -15.699 -7.749 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.273 -17.096 -8.130 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.701 -18.166 -6.027 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.901 -16.720 -5.446 1.00 0.00 H new ATOM 0 HE ARG A 88 2.009 -17.231 -6.708 1.00 0.00 H new ATOM 0 HH11 ARG A 88 4.696 -19.084 -8.073 1.00 0.00 H new ATOM 0 HH12 ARG A 88 3.637 -20.267 -8.847 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.665 -18.819 -7.659 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.384 -20.119 -8.616 1.00 0.00 H new ATOM 1361 N ASN A 89 8.741 -15.149 -4.907 1.00 0.00 N ATOM 1362 CA ASN A 89 10.048 -14.534 -4.789 1.00 0.00 C ATOM 1363 C ASN A 89 11.020 -15.377 -3.942 1.00 0.00 C ATOM 1364 O ASN A 89 12.229 -15.374 -4.194 1.00 0.00 O ATOM 1365 CB ASN A 89 9.925 -13.084 -4.272 1.00 0.00 C ATOM 1366 CG ASN A 89 9.386 -12.130 -5.345 1.00 0.00 C ATOM 1367 OD1 ASN A 89 8.700 -12.545 -6.294 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.633 -10.878 -5.191 1.00 0.00 N ATOM 0 H ASN A 89 8.042 -14.768 -4.270 1.00 0.00 H new ATOM 0 HA ASN A 89 10.484 -14.493 -5.787 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.264 -13.064 -3.405 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.902 -12.736 -3.936 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.263 -10.200 -5.857 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.199 -10.563 -4.403 1.00 0.00 H new ATOM 1375 N GLN A 90 10.507 -16.126 -2.964 1.00 0.00 N ATOM 1376 CA GLN A 90 11.355 -16.981 -2.129 1.00 0.00 C ATOM 1377 C GLN A 90 11.787 -18.221 -2.897 1.00 0.00 C ATOM 1378 O GLN A 90 12.897 -18.687 -2.723 1.00 0.00 O ATOM 1379 CB GLN A 90 10.690 -17.398 -0.809 1.00 0.00 C ATOM 1380 CG GLN A 90 10.078 -16.275 0.029 1.00 0.00 C ATOM 1381 CD GLN A 90 10.904 -14.994 0.100 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.762 -14.824 0.951 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.617 -14.071 -0.790 1.00 0.00 N ATOM 0 H GLN A 90 9.515 -16.159 -2.731 1.00 0.00 H new ATOM 0 HA GLN A 90 12.226 -16.379 -1.871 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.907 -18.121 -1.035 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.433 -17.913 -0.200 1.00 0.00 H new ATOM 0 HG2 GLN A 90 9.096 -16.033 -0.378 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.921 -16.644 1.043 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.894 -14.244 -1.489 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.117 -13.182 -0.782 1.00 0.00 H new ATOM 1392 N GLN A 91 10.914 -18.768 -3.756 1.00 0.00 N ATOM 1393 CA GLN A 91 11.314 -19.911 -4.604 1.00 0.00 C ATOM 1394 C GLN A 91 12.331 -19.481 -5.667 1.00 0.00 C ATOM 1395 O GLN A 91 12.964 -20.299 -6.309 1.00 0.00 O ATOM 1396 CB GLN A 91 10.102 -20.601 -5.233 1.00 0.00 C ATOM 1397 CG GLN A 91 9.277 -19.714 -6.107 1.00 0.00 C ATOM 1398 CD GLN A 91 7.977 -20.352 -6.510 1.00 0.00 C ATOM 1399 OE1 GLN A 91 7.873 -21.018 -7.541 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.982 -20.175 -5.700 1.00 0.00 N ATOM 0 H GLN A 91 9.953 -18.452 -3.884 1.00 0.00 H new ATOM 0 HA GLN A 91 11.799 -20.643 -3.959 1.00 0.00 H new ATOM 0 HB2 GLN A 91 10.447 -21.452 -5.820 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.471 -20.998 -4.438 1.00 0.00 H new ATOM 0 HG2 GLN A 91 9.073 -18.781 -5.583 1.00 0.00 H new ATOM 0 HG3 GLN A 91 9.846 -19.459 -7.001 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.105 -19.617 -4.855 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.075 -20.594 -5.907 1.00 0.00 H new ATOM 1409 N ALA A 92 12.470 -18.174 -5.836 1.00 0.00 N ATOM 1410 CA ALA A 92 13.482 -17.609 -6.710 1.00 0.00 C ATOM 1411 C ALA A 92 14.736 -17.283 -5.870 1.00 0.00 C ATOM 1412 O ALA A 92 15.727 -16.736 -6.363 1.00 0.00 O ATOM 1413 CB ALA A 92 12.949 -16.372 -7.424 1.00 0.00 C ATOM 0 H ALA A 92 11.885 -17.479 -5.372 1.00 0.00 H new ATOM 0 HA ALA A 92 13.749 -18.330 -7.482 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.724 -15.965 -8.074 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.079 -16.644 -8.022 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.662 -15.622 -6.687 1.00 0.00 H new ATOM 1419 N GLY A 93 14.648 -17.638 -4.594 1.00 0.00 N ATOM 1420 CA GLY A 93 15.724 -17.497 -3.619 1.00 0.00 C ATOM 1421 C GLY A 93 16.131 -16.077 -3.355 1.00 0.00 C ATOM 1422 O GLY A 93 17.297 -15.805 -3.057 1.00 0.00 O ATOM 0 H GLY A 93 13.801 -18.044 -4.197 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.411 -17.954 -2.680 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.593 -18.053 -3.970 1.00 0.00 H new ATOM 1426 N ASN A 94 15.191 -15.172 -3.467 1.00 0.00 N ATOM 1427 CA ASN A 94 15.476 -13.756 -3.242 1.00 0.00 C ATOM 1428 C ASN A 94 15.764 -13.445 -1.786 1.00 0.00 C ATOM 1429 O ASN A 94 16.777 -12.807 -1.478 1.00 0.00 O ATOM 1430 CB ASN A 94 14.346 -12.823 -3.743 1.00 0.00 C ATOM 1431 CG ASN A 94 14.272 -12.660 -5.249 1.00 0.00 C ATOM 1432 OD1 ASN A 94 14.939 -11.804 -5.818 1.00 0.00 O ATOM 1433 ND2 ASN A 94 13.444 -13.435 -5.901 1.00 0.00 N ATOM 0 H ASN A 94 14.222 -15.378 -3.711 1.00 0.00 H new ATOM 0 HA ASN A 94 16.372 -13.559 -3.831 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.391 -13.210 -3.387 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.480 -11.840 -3.292 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.340 -13.336 -6.911 1.00 0.00 H new ATOM 0 HD22 ASN A 94 12.902 -14.139 -5.400 1.00 0.00 H new ATOM 1440 N GLY A 95 14.924 -13.958 -0.879 1.00 0.00 N ATOM 1441 CA GLY A 95 15.023 -13.541 0.508 1.00 0.00 C ATOM 1442 C GLY A 95 14.714 -12.083 0.574 1.00 0.00 C ATOM 1443 O GLY A 95 15.548 -11.262 0.961 1.00 0.00 O ATOM 0 H GLY A 95 14.193 -14.641 -1.079 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.326 -14.107 1.127 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.023 -13.736 0.894 1.00 0.00 H new ATOM 1447 N TRP A 96 13.535 -11.764 0.156 1.00 0.00 N ATOM 1448 CA TRP A 96 13.166 -10.420 -0.117 1.00 0.00 C ATOM 1449 C TRP A 96 11.664 -10.422 -0.186 1.00 0.00 C ATOM 1450 O TRP A 96 11.086 -11.501 -0.385 1.00 0.00 O ATOM 1451 CB TRP A 96 13.772 -10.109 -1.493 1.00 0.00 C ATOM 1452 CG TRP A 96 13.851 -8.687 -1.911 1.00 0.00 C ATOM 1453 CD1 TRP A 96 14.038 -7.590 -1.128 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.821 -8.226 -3.253 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.094 -6.468 -1.911 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.966 -6.837 -3.220 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.675 -8.864 -4.493 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 13.975 -6.071 -4.368 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.684 -8.089 -5.631 1.00 0.00 C ATOM 1460 CH2 TRP A 96 13.836 -6.708 -5.557 1.00 0.00 C ATOM 0 H TRP A 96 12.791 -12.442 -0.007 1.00 0.00 H new ATOM 0 HA TRP A 96 13.504 -9.690 0.618 1.00 0.00 H new ATOM 0 HB2 TRP A 96 14.781 -10.521 -1.515 1.00 0.00 H new ATOM 0 HB3 TRP A 96 13.192 -10.647 -2.243 1.00 0.00 H new ATOM 0 HD1 TRP A 96 14.129 -7.602 -0.052 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.212 -5.513 -1.572 1.00 0.00 H new ATOM 0 HE3 TRP A 96 13.558 -9.936 -4.554 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 14.089 -4.998 -4.321 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.571 -8.560 -6.596 1.00 0.00 H new ATOM 0 HH2 TRP A 96 13.843 -6.129 -6.469 1.00 0.00 H new ATOM 1471 N ASP A 97 11.034 -9.292 0.095 1.00 0.00 N ATOM 1472 CA ASP A 97 9.575 -9.100 -0.037 1.00 0.00 C ATOM 1473 C ASP A 97 8.823 -9.640 1.150 1.00 0.00 C ATOM 1474 O ASP A 97 8.296 -8.865 1.917 1.00 0.00 O ATOM 1475 CB ASP A 97 8.968 -9.652 -1.359 1.00 0.00 C ATOM 1476 CG ASP A 97 9.494 -8.972 -2.591 1.00 0.00 C ATOM 1477 OD1 ASP A 97 10.529 -9.438 -3.140 1.00 0.00 O ATOM 1478 OD2 ASP A 97 8.869 -8.016 -3.063 1.00 0.00 O ATOM 0 H ASP A 97 11.520 -8.460 0.428 1.00 0.00 H new ATOM 0 HA ASP A 97 9.450 -8.018 -0.073 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.176 -10.720 -1.427 1.00 0.00 H new ATOM 0 HB3 ASP A 97 7.884 -9.540 -1.326 1.00 0.00 H new ATOM 1483 N PHE A 98 8.886 -10.974 1.340 1.00 0.00 N ATOM 1484 CA PHE A 98 8.118 -11.762 2.331 1.00 0.00 C ATOM 1485 C PHE A 98 7.879 -11.074 3.690 1.00 0.00 C ATOM 1486 O PHE A 98 6.742 -11.032 4.156 1.00 0.00 O ATOM 1487 CB PHE A 98 8.799 -13.165 2.498 1.00 0.00 C ATOM 1488 CG PHE A 98 8.277 -14.032 3.616 1.00 0.00 C ATOM 1489 CD1 PHE A 98 7.199 -14.880 3.417 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.877 -14.008 4.868 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.727 -15.675 4.443 1.00 0.00 C ATOM 1492 CE2 PHE A 98 8.407 -14.800 5.891 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.332 -15.632 5.679 1.00 0.00 C ATOM 0 H PHE A 98 9.504 -11.561 0.780 1.00 0.00 H new ATOM 0 HA PHE A 98 7.111 -11.868 1.929 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.690 -13.712 1.561 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.867 -13.011 2.655 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.723 -14.920 2.449 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.723 -13.360 5.041 1.00 0.00 H new ATOM 0 HE1 PHE A 98 5.884 -16.330 4.276 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.882 -14.768 6.860 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.962 -16.252 6.483 1.00 0.00 H new ATOM 1503 N ASP A 99 8.909 -10.596 4.332 1.00 0.00 N ATOM 1504 CA ASP A 99 8.729 -9.917 5.619 1.00 0.00 C ATOM 1505 C ASP A 99 8.455 -8.445 5.437 1.00 0.00 C ATOM 1506 O ASP A 99 7.651 -7.871 6.152 1.00 0.00 O ATOM 1507 CB ASP A 99 9.909 -10.114 6.567 1.00 0.00 C ATOM 1508 CG ASP A 99 9.667 -9.468 7.925 1.00 0.00 C ATOM 1509 OD1 ASP A 99 9.032 -10.110 8.790 1.00 0.00 O ATOM 1510 OD2 ASP A 99 10.120 -8.336 8.158 1.00 0.00 O ATOM 0 H ASP A 99 9.874 -10.654 4.006 1.00 0.00 H new ATOM 0 HA ASP A 99 7.859 -10.385 6.079 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.092 -11.180 6.701 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.808 -9.690 6.119 1.00 0.00 H new ATOM 1515 N MET A 100 9.112 -7.875 4.432 1.00 0.00 N ATOM 1516 CA MET A 100 9.069 -6.447 4.106 1.00 0.00 C ATOM 1517 C MET A 100 7.650 -5.973 3.828 1.00 0.00 C ATOM 1518 O MET A 100 7.169 -5.009 4.435 1.00 0.00 O ATOM 1519 CB MET A 100 9.974 -6.178 2.913 1.00 0.00 C ATOM 1520 CG MET A 100 11.432 -6.489 3.185 1.00 0.00 C ATOM 1521 SD MET A 100 12.458 -6.350 1.715 1.00 0.00 S ATOM 1522 CE MET A 100 14.091 -6.612 2.395 1.00 0.00 C ATOM 0 H MET A 100 9.709 -8.408 3.800 1.00 0.00 H new ATOM 0 HA MET A 100 9.426 -5.884 4.968 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.634 -6.774 2.066 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.881 -5.131 2.624 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.807 -5.810 3.950 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.515 -7.499 3.587 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.840 -6.414 1.629 1.00 0.00 H new ATOM 0 HE2 MET A 100 14.247 -5.938 3.237 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.183 -7.644 2.734 1.00 0.00 H new ATOM 1532 N LEU A 101 6.977 -6.656 2.922 1.00 0.00 N ATOM 1533 CA LEU A 101 5.589 -6.382 2.659 1.00 0.00 C ATOM 1534 C LEU A 101 4.835 -7.300 3.612 1.00 0.00 C ATOM 1535 O LEU A 101 5.484 -8.146 4.216 1.00 0.00 O ATOM 1536 CB LEU A 101 5.213 -6.651 1.155 1.00 0.00 C ATOM 1537 CG LEU A 101 4.616 -8.001 0.660 1.00 0.00 C ATOM 1538 CD1 LEU A 101 4.313 -7.921 -0.838 1.00 0.00 C ATOM 1539 CD2 LEU A 101 5.509 -9.190 0.905 1.00 0.00 C ATOM 0 H LEU A 101 7.376 -7.406 2.357 1.00 0.00 H new ATOM 0 HA LEU A 101 5.338 -5.333 2.819 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.502 -5.875 0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.120 -6.482 0.574 1.00 0.00 H new ATOM 0 HG LEU A 101 3.707 -8.153 1.242 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.896 -8.870 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.594 -7.122 -1.022 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.233 -7.714 -1.385 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.024 -10.092 0.533 1.00 0.00 H new ATOM 0 HD22 LEU A 101 6.456 -9.047 0.385 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.694 -9.292 1.974 1.00 0.00 H new ATOM 1551 N THR A 102 3.528 -7.126 3.832 1.00 0.00 N ATOM 1552 CA THR A 102 2.752 -8.060 4.696 1.00 0.00 C ATOM 1553 C THR A 102 2.825 -7.678 6.200 1.00 0.00 C ATOM 1554 O THR A 102 1.800 -7.315 6.815 1.00 0.00 O ATOM 1555 CB THR A 102 3.205 -9.562 4.495 1.00 0.00 C ATOM 1556 OG1 THR A 102 3.055 -9.944 3.138 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.471 -10.538 5.376 1.00 0.00 C ATOM 0 H THR A 102 2.980 -6.363 3.436 1.00 0.00 H new ATOM 0 HA THR A 102 1.714 -7.966 4.378 1.00 0.00 H new ATOM 0 HB THR A 102 4.254 -9.600 4.787 1.00 0.00 H new ATOM 0 HG1 THR A 102 3.340 -10.875 3.027 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.835 -11.547 5.183 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.643 -10.284 6.422 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.403 -10.490 5.162 1.00 0.00 H new ATOM 1661 N ASP A 111 12.395 0.869 6.913 1.00 0.00 N ATOM 1662 CA ASP A 111 13.801 0.875 6.490 1.00 0.00 C ATOM 1663 C ASP A 111 13.972 0.141 5.142 1.00 0.00 C ATOM 1664 O ASP A 111 14.524 0.707 4.183 1.00 0.00 O ATOM 1665 CB ASP A 111 14.726 0.283 7.583 1.00 0.00 C ATOM 1666 CG ASP A 111 14.503 -1.186 7.846 1.00 0.00 C ATOM 1667 OD1 ASP A 111 13.551 -1.523 8.539 1.00 0.00 O ATOM 1668 OD2 ASP A 111 15.276 -2.014 7.339 1.00 0.00 O ATOM 0 HA ASP A 111 14.102 1.913 6.345 1.00 0.00 H new ATOM 0 HB2 ASP A 111 15.764 0.435 7.287 1.00 0.00 H new ATOM 0 HB3 ASP A 111 14.574 0.835 8.511 1.00 0.00 H new ATOM 1673 N ALA A 112 13.416 -1.058 5.019 1.00 0.00 N ATOM 1674 CA ALA A 112 13.506 -1.817 3.761 1.00 0.00 C ATOM 1675 C ALA A 112 12.691 -1.131 2.682 1.00 0.00 C ATOM 1676 O ALA A 112 12.903 -1.325 1.512 1.00 0.00 O ATOM 1677 CB ALA A 112 13.032 -3.243 3.944 1.00 0.00 C ATOM 0 H ALA A 112 12.901 -1.529 5.763 1.00 0.00 H new ATOM 0 HA ALA A 112 14.553 -1.847 3.458 1.00 0.00 H new ATOM 0 HB1 ALA A 112 13.111 -3.777 2.997 1.00 0.00 H new ATOM 0 HB2 ALA A 112 13.650 -3.739 4.693 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.993 -3.242 4.274 1.00 0.00 H new ATOM 1683 N GLN A 113 11.777 -0.308 3.120 1.00 0.00 N ATOM 1684 CA GLN A 113 10.934 0.455 2.244 1.00 0.00 C ATOM 1685 C GLN A 113 11.687 1.701 1.756 1.00 0.00 C ATOM 1686 O GLN A 113 11.458 2.156 0.690 1.00 0.00 O ATOM 1687 CB GLN A 113 9.653 0.812 3.004 1.00 0.00 C ATOM 1688 CG GLN A 113 8.560 1.613 2.272 1.00 0.00 C ATOM 1689 CD GLN A 113 8.876 3.090 2.033 1.00 0.00 C ATOM 1690 OE1 GLN A 113 8.386 3.679 1.081 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.720 3.695 2.869 1.00 0.00 N ATOM 0 H GLN A 113 11.595 -0.147 4.111 1.00 0.00 H new ATOM 0 HA GLN A 113 10.663 -0.121 1.359 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.204 -0.119 3.352 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.941 1.378 3.890 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.370 1.139 1.309 1.00 0.00 H new ATOM 0 HG3 GLN A 113 7.637 1.545 2.848 1.00 0.00 H new ATOM 0 HE21 GLN A 113 10.115 3.180 3.656 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.971 4.673 2.722 1.00 0.00 H new ATOM 1700 N MET A 114 12.574 2.268 2.574 1.00 0.00 N ATOM 1701 CA MET A 114 13.348 3.436 2.152 1.00 0.00 C ATOM 1702 C MET A 114 14.368 3.005 1.107 1.00 0.00 C ATOM 1703 O MET A 114 14.843 3.791 0.301 1.00 0.00 O ATOM 1704 CB MET A 114 14.027 4.080 3.370 1.00 0.00 C ATOM 1705 CG MET A 114 14.823 5.344 3.063 1.00 0.00 C ATOM 1706 SD MET A 114 15.550 6.054 4.545 1.00 0.00 S ATOM 1707 CE MET A 114 16.419 7.452 3.848 1.00 0.00 C ATOM 0 H MET A 114 12.773 1.943 3.520 1.00 0.00 H new ATOM 0 HA MET A 114 12.690 4.183 1.707 1.00 0.00 H new ATOM 0 HB2 MET A 114 13.263 4.319 4.110 1.00 0.00 H new ATOM 0 HB3 MET A 114 14.695 3.349 3.825 1.00 0.00 H new ATOM 0 HG2 MET A 114 15.612 5.112 2.347 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.170 6.078 2.591 1.00 0.00 H new ATOM 0 HE1 MET A 114 16.925 7.999 4.643 1.00 0.00 H new ATOM 0 HE2 MET A 114 17.155 7.100 3.125 1.00 0.00 H new ATOM 0 HE3 MET A 114 15.708 8.111 3.350 1.00 0.00 H new ATOM 1717 N GLN A 115 14.671 1.747 1.147 1.00 0.00 N ATOM 1718 CA GLN A 115 15.511 1.083 0.175 1.00 0.00 C ATOM 1719 C GLN A 115 14.621 0.144 -0.631 1.00 0.00 C ATOM 1720 O GLN A 115 14.986 -0.978 -0.937 1.00 0.00 O ATOM 1721 CB GLN A 115 16.646 0.331 0.879 1.00 0.00 C ATOM 1722 CG GLN A 115 17.846 1.220 1.298 1.00 0.00 C ATOM 1723 CD GLN A 115 17.575 2.308 2.354 1.00 0.00 C ATOM 1724 OE1 GLN A 115 18.202 3.373 2.335 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.712 2.053 3.278 1.00 0.00 N ATOM 0 H GLN A 115 14.333 1.123 1.880 1.00 0.00 H new ATOM 0 HA GLN A 115 15.982 1.802 -0.495 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.245 -0.157 1.767 1.00 0.00 H new ATOM 0 HB3 GLN A 115 17.007 -0.457 0.218 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.634 0.569 1.677 1.00 0.00 H new ATOM 0 HG3 GLN A 115 18.236 1.706 0.404 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.206 1.167 3.273 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.535 2.737 4.013 1.00 0.00 H new ATOM 1734 N TYR A 116 13.455 0.684 -0.993 1.00 0.00 N ATOM 1735 CA TYR A 116 12.344 0.005 -1.670 1.00 0.00 C ATOM 1736 C TYR A 116 12.678 -0.764 -2.937 1.00 0.00 C ATOM 1737 O TYR A 116 11.888 -1.607 -3.330 1.00 0.00 O ATOM 1738 CB TYR A 116 11.218 1.009 -1.977 1.00 0.00 C ATOM 1739 CG TYR A 116 11.675 2.294 -2.658 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.757 2.406 -4.034 1.00 0.00 C ATOM 1741 CD2 TYR A 116 12.002 3.405 -1.898 1.00 0.00 C ATOM 1742 CE1 TYR A 116 12.158 3.587 -4.615 1.00 0.00 C ATOM 1743 CE2 TYR A 116 12.402 4.573 -2.469 1.00 0.00 C ATOM 1744 CZ TYR A 116 12.476 4.664 -3.826 1.00 0.00 C ATOM 1745 OH TYR A 116 12.866 5.835 -4.406 1.00 0.00 O ATOM 0 H TYR A 116 13.247 1.666 -0.811 1.00 0.00 H new ATOM 0 HA TYR A 116 12.037 -0.757 -0.954 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.479 0.521 -2.612 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.716 1.267 -1.044 1.00 0.00 H new ATOM 0 HD1 TYR A 116 11.505 1.561 -4.657 1.00 0.00 H new ATOM 0 HD2 TYR A 116 11.938 3.342 -0.822 1.00 0.00 H new ATOM 0 HE1 TYR A 116 12.222 3.666 -5.690 1.00 0.00 H new ATOM 0 HE2 TYR A 116 12.659 5.421 -1.852 1.00 0.00 H new ATOM 0 HH TYR A 116 13.054 6.498 -3.710 1.00 0.00 H new ATOM 1755 N ASP A 117 13.801 -0.471 -3.595 1.00 0.00 N ATOM 1756 CA ASP A 117 14.162 -1.136 -4.872 1.00 0.00 C ATOM 1757 C ASP A 117 13.112 -0.882 -5.981 1.00 0.00 C ATOM 1758 O ASP A 117 12.054 -0.312 -5.740 1.00 0.00 O ATOM 1759 CB ASP A 117 14.349 -2.661 -4.669 1.00 0.00 C ATOM 1760 CG ASP A 117 15.737 -3.063 -4.268 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.127 -2.867 -3.103 1.00 0.00 O ATOM 1762 OD2 ASP A 117 16.466 -3.619 -5.115 1.00 0.00 O ATOM 0 H ASP A 117 14.481 0.218 -3.275 1.00 0.00 H new ATOM 0 HA ASP A 117 15.106 -0.698 -5.196 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.649 -3.003 -3.906 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.087 -3.174 -5.595 1.00 0.00 H new ATOM 1767 N PRO A 118 13.410 -1.221 -7.229 1.00 0.00 N ATOM 1768 CA PRO A 118 12.407 -1.185 -8.280 1.00 0.00 C ATOM 1769 C PRO A 118 11.443 -2.369 -8.167 1.00 0.00 C ATOM 1770 O PRO A 118 10.270 -2.256 -8.495 1.00 0.00 O ATOM 1771 CB PRO A 118 13.217 -1.298 -9.574 1.00 0.00 C ATOM 1772 CG PRO A 118 14.494 -1.945 -9.180 1.00 0.00 C ATOM 1773 CD PRO A 118 14.751 -1.545 -7.752 1.00 0.00 C ATOM 0 HA PRO A 118 11.797 -0.283 -8.230 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.688 -1.893 -10.319 1.00 0.00 H new ATOM 0 HB3 PRO A 118 13.393 -0.317 -10.015 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.425 -3.029 -9.273 1.00 0.00 H new ATOM 0 HG3 PRO A 118 15.309 -1.621 -9.827 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.216 -2.354 -7.188 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.422 -0.688 -7.691 1.00 0.00 H new ATOM 1781 N GLY A 119 11.912 -3.463 -7.559 1.00 0.00 N ATOM 1782 CA GLY A 119 11.149 -4.692 -7.590 1.00 0.00 C ATOM 1783 C GLY A 119 10.261 -4.805 -6.394 1.00 0.00 C ATOM 1784 O GLY A 119 9.050 -4.989 -6.531 1.00 0.00 O ATOM 0 H GLY A 119 12.796 -3.514 -7.053 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.547 -4.727 -8.498 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.828 -5.544 -7.624 1.00 0.00 H new ATOM 1788 N LEU A 120 10.865 -4.681 -5.214 1.00 0.00 N ATOM 1789 CA LEU A 120 10.138 -4.683 -3.956 1.00 0.00 C ATOM 1790 C LEU A 120 9.013 -3.668 -4.022 1.00 0.00 C ATOM 1791 O LEU A 120 7.866 -4.018 -3.829 1.00 0.00 O ATOM 1792 CB LEU A 120 11.093 -4.366 -2.805 1.00 0.00 C ATOM 1793 CG LEU A 120 10.503 -4.297 -1.398 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.996 -5.651 -0.947 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.530 -3.752 -0.430 1.00 0.00 C ATOM 0 H LEU A 120 11.874 -4.576 -5.108 1.00 0.00 H new ATOM 0 HA LEU A 120 9.708 -5.669 -3.780 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.880 -5.120 -2.803 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.570 -3.409 -3.017 1.00 0.00 H new ATOM 0 HG LEU A 120 9.649 -3.620 -1.417 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.582 -5.568 0.058 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.221 -5.996 -1.631 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.820 -6.365 -0.943 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.099 -3.707 0.570 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.403 -4.405 -0.420 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.829 -2.751 -0.742 1.00 0.00 H new ATOM 1807 N PHE A 121 9.343 -2.416 -4.370 1.00 0.00 N ATOM 1808 CA PHE A 121 8.329 -1.378 -4.530 1.00 0.00 C ATOM 1809 C PHE A 121 7.219 -1.820 -5.459 1.00 0.00 C ATOM 1810 O PHE A 121 6.051 -1.837 -5.047 1.00 0.00 O ATOM 1811 CB PHE A 121 8.924 -0.049 -5.021 1.00 0.00 C ATOM 1812 CG PHE A 121 7.878 1.016 -5.292 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.067 1.497 -4.274 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.691 1.507 -6.575 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.104 2.444 -4.531 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.726 2.456 -6.832 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.933 2.927 -5.816 1.00 0.00 C ATOM 0 H PHE A 121 10.299 -2.104 -4.544 1.00 0.00 H new ATOM 0 HA PHE A 121 7.909 -1.212 -3.538 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.626 0.324 -4.275 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.493 -0.229 -5.933 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.194 1.123 -3.269 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.309 1.141 -7.382 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.481 2.811 -3.729 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.593 2.830 -7.836 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.178 3.672 -6.019 1.00 0.00 H new ATOM 1827 N ALA A 122 7.581 -2.217 -6.686 1.00 0.00 N ATOM 1828 CA ALA A 122 6.605 -2.617 -7.680 1.00 0.00 C ATOM 1829 C ALA A 122 5.677 -3.720 -7.163 1.00 0.00 C ATOM 1830 O ALA A 122 4.459 -3.630 -7.315 1.00 0.00 O ATOM 1831 CB ALA A 122 7.301 -3.063 -8.955 1.00 0.00 C ATOM 0 H ALA A 122 8.549 -2.266 -7.004 1.00 0.00 H new ATOM 0 HA ALA A 122 5.985 -1.747 -7.897 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.555 -3.360 -9.692 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.895 -2.240 -9.352 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.953 -3.909 -8.737 1.00 0.00 H new ATOM 1837 N GLN A 123 6.247 -4.710 -6.493 1.00 0.00 N ATOM 1838 CA GLN A 123 5.501 -5.846 -6.019 1.00 0.00 C ATOM 1839 C GLN A 123 4.648 -5.541 -4.806 1.00 0.00 C ATOM 1840 O GLN A 123 3.487 -5.950 -4.758 1.00 0.00 O ATOM 1841 CB GLN A 123 6.398 -7.067 -5.772 1.00 0.00 C ATOM 1842 CG GLN A 123 6.583 -7.987 -6.989 1.00 0.00 C ATOM 1843 CD GLN A 123 7.173 -7.294 -8.202 1.00 0.00 C ATOM 1844 OE1 GLN A 123 8.385 -7.243 -8.373 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.330 -6.774 -9.067 1.00 0.00 N ATOM 0 H GLN A 123 7.241 -4.740 -6.267 1.00 0.00 H new ATOM 0 HA GLN A 123 4.813 -6.095 -6.827 1.00 0.00 H new ATOM 0 HB2 GLN A 123 7.378 -6.720 -5.444 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.976 -7.651 -4.954 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.229 -8.818 -6.708 1.00 0.00 H new ATOM 0 HG3 GLN A 123 5.617 -8.412 -7.260 1.00 0.00 H new ATOM 0 HE21 GLN A 123 5.326 -6.832 -8.898 1.00 0.00 H new ATOM 0 HE22 GLN A 123 6.680 -6.313 -9.907 1.00 0.00 H new ATOM 1854 N ILE A 124 5.182 -4.806 -3.840 1.00 0.00 N ATOM 1855 CA ILE A 124 4.426 -4.556 -2.616 1.00 0.00 C ATOM 1856 C ILE A 124 3.219 -3.656 -2.861 1.00 0.00 C ATOM 1857 O ILE A 124 2.147 -3.886 -2.309 1.00 0.00 O ATOM 1858 CB ILE A 124 5.295 -4.018 -1.412 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.751 -2.575 -1.621 1.00 0.00 C ATOM 1860 CG2 ILE A 124 6.522 -4.897 -1.263 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.377 -1.925 -0.410 1.00 0.00 C ATOM 0 H ILE A 124 6.109 -4.382 -3.874 1.00 0.00 H new ATOM 0 HA ILE A 124 4.068 -5.539 -2.310 1.00 0.00 H new ATOM 0 HB ILE A 124 4.673 -4.045 -0.518 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.469 -2.551 -2.440 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.893 -1.979 -1.932 1.00 0.00 H new ATOM 0 HG21 ILE A 124 7.130 -4.535 -0.434 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.213 -5.923 -1.065 1.00 0.00 H new ATOM 0 HG23 ILE A 124 7.106 -4.865 -2.183 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.668 -0.904 -0.655 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.657 -1.910 0.408 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.258 -2.491 -0.108 1.00 0.00 H new ATOM 1873 N GLN A 125 3.362 -2.682 -3.726 1.00 0.00 N ATOM 1874 CA GLN A 125 2.286 -1.765 -3.958 1.00 0.00 C ATOM 1875 C GLN A 125 1.269 -2.337 -4.929 1.00 0.00 C ATOM 1876 O GLN A 125 0.073 -2.018 -4.850 1.00 0.00 O ATOM 1877 CB GLN A 125 2.822 -0.406 -4.385 1.00 0.00 C ATOM 1878 CG GLN A 125 3.542 -0.346 -5.740 1.00 0.00 C ATOM 1879 CD GLN A 125 2.627 -0.172 -6.939 1.00 0.00 C ATOM 1880 OE1 GLN A 125 2.885 -0.691 -8.018 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.633 0.636 -6.785 1.00 0.00 N ATOM 0 H GLN A 125 4.205 -2.509 -4.273 1.00 0.00 H new ATOM 0 HA GLN A 125 1.751 -1.612 -3.021 1.00 0.00 H new ATOM 0 HB2 GLN A 125 1.989 0.296 -4.411 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.511 -0.055 -3.617 1.00 0.00 H new ATOM 0 HG2 GLN A 125 4.254 0.479 -5.721 1.00 0.00 H new ATOM 0 HG3 GLN A 125 4.119 -1.262 -5.870 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.449 1.049 -5.871 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.031 0.861 -7.577 1.00 0.00 H new ATOM 1890 N ALA A 126 1.724 -3.218 -5.816 1.00 0.00 N ATOM 1891 CA ALA A 126 0.823 -3.860 -6.758 1.00 0.00 C ATOM 1892 C ALA A 126 -0.048 -4.828 -6.011 1.00 0.00 C ATOM 1893 O ALA A 126 -1.243 -4.899 -6.250 1.00 0.00 O ATOM 1894 CB ALA A 126 1.583 -4.578 -7.857 1.00 0.00 C ATOM 0 H ALA A 126 2.701 -3.499 -5.899 1.00 0.00 H new ATOM 0 HA ALA A 126 0.211 -3.095 -7.235 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.876 -5.046 -8.542 1.00 0.00 H new ATOM 0 HB2 ALA A 126 2.197 -3.862 -8.403 1.00 0.00 H new ATOM 0 HB3 ALA A 126 2.223 -5.343 -7.417 1.00 0.00 H new ATOM 1900 N ALA A 127 0.553 -5.525 -5.043 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.169 -6.470 -4.224 1.00 0.00 C ATOM 1902 C ALA A 127 -1.151 -5.742 -3.330 1.00 0.00 C ATOM 1903 O ALA A 127 -2.236 -6.250 -3.039 1.00 0.00 O ATOM 1904 CB ALA A 127 0.792 -7.314 -3.404 1.00 0.00 C ATOM 0 H ALA A 127 1.544 -5.443 -4.816 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.729 -7.141 -4.875 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.227 -8.019 -2.794 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.456 -7.862 -4.072 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.383 -6.667 -2.756 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.778 -4.526 -2.940 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.612 -3.703 -2.100 1.00 0.00 C ATOM 1912 C ALA A 128 -2.909 -3.340 -2.797 1.00 0.00 C ATOM 1913 O ALA A 128 -3.923 -3.756 -2.381 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.878 -2.445 -1.659 1.00 0.00 C ATOM 0 H ALA A 128 0.108 -4.094 -3.201 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.855 -4.287 -1.212 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.532 -1.845 -1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.014 -2.722 -1.098 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.589 -1.866 -2.536 1.00 0.00 H new ATOM 1920 N THR A 129 -2.863 -2.646 -3.905 1.00 0.00 N ATOM 1921 CA THR A 129 -4.111 -2.240 -4.560 1.00 0.00 C ATOM 1922 C THR A 129 -4.947 -3.467 -5.087 1.00 0.00 C ATOM 1923 O THR A 129 -6.232 -3.481 -5.010 1.00 0.00 O ATOM 1924 CB THR A 129 -3.847 -1.192 -5.691 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.046 -0.905 -6.431 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.706 -1.607 -6.642 1.00 0.00 C ATOM 0 H THR A 129 -2.007 -2.349 -4.374 1.00 0.00 H new ATOM 0 HA THR A 129 -4.722 -1.758 -3.797 1.00 0.00 H new ATOM 0 HB THR A 129 -3.523 -0.281 -5.188 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.041 -1.410 -7.271 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.571 -0.840 -7.405 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.783 -1.721 -6.074 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.957 -2.554 -7.120 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.209 -4.539 -5.389 1.00 0.00 N ATOM 1935 CA LYS A 130 -4.787 -5.743 -5.998 1.00 0.00 C ATOM 1936 C LYS A 130 -5.645 -6.437 -4.978 1.00 0.00 C ATOM 1937 O LYS A 130 -6.484 -7.222 -5.296 1.00 0.00 O ATOM 1938 CB LYS A 130 -3.672 -6.648 -6.512 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.126 -7.900 -7.247 1.00 0.00 C ATOM 1940 CD LYS A 130 -2.932 -8.643 -7.787 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.328 -9.944 -8.480 1.00 0.00 C ATOM 1942 NZ LYS A 130 -2.142 -10.667 -8.970 1.00 0.00 N ATOM 0 H LYS A 130 -3.205 -4.598 -5.221 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.411 -5.478 -6.851 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.036 -6.067 -7.180 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.054 -6.949 -5.666 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -4.690 -8.543 -6.572 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.796 -7.630 -8.063 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.398 -8.006 -8.492 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -2.243 -8.863 -6.971 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.881 -10.576 -7.785 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -3.995 -9.727 -9.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -2.440 -11.547 -9.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -1.629 -10.071 -9.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.518 -10.894 -8.169 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.325 -6.183 -3.755 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.076 -6.493 -2.603 1.00 0.00 C ATOM 1958 C ALA A 131 -7.116 -5.411 -2.366 1.00 0.00 C ATOM 1959 O ALA A 131 -8.309 -5.681 -2.417 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.068 -6.510 -1.513 1.00 0.00 C ATOM 0 H ALA A 131 -4.451 -5.710 -3.524 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.616 -7.437 -2.678 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.558 -6.744 -0.568 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.313 -7.266 -1.727 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.592 -5.532 -1.442 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.642 -4.176 -2.249 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.413 -2.989 -1.828 1.00 0.00 C ATOM 1968 C TRP A 132 -8.439 -2.482 -2.866 1.00 0.00 C ATOM 1969 O TRP A 132 -8.713 -1.287 -2.975 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.508 -1.827 -1.358 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.626 -2.182 -0.183 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.138 -3.394 0.067 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.152 -1.358 0.890 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.293 -3.389 1.070 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.293 -2.171 1.643 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.318 -0.028 1.293 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.610 -1.705 2.729 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.651 0.401 2.374 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.809 -0.426 3.071 1.00 0.00 C ATOM 0 H TRP A 132 -5.667 -3.954 -2.452 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.991 -3.349 -0.977 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.880 -1.508 -2.190 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.134 -0.977 -1.087 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.406 -4.279 -0.491 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.726 -4.182 1.369 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.969 0.638 0.746 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.939 -2.340 3.288 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.780 1.422 2.703 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.286 -0.031 3.929 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.935 -3.360 -3.652 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.045 -3.030 -4.540 1.00 0.00 C ATOM 1992 C ARG A 133 -11.483 -3.702 -4.328 1.00 0.00 C ATOM 1993 O ARG A 133 -12.436 -2.997 -4.243 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.603 -2.985 -6.021 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.716 -2.708 -7.036 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.471 -3.965 -7.422 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.769 -3.674 -8.055 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.220 -4.242 -9.188 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.413 -4.995 -9.918 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.474 -4.050 -9.596 1.00 0.00 N ATOM 0 H ARG A 133 -8.607 -4.324 -3.718 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.286 -2.027 -4.187 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.837 -2.217 -6.130 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.136 -3.938 -6.271 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.413 -1.982 -6.618 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.285 -2.257 -7.930 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -10.861 -4.555 -8.106 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -11.633 -4.575 -6.533 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.372 -2.989 -7.599 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.449 -5.145 -9.622 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -12.755 -5.425 -10.777 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.105 -3.466 -9.047 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -14.803 -4.487 -10.457 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.600 -5.029 -4.219 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.935 -5.773 -4.563 1.00 0.00 C ATOM 2016 C LYS A 134 -14.286 -5.530 -3.798 1.00 0.00 C ATOM 2017 O LYS A 134 -15.235 -6.261 -4.099 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.769 -7.301 -4.689 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.479 -7.764 -5.241 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.547 -8.036 -4.113 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.170 -7.775 -4.523 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.763 -8.564 -5.719 1.00 0.00 N ATOM 0 H LYS A 134 -10.845 -5.642 -3.911 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.085 -5.232 -5.498 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -12.900 -7.744 -3.702 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.571 -7.684 -5.320 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.625 -8.665 -5.836 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -11.059 -7.008 -5.904 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.805 -7.409 -3.259 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.648 -9.072 -3.790 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.055 -6.713 -4.738 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -8.499 -8.007 -3.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.740 -8.457 -5.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -8.987 -9.568 -5.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.277 -8.219 -6.554 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.457 -4.593 -2.907 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.797 -4.554 -2.256 1.00 0.00 C ATOM 2038 C LEU A 135 -16.883 -3.687 -2.938 1.00 0.00 C ATOM 2039 O LEU A 135 -16.683 -2.514 -3.181 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.842 -4.544 -0.699 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.935 -3.603 0.079 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.526 -4.093 0.057 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -15.007 -2.219 -0.444 1.00 0.00 C ATOM 0 H LEU A 135 -13.775 -3.893 -2.614 1.00 0.00 H new ATOM 0 HA LEU A 135 -16.115 -5.571 -2.486 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -16.868 -4.323 -0.405 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -15.625 -5.557 -0.361 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.286 -3.588 1.111 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.893 -3.406 0.619 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.478 -5.083 0.510 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.176 -4.148 -0.974 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.346 -1.576 0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -14.698 -2.208 -1.489 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -16.031 -1.853 -0.365 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.072 -4.331 -3.225 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.242 -3.776 -3.996 1.00 0.00 C ATOM 2057 C PRO A 136 -19.615 -2.285 -3.820 1.00 0.00 C ATOM 2058 O PRO A 136 -19.170 -1.592 -2.894 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.391 -4.641 -3.491 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.782 -5.969 -3.287 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.378 -5.727 -2.806 1.00 0.00 C ATOM 0 HA PRO A 136 -18.999 -3.807 -5.058 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.808 -4.248 -2.564 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -21.205 -4.683 -4.214 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -20.348 -6.547 -2.556 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.781 -6.542 -4.214 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -18.304 -5.841 -1.725 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.679 -6.436 -3.250 1.00 0.00 H new