USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 959 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 13 THR OG1 : rot -26:sc= 0.2 USER MOD Single : A 17 THR OG1 : rot 78:sc= 0.207 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 172:sc= 0.488 (180deg=0.447) USER MOD Single : A 33 ASN : amide:sc= -0.187 K(o=-0.19,f=-0.85) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 CYS SG : rot 12:sc= 0.0781 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 CYS SG : rot 180:sc= -0.41 USER MOD Single : A 45 ASN : amide:sc= 0.253 K(o=0.25,f=-7.1!) USER MOD Single : A 49 CYS SG : rot 55:sc= 0.922 USER MOD Single : A 52 CYS SG : rot -26:sc= -0.477 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc=-0.00991 USER MOD Single : A 60 MET CE :methyl 179:sc= 0 (180deg=-0.000455) USER MOD Single : A 61 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.26) USER MOD Single : A 64 CYS SG : rot 180:sc= -0.0147 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 154:sc= 0.162 USER MOD Single : A 70 HIS : no HE2:sc= 0.61 K(o=0.61,f=-2.4!) USER MOD Single : A 74 THR OG1 : rot -77:sc= 1.32 USER MOD Single : A 75 GLN : amide:sc= 0.598 K(o=0.6,f=0) USER MOD Single : A 81 GLN : amide:sc= 0.904 K(o=0.9,f=-4.6!) USER MOD Single : A 84 GLN : amide:sc= -0.0475 X(o=-0.047,f=-0.047) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0.275 USER MOD Single : A 101 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.035) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 CYS SG : rot 180:sc= 0 USER MOD Single : A 108 CYS SG : rot -169:sc= 0.155 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= -0.0324 K(o=-0.032,f=-3.2!) USER MOD Single : A 124 MET CE :methyl -162:sc= -0.085 (180deg=-0.5) USER MOD Single : A 128 ASN : amide:sc= 1.03 K(o=1,f=-0.67) USER MOD Single : A 133 MET CE :methyl -172:sc= 0 (180deg=-0.0863) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 191 N THR A 13 16.214 -1.637 -14.527 1.00 0.00 N ATOM 192 CA THR A 13 16.908 -1.235 -13.284 1.00 0.00 C ATOM 193 C THR A 13 17.547 0.143 -13.415 1.00 0.00 C ATOM 194 O THR A 13 17.354 0.994 -12.548 1.00 0.00 O ATOM 195 CB THR A 13 17.961 -2.290 -12.902 1.00 0.00 C ATOM 196 OG1 THR A 13 18.810 -2.527 -14.010 1.00 0.00 O ATOM 197 CG2 THR A 13 17.311 -3.618 -12.498 1.00 0.00 C ATOM 0 HA THR A 13 16.165 -1.172 -12.489 1.00 0.00 H new ATOM 0 HB THR A 13 18.524 -1.904 -12.052 1.00 0.00 H new ATOM 0 HG1 THR A 13 18.332 -2.316 -14.839 1.00 0.00 H new ATOM 0 HG21 THR A 13 18.086 -4.338 -12.235 1.00 0.00 H new ATOM 0 HG22 THR A 13 16.659 -3.458 -11.639 1.00 0.00 H new ATOM 0 HG23 THR A 13 16.725 -4.005 -13.332 1.00 0.00 H new ATOM 205 N PHE A 14 18.239 0.403 -14.528 1.00 0.00 N ATOM 206 CA PHE A 14 18.835 1.708 -14.823 1.00 0.00 C ATOM 207 C PHE A 14 17.760 2.744 -15.164 1.00 0.00 C ATOM 208 O PHE A 14 17.749 3.833 -14.600 1.00 0.00 O ATOM 209 CB PHE A 14 19.846 1.553 -15.966 1.00 0.00 C ATOM 210 CG PHE A 14 20.909 2.634 -15.964 1.00 0.00 C ATOM 211 CD1 PHE A 14 20.672 3.870 -16.599 1.00 0.00 C ATOM 212 CD2 PHE A 14 22.127 2.421 -15.290 1.00 0.00 C ATOM 213 CE1 PHE A 14 21.648 4.882 -16.562 1.00 0.00 C ATOM 214 CE2 PHE A 14 23.105 3.432 -15.255 1.00 0.00 C ATOM 215 CZ PHE A 14 22.865 4.663 -15.892 1.00 0.00 C ATOM 0 H PHE A 14 18.402 -0.293 -15.256 1.00 0.00 H new ATOM 0 HA PHE A 14 19.355 2.073 -13.937 1.00 0.00 H new ATOM 0 HB2 PHE A 14 20.327 0.578 -15.889 1.00 0.00 H new ATOM 0 HB3 PHE A 14 19.316 1.573 -16.918 1.00 0.00 H new ATOM 0 HD1 PHE A 14 19.739 4.040 -17.115 1.00 0.00 H new ATOM 0 HD2 PHE A 14 22.311 1.477 -14.798 1.00 0.00 H new ATOM 0 HE1 PHE A 14 21.463 5.828 -17.049 1.00 0.00 H new ATOM 0 HE2 PHE A 14 24.039 3.263 -14.740 1.00 0.00 H new ATOM 0 HZ PHE A 14 23.615 5.440 -15.867 1.00 0.00 H new ATOM 225 N LEU A 15 16.808 2.380 -16.033 1.00 0.00 N ATOM 226 CA LEU A 15 15.669 3.227 -16.408 1.00 0.00 C ATOM 227 C LEU A 15 14.773 3.514 -15.200 1.00 0.00 C ATOM 228 O LEU A 15 14.299 4.631 -15.039 1.00 0.00 O ATOM 229 CB LEU A 15 14.893 2.544 -17.551 1.00 0.00 C ATOM 230 CG LEU A 15 13.633 3.310 -17.998 1.00 0.00 C ATOM 231 CD1 LEU A 15 13.963 4.679 -18.611 1.00 0.00 C ATOM 232 CD2 LEU A 15 12.852 2.472 -19.019 1.00 0.00 C ATOM 0 H LEU A 15 16.808 1.474 -16.502 1.00 0.00 H new ATOM 0 HA LEU A 15 16.032 4.193 -16.759 1.00 0.00 H new ATOM 0 HB2 LEU A 15 15.557 2.426 -18.407 1.00 0.00 H new ATOM 0 HB3 LEU A 15 14.603 1.543 -17.232 1.00 0.00 H new ATOM 0 HG LEU A 15 13.030 3.485 -17.107 1.00 0.00 H new ATOM 0 HD11 LEU A 15 13.040 5.176 -18.909 1.00 0.00 H new ATOM 0 HD12 LEU A 15 14.484 5.291 -17.875 1.00 0.00 H new ATOM 0 HD13 LEU A 15 14.600 4.542 -19.485 1.00 0.00 H new ATOM 0 HD21 LEU A 15 11.962 3.017 -19.332 1.00 0.00 H new ATOM 0 HD22 LEU A 15 13.482 2.276 -19.887 1.00 0.00 H new ATOM 0 HD23 LEU A 15 12.557 1.527 -18.564 1.00 0.00 H new ATOM 244 N ASP A 16 14.609 2.546 -14.299 1.00 0.00 N ATOM 245 CA ASP A 16 13.873 2.742 -13.037 1.00 0.00 C ATOM 246 C ASP A 16 14.485 3.839 -12.145 1.00 0.00 C ATOM 247 O ASP A 16 13.770 4.541 -11.426 1.00 0.00 O ATOM 248 CB ASP A 16 13.840 1.411 -12.293 1.00 0.00 C ATOM 249 CG ASP A 16 12.791 1.407 -11.170 1.00 0.00 C ATOM 250 OD1 ASP A 16 11.579 1.358 -11.489 1.00 0.00 O ATOM 251 OD2 ASP A 16 13.182 1.439 -9.979 1.00 0.00 O ATOM 0 H ASP A 16 14.979 1.603 -14.417 1.00 0.00 H new ATOM 0 HA ASP A 16 12.866 3.080 -13.280 1.00 0.00 H new ATOM 0 HB2 ASP A 16 13.622 0.607 -12.996 1.00 0.00 H new ATOM 0 HB3 ASP A 16 14.824 1.207 -11.871 1.00 0.00 H new ATOM 256 N THR A 17 15.808 4.024 -12.260 1.00 0.00 N ATOM 257 CA THR A 17 16.576 5.083 -11.581 1.00 0.00 C ATOM 258 C THR A 17 16.388 6.440 -12.266 1.00 0.00 C ATOM 259 O THR A 17 16.579 7.469 -11.628 1.00 0.00 O ATOM 260 CB THR A 17 18.058 4.685 -11.464 1.00 0.00 C ATOM 261 OG1 THR A 17 18.151 3.448 -10.785 1.00 0.00 O ATOM 262 CG2 THR A 17 18.896 5.680 -10.655 1.00 0.00 C ATOM 0 H THR A 17 16.392 3.425 -12.844 1.00 0.00 H new ATOM 0 HA THR A 17 16.188 5.194 -10.569 1.00 0.00 H new ATOM 0 HB THR A 17 18.441 4.648 -12.484 1.00 0.00 H new ATOM 0 HG1 THR A 17 17.918 2.720 -11.398 1.00 0.00 H new ATOM 0 HG21 THR A 17 19.930 5.336 -10.614 1.00 0.00 H new ATOM 0 HG22 THR A 17 18.858 6.660 -11.132 1.00 0.00 H new ATOM 0 HG23 THR A 17 18.497 5.753 -9.643 1.00 0.00 H new ATOM 270 N ILE A 18 15.951 6.466 -13.529 1.00 0.00 N ATOM 271 CA ILE A 18 15.528 7.679 -14.261 1.00 0.00 C ATOM 272 C ILE A 18 14.067 8.026 -13.967 1.00 0.00 C ATOM 273 O ILE A 18 13.757 9.182 -13.700 1.00 0.00 O ATOM 274 CB ILE A 18 15.748 7.491 -15.783 1.00 0.00 C ATOM 275 CG1 ILE A 18 17.139 6.917 -16.120 1.00 0.00 C ATOM 276 CG2 ILE A 18 15.499 8.792 -16.565 1.00 0.00 C ATOM 277 CD1 ILE A 18 18.328 7.712 -15.561 1.00 0.00 C ATOM 0 H ILE A 18 15.877 5.620 -14.094 1.00 0.00 H new ATOM 0 HA ILE A 18 16.141 8.512 -13.917 1.00 0.00 H new ATOM 0 HB ILE A 18 15.008 6.755 -16.099 1.00 0.00 H new ATOM 0 HG12 ILE A 18 17.195 5.897 -15.741 1.00 0.00 H new ATOM 0 HG13 ILE A 18 17.238 6.860 -17.204 1.00 0.00 H new ATOM 0 HG21 ILE A 18 15.664 8.615 -17.628 1.00 0.00 H new ATOM 0 HG22 ILE A 18 14.472 9.120 -16.407 1.00 0.00 H new ATOM 0 HG23 ILE A 18 16.184 9.564 -16.215 1.00 0.00 H new ATOM 0 HD11 ILE A 18 19.259 7.227 -15.853 1.00 0.00 H new ATOM 0 HD12 ILE A 18 18.307 8.726 -15.959 1.00 0.00 H new ATOM 0 HD13 ILE A 18 18.263 7.748 -14.474 1.00 0.00 H new ATOM 289 N ILE A 19 13.165 7.043 -13.953 1.00 0.00 N ATOM 290 CA ILE A 19 11.730 7.268 -13.682 1.00 0.00 C ATOM 291 C ILE A 19 11.525 7.921 -12.309 1.00 0.00 C ATOM 292 O ILE A 19 10.685 8.812 -12.186 1.00 0.00 O ATOM 293 CB ILE A 19 10.934 5.947 -13.833 1.00 0.00 C ATOM 294 CG1 ILE A 19 10.982 5.442 -15.296 1.00 0.00 C ATOM 295 CG2 ILE A 19 9.460 6.133 -13.410 1.00 0.00 C ATOM 296 CD1 ILE A 19 10.602 3.963 -15.435 1.00 0.00 C ATOM 0 H ILE A 19 13.401 6.066 -14.128 1.00 0.00 H new ATOM 0 HA ILE A 19 11.340 7.966 -14.422 1.00 0.00 H new ATOM 0 HB ILE A 19 11.401 5.210 -13.179 1.00 0.00 H new ATOM 0 HG12 ILE A 19 10.306 6.043 -15.904 1.00 0.00 H new ATOM 0 HG13 ILE A 19 11.986 5.592 -15.693 1.00 0.00 H new ATOM 0 HG21 ILE A 19 8.926 5.190 -13.527 1.00 0.00 H new ATOM 0 HG22 ILE A 19 9.418 6.447 -12.367 1.00 0.00 H new ATOM 0 HG23 ILE A 19 8.995 6.893 -14.037 1.00 0.00 H new ATOM 0 HD11 ILE A 19 10.655 3.671 -16.484 1.00 0.00 H new ATOM 0 HD12 ILE A 19 11.293 3.353 -14.853 1.00 0.00 H new ATOM 0 HD13 ILE A 19 9.587 3.812 -15.067 1.00 0.00 H new ATOM 308 N ARG A 20 12.339 7.581 -11.301 1.00 0.00 N ATOM 309 CA ARG A 20 12.221 8.169 -9.953 1.00 0.00 C ATOM 310 C ARG A 20 12.688 9.632 -9.858 1.00 0.00 C ATOM 311 O ARG A 20 12.456 10.292 -8.847 1.00 0.00 O ATOM 312 CB ARG A 20 12.831 7.235 -8.898 1.00 0.00 C ATOM 313 CG ARG A 20 14.368 7.204 -8.882 1.00 0.00 C ATOM 314 CD ARG A 20 14.955 6.054 -8.049 1.00 0.00 C ATOM 315 NE ARG A 20 14.617 6.149 -6.610 1.00 0.00 N ATOM 316 CZ ARG A 20 15.448 6.004 -5.577 1.00 0.00 C ATOM 317 NH1 ARG A 20 16.746 5.847 -5.719 1.00 0.00 N ATOM 318 NH2 ARG A 20 14.971 6.001 -4.353 1.00 0.00 N ATOM 0 H ARG A 20 13.091 6.898 -11.391 1.00 0.00 H new ATOM 0 HA ARG A 20 11.157 8.245 -9.728 1.00 0.00 H new ATOM 0 HB2 ARG A 20 12.477 7.540 -7.913 1.00 0.00 H new ATOM 0 HB3 ARG A 20 12.462 6.224 -9.070 1.00 0.00 H new ATOM 0 HG2 ARG A 20 14.731 7.121 -9.906 1.00 0.00 H new ATOM 0 HG3 ARG A 20 14.737 8.151 -8.489 1.00 0.00 H new ATOM 0 HD2 ARG A 20 14.588 5.105 -8.441 1.00 0.00 H new ATOM 0 HD3 ARG A 20 16.039 6.048 -8.162 1.00 0.00 H new ATOM 0 HE ARG A 20 13.642 6.347 -6.384 1.00 0.00 H new ATOM 0 HH11 ARG A 20 17.159 5.832 -6.652 1.00 0.00 H new ATOM 0 HH12 ARG A 20 17.340 5.740 -4.897 1.00 0.00 H new ATOM 0 HH21 ARG A 20 13.969 6.109 -4.196 1.00 0.00 H new ATOM 0 HH22 ARG A 20 15.603 5.890 -3.560 1.00 0.00 H new ATOM 332 N LYS A 21 13.291 10.172 -10.917 1.00 0.00 N ATOM 333 CA LYS A 21 13.635 11.598 -11.064 1.00 0.00 C ATOM 334 C LYS A 21 12.431 12.397 -11.591 1.00 0.00 C ATOM 335 O LYS A 21 12.129 13.487 -11.100 1.00 0.00 O ATOM 336 CB LYS A 21 14.819 11.716 -12.041 1.00 0.00 C ATOM 337 CG LYS A 21 15.938 10.720 -11.721 1.00 0.00 C ATOM 338 CD LYS A 21 17.236 10.973 -12.484 1.00 0.00 C ATOM 339 CE LYS A 21 17.075 11.463 -13.935 1.00 0.00 C ATOM 340 NZ LYS A 21 18.395 11.727 -14.576 1.00 0.00 N ATOM 0 H LYS A 21 13.565 9.616 -11.727 1.00 0.00 H new ATOM 0 HA LYS A 21 13.909 12.009 -10.092 1.00 0.00 H new ATOM 0 HB2 LYS A 21 14.466 11.548 -13.058 1.00 0.00 H new ATOM 0 HB3 LYS A 21 15.217 12.730 -12.005 1.00 0.00 H new ATOM 0 HG2 LYS A 21 16.145 10.755 -10.651 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.588 9.712 -11.945 1.00 0.00 H new ATOM 0 HD2 LYS A 21 17.821 11.710 -11.934 1.00 0.00 H new ATOM 0 HD3 LYS A 21 17.815 10.050 -12.494 1.00 0.00 H new ATOM 0 HE2 LYS A 21 16.532 10.716 -14.514 1.00 0.00 H new ATOM 0 HE3 LYS A 21 16.475 12.373 -13.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 18.248 12.055 -15.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 18.902 12.458 -14.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 18.957 10.852 -14.586 1.00 0.00 H new ATOM 354 N PHE A 22 11.728 11.814 -12.570 1.00 0.00 N ATOM 355 CA PHE A 22 10.537 12.385 -13.206 1.00 0.00 C ATOM 356 C PHE A 22 9.260 12.200 -12.369 1.00 0.00 C ATOM 357 O PHE A 22 8.461 13.135 -12.287 1.00 0.00 O ATOM 358 CB PHE A 22 10.374 11.775 -14.607 1.00 0.00 C ATOM 359 CG PHE A 22 11.378 12.299 -15.619 1.00 0.00 C ATOM 360 CD1 PHE A 22 11.159 13.544 -16.239 1.00 0.00 C ATOM 361 CD2 PHE A 22 12.531 11.556 -15.938 1.00 0.00 C ATOM 362 CE1 PHE A 22 12.086 14.044 -17.171 1.00 0.00 C ATOM 363 CE2 PHE A 22 13.459 12.059 -16.868 1.00 0.00 C ATOM 364 CZ PHE A 22 13.237 13.302 -17.485 1.00 0.00 C ATOM 0 H PHE A 22 11.982 10.903 -12.952 1.00 0.00 H new ATOM 0 HA PHE A 22 10.684 13.462 -13.285 1.00 0.00 H new ATOM 0 HB2 PHE A 22 10.474 10.692 -14.536 1.00 0.00 H new ATOM 0 HB3 PHE A 22 9.366 11.980 -14.968 1.00 0.00 H new ATOM 0 HD1 PHE A 22 10.276 14.117 -15.998 1.00 0.00 H new ATOM 0 HD2 PHE A 22 12.703 10.599 -15.468 1.00 0.00 H new ATOM 0 HE1 PHE A 22 11.913 14.999 -17.645 1.00 0.00 H new ATOM 0 HE2 PHE A 22 14.344 11.489 -17.108 1.00 0.00 H new ATOM 0 HZ PHE A 22 13.950 13.686 -18.199 1.00 0.00 H new ATOM 374 N GLU A 23 9.064 11.037 -11.732 1.00 0.00 N ATOM 375 CA GLU A 23 7.867 10.773 -10.911 1.00 0.00 C ATOM 376 C GLU A 23 7.987 11.370 -9.498 1.00 0.00 C ATOM 377 O GLU A 23 6.997 11.751 -8.868 1.00 0.00 O ATOM 378 CB GLU A 23 7.558 9.267 -10.897 1.00 0.00 C ATOM 379 CG GLU A 23 8.100 8.455 -9.713 1.00 0.00 C ATOM 380 CD GLU A 23 7.853 6.946 -9.894 1.00 0.00 C ATOM 381 OE1 GLU A 23 6.695 6.544 -10.161 1.00 0.00 O ATOM 382 OE2 GLU A 23 8.811 6.150 -9.747 1.00 0.00 O ATOM 0 H GLU A 23 9.722 10.258 -11.768 1.00 0.00 H new ATOM 0 HA GLU A 23 7.018 11.282 -11.368 1.00 0.00 H new ATOM 0 HB2 GLU A 23 6.475 9.143 -10.925 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.953 8.832 -11.815 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.169 8.638 -9.606 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.625 8.793 -8.792 1.00 0.00 H new ATOM 424 N ARG A 27 8.237 11.472 -3.067 1.00 0.00 N ATOM 425 CA ARG A 27 6.966 10.787 -2.801 1.00 0.00 C ATOM 426 C ARG A 27 7.234 9.349 -2.354 1.00 0.00 C ATOM 427 O ARG A 27 8.208 8.727 -2.775 1.00 0.00 O ATOM 428 CB ARG A 27 6.050 10.756 -4.036 1.00 0.00 C ATOM 429 CG ARG A 27 5.427 12.102 -4.442 1.00 0.00 C ATOM 430 CD ARG A 27 6.367 13.033 -5.217 1.00 0.00 C ATOM 431 NE ARG A 27 5.659 14.263 -5.616 1.00 0.00 N ATOM 432 CZ ARG A 27 5.110 14.543 -6.796 1.00 0.00 C ATOM 433 NH1 ARG A 27 5.233 13.763 -7.851 1.00 0.00 N ATOM 434 NH2 ARG A 27 4.407 15.647 -6.930 1.00 0.00 N ATOM 0 HA ARG A 27 6.460 11.348 -2.015 1.00 0.00 H new ATOM 0 HB2 ARG A 27 6.623 10.373 -4.880 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.244 10.046 -3.849 1.00 0.00 H new ATOM 0 HG2 ARG A 27 4.544 11.910 -5.051 1.00 0.00 H new ATOM 0 HG3 ARG A 27 5.088 12.616 -3.543 1.00 0.00 H new ATOM 0 HD2 ARG A 27 7.229 13.286 -4.599 1.00 0.00 H new ATOM 0 HD3 ARG A 27 6.748 12.522 -6.101 1.00 0.00 H new ATOM 0 HE ARG A 27 5.580 14.987 -4.902 1.00 0.00 H new ATOM 0 HH11 ARG A 27 5.769 12.898 -7.786 1.00 0.00 H new ATOM 0 HH12 ARG A 27 4.792 14.024 -8.733 1.00 0.00 H new ATOM 0 HH21 ARG A 27 4.288 16.276 -6.136 1.00 0.00 H new ATOM 0 HH22 ARG A 27 3.981 15.874 -7.828 1.00 0.00 H new ATOM 448 N LYS A 28 6.362 8.772 -1.532 1.00 0.00 N ATOM 449 CA LYS A 28 6.510 7.386 -1.068 1.00 0.00 C ATOM 450 C LYS A 28 5.755 6.411 -1.973 1.00 0.00 C ATOM 451 O LYS A 28 4.589 6.624 -2.293 1.00 0.00 O ATOM 452 CB LYS A 28 6.057 7.245 0.391 1.00 0.00 C ATOM 453 CG LYS A 28 6.814 8.191 1.327 1.00 0.00 C ATOM 454 CD LYS A 28 6.119 9.515 1.632 1.00 0.00 C ATOM 455 CE LYS A 28 7.177 10.605 1.824 1.00 0.00 C ATOM 456 NZ LYS A 28 8.069 10.425 3.013 1.00 0.00 N ATOM 0 H LYS A 28 5.535 9.245 -1.167 1.00 0.00 H new ATOM 0 HA LYS A 28 7.569 7.131 -1.120 1.00 0.00 H new ATOM 0 HB2 LYS A 28 4.988 7.448 0.459 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.207 6.216 0.718 1.00 0.00 H new ATOM 0 HG2 LYS A 28 6.997 7.672 2.268 1.00 0.00 H new ATOM 0 HG3 LYS A 28 7.788 8.406 0.887 1.00 0.00 H new ATOM 0 HD2 LYS A 28 5.447 9.783 0.817 1.00 0.00 H new ATOM 0 HD3 LYS A 28 5.509 9.421 2.530 1.00 0.00 H new ATOM 0 HE2 LYS A 28 7.797 10.649 0.928 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.673 11.567 1.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 8.833 11.130 2.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 7.515 10.550 3.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.480 9.470 2.997 1.00 0.00 H new ATOM 470 N PHE A 29 6.407 5.304 -2.330 1.00 0.00 N ATOM 471 CA PHE A 29 5.842 4.250 -3.168 1.00 0.00 C ATOM 472 C PHE A 29 6.547 2.904 -2.989 1.00 0.00 C ATOM 473 O PHE A 29 7.726 2.842 -2.640 1.00 0.00 O ATOM 474 CB PHE A 29 5.816 4.697 -4.640 1.00 0.00 C ATOM 475 CG PHE A 29 7.129 5.233 -5.186 1.00 0.00 C ATOM 476 CD1 PHE A 29 8.145 4.350 -5.601 1.00 0.00 C ATOM 477 CD2 PHE A 29 7.336 6.624 -5.277 1.00 0.00 C ATOM 478 CE1 PHE A 29 9.362 4.857 -6.094 1.00 0.00 C ATOM 479 CE2 PHE A 29 8.550 7.129 -5.773 1.00 0.00 C ATOM 480 CZ PHE A 29 9.564 6.246 -6.181 1.00 0.00 C ATOM 0 H PHE A 29 7.365 5.112 -2.037 1.00 0.00 H new ATOM 0 HA PHE A 29 4.816 4.086 -2.840 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.507 3.850 -5.253 1.00 0.00 H new ATOM 0 HB3 PHE A 29 5.054 5.468 -4.754 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.990 3.283 -5.541 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.558 7.305 -4.964 1.00 0.00 H new ATOM 0 HE1 PHE A 29 10.142 4.178 -6.406 1.00 0.00 H new ATOM 0 HE2 PHE A 29 8.704 8.196 -5.841 1.00 0.00 H new ATOM 0 HZ PHE A 29 10.498 6.634 -6.561 1.00 0.00 H new ATOM 490 N ILE A 30 5.812 1.826 -3.255 1.00 0.00 N ATOM 491 CA ILE A 30 6.289 0.434 -3.248 1.00 0.00 C ATOM 492 C ILE A 30 5.654 -0.337 -4.410 1.00 0.00 C ATOM 493 O ILE A 30 4.542 -0.021 -4.827 1.00 0.00 O ATOM 494 CB ILE A 30 6.015 -0.244 -1.881 1.00 0.00 C ATOM 495 CG1 ILE A 30 4.503 -0.361 -1.575 1.00 0.00 C ATOM 496 CG2 ILE A 30 6.746 0.492 -0.744 1.00 0.00 C ATOM 497 CD1 ILE A 30 4.203 -0.894 -0.171 1.00 0.00 C ATOM 0 H ILE A 30 4.823 1.896 -3.493 1.00 0.00 H new ATOM 0 HA ILE A 30 7.370 0.428 -3.388 1.00 0.00 H new ATOM 0 HB ILE A 30 6.408 -1.258 -1.947 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.040 0.619 -1.689 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.041 -1.019 -2.311 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.537 -0.004 0.204 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.820 0.477 -0.932 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.400 1.525 -0.697 1.00 0.00 H new ATOM 0 HD11 ILE A 30 3.124 -0.950 -0.026 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.636 -1.888 -0.059 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.635 -0.224 0.572 1.00 0.00 H new ATOM 509 N ILE A 31 6.352 -1.340 -4.942 1.00 0.00 N ATOM 510 CA ILE A 31 5.925 -2.162 -6.080 1.00 0.00 C ATOM 511 C ILE A 31 5.703 -3.595 -5.602 1.00 0.00 C ATOM 512 O ILE A 31 6.558 -4.172 -4.930 1.00 0.00 O ATOM 513 CB ILE A 31 6.961 -2.107 -7.230 1.00 0.00 C ATOM 514 CG1 ILE A 31 7.177 -0.657 -7.734 1.00 0.00 C ATOM 515 CG2 ILE A 31 6.494 -2.988 -8.411 1.00 0.00 C ATOM 516 CD1 ILE A 31 8.376 0.058 -7.099 1.00 0.00 C ATOM 0 H ILE A 31 7.265 -1.615 -4.580 1.00 0.00 H new ATOM 0 HA ILE A 31 4.990 -1.768 -6.478 1.00 0.00 H new ATOM 0 HB ILE A 31 7.906 -2.482 -6.836 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.311 -0.677 -8.816 1.00 0.00 H new ATOM 0 HG13 ILE A 31 6.276 -0.077 -7.535 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.230 -2.941 -9.213 1.00 0.00 H new ATOM 0 HG22 ILE A 31 6.388 -4.020 -8.076 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.534 -2.625 -8.778 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.456 1.066 -7.506 1.00 0.00 H new ATOM 0 HD12 ILE A 31 8.237 0.113 -6.019 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.289 -0.496 -7.320 1.00 0.00 H new ATOM 528 N ALA A 32 4.569 -4.178 -5.981 1.00 0.00 N ATOM 529 CA ALA A 32 4.141 -5.509 -5.576 1.00 0.00 C ATOM 530 C ALA A 32 3.656 -6.339 -6.768 1.00 0.00 C ATOM 531 O ALA A 32 3.088 -5.802 -7.720 1.00 0.00 O ATOM 532 CB ALA A 32 3.052 -5.315 -4.522 1.00 0.00 C ATOM 0 H ALA A 32 3.901 -3.719 -6.600 1.00 0.00 H new ATOM 0 HA ALA A 32 4.975 -6.075 -5.160 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.696 -6.288 -4.184 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.460 -4.763 -3.675 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.223 -4.755 -4.954 1.00 0.00 H new ATOM 538 N ASN A 33 3.866 -7.655 -6.722 1.00 0.00 N ATOM 539 CA ASN A 33 3.486 -8.570 -7.792 1.00 0.00 C ATOM 540 C ASN A 33 1.960 -8.804 -7.846 1.00 0.00 C ATOM 541 O ASN A 33 1.362 -9.314 -6.901 1.00 0.00 O ATOM 542 CB ASN A 33 4.329 -9.856 -7.672 1.00 0.00 C ATOM 543 CG ASN A 33 4.389 -10.551 -6.304 1.00 0.00 C ATOM 544 OD1 ASN A 33 3.540 -10.404 -5.436 1.00 0.00 O ATOM 545 ND2 ASN A 33 5.416 -11.349 -6.080 1.00 0.00 N ATOM 0 H ASN A 33 4.310 -8.118 -5.930 1.00 0.00 H new ATOM 0 HA ASN A 33 3.711 -8.124 -8.761 1.00 0.00 H new ATOM 0 HB2 ASN A 33 3.946 -10.575 -8.396 1.00 0.00 H new ATOM 0 HB3 ASN A 33 5.350 -9.616 -7.970 1.00 0.00 H new ATOM 0 HD21 ASN A 33 5.497 -11.838 -5.188 1.00 0.00 H new ATOM 0 HD22 ASN A 33 6.128 -11.477 -6.799 1.00 0.00 H new ATOM 552 N ALA A 34 1.305 -8.458 -8.965 1.00 0.00 N ATOM 553 CA ALA A 34 -0.157 -8.618 -9.092 1.00 0.00 C ATOM 554 C ALA A 34 -0.568 -10.093 -9.270 1.00 0.00 C ATOM 555 O ALA A 34 -1.628 -10.512 -8.811 1.00 0.00 O ATOM 556 CB ALA A 34 -0.666 -7.749 -10.251 1.00 0.00 C ATOM 0 H ALA A 34 1.758 -8.068 -9.791 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.621 -8.284 -8.164 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.746 -7.866 -10.346 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.430 -6.703 -10.053 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.184 -8.060 -11.178 1.00 0.00 H new ATOM 562 N ARG A 35 0.309 -10.910 -9.868 1.00 0.00 N ATOM 563 CA ARG A 35 0.095 -12.331 -10.207 1.00 0.00 C ATOM 564 C ARG A 35 0.149 -13.288 -8.985 1.00 0.00 C ATOM 565 O ARG A 35 0.538 -14.449 -9.118 1.00 0.00 O ATOM 566 CB ARG A 35 1.115 -12.736 -11.299 1.00 0.00 C ATOM 567 CG ARG A 35 1.179 -11.814 -12.535 1.00 0.00 C ATOM 568 CD ARG A 35 -0.158 -11.629 -13.264 1.00 0.00 C ATOM 569 NE ARG A 35 -0.678 -12.904 -13.795 1.00 0.00 N ATOM 570 CZ ARG A 35 -1.902 -13.127 -14.260 1.00 0.00 C ATOM 571 NH1 ARG A 35 -2.815 -12.179 -14.321 1.00 0.00 N ATOM 572 NH2 ARG A 35 -2.228 -14.331 -14.681 1.00 0.00 N ATOM 0 H ARG A 35 1.236 -10.585 -10.144 1.00 0.00 H new ATOM 0 HA ARG A 35 -0.922 -12.434 -10.584 1.00 0.00 H new ATOM 0 HB2 ARG A 35 2.106 -12.775 -10.847 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.878 -13.746 -11.634 1.00 0.00 H new ATOM 0 HG2 ARG A 35 1.546 -10.836 -12.224 1.00 0.00 H new ATOM 0 HG3 ARG A 35 1.908 -12.220 -13.237 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -0.888 -11.197 -12.579 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -0.030 -10.921 -14.082 1.00 0.00 H new ATOM 0 HE ARG A 35 -0.032 -13.694 -13.806 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -2.592 -11.235 -14.005 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -3.745 -12.389 -14.685 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -1.542 -15.086 -14.649 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -3.166 -14.509 -15.039 1.00 0.00 H new ATOM 586 N VAL A 36 -0.183 -12.794 -7.788 1.00 0.00 N ATOM 587 CA VAL A 36 -0.031 -13.463 -6.476 1.00 0.00 C ATOM 588 C VAL A 36 -1.172 -13.012 -5.556 1.00 0.00 C ATOM 589 O VAL A 36 -1.479 -11.822 -5.503 1.00 0.00 O ATOM 590 CB VAL A 36 1.340 -13.134 -5.822 1.00 0.00 C ATOM 591 CG1 VAL A 36 1.496 -13.768 -4.427 1.00 0.00 C ATOM 592 CG2 VAL A 36 2.526 -13.596 -6.686 1.00 0.00 C ATOM 0 H VAL A 36 -0.589 -11.863 -7.695 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.071 -14.542 -6.628 1.00 0.00 H new ATOM 0 HB VAL A 36 1.352 -12.048 -5.732 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.471 -13.507 -4.016 1.00 0.00 H new ATOM 0 HG12 VAL A 36 0.712 -13.395 -3.768 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.415 -14.852 -4.509 1.00 0.00 H new ATOM 0 HG21 VAL A 36 3.461 -13.343 -6.186 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.472 -14.675 -6.831 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.487 -13.098 -7.655 1.00 0.00 H new ATOM 602 N GLU A 37 -1.777 -13.951 -4.818 1.00 0.00 N ATOM 603 CA GLU A 37 -2.970 -13.720 -3.984 1.00 0.00 C ATOM 604 C GLU A 37 -2.767 -12.606 -2.936 1.00 0.00 C ATOM 605 O GLU A 37 -3.629 -11.745 -2.756 1.00 0.00 O ATOM 606 CB GLU A 37 -3.335 -15.047 -3.291 1.00 0.00 C ATOM 607 CG GLU A 37 -4.707 -15.055 -2.605 1.00 0.00 C ATOM 608 CD GLU A 37 -5.862 -14.995 -3.619 1.00 0.00 C ATOM 609 OE1 GLU A 37 -6.126 -16.015 -4.301 1.00 0.00 O ATOM 610 OE2 GLU A 37 -6.527 -13.939 -3.734 1.00 0.00 O ATOM 0 H GLU A 37 -1.446 -14.915 -4.781 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.779 -13.380 -4.631 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.309 -15.847 -4.031 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.571 -15.275 -2.548 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -4.804 -15.956 -1.999 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.777 -14.205 -1.926 1.00 0.00 H new ATOM 617 N ASN A 38 -1.608 -12.596 -2.267 1.00 0.00 N ATOM 618 CA ASN A 38 -1.279 -11.631 -1.207 1.00 0.00 C ATOM 619 C ASN A 38 -0.812 -10.255 -1.732 1.00 0.00 C ATOM 620 O ASN A 38 -0.731 -9.312 -0.946 1.00 0.00 O ATOM 621 CB ASN A 38 -0.193 -12.245 -0.305 1.00 0.00 C ATOM 622 CG ASN A 38 -0.659 -13.514 0.407 1.00 0.00 C ATOM 623 OD1 ASN A 38 -1.699 -13.546 1.055 1.00 0.00 O ATOM 624 ND2 ASN A 38 0.092 -14.597 0.304 1.00 0.00 N ATOM 0 H ASN A 38 -0.861 -13.266 -2.448 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.197 -11.439 -0.651 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.686 -12.474 -0.908 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.114 -11.509 0.438 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -0.194 -15.461 0.764 1.00 0.00 H new ATOM 0 HD22 ASN A 38 0.957 -14.568 -0.236 1.00 0.00 H new ATOM 631 N CYS A 39 -0.454 -10.144 -3.023 1.00 0.00 N ATOM 632 CA CYS A 39 0.231 -8.986 -3.628 1.00 0.00 C ATOM 633 C CYS A 39 1.471 -8.570 -2.807 1.00 0.00 C ATOM 634 O CYS A 39 1.485 -7.536 -2.138 1.00 0.00 O ATOM 635 CB CYS A 39 -0.773 -7.844 -3.864 1.00 0.00 C ATOM 636 SG CYS A 39 -1.993 -8.339 -5.116 1.00 0.00 S ATOM 0 H CYS A 39 -0.640 -10.885 -3.699 1.00 0.00 H new ATOM 0 HA CYS A 39 0.620 -9.267 -4.606 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.278 -7.594 -2.931 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.247 -6.948 -4.192 1.00 0.00 H new ATOM 0 HG CYS A 39 -1.891 -9.615 -5.341 1.00 0.00 H new ATOM 642 N ALA A 40 2.500 -9.421 -2.805 1.00 0.00 N ATOM 643 CA ALA A 40 3.700 -9.237 -1.989 1.00 0.00 C ATOM 644 C ALA A 40 4.593 -8.109 -2.543 1.00 0.00 C ATOM 645 O ALA A 40 4.830 -8.053 -3.749 1.00 0.00 O ATOM 646 CB ALA A 40 4.444 -10.579 -1.908 1.00 0.00 C ATOM 0 H ALA A 40 2.522 -10.266 -3.376 1.00 0.00 H new ATOM 0 HA ALA A 40 3.417 -8.926 -0.983 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.343 -10.461 -1.303 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.796 -11.328 -1.453 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.722 -10.902 -2.911 1.00 0.00 H new ATOM 652 N VAL A 41 5.117 -7.236 -1.673 1.00 0.00 N ATOM 653 CA VAL A 41 6.075 -6.179 -2.069 1.00 0.00 C ATOM 654 C VAL A 41 7.358 -6.829 -2.590 1.00 0.00 C ATOM 655 O VAL A 41 8.004 -7.598 -1.876 1.00 0.00 O ATOM 656 CB VAL A 41 6.414 -5.174 -0.938 1.00 0.00 C ATOM 657 CG1 VAL A 41 7.311 -4.039 -1.448 1.00 0.00 C ATOM 658 CG2 VAL A 41 5.134 -4.551 -0.355 1.00 0.00 C ATOM 0 H VAL A 41 4.894 -7.237 -0.678 1.00 0.00 H new ATOM 0 HA VAL A 41 5.587 -5.595 -2.850 1.00 0.00 H new ATOM 0 HB VAL A 41 6.941 -5.735 -0.166 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.530 -3.352 -0.630 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.243 -4.456 -1.831 1.00 0.00 H new ATOM 0 HG13 VAL A 41 6.799 -3.501 -2.246 1.00 0.00 H new ATOM 0 HG21 VAL A 41 5.399 -3.850 0.436 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.595 -4.024 -1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.500 -5.338 0.054 1.00 0.00 H new ATOM 668 N ILE A 42 7.720 -6.499 -3.833 1.00 0.00 N ATOM 669 CA ILE A 42 8.965 -6.930 -4.493 1.00 0.00 C ATOM 670 C ILE A 42 10.020 -5.817 -4.530 1.00 0.00 C ATOM 671 O ILE A 42 11.205 -6.112 -4.680 1.00 0.00 O ATOM 672 CB ILE A 42 8.693 -7.465 -5.920 1.00 0.00 C ATOM 673 CG1 ILE A 42 8.021 -6.428 -6.851 1.00 0.00 C ATOM 674 CG2 ILE A 42 7.865 -8.757 -5.834 1.00 0.00 C ATOM 675 CD1 ILE A 42 7.987 -6.859 -8.321 1.00 0.00 C ATOM 0 H ILE A 42 7.141 -5.907 -4.429 1.00 0.00 H new ATOM 0 HA ILE A 42 9.368 -7.744 -3.890 1.00 0.00 H new ATOM 0 HB ILE A 42 9.660 -7.678 -6.376 1.00 0.00 H new ATOM 0 HG12 ILE A 42 7.001 -6.251 -6.509 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.553 -5.480 -6.771 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.673 -9.134 -6.839 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.416 -9.505 -5.265 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.917 -8.549 -5.337 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.502 -6.085 -8.916 1.00 0.00 H new ATOM 0 HD12 ILE A 42 9.005 -7.008 -8.680 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.429 -7.791 -8.414 1.00 0.00 H new ATOM 687 N TYR A 43 9.604 -4.556 -4.367 1.00 0.00 N ATOM 688 CA TYR A 43 10.499 -3.396 -4.352 1.00 0.00 C ATOM 689 C TYR A 43 9.910 -2.209 -3.580 1.00 0.00 C ATOM 690 O TYR A 43 8.710 -1.951 -3.638 1.00 0.00 O ATOM 691 CB TYR A 43 10.836 -2.988 -5.795 1.00 0.00 C ATOM 692 CG TYR A 43 12.144 -2.229 -5.900 1.00 0.00 C ATOM 693 CD1 TYR A 43 13.364 -2.934 -5.877 1.00 0.00 C ATOM 694 CD2 TYR A 43 12.151 -0.821 -5.952 1.00 0.00 C ATOM 695 CE1 TYR A 43 14.587 -2.237 -5.913 1.00 0.00 C ATOM 696 CE2 TYR A 43 13.370 -0.118 -5.993 1.00 0.00 C ATOM 697 CZ TYR A 43 14.594 -0.825 -5.974 1.00 0.00 C ATOM 698 OH TYR A 43 15.781 -0.154 -5.986 1.00 0.00 O ATOM 0 H TYR A 43 8.622 -4.310 -4.240 1.00 0.00 H new ATOM 0 HA TYR A 43 11.410 -3.687 -3.829 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.888 -3.881 -6.418 1.00 0.00 H new ATOM 0 HB3 TYR A 43 10.030 -2.370 -6.191 1.00 0.00 H new ATOM 0 HD1 TYR A 43 13.361 -4.013 -5.832 1.00 0.00 H new ATOM 0 HD2 TYR A 43 11.217 -0.279 -5.960 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.520 -2.781 -5.894 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.370 0.961 -6.039 1.00 0.00 H new ATOM 0 HH TYR A 43 15.611 0.810 -6.031 1.00 0.00 H new ATOM 708 N CYS A 44 10.758 -1.449 -2.889 1.00 0.00 N ATOM 709 CA CYS A 44 10.372 -0.279 -2.085 1.00 0.00 C ATOM 710 C CYS A 44 11.235 0.961 -2.389 1.00 0.00 C ATOM 711 O CYS A 44 12.406 0.812 -2.734 1.00 0.00 O ATOM 712 CB CYS A 44 10.460 -0.628 -0.584 1.00 0.00 C ATOM 713 SG CYS A 44 10.090 -2.364 -0.185 1.00 0.00 S ATOM 0 H CYS A 44 11.761 -1.631 -2.869 1.00 0.00 H new ATOM 0 HA CYS A 44 9.346 -0.026 -2.352 1.00 0.00 H new ATOM 0 HB2 CYS A 44 11.463 -0.393 -0.228 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.769 0.012 -0.035 1.00 0.00 H new ATOM 0 HG CYS A 44 10.195 -2.546 1.098 1.00 0.00 H new ATOM 719 N ASN A 45 10.696 2.169 -2.186 1.00 0.00 N ATOM 720 CA ASN A 45 11.484 3.419 -2.237 1.00 0.00 C ATOM 721 C ASN A 45 12.364 3.608 -0.967 1.00 0.00 C ATOM 722 O ASN A 45 12.496 2.698 -0.150 1.00 0.00 O ATOM 723 CB ASN A 45 10.511 4.601 -2.476 1.00 0.00 C ATOM 724 CG ASN A 45 11.181 5.894 -2.948 1.00 0.00 C ATOM 725 OD1 ASN A 45 12.337 5.914 -3.346 1.00 0.00 O ATOM 726 ND2 ASN A 45 10.525 7.028 -2.836 1.00 0.00 N ATOM 0 H ASN A 45 9.707 2.314 -1.982 1.00 0.00 H new ATOM 0 HA ASN A 45 12.192 3.373 -3.065 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.770 4.300 -3.217 1.00 0.00 H new ATOM 0 HB3 ASN A 45 9.972 4.804 -1.550 1.00 0.00 H new ATOM 0 HD21 ASN A 45 10.981 7.907 -3.080 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.560 7.028 -2.505 1.00 0.00 H new ATOM 733 N ASP A 46 12.919 4.807 -0.750 1.00 0.00 N ATOM 734 CA ASP A 46 13.577 5.228 0.502 1.00 0.00 C ATOM 735 C ASP A 46 12.691 6.157 1.357 1.00 0.00 C ATOM 736 O ASP A 46 12.850 6.223 2.575 1.00 0.00 O ATOM 737 CB ASP A 46 14.888 5.954 0.155 1.00 0.00 C ATOM 738 CG ASP A 46 15.880 5.075 -0.626 1.00 0.00 C ATOM 739 OD1 ASP A 46 16.474 4.151 -0.019 1.00 0.00 O ATOM 740 OD2 ASP A 46 16.082 5.331 -1.839 1.00 0.00 O ATOM 0 H ASP A 46 12.925 5.538 -1.462 1.00 0.00 H new ATOM 0 HA ASP A 46 13.768 4.332 1.092 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.659 6.842 -0.433 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.362 6.295 1.076 1.00 0.00 H new ATOM 745 N GLY A 47 11.720 6.841 0.735 1.00 0.00 N ATOM 746 CA GLY A 47 10.817 7.800 1.387 1.00 0.00 C ATOM 747 C GLY A 47 9.779 7.124 2.270 1.00 0.00 C ATOM 748 O GLY A 47 9.374 7.685 3.286 1.00 0.00 O ATOM 0 H GLY A 47 11.536 6.739 -0.263 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.404 8.493 1.989 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.310 8.391 0.624 1.00 0.00 H new ATOM 752 N PHE A 48 9.321 5.932 1.873 1.00 0.00 N ATOM 753 CA PHE A 48 8.273 5.180 2.578 1.00 0.00 C ATOM 754 C PHE A 48 8.796 4.610 3.917 1.00 0.00 C ATOM 755 O PHE A 48 8.070 4.585 4.906 1.00 0.00 O ATOM 756 CB PHE A 48 7.709 4.100 1.621 1.00 0.00 C ATOM 757 CG PHE A 48 8.364 2.749 1.762 1.00 0.00 C ATOM 758 CD1 PHE A 48 9.724 2.565 1.461 1.00 0.00 C ATOM 759 CD2 PHE A 48 7.634 1.722 2.370 1.00 0.00 C ATOM 760 CE1 PHE A 48 10.386 1.406 1.913 1.00 0.00 C ATOM 761 CE2 PHE A 48 8.280 0.550 2.766 1.00 0.00 C ATOM 762 CZ PHE A 48 9.663 0.397 2.573 1.00 0.00 C ATOM 0 H PHE A 48 9.671 5.455 1.042 1.00 0.00 H new ATOM 0 HA PHE A 48 7.452 5.842 2.854 1.00 0.00 H new ATOM 0 HB2 PHE A 48 6.639 3.994 1.801 1.00 0.00 H new ATOM 0 HB3 PHE A 48 7.827 4.443 0.593 1.00 0.00 H new ATOM 0 HD1 PHE A 48 10.259 3.307 0.887 1.00 0.00 H new ATOM 0 HD2 PHE A 48 6.572 1.836 2.533 1.00 0.00 H new ATOM 0 HE1 PHE A 48 11.448 1.293 1.753 1.00 0.00 H new ATOM 0 HE2 PHE A 48 7.712 -0.246 3.225 1.00 0.00 H new ATOM 0 HZ PHE A 48 10.167 -0.489 2.929 1.00 0.00 H new ATOM 772 N CYS A 49 10.086 4.246 3.976 1.00 0.00 N ATOM 773 CA CYS A 49 10.788 3.852 5.207 1.00 0.00 C ATOM 774 C CYS A 49 10.651 4.922 6.307 1.00 0.00 C ATOM 775 O CYS A 49 10.229 4.609 7.419 1.00 0.00 O ATOM 776 CB CYS A 49 12.248 3.544 4.822 1.00 0.00 C ATOM 777 SG CYS A 49 13.342 3.454 6.271 1.00 0.00 S ATOM 0 H CYS A 49 10.684 4.217 3.150 1.00 0.00 H new ATOM 0 HA CYS A 49 10.341 2.959 5.644 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.287 2.598 4.282 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.612 4.315 4.142 1.00 0.00 H new ATOM 0 HG CYS A 49 12.869 2.589 7.119 1.00 0.00 H new ATOM 783 N GLU A 50 10.918 6.189 5.974 1.00 0.00 N ATOM 784 CA GLU A 50 10.848 7.311 6.925 1.00 0.00 C ATOM 785 C GLU A 50 9.407 7.745 7.251 1.00 0.00 C ATOM 786 O GLU A 50 9.160 8.342 8.301 1.00 0.00 O ATOM 787 CB GLU A 50 11.657 8.501 6.385 1.00 0.00 C ATOM 788 CG GLU A 50 13.141 8.146 6.251 1.00 0.00 C ATOM 789 CD GLU A 50 13.986 9.396 5.963 1.00 0.00 C ATOM 790 OE1 GLU A 50 14.024 9.856 4.797 1.00 0.00 O ATOM 791 OE2 GLU A 50 14.623 9.930 6.902 1.00 0.00 O ATOM 0 H GLU A 50 11.191 6.470 5.032 1.00 0.00 H new ATOM 0 HA GLU A 50 11.280 6.960 7.862 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.263 8.801 5.414 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.543 9.355 7.053 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.489 7.672 7.169 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.273 7.421 5.448 1.00 0.00 H new ATOM 798 N LEU A 51 8.437 7.420 6.386 1.00 0.00 N ATOM 799 CA LEU A 51 7.012 7.639 6.650 1.00 0.00 C ATOM 800 C LEU A 51 6.533 6.802 7.851 1.00 0.00 C ATOM 801 O LEU A 51 5.897 7.351 8.750 1.00 0.00 O ATOM 802 CB LEU A 51 6.222 7.341 5.357 1.00 0.00 C ATOM 803 CG LEU A 51 4.707 7.608 5.430 1.00 0.00 C ATOM 804 CD1 LEU A 51 4.381 9.096 5.616 1.00 0.00 C ATOM 805 CD2 LEU A 51 4.019 7.065 4.172 1.00 0.00 C ATOM 0 H LEU A 51 8.622 6.995 5.478 1.00 0.00 H new ATOM 0 HA LEU A 51 6.836 8.678 6.929 1.00 0.00 H new ATOM 0 HB2 LEU A 51 6.641 7.942 4.549 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.377 6.296 5.090 1.00 0.00 H new ATOM 0 HG LEU A 51 4.327 7.087 6.309 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.300 9.229 5.661 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.830 9.454 6.543 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.781 9.664 4.776 1.00 0.00 H new ATOM 0 HD21 LEU A 51 2.948 7.258 4.231 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.428 7.560 3.291 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.191 5.991 4.098 1.00 0.00 H new ATOM 817 N CYS A 52 6.849 5.502 7.890 1.00 0.00 N ATOM 818 CA CYS A 52 6.322 4.567 8.901 1.00 0.00 C ATOM 819 C CYS A 52 7.308 4.178 10.025 1.00 0.00 C ATOM 820 O CYS A 52 6.876 3.876 11.141 1.00 0.00 O ATOM 821 CB CYS A 52 5.834 3.326 8.146 1.00 0.00 C ATOM 822 SG CYS A 52 4.854 2.305 9.277 1.00 0.00 S ATOM 0 H CYS A 52 7.480 5.063 7.219 1.00 0.00 H new ATOM 0 HA CYS A 52 5.519 5.074 9.436 1.00 0.00 H new ATOM 0 HB2 CYS A 52 5.233 3.620 7.285 1.00 0.00 H new ATOM 0 HB3 CYS A 52 6.682 2.758 7.764 1.00 0.00 H new ATOM 0 HG CYS A 52 5.239 2.520 10.500 1.00 0.00 H new ATOM 828 N GLY A 53 8.616 4.142 9.749 1.00 0.00 N ATOM 829 CA GLY A 53 9.654 3.722 10.704 1.00 0.00 C ATOM 830 C GLY A 53 10.082 2.256 10.576 1.00 0.00 C ATOM 831 O GLY A 53 10.856 1.784 11.409 1.00 0.00 O ATOM 0 H GLY A 53 8.993 4.408 8.839 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.531 4.356 10.570 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.289 3.893 11.717 1.00 0.00 H new ATOM 835 N TYR A 54 9.604 1.533 9.554 1.00 0.00 N ATOM 836 CA TYR A 54 10.098 0.197 9.187 1.00 0.00 C ATOM 837 C TYR A 54 11.285 0.279 8.197 1.00 0.00 C ATOM 838 O TYR A 54 11.959 1.304 8.121 1.00 0.00 O ATOM 839 CB TYR A 54 8.909 -0.665 8.715 1.00 0.00 C ATOM 840 CG TYR A 54 7.966 -0.143 7.640 1.00 0.00 C ATOM 841 CD1 TYR A 54 8.359 0.821 6.689 1.00 0.00 C ATOM 842 CD2 TYR A 54 6.650 -0.647 7.608 1.00 0.00 C ATOM 843 CE1 TYR A 54 7.429 1.307 5.753 1.00 0.00 C ATOM 844 CE2 TYR A 54 5.721 -0.180 6.659 1.00 0.00 C ATOM 845 CZ TYR A 54 6.106 0.813 5.733 1.00 0.00 C ATOM 846 OH TYR A 54 5.209 1.296 4.829 1.00 0.00 O ATOM 0 H TYR A 54 8.852 1.864 8.949 1.00 0.00 H new ATOM 0 HA TYR A 54 10.522 -0.306 10.056 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.317 -1.610 8.356 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.305 -0.891 9.593 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.375 1.186 6.679 1.00 0.00 H new ATOM 0 HD2 TYR A 54 6.351 -1.401 8.321 1.00 0.00 H new ATOM 0 HE1 TYR A 54 7.729 2.064 5.044 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.718 -0.580 6.640 1.00 0.00 H new ATOM 0 HH TYR A 54 4.347 0.847 4.952 1.00 0.00 H new ATOM 856 N SER A 55 11.535 -0.760 7.394 1.00 0.00 N ATOM 857 CA SER A 55 12.568 -0.770 6.342 1.00 0.00 C ATOM 858 C SER A 55 12.314 -1.898 5.332 1.00 0.00 C ATOM 859 O SER A 55 11.505 -2.799 5.589 1.00 0.00 O ATOM 860 CB SER A 55 13.970 -0.906 6.963 1.00 0.00 C ATOM 861 OG SER A 55 14.984 -0.664 5.995 1.00 0.00 O ATOM 0 H SER A 55 11.017 -1.637 7.455 1.00 0.00 H new ATOM 0 HA SER A 55 12.516 0.179 5.808 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.075 -0.202 7.789 1.00 0.00 H new ATOM 0 HB3 SER A 55 14.091 -1.906 7.379 1.00 0.00 H new ATOM 0 HG SER A 55 15.865 -0.755 6.414 1.00 0.00 H new ATOM 867 N ARG A 56 13.035 -1.894 4.205 1.00 0.00 N ATOM 868 CA ARG A 56 12.910 -2.904 3.141 1.00 0.00 C ATOM 869 C ARG A 56 13.065 -4.324 3.697 1.00 0.00 C ATOM 870 O ARG A 56 12.219 -5.158 3.415 1.00 0.00 O ATOM 871 CB ARG A 56 13.895 -2.610 1.988 1.00 0.00 C ATOM 872 CG ARG A 56 13.732 -3.625 0.837 1.00 0.00 C ATOM 873 CD ARG A 56 14.697 -3.409 -0.333 1.00 0.00 C ATOM 874 NE ARG A 56 14.368 -2.217 -1.137 1.00 0.00 N ATOM 875 CZ ARG A 56 15.195 -1.647 -2.016 1.00 0.00 C ATOM 876 NH1 ARG A 56 16.386 -2.145 -2.277 1.00 0.00 N ATOM 877 NH2 ARG A 56 14.850 -0.558 -2.665 1.00 0.00 N ATOM 0 H ARG A 56 13.733 -1.179 4.001 1.00 0.00 H new ATOM 0 HA ARG A 56 11.904 -2.843 2.727 1.00 0.00 H new ATOM 0 HB2 ARG A 56 13.727 -1.601 1.612 1.00 0.00 H new ATOM 0 HB3 ARG A 56 14.918 -2.644 2.363 1.00 0.00 H new ATOM 0 HG2 ARG A 56 13.877 -4.631 1.231 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.709 -3.573 0.464 1.00 0.00 H new ATOM 0 HD2 ARG A 56 15.712 -3.312 0.053 1.00 0.00 H new ATOM 0 HD3 ARG A 56 14.683 -4.289 -0.976 1.00 0.00 H new ATOM 0 HE ARG A 56 13.446 -1.800 -1.013 1.00 0.00 H new ATOM 0 HH11 ARG A 56 16.700 -2.991 -1.802 1.00 0.00 H new ATOM 0 HH12 ARG A 56 16.994 -1.685 -2.955 1.00 0.00 H new ATOM 0 HH21 ARG A 56 13.937 -0.134 -2.501 1.00 0.00 H new ATOM 0 HH22 ARG A 56 15.495 -0.136 -3.333 1.00 0.00 H new ATOM 891 N ALA A 57 14.043 -4.594 4.563 1.00 0.00 N ATOM 892 CA ALA A 57 14.236 -5.910 5.198 1.00 0.00 C ATOM 893 C ALA A 57 12.994 -6.429 5.963 1.00 0.00 C ATOM 894 O ALA A 57 12.786 -7.641 6.044 1.00 0.00 O ATOM 895 CB ALA A 57 15.455 -5.806 6.124 1.00 0.00 C ATOM 0 H ALA A 57 14.734 -3.901 4.850 1.00 0.00 H new ATOM 0 HA ALA A 57 14.399 -6.647 4.412 1.00 0.00 H new ATOM 0 HB1 ALA A 57 15.625 -6.766 6.611 1.00 0.00 H new ATOM 0 HB2 ALA A 57 16.334 -5.535 5.539 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.273 -5.043 6.881 1.00 0.00 H new ATOM 901 N GLU A 58 12.155 -5.522 6.480 1.00 0.00 N ATOM 902 CA GLU A 58 10.905 -5.840 7.187 1.00 0.00 C ATOM 903 C GLU A 58 9.697 -5.869 6.237 1.00 0.00 C ATOM 904 O GLU A 58 8.808 -6.706 6.397 1.00 0.00 O ATOM 905 CB GLU A 58 10.634 -4.789 8.280 1.00 0.00 C ATOM 906 CG GLU A 58 11.854 -4.456 9.144 1.00 0.00 C ATOM 907 CD GLU A 58 12.396 -5.677 9.905 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.665 -6.243 10.753 1.00 0.00 O ATOM 909 OE2 GLU A 58 13.565 -6.068 9.678 1.00 0.00 O ATOM 0 H GLU A 58 12.331 -4.519 6.417 1.00 0.00 H new ATOM 0 HA GLU A 58 11.031 -6.830 7.625 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.276 -3.874 7.808 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.833 -5.150 8.925 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.642 -4.049 8.510 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.586 -3.678 9.859 1.00 0.00 H new ATOM 916 N VAL A 59 9.668 -4.950 5.261 1.00 0.00 N ATOM 917 CA VAL A 59 8.583 -4.762 4.275 1.00 0.00 C ATOM 918 C VAL A 59 8.670 -5.800 3.131 1.00 0.00 C ATOM 919 O VAL A 59 7.674 -6.080 2.463 1.00 0.00 O ATOM 920 CB VAL A 59 8.579 -3.287 3.776 1.00 0.00 C ATOM 921 CG1 VAL A 59 7.594 -3.070 2.611 1.00 0.00 C ATOM 922 CG2 VAL A 59 8.231 -2.364 4.961 1.00 0.00 C ATOM 0 H VAL A 59 10.431 -4.286 5.128 1.00 0.00 H new ATOM 0 HA VAL A 59 7.621 -4.944 4.755 1.00 0.00 H new ATOM 0 HB VAL A 59 9.571 -3.048 3.393 1.00 0.00 H new ATOM 0 HG11 VAL A 59 7.626 -2.027 2.297 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.874 -3.710 1.774 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.584 -3.320 2.937 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.225 -1.327 4.625 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.247 -2.626 5.349 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.975 -2.486 5.748 1.00 0.00 H new ATOM 932 N MET A 60 9.831 -6.434 2.932 1.00 0.00 N ATOM 933 CA MET A 60 10.014 -7.548 1.985 1.00 0.00 C ATOM 934 C MET A 60 9.124 -8.743 2.369 1.00 0.00 C ATOM 935 O MET A 60 9.079 -9.139 3.534 1.00 0.00 O ATOM 936 CB MET A 60 11.495 -7.967 1.929 1.00 0.00 C ATOM 937 CG MET A 60 12.355 -7.009 1.091 1.00 0.00 C ATOM 938 SD MET A 60 12.832 -7.554 -0.573 1.00 0.00 S ATOM 939 CE MET A 60 11.230 -7.579 -1.408 1.00 0.00 C ATOM 0 H MET A 60 10.686 -6.186 3.431 1.00 0.00 H new ATOM 0 HA MET A 60 9.714 -7.209 0.993 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.893 -8.013 2.943 1.00 0.00 H new ATOM 0 HB3 MET A 60 11.568 -8.972 1.512 1.00 0.00 H new ATOM 0 HG2 MET A 60 11.814 -6.067 0.995 1.00 0.00 H new ATOM 0 HG3 MET A 60 13.266 -6.798 1.650 1.00 0.00 H new ATOM 0 HE1 MET A 60 11.366 -7.879 -2.447 1.00 0.00 H new ATOM 0 HE2 MET A 60 10.571 -8.289 -0.909 1.00 0.00 H new ATOM 0 HE3 MET A 60 10.786 -6.584 -1.372 1.00 0.00 H new ATOM 949 N GLN A 61 8.397 -9.290 1.381 1.00 0.00 N ATOM 950 CA GLN A 61 7.484 -10.448 1.505 1.00 0.00 C ATOM 951 C GLN A 61 6.144 -10.107 2.195 1.00 0.00 C ATOM 952 O GLN A 61 5.307 -10.984 2.402 1.00 0.00 O ATOM 953 CB GLN A 61 8.238 -11.657 2.120 1.00 0.00 C ATOM 954 CG GLN A 61 7.738 -13.059 1.709 1.00 0.00 C ATOM 955 CD GLN A 61 6.643 -13.652 2.608 1.00 0.00 C ATOM 956 OE1 GLN A 61 6.717 -13.643 3.831 1.00 0.00 O ATOM 957 NE2 GLN A 61 5.605 -14.235 2.038 1.00 0.00 N ATOM 0 H GLN A 61 8.428 -8.924 0.430 1.00 0.00 H new ATOM 0 HA GLN A 61 7.173 -10.744 0.503 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.291 -11.577 1.849 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.181 -11.579 3.206 1.00 0.00 H new ATOM 0 HG2 GLN A 61 7.359 -13.007 0.688 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.587 -13.742 1.700 1.00 0.00 H new ATOM 0 HE21 GLN A 61 5.525 -14.253 1.021 1.00 0.00 H new ATOM 0 HE22 GLN A 61 4.883 -14.667 2.614 1.00 0.00 H new ATOM 966 N ARG A 62 5.898 -8.823 2.492 1.00 0.00 N ATOM 967 CA ARG A 62 4.642 -8.328 3.081 1.00 0.00 C ATOM 968 C ARG A 62 3.593 -8.040 1.999 1.00 0.00 C ATOM 969 O ARG A 62 3.981 -7.682 0.881 1.00 0.00 O ATOM 970 CB ARG A 62 4.870 -7.036 3.892 1.00 0.00 C ATOM 971 CG ARG A 62 5.847 -7.186 5.058 1.00 0.00 C ATOM 972 CD ARG A 62 5.403 -8.148 6.162 1.00 0.00 C ATOM 973 NE ARG A 62 6.535 -8.383 7.073 1.00 0.00 N ATOM 974 CZ ARG A 62 6.596 -9.236 8.086 1.00 0.00 C ATOM 975 NH1 ARG A 62 5.572 -9.990 8.434 1.00 0.00 N ATOM 976 NH2 ARG A 62 7.713 -9.339 8.772 1.00 0.00 N ATOM 0 H ARG A 62 6.580 -8.083 2.327 1.00 0.00 H new ATOM 0 HA ARG A 62 4.280 -9.115 3.743 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.240 -6.261 3.221 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.911 -6.691 4.279 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.806 -7.526 4.666 1.00 0.00 H new ATOM 0 HG3 ARG A 62 6.014 -6.204 5.500 1.00 0.00 H new ATOM 0 HD2 ARG A 62 4.559 -7.729 6.710 1.00 0.00 H new ATOM 0 HD3 ARG A 62 5.066 -9.090 5.729 1.00 0.00 H new ATOM 0 HE ARG A 62 7.371 -7.824 6.905 1.00 0.00 H new ATOM 0 HH11 ARG A 62 4.695 -9.928 7.918 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.657 -10.635 9.220 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.519 -8.766 8.522 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.773 -9.991 9.554 1.00 0.00 H new ATOM 990 N PRO A 63 2.287 -8.120 2.327 1.00 0.00 N ATOM 991 CA PRO A 63 1.215 -7.692 1.438 1.00 0.00 C ATOM 992 C PRO A 63 1.220 -6.164 1.309 1.00 0.00 C ATOM 993 O PRO A 63 1.338 -5.445 2.303 1.00 0.00 O ATOM 994 CB PRO A 63 -0.074 -8.223 2.071 1.00 0.00 C ATOM 995 CG PRO A 63 0.246 -8.291 3.564 1.00 0.00 C ATOM 996 CD PRO A 63 1.746 -8.573 3.607 1.00 0.00 C ATOM 0 HA PRO A 63 1.326 -8.076 0.424 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -0.917 -7.561 1.874 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.339 -9.203 1.675 1.00 0.00 H new ATOM 0 HG2 PRO A 63 0.001 -7.356 4.068 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.323 -9.078 4.059 1.00 0.00 H new ATOM 0 HD2 PRO A 63 2.217 -8.045 4.436 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.937 -9.636 3.755 1.00 0.00 H new ATOM 1004 N CYS A 64 1.086 -5.660 0.079 1.00 0.00 N ATOM 1005 CA CYS A 64 1.190 -4.229 -0.235 1.00 0.00 C ATOM 1006 C CYS A 64 0.056 -3.357 0.336 1.00 0.00 C ATOM 1007 O CYS A 64 0.168 -2.129 0.342 1.00 0.00 O ATOM 1008 CB CYS A 64 1.290 -4.099 -1.758 1.00 0.00 C ATOM 1009 SG CYS A 64 -0.294 -4.547 -2.532 1.00 0.00 S ATOM 0 H CYS A 64 0.900 -6.241 -0.739 1.00 0.00 H new ATOM 0 HA CYS A 64 2.081 -3.840 0.257 1.00 0.00 H new ATOM 0 HB2 CYS A 64 1.558 -3.077 -2.026 1.00 0.00 H new ATOM 0 HB3 CYS A 64 2.083 -4.746 -2.134 1.00 0.00 H new ATOM 0 HG CYS A 64 -0.195 -4.430 -3.823 1.00 0.00 H new ATOM 1015 N THR A 65 -1.013 -3.988 0.840 1.00 0.00 N ATOM 1016 CA THR A 65 -2.119 -3.344 1.562 1.00 0.00 C ATOM 1017 C THR A 65 -1.637 -2.595 2.802 1.00 0.00 C ATOM 1018 O THR A 65 -2.265 -1.606 3.180 1.00 0.00 O ATOM 1019 CB THR A 65 -3.159 -4.385 1.992 1.00 0.00 C ATOM 1020 OG1 THR A 65 -2.504 -5.382 2.750 1.00 0.00 O ATOM 1021 CG2 THR A 65 -3.841 -5.057 0.800 1.00 0.00 C ATOM 0 H THR A 65 -1.136 -4.997 0.753 1.00 0.00 H new ATOM 0 HA THR A 65 -2.565 -2.626 0.874 1.00 0.00 H new ATOM 0 HB THR A 65 -3.927 -3.871 2.570 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.155 -6.056 3.035 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.568 -5.785 1.160 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.349 -4.303 0.199 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.092 -5.563 0.190 1.00 0.00 H new ATOM 1029 N CYS A 66 -0.551 -3.071 3.433 1.00 0.00 N ATOM 1030 CA CYS A 66 -0.023 -2.560 4.703 1.00 0.00 C ATOM 1031 C CYS A 66 -1.103 -2.483 5.808 1.00 0.00 C ATOM 1032 O CYS A 66 -1.082 -1.595 6.660 1.00 0.00 O ATOM 1033 CB CYS A 66 0.746 -1.250 4.452 1.00 0.00 C ATOM 1034 SG CYS A 66 2.263 -1.605 3.513 1.00 0.00 S ATOM 0 H CYS A 66 -0.002 -3.845 3.060 1.00 0.00 H new ATOM 0 HA CYS A 66 0.697 -3.272 5.108 1.00 0.00 H new ATOM 0 HB2 CYS A 66 0.120 -0.549 3.900 1.00 0.00 H new ATOM 0 HB3 CYS A 66 0.996 -0.775 5.401 1.00 0.00 H new ATOM 0 HG CYS A 66 2.608 -0.553 2.832 1.00 0.00 H new ATOM 1040 N ASP A 67 -2.040 -3.442 5.815 1.00 0.00 N ATOM 1041 CA ASP A 67 -3.146 -3.516 6.780 1.00 0.00 C ATOM 1042 C ASP A 67 -2.649 -3.593 8.234 1.00 0.00 C ATOM 1043 O ASP A 67 -3.292 -3.067 9.143 1.00 0.00 O ATOM 1044 CB ASP A 67 -4.012 -4.737 6.440 1.00 0.00 C ATOM 1045 CG ASP A 67 -5.201 -4.887 7.406 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -6.228 -4.198 7.203 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -5.106 -5.700 8.356 1.00 0.00 O ATOM 0 H ASP A 67 -2.050 -4.203 5.136 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.734 -2.602 6.703 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -4.383 -4.645 5.419 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -3.399 -5.638 6.477 1.00 0.00 H new ATOM 1052 N PHE A 68 -1.465 -4.177 8.445 1.00 0.00 N ATOM 1053 CA PHE A 68 -0.786 -4.271 9.736 1.00 0.00 C ATOM 1054 C PHE A 68 -0.441 -2.905 10.375 1.00 0.00 C ATOM 1055 O PHE A 68 -0.081 -2.863 11.554 1.00 0.00 O ATOM 1056 CB PHE A 68 0.449 -5.175 9.576 1.00 0.00 C ATOM 1057 CG PHE A 68 1.446 -4.753 8.509 1.00 0.00 C ATOM 1058 CD1 PHE A 68 2.456 -3.819 8.812 1.00 0.00 C ATOM 1059 CD2 PHE A 68 1.383 -5.311 7.216 1.00 0.00 C ATOM 1060 CE1 PHE A 68 3.388 -3.439 7.829 1.00 0.00 C ATOM 1061 CE2 PHE A 68 2.316 -4.933 6.234 1.00 0.00 C ATOM 1062 CZ PHE A 68 3.319 -3.996 6.539 1.00 0.00 C ATOM 0 H PHE A 68 -0.935 -4.613 7.690 1.00 0.00 H new ATOM 0 HA PHE A 68 -1.481 -4.717 10.447 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.968 -5.221 10.533 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.109 -6.185 9.349 1.00 0.00 H new ATOM 0 HD1 PHE A 68 2.515 -3.393 9.803 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.615 -6.032 6.978 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.157 -2.719 8.065 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.262 -5.363 5.245 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.035 -3.705 5.785 1.00 0.00 H new ATOM 1072 N LEU A 69 -0.582 -1.790 9.640 1.00 0.00 N ATOM 1073 CA LEU A 69 -0.430 -0.420 10.151 1.00 0.00 C ATOM 1074 C LEU A 69 -1.708 0.152 10.800 1.00 0.00 C ATOM 1075 O LEU A 69 -1.703 1.312 11.212 1.00 0.00 O ATOM 1076 CB LEU A 69 0.071 0.504 9.021 1.00 0.00 C ATOM 1077 CG LEU A 69 1.385 0.064 8.344 1.00 0.00 C ATOM 1078 CD1 LEU A 69 1.807 1.137 7.329 1.00 0.00 C ATOM 1079 CD2 LEU A 69 2.508 -0.177 9.363 1.00 0.00 C ATOM 0 H LEU A 69 -0.811 -1.819 8.647 1.00 0.00 H new ATOM 0 HA LEU A 69 0.308 -0.466 10.952 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.706 0.573 8.259 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.209 1.506 9.427 1.00 0.00 H new ATOM 0 HG LEU A 69 1.208 -0.885 7.837 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.736 0.835 6.845 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.027 1.253 6.577 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.958 2.086 7.844 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.414 -0.485 8.840 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.702 0.743 9.915 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.206 -0.960 10.058 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.803 -0.610 10.890 1.00 0.00 N ATOM 1092 CA HIS A 70 -4.035 -0.149 11.531 1.00 0.00 C ATOM 1093 C HIS A 70 -3.921 0.090 13.057 1.00 0.00 C ATOM 1094 O HIS A 70 -3.130 -0.542 13.768 1.00 0.00 O ATOM 1095 CB HIS A 70 -5.201 -1.102 11.201 1.00 0.00 C ATOM 1096 CG HIS A 70 -5.204 -2.421 11.939 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -4.808 -3.639 11.438 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -5.687 -2.651 13.202 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -5.029 -4.576 12.375 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -5.567 -4.021 13.479 1.00 0.00 N ATOM 0 H HIS A 70 -2.859 -1.560 10.522 1.00 0.00 H new ATOM 0 HA HIS A 70 -4.236 0.836 11.110 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -6.138 -0.587 11.414 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -5.186 -1.307 10.130 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -4.413 -3.803 10.512 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -6.091 -1.904 13.870 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -4.807 -5.627 12.260 1.00 0.00 H new ATOM 1108 N GLY A 71 -4.790 0.974 13.561 1.00 0.00 N ATOM 1109 CA GLY A 71 -5.089 1.221 14.976 1.00 0.00 C ATOM 1110 C GLY A 71 -6.528 1.737 15.160 1.00 0.00 C ATOM 1111 O GLY A 71 -7.331 1.609 14.230 1.00 0.00 O ATOM 0 H GLY A 71 -5.340 1.577 12.949 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.954 0.301 15.545 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -4.385 1.950 15.377 1.00 0.00 H new ATOM 1115 N PRO A 72 -6.888 2.323 16.320 1.00 0.00 N ATOM 1116 CA PRO A 72 -8.268 2.713 16.623 1.00 0.00 C ATOM 1117 C PRO A 72 -8.843 3.821 15.719 1.00 0.00 C ATOM 1118 O PRO A 72 -10.064 3.886 15.570 1.00 0.00 O ATOM 1119 CB PRO A 72 -8.269 3.114 18.105 1.00 0.00 C ATOM 1120 CG PRO A 72 -6.813 3.473 18.396 1.00 0.00 C ATOM 1121 CD PRO A 72 -6.037 2.525 17.484 1.00 0.00 C ATOM 0 HA PRO A 72 -8.935 1.875 16.421 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -8.932 3.959 18.289 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -8.612 2.296 18.739 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -6.601 4.517 18.167 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -6.561 3.320 19.445 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -5.076 2.954 17.198 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -5.828 1.580 17.986 1.00 0.00 H new ATOM 1129 N ARG A 73 -8.005 4.659 15.084 1.00 0.00 N ATOM 1130 CA ARG A 73 -8.443 5.682 14.115 1.00 0.00 C ATOM 1131 C ARG A 73 -8.493 5.175 12.662 1.00 0.00 C ATOM 1132 O ARG A 73 -8.910 5.926 11.775 1.00 0.00 O ATOM 1133 CB ARG A 73 -7.545 6.934 14.223 1.00 0.00 C ATOM 1134 CG ARG A 73 -7.625 7.652 15.583 1.00 0.00 C ATOM 1135 CD ARG A 73 -9.005 8.271 15.843 1.00 0.00 C ATOM 1136 NE ARG A 73 -9.035 8.995 17.126 1.00 0.00 N ATOM 1137 CZ ARG A 73 -10.055 9.699 17.609 1.00 0.00 C ATOM 1138 NH1 ARG A 73 -11.190 9.829 16.953 1.00 0.00 N ATOM 1139 NH2 ARG A 73 -9.944 10.291 18.779 1.00 0.00 N ATOM 0 H ARG A 73 -6.996 4.646 15.229 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.469 5.939 14.378 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -6.511 6.643 14.039 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.823 7.636 13.437 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.393 6.943 16.378 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -6.867 8.434 15.622 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -9.258 8.954 15.032 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.762 7.487 15.848 1.00 0.00 H new ATOM 0 HE ARG A 73 -8.192 8.952 17.699 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -11.308 9.382 16.044 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -11.951 10.377 17.354 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -9.078 10.209 19.312 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -10.724 10.832 19.153 1.00 0.00 H new ATOM 1153 N THR A 74 -8.071 3.933 12.380 1.00 0.00 N ATOM 1154 CA THR A 74 -8.084 3.355 11.022 1.00 0.00 C ATOM 1155 C THR A 74 -9.521 3.025 10.621 1.00 0.00 C ATOM 1156 O THR A 74 -10.282 2.473 11.415 1.00 0.00 O ATOM 1157 CB THR A 74 -7.152 2.144 10.929 1.00 0.00 C ATOM 1158 OG1 THR A 74 -5.892 2.555 11.399 1.00 0.00 O ATOM 1159 CG2 THR A 74 -6.979 1.653 9.495 1.00 0.00 C ATOM 0 H THR A 74 -7.709 3.296 13.089 1.00 0.00 H new ATOM 0 HA THR A 74 -7.700 4.087 10.312 1.00 0.00 H new ATOM 0 HB THR A 74 -7.581 1.329 11.512 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.444 3.088 10.710 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.309 0.793 9.483 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.949 1.363 9.090 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.555 2.451 8.886 1.00 0.00 H new ATOM 1167 N GLN A 75 -9.904 3.397 9.396 1.00 0.00 N ATOM 1168 CA GLN A 75 -11.278 3.270 8.901 1.00 0.00 C ATOM 1169 C GLN A 75 -11.426 1.904 8.213 1.00 0.00 C ATOM 1170 O GLN A 75 -10.775 1.658 7.196 1.00 0.00 O ATOM 1171 CB GLN A 75 -11.614 4.417 7.924 1.00 0.00 C ATOM 1172 CG GLN A 75 -11.289 5.837 8.420 1.00 0.00 C ATOM 1173 CD GLN A 75 -12.110 6.301 9.623 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -13.334 6.361 9.597 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -11.471 6.664 10.716 1.00 0.00 N ATOM 0 H GLN A 75 -9.262 3.799 8.713 1.00 0.00 H new ATOM 0 HA GLN A 75 -11.977 3.337 9.734 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.074 4.245 6.993 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.677 4.369 7.689 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -10.232 5.882 8.681 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.445 6.538 7.600 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.453 6.619 10.750 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -11.995 6.990 11.528 1.00 0.00 H new ATOM 1184 N ARG A 76 -12.295 1.019 8.720 1.00 0.00 N ATOM 1185 CA ARG A 76 -12.465 -0.345 8.180 1.00 0.00 C ATOM 1186 C ARG A 76 -12.894 -0.331 6.705 1.00 0.00 C ATOM 1187 O ARG A 76 -12.397 -1.123 5.905 1.00 0.00 O ATOM 1188 CB ARG A 76 -13.439 -1.123 9.091 1.00 0.00 C ATOM 1189 CG ARG A 76 -13.450 -2.652 8.883 1.00 0.00 C ATOM 1190 CD ARG A 76 -14.394 -3.186 7.791 1.00 0.00 C ATOM 1191 NE ARG A 76 -15.810 -2.852 8.057 1.00 0.00 N ATOM 1192 CZ ARG A 76 -16.636 -3.471 8.897 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -16.259 -4.499 9.630 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -17.878 -3.053 9.015 1.00 0.00 N ATOM 0 H ARG A 76 -12.901 1.224 9.515 1.00 0.00 H new ATOM 0 HA ARG A 76 -11.506 -0.862 8.185 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -13.184 -0.915 10.130 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.447 -0.742 8.928 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -12.436 -2.972 8.644 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -13.719 -3.124 9.828 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -14.101 -2.771 6.827 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -14.286 -4.268 7.719 1.00 0.00 H new ATOM 0 HE ARG A 76 -16.195 -2.061 7.541 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -15.303 -4.848 9.565 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -16.923 -4.946 10.262 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -18.203 -2.258 8.464 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -18.516 -3.524 9.657 1.00 0.00 H new ATOM 1208 N ARG A 77 -13.744 0.628 6.313 1.00 0.00 N ATOM 1209 CA ARG A 77 -14.144 0.859 4.912 1.00 0.00 C ATOM 1210 C ARG A 77 -12.947 1.218 4.022 1.00 0.00 C ATOM 1211 O ARG A 77 -12.827 0.710 2.915 1.00 0.00 O ATOM 1212 CB ARG A 77 -15.232 1.952 4.875 1.00 0.00 C ATOM 1213 CG ARG A 77 -15.936 2.124 3.514 1.00 0.00 C ATOM 1214 CD ARG A 77 -16.727 0.882 3.077 1.00 0.00 C ATOM 1215 NE ARG A 77 -17.498 1.147 1.850 1.00 0.00 N ATOM 1216 CZ ARG A 77 -18.337 0.309 1.249 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -18.560 -0.907 1.706 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -18.975 0.690 0.163 1.00 0.00 N ATOM 0 H ARG A 77 -14.181 1.276 6.968 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.552 -0.066 4.505 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -15.984 1.721 5.630 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -14.780 2.903 5.156 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -16.613 2.977 3.568 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -15.190 2.357 2.754 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -16.041 0.052 2.907 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -17.403 0.578 3.876 1.00 0.00 H new ATOM 0 HE ARG A 77 -17.376 2.064 1.419 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -18.082 -1.232 2.547 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -19.211 -1.523 1.219 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -18.825 1.625 -0.215 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -19.619 0.050 -0.301 1.00 0.00 H new ATOM 1232 N ALA A 78 -12.009 2.033 4.503 1.00 0.00 N ATOM 1233 CA ALA A 78 -10.797 2.386 3.753 1.00 0.00 C ATOM 1234 C ALA A 78 -9.802 1.218 3.649 1.00 0.00 C ATOM 1235 O ALA A 78 -9.288 0.944 2.567 1.00 0.00 O ATOM 1236 CB ALA A 78 -10.182 3.619 4.410 1.00 0.00 C ATOM 0 H ALA A 78 -12.065 2.469 5.423 1.00 0.00 H new ATOM 0 HA ALA A 78 -11.062 2.613 2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.278 3.905 3.873 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -10.897 4.441 4.381 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -9.932 3.392 5.446 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.603 0.460 4.732 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.810 -0.778 4.702 1.00 0.00 C ATOM 1244 C ALA A 79 -9.347 -1.780 3.654 1.00 0.00 C ATOM 1245 O ALA A 79 -8.570 -2.443 2.965 1.00 0.00 O ATOM 1246 CB ALA A 79 -8.796 -1.371 6.116 1.00 0.00 C ATOM 0 H ALA A 79 -9.984 0.684 5.651 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.789 -0.554 4.394 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.213 -2.292 6.119 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -8.348 -0.656 6.806 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -9.817 -1.588 6.430 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.673 -1.815 3.473 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.353 -2.579 2.427 1.00 0.00 C ATOM 1254 C ALA A 80 -11.137 -1.986 1.031 1.00 0.00 C ATOM 1255 O ALA A 80 -10.789 -2.723 0.113 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.847 -2.618 2.757 1.00 0.00 C ATOM 0 H ALA A 80 -11.318 -1.297 4.069 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.932 -3.584 2.405 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.375 -3.184 1.989 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -12.993 -3.097 3.725 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.239 -1.601 2.792 1.00 0.00 H new ATOM 1262 N GLN A 81 -11.311 -0.670 0.856 1.00 0.00 N ATOM 1263 CA GLN A 81 -11.095 -0.012 -0.437 1.00 0.00 C ATOM 1264 C GLN A 81 -9.664 -0.241 -0.951 1.00 0.00 C ATOM 1265 O GLN A 81 -9.498 -0.467 -2.144 1.00 0.00 O ATOM 1266 CB GLN A 81 -11.397 1.495 -0.371 1.00 0.00 C ATOM 1267 CG GLN A 81 -12.874 1.894 -0.229 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.108 3.338 -0.683 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -13.126 3.645 -1.868 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -13.270 4.284 0.221 1.00 0.00 N ATOM 0 H GLN A 81 -11.603 -0.037 1.600 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.794 -0.467 -1.139 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -10.848 1.916 0.471 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -11.003 1.961 -1.274 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -13.493 1.220 -0.821 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -13.184 1.783 0.810 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -13.258 4.049 1.213 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -13.407 5.251 -0.072 1.00 0.00 H new ATOM 1279 N ILE A 82 -8.634 -0.258 -0.090 1.00 0.00 N ATOM 1280 CA ILE A 82 -7.260 -0.607 -0.518 1.00 0.00 C ATOM 1281 C ILE A 82 -7.169 -2.044 -1.049 1.00 0.00 C ATOM 1282 O ILE A 82 -6.499 -2.269 -2.053 1.00 0.00 O ATOM 1283 CB ILE A 82 -6.253 -0.328 0.622 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -6.160 1.199 0.814 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -4.853 -0.899 0.323 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -5.469 1.628 2.102 1.00 0.00 C ATOM 0 H ILE A 82 -8.720 -0.036 0.902 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.992 0.035 -1.357 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.609 -0.821 1.527 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.624 1.628 -0.032 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.166 1.617 0.799 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.184 -0.676 1.154 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.921 -1.979 0.192 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.463 -0.446 -0.588 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.446 2.716 2.158 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -6.016 1.232 2.958 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.449 1.243 2.114 1.00 0.00 H new ATOM 1298 N ALA A 83 -7.868 -3.010 -0.446 1.00 0.00 N ATOM 1299 CA ALA A 83 -7.928 -4.380 -0.962 1.00 0.00 C ATOM 1300 C ALA A 83 -8.734 -4.473 -2.276 1.00 0.00 C ATOM 1301 O ALA A 83 -8.333 -5.189 -3.193 1.00 0.00 O ATOM 1302 CB ALA A 83 -8.494 -5.291 0.136 1.00 0.00 C ATOM 0 H ALA A 83 -8.405 -2.865 0.409 1.00 0.00 H new ATOM 0 HA ALA A 83 -6.922 -4.713 -1.218 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.545 -6.316 -0.232 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -7.846 -5.252 1.011 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -9.494 -4.953 0.410 1.00 0.00 H new ATOM 1308 N GLN A 84 -9.830 -3.714 -2.405 1.00 0.00 N ATOM 1309 CA GLN A 84 -10.612 -3.620 -3.647 1.00 0.00 C ATOM 1310 C GLN A 84 -9.820 -2.933 -4.774 1.00 0.00 C ATOM 1311 O GLN A 84 -9.973 -3.303 -5.937 1.00 0.00 O ATOM 1312 CB GLN A 84 -11.933 -2.865 -3.402 1.00 0.00 C ATOM 1313 CG GLN A 84 -12.919 -3.565 -2.447 1.00 0.00 C ATOM 1314 CD GLN A 84 -13.401 -4.925 -2.959 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -14.041 -5.040 -3.997 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -13.106 -6.009 -2.267 1.00 0.00 N ATOM 0 H GLN A 84 -10.202 -3.144 -1.646 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.833 -4.639 -3.964 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -11.701 -1.879 -3.000 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -12.428 -2.710 -4.361 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.440 -3.699 -1.477 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.782 -2.918 -2.290 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -12.574 -5.932 -1.400 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.410 -6.924 -2.599 1.00 0.00 H new ATOM 1325 N ALA A 85 -8.929 -1.985 -4.456 1.00 0.00 N ATOM 1326 CA ALA A 85 -8.075 -1.304 -5.431 1.00 0.00 C ATOM 1327 C ALA A 85 -7.108 -2.270 -6.156 1.00 0.00 C ATOM 1328 O ALA A 85 -6.694 -1.989 -7.281 1.00 0.00 O ATOM 1329 CB ALA A 85 -7.336 -0.168 -4.714 1.00 0.00 C ATOM 0 H ALA A 85 -8.781 -1.666 -3.498 1.00 0.00 H new ATOM 0 HA ALA A 85 -8.699 -0.889 -6.223 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -6.693 0.353 -5.424 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -8.061 0.532 -4.299 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -6.728 -0.581 -3.909 1.00 0.00 H new ATOM 1335 N LEU A 86 -6.791 -3.423 -5.545 1.00 0.00 N ATOM 1336 CA LEU A 86 -6.004 -4.514 -6.144 1.00 0.00 C ATOM 1337 C LEU A 86 -6.844 -5.455 -7.030 1.00 0.00 C ATOM 1338 O LEU A 86 -6.286 -6.233 -7.804 1.00 0.00 O ATOM 1339 CB LEU A 86 -5.328 -5.333 -5.028 1.00 0.00 C ATOM 1340 CG LEU A 86 -4.554 -4.522 -3.972 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -4.008 -5.467 -2.898 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -3.411 -3.691 -4.567 1.00 0.00 C ATOM 0 H LEU A 86 -7.085 -3.628 -4.590 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.260 -4.048 -6.790 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.094 -5.918 -4.519 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.640 -6.041 -5.490 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.259 -3.815 -3.534 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.460 -4.892 -2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.836 -5.989 -2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.339 -6.193 -3.359 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.906 -3.144 -3.771 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.699 -4.352 -5.061 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.814 -2.985 -5.293 1.00 0.00 H new ATOM 1354 N LEU A 87 -8.178 -5.404 -6.933 1.00 0.00 N ATOM 1355 CA LEU A 87 -9.100 -6.137 -7.813 1.00 0.00 C ATOM 1356 C LEU A 87 -9.489 -5.313 -9.057 1.00 0.00 C ATOM 1357 O LEU A 87 -9.981 -5.877 -10.038 1.00 0.00 O ATOM 1358 CB LEU A 87 -10.349 -6.564 -7.014 1.00 0.00 C ATOM 1359 CG LEU A 87 -10.069 -7.409 -5.751 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -11.399 -7.763 -5.074 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -9.292 -8.698 -6.060 1.00 0.00 C ATOM 0 H LEU A 87 -8.657 -4.843 -6.229 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.588 -7.028 -8.178 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.894 -5.668 -6.718 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.005 -7.133 -7.673 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.446 -6.809 -5.088 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.206 -8.359 -4.182 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.919 -6.847 -4.793 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -12.018 -8.334 -5.765 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.124 -9.252 -5.136 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.868 -9.313 -6.752 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.333 -8.445 -6.511 1.00 0.00 H new ATOM 1373 N GLY A 88 -9.250 -3.995 -9.032 1.00 0.00 N ATOM 1374 CA GLY A 88 -9.489 -3.069 -10.147 1.00 0.00 C ATOM 1375 C GLY A 88 -8.316 -3.011 -11.131 1.00 0.00 C ATOM 1376 O GLY A 88 -7.155 -3.144 -10.741 1.00 0.00 O ATOM 0 H GLY A 88 -8.872 -3.529 -8.207 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.390 -3.374 -10.680 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.675 -2.071 -9.751 1.00 0.00 H new ATOM 1380 N ALA A 89 -8.621 -2.775 -12.412 1.00 0.00 N ATOM 1381 CA ALA A 89 -7.638 -2.692 -13.504 1.00 0.00 C ATOM 1382 C ALA A 89 -7.203 -1.249 -13.861 1.00 0.00 C ATOM 1383 O ALA A 89 -6.445 -1.053 -14.812 1.00 0.00 O ATOM 1384 CB ALA A 89 -8.218 -3.443 -14.711 1.00 0.00 C ATOM 0 H ALA A 89 -9.580 -2.633 -12.728 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.711 -3.160 -13.171 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.512 -3.400 -15.540 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.397 -4.484 -14.440 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -9.158 -2.979 -15.011 1.00 0.00 H new ATOM 1390 N GLU A 90 -7.676 -0.252 -13.108 1.00 0.00 N ATOM 1391 CA GLU A 90 -7.343 1.175 -13.241 1.00 0.00 C ATOM 1392 C GLU A 90 -6.900 1.751 -11.880 1.00 0.00 C ATOM 1393 O GLU A 90 -7.176 1.157 -10.833 1.00 0.00 O ATOM 1394 CB GLU A 90 -8.563 1.940 -13.803 1.00 0.00 C ATOM 1395 CG GLU A 90 -8.256 2.706 -15.095 1.00 0.00 C ATOM 1396 CD GLU A 90 -7.381 3.943 -14.845 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -6.162 3.784 -14.599 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -7.909 5.080 -14.889 1.00 0.00 O ATOM 0 H GLU A 90 -8.336 -0.424 -12.349 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.511 1.291 -13.936 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -9.371 1.233 -13.991 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -8.922 2.641 -13.050 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -7.751 2.042 -15.797 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.191 3.014 -15.563 1.00 0.00 H new ATOM 1405 N GLU A 91 -6.202 2.893 -11.877 1.00 0.00 N ATOM 1406 CA GLU A 91 -5.700 3.512 -10.642 1.00 0.00 C ATOM 1407 C GLU A 91 -6.827 3.978 -9.699 1.00 0.00 C ATOM 1408 O GLU A 91 -7.898 4.413 -10.138 1.00 0.00 O ATOM 1409 CB GLU A 91 -4.662 4.618 -10.917 1.00 0.00 C ATOM 1410 CG GLU A 91 -5.193 5.850 -11.648 1.00 0.00 C ATOM 1411 CD GLU A 91 -4.099 6.919 -11.787 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -3.303 6.861 -12.755 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -4.036 7.838 -10.935 1.00 0.00 O ATOM 0 H GLU A 91 -5.970 3.412 -12.724 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.174 2.723 -10.105 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.236 4.937 -9.966 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.849 4.191 -11.504 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.555 5.564 -12.636 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -6.043 6.262 -11.104 1.00 0.00 H new ATOM 1420 N ARG A 92 -6.570 3.878 -8.386 1.00 0.00 N ATOM 1421 CA ARG A 92 -7.549 4.105 -7.313 1.00 0.00 C ATOM 1422 C ARG A 92 -6.871 4.675 -6.066 1.00 0.00 C ATOM 1423 O ARG A 92 -5.880 4.127 -5.577 1.00 0.00 O ATOM 1424 CB ARG A 92 -8.283 2.778 -7.022 1.00 0.00 C ATOM 1425 CG ARG A 92 -9.359 2.820 -5.919 1.00 0.00 C ATOM 1426 CD ARG A 92 -10.492 3.822 -6.183 1.00 0.00 C ATOM 1427 NE ARG A 92 -11.614 3.609 -5.247 1.00 0.00 N ATOM 1428 CZ ARG A 92 -12.745 2.951 -5.486 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -12.998 2.378 -6.646 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -13.652 2.858 -4.541 1.00 0.00 N ATOM 0 H ARG A 92 -5.647 3.629 -8.031 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.282 4.847 -7.630 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.752 2.437 -7.945 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.540 2.029 -6.747 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -9.788 1.824 -5.808 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.882 3.069 -4.971 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -10.115 4.839 -6.079 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -10.844 3.716 -7.209 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.510 4.010 -4.315 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -12.314 2.430 -7.401 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.878 1.883 -6.789 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.487 3.289 -3.631 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.522 2.355 -4.717 1.00 0.00 H new ATOM 1444 N LYS A 93 -7.431 5.767 -5.545 1.00 0.00 N ATOM 1445 CA LYS A 93 -6.974 6.467 -4.336 1.00 0.00 C ATOM 1446 C LYS A 93 -7.900 6.176 -3.137 1.00 0.00 C ATOM 1447 O LYS A 93 -9.120 6.152 -3.296 1.00 0.00 O ATOM 1448 CB LYS A 93 -6.892 7.978 -4.627 1.00 0.00 C ATOM 1449 CG LYS A 93 -6.089 8.298 -5.904 1.00 0.00 C ATOM 1450 CD LYS A 93 -5.610 9.755 -5.964 1.00 0.00 C ATOM 1451 CE LYS A 93 -6.781 10.745 -5.886 1.00 0.00 C ATOM 1452 NZ LYS A 93 -6.330 12.153 -6.072 1.00 0.00 N ATOM 0 H LYS A 93 -8.248 6.208 -5.967 1.00 0.00 H new ATOM 0 HA LYS A 93 -5.983 6.102 -4.066 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.900 8.379 -4.727 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.431 8.482 -3.778 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -5.225 7.635 -5.959 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.707 8.089 -6.777 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.919 9.944 -5.143 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -5.058 9.918 -6.889 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.519 10.496 -6.649 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.276 10.647 -4.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -7.149 12.791 -6.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.645 12.399 -5.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.880 12.253 -7.004 1.00 0.00 H new ATOM 1466 N VAL A 94 -7.330 5.956 -1.948 1.00 0.00 N ATOM 1467 CA VAL A 94 -8.061 5.676 -0.690 1.00 0.00 C ATOM 1468 C VAL A 94 -7.394 6.428 0.459 1.00 0.00 C ATOM 1469 O VAL A 94 -6.171 6.396 0.575 1.00 0.00 O ATOM 1470 CB VAL A 94 -8.095 4.162 -0.358 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -8.936 3.914 0.894 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -8.619 3.345 -1.535 1.00 0.00 C ATOM 0 H VAL A 94 -6.318 5.966 -1.822 1.00 0.00 H new ATOM 0 HA VAL A 94 -9.090 6.010 -0.823 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.074 3.835 -0.163 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.952 2.847 1.116 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.503 4.454 1.736 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.954 4.264 0.724 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.630 2.288 -1.268 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.631 3.668 -1.780 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.971 3.495 -2.399 1.00 0.00 H new ATOM 1482 N GLU A 95 -8.186 7.084 1.310 1.00 0.00 N ATOM 1483 CA GLU A 95 -7.696 7.824 2.474 1.00 0.00 C ATOM 1484 C GLU A 95 -7.894 7.014 3.769 1.00 0.00 C ATOM 1485 O GLU A 95 -8.996 6.537 4.037 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.416 9.182 2.524 1.00 0.00 C ATOM 1487 CG GLU A 95 -7.888 10.112 3.618 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.651 11.447 3.609 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.470 12.252 2.665 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.448 11.698 4.545 1.00 0.00 O ATOM 0 H GLU A 95 -9.200 7.116 1.208 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.623 7.995 2.384 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.312 9.675 1.558 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.481 9.014 2.684 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.993 9.633 4.592 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.824 10.294 3.466 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.839 6.848 4.577 1.00 0.00 N ATOM 1498 CA ILE A 96 -6.781 5.899 5.709 1.00 0.00 C ATOM 1499 C ILE A 96 -5.784 6.359 6.786 1.00 0.00 C ATOM 1500 O ILE A 96 -4.772 6.969 6.460 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.438 4.483 5.164 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -6.544 3.413 6.270 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -5.062 4.438 4.470 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -6.504 1.970 5.752 1.00 0.00 C ATOM 0 H ILE A 96 -5.977 7.381 4.463 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.755 5.863 6.197 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.183 4.252 4.402 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.728 3.556 6.978 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.473 3.565 6.819 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -4.870 3.428 4.108 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.055 5.132 3.630 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.286 4.722 5.181 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.584 1.280 6.592 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.336 1.806 5.067 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.564 1.797 5.228 1.00 0.00 H new ATOM 1516 N ALA A 97 -6.030 6.081 8.071 1.00 0.00 N ATOM 1517 CA ALA A 97 -5.057 6.374 9.132 1.00 0.00 C ATOM 1518 C ALA A 97 -4.027 5.239 9.281 1.00 0.00 C ATOM 1519 O ALA A 97 -4.403 4.090 9.519 1.00 0.00 O ATOM 1520 CB ALA A 97 -5.786 6.676 10.450 1.00 0.00 C ATOM 0 H ALA A 97 -6.895 5.653 8.403 1.00 0.00 H new ATOM 0 HA ALA A 97 -4.494 7.264 8.852 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.055 6.892 11.229 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.438 7.539 10.316 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.383 5.812 10.742 1.00 0.00 H new ATOM 1526 N PHE A 98 -2.739 5.574 9.169 1.00 0.00 N ATOM 1527 CA PHE A 98 -1.597 4.689 9.422 1.00 0.00 C ATOM 1528 C PHE A 98 -0.919 5.045 10.753 1.00 0.00 C ATOM 1529 O PHE A 98 -0.816 6.218 11.121 1.00 0.00 O ATOM 1530 CB PHE A 98 -0.573 4.823 8.278 1.00 0.00 C ATOM 1531 CG PHE A 98 -0.841 4.102 6.963 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -1.988 3.306 6.749 1.00 0.00 C ATOM 1533 CD2 PHE A 98 0.131 4.192 5.946 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.146 2.603 5.540 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -0.030 3.491 4.737 1.00 0.00 C ATOM 1536 CZ PHE A 98 -1.166 2.692 4.536 1.00 0.00 C ATOM 0 H PHE A 98 -2.450 6.511 8.887 1.00 0.00 H new ATOM 0 HA PHE A 98 -1.961 3.663 9.475 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -0.464 5.885 8.056 1.00 0.00 H new ATOM 0 HB3 PHE A 98 0.389 4.476 8.654 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.746 3.237 7.515 1.00 0.00 H new ATOM 0 HD2 PHE A 98 1.007 4.805 6.096 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -3.023 1.993 5.383 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.720 3.568 3.964 1.00 0.00 H new ATOM 0 HZ PHE A 98 -1.287 2.147 3.612 1.00 0.00 H new ATOM 1546 N TYR A 99 -0.413 4.023 11.449 1.00 0.00 N ATOM 1547 CA TYR A 99 0.353 4.144 12.695 1.00 0.00 C ATOM 1548 C TYR A 99 1.835 3.771 12.492 1.00 0.00 C ATOM 1549 O TYR A 99 2.155 2.716 11.938 1.00 0.00 O ATOM 1550 CB TYR A 99 -0.283 3.261 13.781 1.00 0.00 C ATOM 1551 CG TYR A 99 -1.589 3.798 14.346 1.00 0.00 C ATOM 1552 CD1 TYR A 99 -2.766 3.799 13.568 1.00 0.00 C ATOM 1553 CD2 TYR A 99 -1.619 4.316 15.656 1.00 0.00 C ATOM 1554 CE1 TYR A 99 -3.958 4.340 14.083 1.00 0.00 C ATOM 1555 CE2 TYR A 99 -2.810 4.847 16.182 1.00 0.00 C ATOM 1556 CZ TYR A 99 -3.982 4.865 15.395 1.00 0.00 C ATOM 1557 OH TYR A 99 -5.138 5.367 15.906 1.00 0.00 O ATOM 0 H TYR A 99 -0.529 3.054 11.151 1.00 0.00 H new ATOM 0 HA TYR A 99 0.323 5.186 13.013 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -0.462 2.269 13.366 1.00 0.00 H new ATOM 0 HB3 TYR A 99 0.429 3.141 14.597 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.752 3.382 12.572 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -0.723 4.305 16.259 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -4.852 4.354 13.478 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.828 5.241 17.187 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.981 5.686 16.819 1.00 0.00 H new ATOM 1567 N ARG A 100 2.737 4.632 12.978 1.00 0.00 N ATOM 1568 CA ARG A 100 4.192 4.434 13.001 1.00 0.00 C ATOM 1569 C ARG A 100 4.625 3.368 14.018 1.00 0.00 C ATOM 1570 O ARG A 100 3.901 3.043 14.960 1.00 0.00 O ATOM 1571 CB ARG A 100 4.896 5.767 13.331 1.00 0.00 C ATOM 1572 CG ARG A 100 4.892 6.739 12.149 1.00 0.00 C ATOM 1573 CD ARG A 100 5.651 8.031 12.489 1.00 0.00 C ATOM 1574 NE ARG A 100 6.264 8.624 11.290 1.00 0.00 N ATOM 1575 CZ ARG A 100 6.972 9.746 11.234 1.00 0.00 C ATOM 1576 NH1 ARG A 100 7.037 10.585 12.249 1.00 0.00 N ATOM 1577 NH2 ARG A 100 7.646 10.040 10.143 1.00 0.00 N ATOM 0 H ARG A 100 2.461 5.526 13.384 1.00 0.00 H new ATOM 0 HA ARG A 100 4.483 4.084 12.011 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.402 6.234 14.183 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.925 5.567 13.629 1.00 0.00 H new ATOM 0 HG2 ARG A 100 5.350 6.263 11.282 1.00 0.00 H new ATOM 0 HG3 ARG A 100 3.864 6.979 11.876 1.00 0.00 H new ATOM 0 HD2 ARG A 100 4.967 8.748 12.942 1.00 0.00 H new ATOM 0 HD3 ARG A 100 6.424 7.817 13.227 1.00 0.00 H new ATOM 0 HE ARG A 100 6.132 8.122 10.412 1.00 0.00 H new ATOM 0 HH11 ARG A 100 6.533 10.381 13.112 1.00 0.00 H new ATOM 0 HH12 ARG A 100 7.591 11.438 12.171 1.00 0.00 H new ATOM 0 HH21 ARG A 100 7.624 9.407 9.344 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.191 10.901 10.097 1.00 0.00 H new ATOM 1591 N LYS A 101 5.876 2.914 13.895 1.00 0.00 N ATOM 1592 CA LYS A 101 6.546 2.053 14.891 1.00 0.00 C ATOM 1593 C LYS A 101 6.795 2.776 16.236 1.00 0.00 C ATOM 1594 O LYS A 101 6.876 2.135 17.284 1.00 0.00 O ATOM 1595 CB LYS A 101 7.855 1.495 14.287 1.00 0.00 C ATOM 1596 CG LYS A 101 7.673 0.136 13.594 1.00 0.00 C ATOM 1597 CD LYS A 101 6.941 0.237 12.248 1.00 0.00 C ATOM 1598 CE LYS A 101 6.606 -1.143 11.661 1.00 0.00 C ATOM 1599 NZ LYS A 101 5.558 -1.873 12.435 1.00 0.00 N ATOM 0 H LYS A 101 6.465 3.134 13.092 1.00 0.00 H new ATOM 0 HA LYS A 101 5.879 1.224 15.126 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.250 2.212 13.567 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.598 1.395 15.078 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.651 -0.318 13.435 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.117 -0.530 14.254 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.021 0.807 12.379 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.560 0.790 11.541 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.269 -1.021 10.632 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.513 -1.747 11.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.316 -2.757 11.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 5.918 -2.093 13.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.709 -1.278 12.516 1.00 0.00 H new ATOM 1613 N ASP A 102 6.844 4.113 16.216 1.00 0.00 N ATOM 1614 CA ASP A 102 6.916 4.987 17.400 1.00 0.00 C ATOM 1615 C ASP A 102 5.588 5.082 18.188 1.00 0.00 C ATOM 1616 O ASP A 102 5.570 5.621 19.295 1.00 0.00 O ATOM 1617 CB ASP A 102 7.339 6.392 16.942 1.00 0.00 C ATOM 1618 CG ASP A 102 8.717 6.402 16.262 1.00 0.00 C ATOM 1619 OD1 ASP A 102 9.744 6.433 16.982 1.00 0.00 O ATOM 1620 OD2 ASP A 102 8.762 6.383 15.009 1.00 0.00 O ATOM 0 H ASP A 102 6.834 4.639 15.342 1.00 0.00 H new ATOM 0 HA ASP A 102 7.644 4.547 18.082 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.594 6.784 16.250 1.00 0.00 H new ATOM 0 HB3 ASP A 102 7.358 7.060 17.803 1.00 0.00 H new ATOM 1625 N GLY A 103 4.476 4.589 17.620 1.00 0.00 N ATOM 1626 CA GLY A 103 3.121 4.680 18.186 1.00 0.00 C ATOM 1627 C GLY A 103 2.338 5.930 17.757 1.00 0.00 C ATOM 1628 O GLY A 103 1.165 6.063 18.104 1.00 0.00 O ATOM 0 H GLY A 103 4.496 4.100 16.725 1.00 0.00 H new ATOM 0 HA2 GLY A 103 2.557 3.794 17.893 1.00 0.00 H new ATOM 0 HA3 GLY A 103 3.193 4.666 19.274 1.00 0.00 H new ATOM 1632 N SER A 104 2.961 6.836 17.001 1.00 0.00 N ATOM 1633 CA SER A 104 2.309 8.033 16.433 1.00 0.00 C ATOM 1634 C SER A 104 1.449 7.682 15.201 1.00 0.00 C ATOM 1635 O SER A 104 1.618 6.613 14.613 1.00 0.00 O ATOM 1636 CB SER A 104 3.370 9.079 16.046 1.00 0.00 C ATOM 1637 OG SER A 104 4.198 9.416 17.156 1.00 0.00 O ATOM 0 H SER A 104 3.949 6.764 16.758 1.00 0.00 H new ATOM 0 HA SER A 104 1.650 8.445 17.197 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.986 8.691 15.235 1.00 0.00 H new ATOM 0 HB3 SER A 104 2.878 9.977 15.671 1.00 0.00 H new ATOM 0 HG SER A 104 4.863 10.081 16.879 1.00 0.00 H new ATOM 1643 N CYS A 105 0.553 8.576 14.760 1.00 0.00 N ATOM 1644 CA CYS A 105 -0.339 8.326 13.619 1.00 0.00 C ATOM 1645 C CYS A 105 -0.646 9.577 12.779 1.00 0.00 C ATOM 1646 O CYS A 105 -0.406 10.713 13.196 1.00 0.00 O ATOM 1647 CB CYS A 105 -1.615 7.629 14.128 1.00 0.00 C ATOM 1648 SG CYS A 105 -2.556 8.689 15.268 1.00 0.00 S ATOM 0 H CYS A 105 0.426 9.494 15.185 1.00 0.00 H new ATOM 0 HA CYS A 105 0.183 7.668 12.924 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -2.244 7.359 13.280 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.345 6.701 14.633 1.00 0.00 H new ATOM 0 HG CYS A 105 -3.621 8.059 15.667 1.00 0.00 H new ATOM 1654 N PHE A 106 -1.203 9.343 11.590 1.00 0.00 N ATOM 1655 CA PHE A 106 -1.566 10.353 10.591 1.00 0.00 C ATOM 1656 C PHE A 106 -2.496 9.759 9.524 1.00 0.00 C ATOM 1657 O PHE A 106 -2.534 8.544 9.323 1.00 0.00 O ATOM 1658 CB PHE A 106 -0.294 10.946 9.952 1.00 0.00 C ATOM 1659 CG PHE A 106 0.676 9.920 9.390 1.00 0.00 C ATOM 1660 CD1 PHE A 106 0.415 9.273 8.165 1.00 0.00 C ATOM 1661 CD2 PHE A 106 1.841 9.597 10.112 1.00 0.00 C ATOM 1662 CE1 PHE A 106 1.287 8.277 7.691 1.00 0.00 C ATOM 1663 CE2 PHE A 106 2.721 8.618 9.624 1.00 0.00 C ATOM 1664 CZ PHE A 106 2.431 7.939 8.431 1.00 0.00 C ATOM 0 H PHE A 106 -1.425 8.397 11.281 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.108 11.157 11.089 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.589 11.623 9.150 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.226 11.545 10.700 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -0.458 9.543 7.589 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.058 10.103 11.041 1.00 0.00 H new ATOM 0 HE1 PHE A 106 1.077 7.773 6.759 1.00 0.00 H new ATOM 0 HE2 PHE A 106 3.624 8.387 10.169 1.00 0.00 H new ATOM 0 HZ PHE A 106 3.088 7.156 8.082 1.00 0.00 H new ATOM 1674 N LEU A 107 -3.214 10.623 8.804 1.00 0.00 N ATOM 1675 CA LEU A 107 -3.968 10.253 7.604 1.00 0.00 C ATOM 1676 C LEU A 107 -3.033 10.152 6.394 1.00 0.00 C ATOM 1677 O LEU A 107 -2.397 11.123 5.987 1.00 0.00 O ATOM 1678 CB LEU A 107 -5.093 11.272 7.336 1.00 0.00 C ATOM 1679 CG LEU A 107 -6.501 10.924 7.868 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -6.986 9.544 7.408 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -6.580 11.001 9.398 1.00 0.00 C ATOM 0 H LEU A 107 -3.289 11.612 9.041 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.423 9.277 7.770 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.794 12.227 7.769 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.166 11.420 6.258 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.159 11.680 7.440 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.980 9.354 7.812 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.026 9.517 6.319 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.297 8.779 7.765 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.589 10.748 9.723 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.871 10.298 9.835 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.336 12.012 9.724 1.00 0.00 H new ATOM 1693 N CYS A 108 -3.011 8.977 5.779 1.00 0.00 N ATOM 1694 CA CYS A 108 -2.314 8.635 4.547 1.00 0.00 C ATOM 1695 C CYS A 108 -3.327 8.513 3.395 1.00 0.00 C ATOM 1696 O CYS A 108 -4.401 7.927 3.547 1.00 0.00 O ATOM 1697 CB CYS A 108 -1.606 7.296 4.795 1.00 0.00 C ATOM 1698 SG CYS A 108 -0.596 6.868 3.351 1.00 0.00 S ATOM 0 H CYS A 108 -3.519 8.178 6.158 1.00 0.00 H new ATOM 0 HA CYS A 108 -1.591 9.402 4.270 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.978 7.364 5.684 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -2.341 6.513 4.983 1.00 0.00 H new ATOM 0 HG CYS A 108 -0.184 5.640 3.458 1.00 0.00 H new ATOM 1704 N LEU A 109 -2.977 9.031 2.223 1.00 0.00 N ATOM 1705 CA LEU A 109 -3.636 8.747 0.956 1.00 0.00 C ATOM 1706 C LEU A 109 -2.829 7.645 0.253 1.00 0.00 C ATOM 1707 O LEU A 109 -1.678 7.869 -0.119 1.00 0.00 O ATOM 1708 CB LEU A 109 -3.707 10.054 0.139 1.00 0.00 C ATOM 1709 CG LEU A 109 -4.699 9.993 -1.038 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -6.161 10.009 -0.566 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -4.462 11.183 -1.978 1.00 0.00 C ATOM 0 H LEU A 109 -2.199 9.683 2.127 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.658 8.391 1.084 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.992 10.871 0.801 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.714 10.287 -0.245 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.524 9.053 -1.561 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -6.823 9.965 -1.431 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.345 9.148 0.077 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -6.353 10.926 -0.009 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.166 11.136 -2.809 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.609 12.114 -1.430 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.443 11.145 -2.363 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.424 6.459 0.113 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.869 5.320 -0.633 1.00 0.00 C ATOM 1725 C VAL A 110 -3.429 5.350 -2.054 1.00 0.00 C ATOM 1726 O VAL A 110 -4.631 5.154 -2.237 1.00 0.00 O ATOM 1727 CB VAL A 110 -3.192 3.961 0.027 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -2.635 2.793 -0.782 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -2.661 3.920 1.470 1.00 0.00 C ATOM 0 H VAL A 110 -4.334 6.255 0.527 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.783 5.417 -0.638 1.00 0.00 H new ATOM 0 HB VAL A 110 -4.277 3.858 0.050 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.883 1.855 -0.285 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.072 2.801 -1.781 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.552 2.887 -0.859 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.898 2.955 1.918 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.580 4.061 1.464 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.128 4.715 2.052 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.576 5.570 -3.054 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.919 5.530 -4.467 1.00 0.00 C ATOM 1741 C ASP A 111 -2.336 4.245 -5.054 1.00 0.00 C ATOM 1742 O ASP A 111 -1.127 4.146 -5.230 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.356 6.765 -5.196 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.720 8.122 -4.566 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -3.687 8.198 -3.776 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -2.042 9.122 -4.908 1.00 0.00 O ATOM 0 H ASP A 111 -1.593 5.788 -2.892 1.00 0.00 H new ATOM 0 HA ASP A 111 -4.002 5.543 -4.593 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -1.270 6.680 -5.235 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.713 6.753 -6.226 1.00 0.00 H new ATOM 1751 N VAL A 112 -3.163 3.254 -5.372 1.00 0.00 N ATOM 1752 CA VAL A 112 -2.697 2.136 -6.209 1.00 0.00 C ATOM 1753 C VAL A 112 -2.679 2.643 -7.645 1.00 0.00 C ATOM 1754 O VAL A 112 -3.686 3.156 -8.125 1.00 0.00 O ATOM 1755 CB VAL A 112 -3.628 0.924 -6.143 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -3.291 -0.176 -7.166 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -3.694 0.262 -4.767 1.00 0.00 C ATOM 0 H VAL A 112 -4.137 3.194 -5.075 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.718 1.814 -5.854 1.00 0.00 H new ATOM 0 HB VAL A 112 -4.597 1.363 -6.381 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.994 -1.002 -7.058 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.362 0.231 -8.175 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.278 -0.537 -6.991 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.375 -0.588 -4.805 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -2.700 -0.081 -4.480 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.054 0.983 -4.033 1.00 0.00 H new ATOM 1767 N VAL A 113 -1.566 2.437 -8.338 1.00 0.00 N ATOM 1768 CA VAL A 113 -1.467 2.616 -9.789 1.00 0.00 C ATOM 1769 C VAL A 113 -1.073 1.256 -10.387 1.00 0.00 C ATOM 1770 O VAL A 113 0.025 0.778 -10.095 1.00 0.00 O ATOM 1771 CB VAL A 113 -0.464 3.736 -10.150 1.00 0.00 C ATOM 1772 CG1 VAL A 113 -0.309 3.876 -11.673 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -0.894 5.089 -9.560 1.00 0.00 C ATOM 0 H VAL A 113 -0.692 2.137 -7.906 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.421 2.938 -10.208 1.00 0.00 H new ATOM 0 HB VAL A 113 0.495 3.450 -9.717 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.403 4.671 -11.895 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.055 2.937 -12.090 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -1.275 4.119 -12.116 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -0.166 5.853 -9.833 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.873 5.363 -9.953 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.948 5.012 -8.474 1.00 0.00 H new ATOM 1783 N PRO A 114 -1.957 0.594 -11.159 1.00 0.00 N ATOM 1784 CA PRO A 114 -1.667 -0.702 -11.753 1.00 0.00 C ATOM 1785 C PRO A 114 -0.706 -0.532 -12.930 1.00 0.00 C ATOM 1786 O PRO A 114 -0.892 0.337 -13.781 1.00 0.00 O ATOM 1787 CB PRO A 114 -3.015 -1.275 -12.194 1.00 0.00 C ATOM 1788 CG PRO A 114 -3.862 -0.037 -12.465 1.00 0.00 C ATOM 1789 CD PRO A 114 -3.326 0.985 -11.465 1.00 0.00 C ATOM 0 HA PRO A 114 -1.179 -1.379 -11.052 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -2.915 -1.895 -13.085 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -3.457 -1.901 -11.419 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -3.750 0.309 -13.492 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -4.923 -0.234 -12.309 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -3.356 1.990 -11.885 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -3.936 0.999 -10.561 1.00 0.00 H new ATOM 1797 N VAL A 115 0.309 -1.392 -12.979 1.00 0.00 N ATOM 1798 CA VAL A 115 1.236 -1.500 -14.115 1.00 0.00 C ATOM 1799 C VAL A 115 0.700 -2.573 -15.055 1.00 0.00 C ATOM 1800 O VAL A 115 0.594 -3.736 -14.663 1.00 0.00 O ATOM 1801 CB VAL A 115 2.670 -1.866 -13.670 1.00 0.00 C ATOM 1802 CG1 VAL A 115 3.647 -1.888 -14.855 1.00 0.00 C ATOM 1803 CG2 VAL A 115 3.196 -0.905 -12.595 1.00 0.00 C ATOM 0 H VAL A 115 0.518 -2.044 -12.223 1.00 0.00 H new ATOM 0 HA VAL A 115 1.297 -0.531 -14.611 1.00 0.00 H new ATOM 0 HB VAL A 115 2.610 -2.868 -13.246 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.644 -2.149 -14.500 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.317 -2.627 -15.585 1.00 0.00 H new ATOM 0 HG13 VAL A 115 3.675 -0.903 -15.322 1.00 0.00 H new ATOM 0 HG21 VAL A 115 4.207 -1.197 -12.309 1.00 0.00 H new ATOM 0 HG22 VAL A 115 3.209 0.111 -12.990 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.546 -0.946 -11.721 1.00 0.00 H new ATOM 1813 N LYS A 116 0.396 -2.197 -16.298 1.00 0.00 N ATOM 1814 CA LYS A 116 0.113 -3.153 -17.372 1.00 0.00 C ATOM 1815 C LYS A 116 1.365 -3.498 -18.189 1.00 0.00 C ATOM 1816 O LYS A 116 2.290 -2.695 -18.325 1.00 0.00 O ATOM 1817 CB LYS A 116 -1.016 -2.651 -18.283 1.00 0.00 C ATOM 1818 CG LYS A 116 -2.363 -2.648 -17.556 1.00 0.00 C ATOM 1819 CD LYS A 116 -3.509 -2.251 -18.496 1.00 0.00 C ATOM 1820 CE LYS A 116 -4.805 -2.907 -18.003 1.00 0.00 C ATOM 1821 NZ LYS A 116 -5.961 -2.587 -18.889 1.00 0.00 N ATOM 0 H LYS A 116 0.339 -1.221 -16.590 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.221 -4.073 -16.893 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.785 -1.643 -18.628 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -1.080 -3.284 -19.168 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.557 -3.638 -17.143 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -2.323 -1.954 -16.716 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -3.620 -1.167 -18.518 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.289 -2.570 -19.515 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.671 -3.988 -17.957 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -5.020 -2.570 -16.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -6.818 -3.049 -18.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -6.106 -1.557 -18.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -5.767 -2.932 -19.851 1.00 0.00 H new ATOM 1835 N ASN A 117 1.365 -4.708 -18.751 1.00 0.00 N ATOM 1836 CA ASN A 117 2.410 -5.187 -19.657 1.00 0.00 C ATOM 1837 C ASN A 117 2.067 -4.890 -21.127 1.00 0.00 C ATOM 1838 O ASN A 117 1.048 -4.269 -21.438 1.00 0.00 O ATOM 1839 CB ASN A 117 2.682 -6.678 -19.378 1.00 0.00 C ATOM 1840 CG ASN A 117 1.695 -7.633 -20.037 1.00 0.00 C ATOM 1841 OD1 ASN A 117 2.007 -8.256 -21.039 1.00 0.00 O ATOM 1842 ND2 ASN A 117 0.473 -7.737 -19.552 1.00 0.00 N ATOM 0 H ASN A 117 0.627 -5.393 -18.587 1.00 0.00 H new ATOM 0 HA ASN A 117 3.335 -4.643 -19.468 1.00 0.00 H new ATOM 0 HB2 ASN A 117 3.688 -6.921 -19.720 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.664 -6.843 -18.301 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -0.210 -8.337 -20.014 1.00 0.00 H new ATOM 0 HD22 ASN A 117 0.211 -7.217 -18.715 1.00 0.00 H new ATOM 1849 N GLU A 118 2.900 -5.405 -22.027 1.00 0.00 N ATOM 1850 CA GLU A 118 2.750 -5.278 -23.486 1.00 0.00 C ATOM 1851 C GLU A 118 1.441 -5.880 -24.047 1.00 0.00 C ATOM 1852 O GLU A 118 0.992 -5.472 -25.120 1.00 0.00 O ATOM 1853 CB GLU A 118 3.976 -5.891 -24.190 1.00 0.00 C ATOM 1854 CG GLU A 118 4.231 -7.362 -23.825 1.00 0.00 C ATOM 1855 CD GLU A 118 5.335 -7.961 -24.707 1.00 0.00 C ATOM 1856 OE1 GLU A 118 6.531 -7.858 -24.344 1.00 0.00 O ATOM 1857 OE2 GLU A 118 5.020 -8.547 -25.771 1.00 0.00 O ATOM 0 H GLU A 118 3.726 -5.940 -21.760 1.00 0.00 H new ATOM 0 HA GLU A 118 2.688 -4.210 -23.695 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.841 -5.812 -25.269 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.859 -5.305 -23.936 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.518 -7.436 -22.776 1.00 0.00 H new ATOM 0 HG3 GLU A 118 3.312 -7.936 -23.946 1.00 0.00 H new ATOM 1864 N ASP A 119 0.802 -6.815 -23.331 1.00 0.00 N ATOM 1865 CA ASP A 119 -0.468 -7.452 -23.724 1.00 0.00 C ATOM 1866 C ASP A 119 -1.712 -6.702 -23.192 1.00 0.00 C ATOM 1867 O ASP A 119 -2.845 -7.062 -23.515 1.00 0.00 O ATOM 1868 CB ASP A 119 -0.444 -8.910 -23.233 1.00 0.00 C ATOM 1869 CG ASP A 119 -1.590 -9.762 -23.808 1.00 0.00 C ATOM 1870 OD1 ASP A 119 -1.665 -9.914 -25.052 1.00 0.00 O ATOM 1871 OD2 ASP A 119 -2.387 -10.314 -23.012 1.00 0.00 O ATOM 0 H ASP A 119 1.160 -7.160 -22.440 1.00 0.00 H new ATOM 0 HA ASP A 119 -0.553 -7.416 -24.810 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.509 -9.363 -23.506 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -0.502 -8.921 -22.145 1.00 0.00 H new ATOM 1876 N GLY A 120 -1.511 -5.664 -22.365 1.00 0.00 N ATOM 1877 CA GLY A 120 -2.586 -4.877 -21.745 1.00 0.00 C ATOM 1878 C GLY A 120 -3.232 -5.544 -20.526 1.00 0.00 C ATOM 1879 O GLY A 120 -4.341 -5.163 -20.153 1.00 0.00 O ATOM 0 H GLY A 120 -0.579 -5.343 -22.104 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.185 -3.909 -21.445 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -3.357 -4.685 -22.491 1.00 0.00 H new ATOM 1883 N ALA A 121 -2.554 -6.509 -19.890 1.00 0.00 N ATOM 1884 CA ALA A 121 -2.972 -7.135 -18.630 1.00 0.00 C ATOM 1885 C ALA A 121 -2.212 -6.495 -17.466 1.00 0.00 C ATOM 1886 O ALA A 121 -1.042 -6.145 -17.632 1.00 0.00 O ATOM 1887 CB ALA A 121 -2.710 -8.651 -18.675 1.00 0.00 C ATOM 0 H ALA A 121 -1.676 -6.885 -20.248 1.00 0.00 H new ATOM 0 HA ALA A 121 -4.041 -6.977 -18.487 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.025 -9.103 -17.734 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.274 -9.093 -19.496 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.646 -8.832 -18.826 1.00 0.00 H new ATOM 1893 N VAL A 122 -2.839 -6.379 -16.298 1.00 0.00 N ATOM 1894 CA VAL A 122 -2.186 -5.852 -15.083 1.00 0.00 C ATOM 1895 C VAL A 122 -1.263 -6.927 -14.500 1.00 0.00 C ATOM 1896 O VAL A 122 -1.673 -8.068 -14.293 1.00 0.00 O ATOM 1897 CB VAL A 122 -3.200 -5.357 -14.024 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -2.502 -4.844 -12.753 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -4.059 -4.218 -14.594 1.00 0.00 C ATOM 0 H VAL A 122 -3.814 -6.645 -16.158 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.600 -4.978 -15.369 1.00 0.00 H new ATOM 0 HB VAL A 122 -3.823 -6.213 -13.764 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.252 -4.507 -12.037 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.914 -5.648 -12.311 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.845 -4.013 -13.009 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.767 -3.882 -13.836 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.416 -3.387 -14.884 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.605 -4.576 -15.467 1.00 0.00 H new ATOM 1909 N ILE A 123 -0.008 -6.547 -14.248 1.00 0.00 N ATOM 1910 CA ILE A 123 1.075 -7.467 -13.837 1.00 0.00 C ATOM 1911 C ILE A 123 1.737 -7.091 -12.502 1.00 0.00 C ATOM 1912 O ILE A 123 2.233 -7.964 -11.793 1.00 0.00 O ATOM 1913 CB ILE A 123 2.114 -7.570 -14.979 1.00 0.00 C ATOM 1914 CG1 ILE A 123 2.631 -6.181 -15.438 1.00 0.00 C ATOM 1915 CG2 ILE A 123 1.514 -8.352 -16.158 1.00 0.00 C ATOM 1916 CD1 ILE A 123 4.102 -6.167 -15.834 1.00 0.00 C ATOM 0 H ILE A 123 0.297 -5.577 -14.323 1.00 0.00 H new ATOM 0 HA ILE A 123 0.624 -8.443 -13.657 1.00 0.00 H new ATOM 0 HB ILE A 123 2.980 -8.108 -14.593 1.00 0.00 H new ATOM 0 HG12 ILE A 123 2.034 -5.845 -16.286 1.00 0.00 H new ATOM 0 HG13 ILE A 123 2.475 -5.463 -14.633 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.249 -8.422 -16.960 1.00 0.00 H new ATOM 0 HG22 ILE A 123 1.240 -9.354 -15.828 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.627 -7.835 -16.523 1.00 0.00 H new ATOM 0 HD11 ILE A 123 4.386 -5.161 -16.142 1.00 0.00 H new ATOM 0 HD12 ILE A 123 4.711 -6.471 -14.983 1.00 0.00 H new ATOM 0 HD13 ILE A 123 4.263 -6.859 -16.661 1.00 0.00 H new ATOM 1928 N MET A 124 1.687 -5.815 -12.109 1.00 0.00 N ATOM 1929 CA MET A 124 2.216 -5.290 -10.838 1.00 0.00 C ATOM 1930 C MET A 124 1.367 -4.113 -10.350 1.00 0.00 C ATOM 1931 O MET A 124 0.760 -3.409 -11.156 1.00 0.00 O ATOM 1932 CB MET A 124 3.676 -4.832 -11.010 1.00 0.00 C ATOM 1933 CG MET A 124 4.655 -5.972 -11.320 1.00 0.00 C ATOM 1934 SD MET A 124 6.387 -5.463 -11.484 1.00 0.00 S ATOM 1935 CE MET A 124 6.244 -4.340 -12.896 1.00 0.00 C ATOM 0 H MET A 124 1.262 -5.089 -12.686 1.00 0.00 H new ATOM 0 HA MET A 124 2.177 -6.090 -10.099 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.723 -4.097 -11.814 1.00 0.00 H new ATOM 0 HB3 MET A 124 3.998 -4.328 -10.099 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.584 -6.719 -10.529 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.344 -6.457 -12.245 1.00 0.00 H new ATOM 0 HE1 MET A 124 7.228 -4.183 -13.337 1.00 0.00 H new ATOM 0 HE2 MET A 124 5.578 -4.775 -13.641 1.00 0.00 H new ATOM 0 HE3 MET A 124 5.839 -3.385 -12.562 1.00 0.00 H new ATOM 1945 N PHE A 125 1.372 -3.862 -9.044 1.00 0.00 N ATOM 1946 CA PHE A 125 0.773 -2.678 -8.426 1.00 0.00 C ATOM 1947 C PHE A 125 1.867 -1.789 -7.848 1.00 0.00 C ATOM 1948 O PHE A 125 2.737 -2.266 -7.124 1.00 0.00 O ATOM 1949 CB PHE A 125 -0.206 -3.125 -7.330 1.00 0.00 C ATOM 1950 CG PHE A 125 -1.397 -3.885 -7.873 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -2.328 -3.219 -8.692 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -1.561 -5.254 -7.591 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -3.413 -3.924 -9.239 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -2.646 -5.957 -8.141 1.00 0.00 C ATOM 1955 CZ PHE A 125 -3.557 -5.297 -8.983 1.00 0.00 C ATOM 0 H PHE A 125 1.803 -4.491 -8.367 1.00 0.00 H new ATOM 0 HA PHE A 125 0.227 -2.102 -9.173 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.322 -3.753 -6.613 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.559 -2.249 -6.786 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.208 -2.166 -8.900 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.854 -5.763 -6.953 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.136 -3.410 -9.856 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.780 -7.005 -7.917 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.370 -5.847 -9.434 1.00 0.00 H new ATOM 1965 N ILE A 126 1.795 -0.489 -8.131 1.00 0.00 N ATOM 1966 CA ILE A 126 2.544 0.538 -7.394 1.00 0.00 C ATOM 1967 C ILE A 126 1.572 1.109 -6.366 1.00 0.00 C ATOM 1968 O ILE A 126 0.565 1.688 -6.770 1.00 0.00 O ATOM 1969 CB ILE A 126 3.083 1.644 -8.336 1.00 0.00 C ATOM 1970 CG1 ILE A 126 3.907 1.058 -9.505 1.00 0.00 C ATOM 1971 CG2 ILE A 126 3.933 2.636 -7.517 1.00 0.00 C ATOM 1972 CD1 ILE A 126 4.249 2.082 -10.594 1.00 0.00 C ATOM 0 H ILE A 126 1.214 -0.113 -8.880 1.00 0.00 H new ATOM 0 HA ILE A 126 3.424 0.110 -6.914 1.00 0.00 H new ATOM 0 HB ILE A 126 2.232 2.163 -8.778 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.832 0.638 -9.111 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.350 0.236 -9.954 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.315 3.417 -8.174 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.317 3.086 -6.738 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.768 2.107 -7.058 1.00 0.00 H new ATOM 0 HD11 ILE A 126 4.828 1.597 -11.380 1.00 0.00 H new ATOM 0 HD12 ILE A 126 3.329 2.485 -11.017 1.00 0.00 H new ATOM 0 HD13 ILE A 126 4.834 2.893 -10.160 1.00 0.00 H new ATOM 1984 N LEU A 127 1.837 0.941 -5.072 1.00 0.00 N ATOM 1985 CA LEU A 127 1.076 1.594 -4.001 1.00 0.00 C ATOM 1986 C LEU A 127 1.836 2.857 -3.632 1.00 0.00 C ATOM 1987 O LEU A 127 3.023 2.763 -3.321 1.00 0.00 O ATOM 1988 CB LEU A 127 0.976 0.677 -2.764 1.00 0.00 C ATOM 1989 CG LEU A 127 -0.112 -0.407 -2.766 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -1.453 0.177 -2.339 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -0.191 -1.199 -4.079 1.00 0.00 C ATOM 0 H LEU A 127 2.591 0.344 -4.731 1.00 0.00 H new ATOM 0 HA LEU A 127 0.062 1.815 -4.335 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.940 0.185 -2.632 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.819 1.309 -1.890 1.00 0.00 H new ATOM 0 HG LEU A 127 0.177 -1.150 -2.023 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.210 -0.607 -2.347 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.367 0.588 -1.333 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.742 0.968 -3.031 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -0.981 -1.946 -4.006 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.410 -0.518 -4.902 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.762 -1.696 -4.262 1.00 0.00 H new ATOM 2003 N ASN A 128 1.177 4.016 -3.657 1.00 0.00 N ATOM 2004 CA ASN A 128 1.833 5.289 -3.296 1.00 0.00 C ATOM 2005 C ASN A 128 1.231 5.897 -2.017 1.00 0.00 C ATOM 2006 O ASN A 128 0.023 6.105 -1.977 1.00 0.00 O ATOM 2007 CB ASN A 128 1.789 6.320 -4.433 1.00 0.00 C ATOM 2008 CG ASN A 128 2.126 5.799 -5.829 1.00 0.00 C ATOM 2009 OD1 ASN A 128 3.200 6.042 -6.364 1.00 0.00 O ATOM 2010 ND2 ASN A 128 1.212 5.107 -6.484 1.00 0.00 N ATOM 0 H ASN A 128 0.196 4.108 -3.921 1.00 0.00 H new ATOM 0 HA ASN A 128 2.878 5.042 -3.110 1.00 0.00 H new ATOM 0 HB2 ASN A 128 0.790 6.756 -4.462 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.482 7.126 -4.192 1.00 0.00 H new ATOM 0 HD21 ASN A 128 1.403 4.778 -7.430 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.315 4.901 -6.044 1.00 0.00 H new ATOM 2017 N PHE A 129 2.044 6.164 -0.983 1.00 0.00 N ATOM 2018 CA PHE A 129 1.607 6.559 0.365 1.00 0.00 C ATOM 2019 C PHE A 129 1.903 8.038 0.698 1.00 0.00 C ATOM 2020 O PHE A 129 2.989 8.379 1.162 1.00 0.00 O ATOM 2021 CB PHE A 129 2.310 5.661 1.400 1.00 0.00 C ATOM 2022 CG PHE A 129 2.121 4.156 1.320 1.00 0.00 C ATOM 2023 CD1 PHE A 129 1.005 3.578 0.687 1.00 0.00 C ATOM 2024 CD2 PHE A 129 3.063 3.323 1.956 1.00 0.00 C ATOM 2025 CE1 PHE A 129 0.818 2.184 0.719 1.00 0.00 C ATOM 2026 CE2 PHE A 129 2.888 1.930 1.966 1.00 0.00 C ATOM 2027 CZ PHE A 129 1.762 1.359 1.351 1.00 0.00 C ATOM 0 H PHE A 129 3.059 6.109 -1.066 1.00 0.00 H new ATOM 0 HA PHE A 129 0.524 6.438 0.398 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.379 5.862 1.337 1.00 0.00 H new ATOM 0 HB3 PHE A 129 1.983 5.981 2.389 1.00 0.00 H new ATOM 0 HD1 PHE A 129 0.290 4.206 0.176 1.00 0.00 H new ATOM 0 HD2 PHE A 129 3.925 3.759 2.439 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -0.054 1.747 0.256 1.00 0.00 H new ATOM 0 HE2 PHE A 129 3.620 1.297 2.447 1.00 0.00 H new ATOM 0 HZ PHE A 129 1.623 0.288 1.364 1.00 0.00 H new ATOM 2037 N GLU A 130 0.928 8.930 0.551 1.00 0.00 N ATOM 2038 CA GLU A 130 1.111 10.369 0.779 1.00 0.00 C ATOM 2039 C GLU A 130 0.373 10.789 2.055 1.00 0.00 C ATOM 2040 O GLU A 130 -0.853 10.772 2.092 1.00 0.00 O ATOM 2041 CB GLU A 130 0.610 11.160 -0.448 1.00 0.00 C ATOM 2042 CG GLU A 130 1.758 11.618 -1.360 1.00 0.00 C ATOM 2043 CD GLU A 130 2.629 10.457 -1.878 1.00 0.00 C ATOM 2044 OE1 GLU A 130 2.160 9.704 -2.765 1.00 0.00 O ATOM 2045 OE2 GLU A 130 3.794 10.337 -1.429 1.00 0.00 O ATOM 0 H GLU A 130 -0.019 8.678 0.269 1.00 0.00 H new ATOM 0 HA GLU A 130 2.170 10.589 0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.079 10.539 -1.020 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.049 12.031 -0.110 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.343 12.158 -2.211 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.388 12.320 -0.814 1.00 0.00 H new ATOM 2052 N VAL A 131 1.093 11.190 3.108 1.00 0.00 N ATOM 2053 CA VAL A 131 0.466 11.736 4.330 1.00 0.00 C ATOM 2054 C VAL A 131 -0.288 13.034 4.002 1.00 0.00 C ATOM 2055 O VAL A 131 0.310 14.070 3.717 1.00 0.00 O ATOM 2056 CB VAL A 131 1.435 11.870 5.530 1.00 0.00 C ATOM 2057 CG1 VAL A 131 2.775 12.527 5.178 1.00 0.00 C ATOM 2058 CG2 VAL A 131 0.789 12.588 6.726 1.00 0.00 C ATOM 0 H VAL A 131 2.112 11.149 3.145 1.00 0.00 H new ATOM 0 HA VAL A 131 -0.263 11.003 4.676 1.00 0.00 H new ATOM 0 HB VAL A 131 1.654 10.842 5.818 1.00 0.00 H new ATOM 0 HG11 VAL A 131 3.398 12.585 6.071 1.00 0.00 H new ATOM 0 HG12 VAL A 131 3.283 11.933 4.419 1.00 0.00 H new ATOM 0 HG13 VAL A 131 2.598 13.532 4.794 1.00 0.00 H new ATOM 0 HG21 VAL A 131 1.509 12.657 7.541 1.00 0.00 H new ATOM 0 HG22 VAL A 131 0.483 13.590 6.427 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -0.084 12.027 7.059 1.00 0.00 H new ATOM 2068 N VAL A 132 -1.618 12.938 4.024 1.00 0.00 N ATOM 2069 CA VAL A 132 -2.554 14.021 3.672 1.00 0.00 C ATOM 2070 C VAL A 132 -2.856 14.954 4.856 1.00 0.00 C ATOM 2071 O VAL A 132 -3.221 16.111 4.647 1.00 0.00 O ATOM 2072 CB VAL A 132 -3.851 13.454 3.041 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -4.828 12.861 4.050 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -4.558 14.483 2.146 1.00 0.00 C ATOM 0 H VAL A 132 -2.095 12.078 4.296 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.057 14.636 2.922 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.513 12.626 2.418 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -5.708 12.487 3.527 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -4.347 12.041 4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -5.128 13.630 4.761 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.461 14.040 1.726 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -4.824 15.358 2.738 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.891 14.781 1.337 1.00 0.00 H new ATOM 2084 N MET A 133 -2.689 14.466 6.094 1.00 0.00 N ATOM 2085 CA MET A 133 -3.025 15.186 7.329 1.00 0.00 C ATOM 2086 C MET A 133 -2.345 14.533 8.539 1.00 0.00 C ATOM 2087 O MET A 133 -2.544 13.349 8.799 1.00 0.00 O ATOM 2088 CB MET A 133 -4.564 15.256 7.462 1.00 0.00 C ATOM 2089 CG MET A 133 -5.064 15.580 8.875 1.00 0.00 C ATOM 2090 SD MET A 133 -6.866 15.682 9.051 1.00 0.00 S ATOM 2091 CE MET A 133 -7.185 17.230 8.166 1.00 0.00 C ATOM 0 H MET A 133 -2.307 13.536 6.267 1.00 0.00 H new ATOM 0 HA MET A 133 -2.646 16.207 7.289 1.00 0.00 H new ATOM 0 HB2 MET A 133 -4.942 16.012 6.774 1.00 0.00 H new ATOM 0 HB3 MET A 133 -4.987 14.301 7.150 1.00 0.00 H new ATOM 0 HG2 MET A 133 -4.691 14.818 9.559 1.00 0.00 H new ATOM 0 HG3 MET A 133 -4.630 16.530 9.188 1.00 0.00 H new ATOM 0 HE1 MET A 133 -8.228 17.517 8.299 1.00 0.00 H new ATOM 0 HE2 MET A 133 -6.539 18.015 8.561 1.00 0.00 H new ATOM 0 HE3 MET A 133 -6.980 17.091 7.105 1.00 0.00 H new ATOM 2101 N GLU A 134 -1.578 15.302 9.310 1.00 0.00 N ATOM 2102 CA GLU A 134 -1.001 14.846 10.578 1.00 0.00 C ATOM 2103 C GLU A 134 -2.052 14.945 11.699 1.00 0.00 C ATOM 2104 O GLU A 134 -2.657 16.005 11.898 1.00 0.00 O ATOM 2105 CB GLU A 134 0.259 15.667 10.895 1.00 0.00 C ATOM 2106 CG GLU A 134 1.011 15.137 12.121 1.00 0.00 C ATOM 2107 CD GLU A 134 2.292 15.947 12.367 1.00 0.00 C ATOM 2108 OE1 GLU A 134 2.234 16.985 13.070 1.00 0.00 O ATOM 2109 OE2 GLU A 134 3.370 15.555 11.859 1.00 0.00 O ATOM 0 H GLU A 134 -1.337 16.264 9.073 1.00 0.00 H new ATOM 0 HA GLU A 134 -0.706 13.800 10.498 1.00 0.00 H new ATOM 0 HB2 GLU A 134 0.924 15.654 10.031 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -0.022 16.706 11.066 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.367 15.190 12.999 1.00 0.00 H new ATOM 0 HG3 GLU A 134 1.262 14.087 11.973 1.00 0.00 H new ATOM 2116 N LYS A 135 -2.272 13.839 12.422 1.00 0.00 N ATOM 2117 CA LYS A 135 -3.194 13.756 13.570 1.00 0.00 C ATOM 2118 C LYS A 135 -2.531 14.161 14.898 1.00 0.00 C ATOM 2119 O LYS A 135 -3.178 14.909 15.668 1.00 0.00 O ATOM 2120 CB LYS A 135 -3.799 12.342 13.661 1.00 0.00 C ATOM 2121 CG LYS A 135 -4.813 11.996 12.551 1.00 0.00 C ATOM 2122 CD LYS A 135 -6.261 12.442 12.835 1.00 0.00 C ATOM 2123 CE LYS A 135 -6.472 13.963 12.775 1.00 0.00 C ATOM 2124 NZ LYS A 135 -7.913 14.329 12.883 1.00 0.00 N ATOM 2125 OXT LYS A 135 -1.386 13.738 15.180 1.00 0.00 O ATOM 0 H LYS A 135 -1.804 12.955 12.223 1.00 0.00 H new ATOM 0 HA LYS A 135 -3.993 14.477 13.397 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -2.989 11.614 13.632 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.290 12.235 14.628 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -4.482 12.456 11.620 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -4.804 10.917 12.394 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -6.925 11.965 12.114 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -6.553 12.084 13.822 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -5.915 14.439 13.582 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -6.069 14.349 11.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -8.013 15.363 12.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -8.441 13.896 12.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -8.292 13.983 13.788 1.00 0.00 H new