USER MOD reduce.3.24.130724 H: found=0, std=0, add=958, rem=0, adj=21 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 Set 1.1: A 52 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0.773 K(o=0.77,f=-8.4!) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 39 CYS SG : rot -170:sc= 0 USER MOD Single : A 43 TYR OH : rot 43:sc= 0.364 USER MOD Single : A 44 CYS SG : rot 170:sc= -0.594 USER MOD Single : A 45 ASN : amide:sc= 0.332 K(o=0.33,f=-2.8!) USER MOD Single : A 49 CYS SG : rot 55:sc= 0.824 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl -174:sc= 0 (180deg=-0.0374) USER MOD Single : A 61 GLN : amide:sc= -0.164 X(o=-0.16,f=-0.16) USER MOD Single : A 64 CYS SG : rot 180:sc= -0.201 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 CYS SG : rot 73:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= -0.0529 X(o=-0.053,f=0) USER MOD Single : A 74 THR OG1 : rot -75:sc= 0.952 USER MOD Single : A 75 GLN : amide:sc= 0.692 K(o=0.69,f=0) USER MOD Single : A 81 GLN : amide:sc= -0.0585 X(o=-0.058,f=-0.15) USER MOD Single : A 84 GLN : amide:sc= -0.0541 X(o=-0.054,f=-0.054) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0.213 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0.0634 USER MOD Single : A 105 CYS SG : rot 119:sc= 0.249 USER MOD Single : A 108 CYS SG : rot 22:sc= 0.537 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= 0.011 K(o=0.011,f=-3.6!) USER MOD Single : A 124 MET CE :methyl -155:sc= -0.0729 (180deg=-0.905) USER MOD Single : A 128 ASN : amide:sc= 1.04 K(o=1,f=-0.18) USER MOD Single : A 133 MET CE :methyl 174:sc= 0 (180deg=-0.0639) USER MOD Single : A 135 LYS NZ :NH3+ 178:sc= 0.954 (180deg=0.943) USER MOD ----------------------------------------------------------------- ATOM 191 N THR A 13 16.380 -5.806 -12.061 1.00 0.00 N ATOM 192 CA THR A 13 17.243 -4.721 -12.578 1.00 0.00 C ATOM 193 C THR A 13 16.687 -3.985 -13.812 1.00 0.00 C ATOM 194 O THR A 13 17.012 -2.820 -14.027 1.00 0.00 O ATOM 195 CB THR A 13 18.661 -5.266 -12.796 1.00 0.00 C ATOM 196 OG1 THR A 13 19.560 -4.198 -12.997 1.00 0.00 O ATOM 197 CG2 THR A 13 18.726 -6.219 -13.986 1.00 0.00 C ATOM 0 HA THR A 13 17.269 -3.940 -11.818 1.00 0.00 H new ATOM 0 HB THR A 13 18.940 -5.825 -11.903 1.00 0.00 H new ATOM 0 HG1 THR A 13 20.463 -4.552 -13.134 1.00 0.00 H new ATOM 0 HG21 THR A 13 19.747 -6.582 -14.106 1.00 0.00 H new ATOM 0 HG22 THR A 13 18.058 -7.063 -13.813 1.00 0.00 H new ATOM 0 HG23 THR A 13 18.419 -5.693 -14.890 1.00 0.00 H new ATOM 205 N PHE A 14 15.795 -4.614 -14.592 1.00 0.00 N ATOM 206 CA PHE A 14 15.085 -3.954 -15.699 1.00 0.00 C ATOM 207 C PHE A 14 13.969 -3.024 -15.195 1.00 0.00 C ATOM 208 O PHE A 14 13.849 -1.883 -15.643 1.00 0.00 O ATOM 209 CB PHE A 14 14.512 -5.029 -16.632 1.00 0.00 C ATOM 210 CG PHE A 14 14.266 -4.531 -18.044 1.00 0.00 C ATOM 211 CD1 PHE A 14 13.059 -3.882 -18.373 1.00 0.00 C ATOM 212 CD2 PHE A 14 15.258 -4.701 -19.031 1.00 0.00 C ATOM 213 CE1 PHE A 14 12.846 -3.410 -19.682 1.00 0.00 C ATOM 214 CE2 PHE A 14 15.041 -4.230 -20.339 1.00 0.00 C ATOM 215 CZ PHE A 14 13.836 -3.585 -20.664 1.00 0.00 C ATOM 0 H PHE A 14 15.545 -5.596 -14.473 1.00 0.00 H new ATOM 0 HA PHE A 14 15.794 -3.328 -16.242 1.00 0.00 H new ATOM 0 HB2 PHE A 14 15.200 -5.874 -16.667 1.00 0.00 H new ATOM 0 HB3 PHE A 14 13.575 -5.399 -16.216 1.00 0.00 H new ATOM 0 HD1 PHE A 14 12.297 -3.747 -17.620 1.00 0.00 H new ATOM 0 HD2 PHE A 14 16.186 -5.194 -18.783 1.00 0.00 H new ATOM 0 HE1 PHE A 14 11.920 -2.913 -19.932 1.00 0.00 H new ATOM 0 HE2 PHE A 14 15.802 -4.364 -21.094 1.00 0.00 H new ATOM 0 HZ PHE A 14 13.670 -3.224 -21.668 1.00 0.00 H new ATOM 225 N LEU A 15 13.172 -3.503 -14.231 1.00 0.00 N ATOM 226 CA LEU A 15 12.166 -2.715 -13.508 1.00 0.00 C ATOM 227 C LEU A 15 12.822 -1.584 -12.702 1.00 0.00 C ATOM 228 O LEU A 15 12.284 -0.484 -12.650 1.00 0.00 O ATOM 229 CB LEU A 15 11.337 -3.675 -12.629 1.00 0.00 C ATOM 230 CG LEU A 15 10.356 -2.987 -11.661 1.00 0.00 C ATOM 231 CD1 LEU A 15 9.257 -2.209 -12.399 1.00 0.00 C ATOM 232 CD2 LEU A 15 9.724 -4.036 -10.738 1.00 0.00 C ATOM 0 H LEU A 15 13.210 -4.475 -13.925 1.00 0.00 H new ATOM 0 HA LEU A 15 11.495 -2.222 -14.211 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.773 -4.344 -13.279 1.00 0.00 H new ATOM 0 HB3 LEU A 15 12.021 -4.295 -12.050 1.00 0.00 H new ATOM 0 HG LEU A 15 10.924 -2.265 -11.074 1.00 0.00 H new ATOM 0 HD11 LEU A 15 8.591 -1.742 -11.673 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.712 -1.439 -13.022 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.686 -2.893 -13.027 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.030 -3.548 -10.054 1.00 0.00 H new ATOM 0 HD22 LEU A 15 9.186 -4.771 -11.337 1.00 0.00 H new ATOM 0 HD23 LEU A 15 10.506 -4.536 -10.166 1.00 0.00 H new ATOM 244 N ASP A 16 14.008 -1.814 -12.136 1.00 0.00 N ATOM 245 CA ASP A 16 14.815 -0.821 -11.402 1.00 0.00 C ATOM 246 C ASP A 16 15.038 0.474 -12.209 1.00 0.00 C ATOM 247 O ASP A 16 15.041 1.576 -11.651 1.00 0.00 O ATOM 248 CB ASP A 16 16.166 -1.474 -11.062 1.00 0.00 C ATOM 249 CG ASP A 16 16.880 -0.807 -9.876 1.00 0.00 C ATOM 250 OD1 ASP A 16 17.533 0.245 -10.074 1.00 0.00 O ATOM 251 OD2 ASP A 16 16.827 -1.370 -8.756 1.00 0.00 O ATOM 0 H ASP A 16 14.455 -2.730 -12.174 1.00 0.00 H new ATOM 0 HA ASP A 16 14.278 -0.530 -10.499 1.00 0.00 H new ATOM 0 HB2 ASP A 16 16.006 -2.528 -10.835 1.00 0.00 H new ATOM 0 HB3 ASP A 16 16.813 -1.431 -11.938 1.00 0.00 H new ATOM 256 N THR A 17 15.140 0.337 -13.539 1.00 0.00 N ATOM 257 CA THR A 17 15.289 1.440 -14.505 1.00 0.00 C ATOM 258 C THR A 17 13.994 2.231 -14.675 1.00 0.00 C ATOM 259 O THR A 17 14.038 3.386 -15.079 1.00 0.00 O ATOM 260 CB THR A 17 15.758 0.879 -15.861 1.00 0.00 C ATOM 261 OG1 THR A 17 16.875 0.033 -15.673 1.00 0.00 O ATOM 262 CG2 THR A 17 16.176 1.954 -16.867 1.00 0.00 C ATOM 0 H THR A 17 15.120 -0.578 -13.990 1.00 0.00 H new ATOM 0 HA THR A 17 16.037 2.130 -14.115 1.00 0.00 H new ATOM 0 HB THR A 17 14.896 0.347 -16.265 1.00 0.00 H new ATOM 0 HG1 THR A 17 17.166 -0.321 -16.539 1.00 0.00 H new ATOM 0 HG21 THR A 17 16.493 1.480 -17.796 1.00 0.00 H new ATOM 0 HG22 THR A 17 15.332 2.614 -17.066 1.00 0.00 H new ATOM 0 HG23 THR A 17 17.002 2.535 -16.456 1.00 0.00 H new ATOM 270 N ILE A 18 12.835 1.657 -14.347 1.00 0.00 N ATOM 271 CA ILE A 18 11.530 2.333 -14.414 1.00 0.00 C ATOM 272 C ILE A 18 11.315 3.178 -13.158 1.00 0.00 C ATOM 273 O ILE A 18 10.867 4.317 -13.254 1.00 0.00 O ATOM 274 CB ILE A 18 10.398 1.297 -14.609 1.00 0.00 C ATOM 275 CG1 ILE A 18 10.722 0.225 -15.677 1.00 0.00 C ATOM 276 CG2 ILE A 18 9.068 1.999 -14.931 1.00 0.00 C ATOM 277 CD1 ILE A 18 11.041 0.749 -17.082 1.00 0.00 C ATOM 0 H ILE A 18 12.772 0.693 -14.021 1.00 0.00 H new ATOM 0 HA ILE A 18 11.513 3.002 -15.274 1.00 0.00 H new ATOM 0 HB ILE A 18 10.304 0.766 -13.662 1.00 0.00 H new ATOM 0 HG12 ILE A 18 11.572 -0.361 -15.328 1.00 0.00 H new ATOM 0 HG13 ILE A 18 9.874 -0.455 -15.749 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.285 1.252 -15.064 1.00 0.00 H new ATOM 0 HG22 ILE A 18 8.799 2.664 -14.110 1.00 0.00 H new ATOM 0 HG23 ILE A 18 9.175 2.579 -15.847 1.00 0.00 H new ATOM 0 HD11 ILE A 18 11.252 -0.091 -17.744 1.00 0.00 H new ATOM 0 HD12 ILE A 18 10.187 1.308 -17.465 1.00 0.00 H new ATOM 0 HD13 ILE A 18 11.912 1.403 -17.037 1.00 0.00 H new ATOM 289 N ILE A 19 11.718 2.672 -11.988 1.00 0.00 N ATOM 290 CA ILE A 19 11.627 3.404 -10.713 1.00 0.00 C ATOM 291 C ILE A 19 12.337 4.762 -10.796 1.00 0.00 C ATOM 292 O ILE A 19 11.794 5.748 -10.300 1.00 0.00 O ATOM 293 CB ILE A 19 12.140 2.517 -9.547 1.00 0.00 C ATOM 294 CG1 ILE A 19 11.071 1.491 -9.107 1.00 0.00 C ATOM 295 CG2 ILE A 19 12.511 3.349 -8.301 1.00 0.00 C ATOM 296 CD1 ILE A 19 10.803 0.324 -10.053 1.00 0.00 C ATOM 0 H ILE A 19 12.119 1.739 -11.895 1.00 0.00 H new ATOM 0 HA ILE A 19 10.581 3.629 -10.507 1.00 0.00 H new ATOM 0 HB ILE A 19 13.025 2.011 -9.933 1.00 0.00 H new ATOM 0 HG12 ILE A 19 11.370 1.083 -8.141 1.00 0.00 H new ATOM 0 HG13 ILE A 19 10.133 2.024 -8.952 1.00 0.00 H new ATOM 0 HG21 ILE A 19 12.864 2.685 -7.512 1.00 0.00 H new ATOM 0 HG22 ILE A 19 13.298 4.058 -8.558 1.00 0.00 H new ATOM 0 HG23 ILE A 19 11.633 3.892 -7.952 1.00 0.00 H new ATOM 0 HD11 ILE A 19 10.034 -0.320 -9.627 1.00 0.00 H new ATOM 0 HD12 ILE A 19 10.464 0.707 -11.016 1.00 0.00 H new ATOM 0 HD13 ILE A 19 11.720 -0.249 -10.193 1.00 0.00 H new ATOM 308 N ARG A 20 13.491 4.859 -11.471 1.00 0.00 N ATOM 309 CA ARG A 20 14.231 6.130 -11.566 1.00 0.00 C ATOM 310 C ARG A 20 13.582 7.166 -12.507 1.00 0.00 C ATOM 311 O ARG A 20 13.892 8.354 -12.416 1.00 0.00 O ATOM 312 CB ARG A 20 15.717 5.886 -11.884 1.00 0.00 C ATOM 313 CG ARG A 20 16.007 5.386 -13.306 1.00 0.00 C ATOM 314 CD ARG A 20 17.515 5.427 -13.594 1.00 0.00 C ATOM 315 NE ARG A 20 17.833 4.999 -14.971 1.00 0.00 N ATOM 316 CZ ARG A 20 17.733 5.725 -16.082 1.00 0.00 C ATOM 317 NH1 ARG A 20 17.257 6.955 -16.082 1.00 0.00 N ATOM 318 NH2 ARG A 20 18.125 5.218 -17.232 1.00 0.00 N ATOM 0 H ARG A 20 13.932 4.079 -11.958 1.00 0.00 H new ATOM 0 HA ARG A 20 14.175 6.589 -10.579 1.00 0.00 H new ATOM 0 HB2 ARG A 20 16.264 6.815 -11.724 1.00 0.00 H new ATOM 0 HB3 ARG A 20 16.110 5.159 -11.173 1.00 0.00 H new ATOM 0 HG2 ARG A 20 15.636 4.368 -13.422 1.00 0.00 H new ATOM 0 HG3 ARG A 20 15.476 6.003 -14.030 1.00 0.00 H new ATOM 0 HD2 ARG A 20 17.886 6.440 -13.436 1.00 0.00 H new ATOM 0 HD3 ARG A 20 18.036 4.783 -12.886 1.00 0.00 H new ATOM 0 HE ARG A 20 18.166 4.041 -15.083 1.00 0.00 H new ATOM 0 HH11 ARG A 20 16.949 7.383 -15.209 1.00 0.00 H new ATOM 0 HH12 ARG A 20 17.197 7.479 -16.955 1.00 0.00 H new ATOM 0 HH21 ARG A 20 18.504 4.272 -17.270 1.00 0.00 H new ATOM 0 HH22 ARG A 20 18.050 5.771 -18.085 1.00 0.00 H new ATOM 332 N LYS A 21 12.664 6.739 -13.383 1.00 0.00 N ATOM 333 CA LYS A 21 11.824 7.613 -14.228 1.00 0.00 C ATOM 334 C LYS A 21 10.560 8.065 -13.480 1.00 0.00 C ATOM 335 O LYS A 21 10.101 9.199 -13.638 1.00 0.00 O ATOM 336 CB LYS A 21 11.384 6.832 -15.476 1.00 0.00 C ATOM 337 CG LYS A 21 12.556 6.305 -16.298 1.00 0.00 C ATOM 338 CD LYS A 21 12.015 5.385 -17.392 1.00 0.00 C ATOM 339 CE LYS A 21 13.213 4.647 -17.973 1.00 0.00 C ATOM 340 NZ LYS A 21 12.872 3.893 -19.213 1.00 0.00 N ATOM 0 H LYS A 21 12.476 5.748 -13.532 1.00 0.00 H new ATOM 0 HA LYS A 21 12.413 8.490 -14.496 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.757 5.994 -15.170 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.770 7.478 -16.103 1.00 0.00 H new ATOM 0 HG2 LYS A 21 13.109 7.133 -16.741 1.00 0.00 H new ATOM 0 HG3 LYS A 21 13.252 5.762 -15.658 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.289 4.683 -16.983 1.00 0.00 H new ATOM 0 HD3 LYS A 21 11.503 5.960 -18.164 1.00 0.00 H new ATOM 0 HE2 LYS A 21 14.005 5.363 -18.193 1.00 0.00 H new ATOM 0 HE3 LYS A 21 13.606 3.956 -17.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 13.721 3.408 -19.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 12.135 3.190 -19.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 12.522 4.554 -19.936 1.00 0.00 H new ATOM 354 N PHE A 22 10.011 7.154 -12.670 1.00 0.00 N ATOM 355 CA PHE A 22 8.880 7.415 -11.771 1.00 0.00 C ATOM 356 C PHE A 22 9.279 8.317 -10.587 1.00 0.00 C ATOM 357 O PHE A 22 8.439 9.075 -10.099 1.00 0.00 O ATOM 358 CB PHE A 22 8.267 6.086 -11.302 1.00 0.00 C ATOM 359 CG PHE A 22 7.190 5.551 -12.234 1.00 0.00 C ATOM 360 CD1 PHE A 22 7.518 5.119 -13.534 1.00 0.00 C ATOM 361 CD2 PHE A 22 5.845 5.513 -11.812 1.00 0.00 C ATOM 362 CE1 PHE A 22 6.515 4.653 -14.403 1.00 0.00 C ATOM 363 CE2 PHE A 22 4.841 5.048 -12.681 1.00 0.00 C ATOM 364 CZ PHE A 22 5.176 4.617 -13.976 1.00 0.00 C ATOM 0 H PHE A 22 10.348 6.192 -12.619 1.00 0.00 H new ATOM 0 HA PHE A 22 8.121 7.966 -12.326 1.00 0.00 H new ATOM 0 HB2 PHE A 22 9.059 5.342 -11.210 1.00 0.00 H new ATOM 0 HB3 PHE A 22 7.841 6.222 -10.308 1.00 0.00 H new ATOM 0 HD1 PHE A 22 8.546 5.146 -13.865 1.00 0.00 H new ATOM 0 HD2 PHE A 22 5.584 5.842 -10.817 1.00 0.00 H new ATOM 0 HE1 PHE A 22 6.773 4.323 -15.398 1.00 0.00 H new ATOM 0 HE2 PHE A 22 3.812 5.022 -12.353 1.00 0.00 H new ATOM 0 HZ PHE A 22 4.406 4.258 -14.643 1.00 0.00 H new ATOM 374 N GLU A 23 10.544 8.277 -10.154 1.00 0.00 N ATOM 375 CA GLU A 23 11.121 9.252 -9.233 1.00 0.00 C ATOM 376 C GLU A 23 11.469 10.605 -9.884 1.00 0.00 C ATOM 377 O GLU A 23 11.493 10.761 -11.109 1.00 0.00 O ATOM 378 CB GLU A 23 12.351 8.664 -8.511 1.00 0.00 C ATOM 379 CG GLU A 23 12.001 8.148 -7.112 1.00 0.00 C ATOM 380 CD GLU A 23 11.765 9.274 -6.080 1.00 0.00 C ATOM 381 OE1 GLU A 23 11.325 10.392 -6.450 1.00 0.00 O ATOM 382 OE2 GLU A 23 12.010 9.031 -4.874 1.00 0.00 O ATOM 0 H GLU A 23 11.203 7.553 -10.441 1.00 0.00 H new ATOM 0 HA GLU A 23 10.339 9.465 -8.504 1.00 0.00 H new ATOM 0 HB2 GLU A 23 12.765 7.849 -9.105 1.00 0.00 H new ATOM 0 HB3 GLU A 23 13.125 9.427 -8.433 1.00 0.00 H new ATOM 0 HG2 GLU A 23 11.105 7.530 -7.175 1.00 0.00 H new ATOM 0 HG3 GLU A 23 12.807 7.505 -6.758 1.00 0.00 H new ATOM 424 N ARG A 27 8.103 11.587 -3.730 1.00 0.00 N ATOM 425 CA ARG A 27 7.038 10.915 -2.972 1.00 0.00 C ATOM 426 C ARG A 27 7.431 9.472 -2.606 1.00 0.00 C ATOM 427 O ARG A 27 8.438 8.924 -3.058 1.00 0.00 O ATOM 428 CB ARG A 27 5.702 10.915 -3.735 1.00 0.00 C ATOM 429 CG ARG A 27 4.919 12.232 -3.705 1.00 0.00 C ATOM 430 CD ARG A 27 5.582 13.423 -4.406 1.00 0.00 C ATOM 431 NE ARG A 27 6.381 14.271 -3.505 1.00 0.00 N ATOM 432 CZ ARG A 27 5.945 15.088 -2.552 1.00 0.00 C ATOM 433 NH1 ARG A 27 4.685 15.151 -2.169 1.00 0.00 N ATOM 434 NH2 ARG A 27 6.808 15.883 -1.956 1.00 0.00 N ATOM 0 HA ARG A 27 6.906 11.485 -2.053 1.00 0.00 H new ATOM 0 HB2 ARG A 27 5.899 10.654 -4.775 1.00 0.00 H new ATOM 0 HB3 ARG A 27 5.070 10.128 -3.323 1.00 0.00 H new ATOM 0 HG2 ARG A 27 3.944 12.063 -4.163 1.00 0.00 H new ATOM 0 HG3 ARG A 27 4.740 12.502 -2.664 1.00 0.00 H new ATOM 0 HD2 ARG A 27 6.224 13.052 -5.205 1.00 0.00 H new ATOM 0 HD3 ARG A 27 4.810 14.033 -4.875 1.00 0.00 H new ATOM 0 HE ARG A 27 7.393 14.226 -3.628 1.00 0.00 H new ATOM 0 HH11 ARG A 27 3.987 14.552 -2.611 1.00 0.00 H new ATOM 0 HH12 ARG A 27 4.408 15.798 -1.431 1.00 0.00 H new ATOM 0 HH21 ARG A 27 7.791 15.864 -2.228 1.00 0.00 H new ATOM 0 HH22 ARG A 27 6.494 16.518 -1.222 1.00 0.00 H new ATOM 448 N LYS A 28 6.589 8.828 -1.799 1.00 0.00 N ATOM 449 CA LYS A 28 6.764 7.464 -1.303 1.00 0.00 C ATOM 450 C LYS A 28 5.957 6.476 -2.160 1.00 0.00 C ATOM 451 O LYS A 28 4.804 6.745 -2.484 1.00 0.00 O ATOM 452 CB LYS A 28 6.305 7.414 0.168 1.00 0.00 C ATOM 453 CG LYS A 28 6.904 8.526 1.047 1.00 0.00 C ATOM 454 CD LYS A 28 5.967 9.746 1.197 1.00 0.00 C ATOM 455 CE LYS A 28 6.786 10.885 1.810 1.00 0.00 C ATOM 456 NZ LYS A 28 6.040 12.173 1.913 1.00 0.00 N ATOM 0 H LYS A 28 5.730 9.261 -1.459 1.00 0.00 H new ATOM 0 HA LYS A 28 7.814 7.177 -1.367 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.218 7.484 0.202 1.00 0.00 H new ATOM 0 HB3 LYS A 28 6.575 6.446 0.590 1.00 0.00 H new ATOM 0 HG2 LYS A 28 7.126 8.121 2.034 1.00 0.00 H new ATOM 0 HG3 LYS A 28 7.851 8.852 0.616 1.00 0.00 H new ATOM 0 HD2 LYS A 28 5.565 10.042 0.228 1.00 0.00 H new ATOM 0 HD3 LYS A 28 5.117 9.500 1.833 1.00 0.00 H new ATOM 0 HE2 LYS A 28 7.118 10.587 2.805 1.00 0.00 H new ATOM 0 HE3 LYS A 28 7.681 11.041 1.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 6.655 12.897 2.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.745 12.480 0.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.199 12.040 2.511 1.00 0.00 H new ATOM 470 N PHE A 29 6.525 5.311 -2.467 1.00 0.00 N ATOM 471 CA PHE A 29 5.835 4.218 -3.155 1.00 0.00 C ATOM 472 C PHE A 29 6.544 2.870 -3.004 1.00 0.00 C ATOM 473 O PHE A 29 7.733 2.802 -2.692 1.00 0.00 O ATOM 474 CB PHE A 29 5.575 4.572 -4.634 1.00 0.00 C ATOM 475 CG PHE A 29 6.793 4.906 -5.478 1.00 0.00 C ATOM 476 CD1 PHE A 29 7.597 3.876 -6.005 1.00 0.00 C ATOM 477 CD2 PHE A 29 7.083 6.247 -5.797 1.00 0.00 C ATOM 478 CE1 PHE A 29 8.684 4.187 -6.840 1.00 0.00 C ATOM 479 CE2 PHE A 29 8.162 6.558 -6.645 1.00 0.00 C ATOM 480 CZ PHE A 29 8.961 5.526 -7.169 1.00 0.00 C ATOM 0 H PHE A 29 7.496 5.095 -2.241 1.00 0.00 H new ATOM 0 HA PHE A 29 4.870 4.098 -2.663 1.00 0.00 H new ATOM 0 HB2 PHE A 29 5.058 3.733 -5.099 1.00 0.00 H new ATOM 0 HB3 PHE A 29 4.895 5.423 -4.666 1.00 0.00 H new ATOM 0 HD1 PHE A 29 7.378 2.846 -5.767 1.00 0.00 H new ATOM 0 HD2 PHE A 29 6.474 7.040 -5.389 1.00 0.00 H new ATOM 0 HE1 PHE A 29 9.308 3.396 -7.230 1.00 0.00 H new ATOM 0 HE2 PHE A 29 8.376 7.587 -6.893 1.00 0.00 H new ATOM 0 HZ PHE A 29 9.787 5.762 -7.824 1.00 0.00 H new ATOM 490 N ILE A 30 5.798 1.794 -3.250 1.00 0.00 N ATOM 491 CA ILE A 30 6.268 0.399 -3.259 1.00 0.00 C ATOM 492 C ILE A 30 5.615 -0.365 -4.416 1.00 0.00 C ATOM 493 O ILE A 30 4.524 -0.009 -4.853 1.00 0.00 O ATOM 494 CB ILE A 30 6.006 -0.283 -1.891 1.00 0.00 C ATOM 495 CG1 ILE A 30 4.498 -0.418 -1.581 1.00 0.00 C ATOM 496 CG2 ILE A 30 6.724 0.463 -0.752 1.00 0.00 C ATOM 497 CD1 ILE A 30 4.216 -0.931 -0.168 1.00 0.00 C ATOM 0 H ILE A 30 4.802 1.869 -3.459 1.00 0.00 H new ATOM 0 HA ILE A 30 7.347 0.388 -3.416 1.00 0.00 H new ATOM 0 HB ILE A 30 6.416 -1.291 -1.961 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.019 0.553 -1.710 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.045 -1.096 -2.304 1.00 0.00 H new ATOM 0 HG21 ILE A 30 6.522 -0.038 0.195 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.798 0.466 -0.939 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.361 1.490 -0.704 1.00 0.00 H new ATOM 0 HD11 ILE A 30 3.139 -1.003 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.667 -1.915 -0.042 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.641 -0.241 0.561 1.00 0.00 H new ATOM 509 N ILE A 31 6.270 -1.407 -4.923 1.00 0.00 N ATOM 510 CA ILE A 31 5.807 -2.239 -6.040 1.00 0.00 C ATOM 511 C ILE A 31 5.580 -3.665 -5.542 1.00 0.00 C ATOM 512 O ILE A 31 6.432 -4.243 -4.866 1.00 0.00 O ATOM 513 CB ILE A 31 6.805 -2.208 -7.224 1.00 0.00 C ATOM 514 CG1 ILE A 31 7.023 -0.771 -7.762 1.00 0.00 C ATOM 515 CG2 ILE A 31 6.284 -3.102 -8.373 1.00 0.00 C ATOM 516 CD1 ILE A 31 8.212 -0.033 -7.134 1.00 0.00 C ATOM 0 H ILE A 31 7.172 -1.709 -4.556 1.00 0.00 H new ATOM 0 HA ILE A 31 4.866 -1.837 -6.414 1.00 0.00 H new ATOM 0 HB ILE A 31 7.760 -2.582 -6.854 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.169 -0.818 -8.841 1.00 0.00 H new ATOM 0 HG13 ILE A 31 6.117 -0.190 -7.588 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.990 -3.076 -9.203 1.00 0.00 H new ATOM 0 HG22 ILE A 31 6.179 -4.127 -8.018 1.00 0.00 H new ATOM 0 HG23 ILE A 31 5.315 -2.734 -8.710 1.00 0.00 H new ATOM 0 HD11 ILE A 31 8.292 0.964 -7.567 1.00 0.00 H new ATOM 0 HD12 ILE A 31 8.061 0.050 -6.058 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.129 -0.588 -7.330 1.00 0.00 H new ATOM 528 N ALA A 32 4.439 -4.239 -5.910 1.00 0.00 N ATOM 529 CA ALA A 32 3.995 -5.556 -5.480 1.00 0.00 C ATOM 530 C ALA A 32 3.503 -6.403 -6.657 1.00 0.00 C ATOM 531 O ALA A 32 2.863 -5.902 -7.584 1.00 0.00 O ATOM 532 CB ALA A 32 2.907 -5.330 -4.430 1.00 0.00 C ATOM 0 H ALA A 32 3.777 -3.783 -6.537 1.00 0.00 H new ATOM 0 HA ALA A 32 4.821 -6.124 -5.052 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.539 -6.292 -4.074 1.00 0.00 H new ATOM 0 HB2 ALA A 32 3.320 -4.767 -3.593 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.084 -4.769 -4.873 1.00 0.00 H new ATOM 538 N ASN A 33 3.790 -7.703 -6.612 1.00 0.00 N ATOM 539 CA ASN A 33 3.365 -8.677 -7.608 1.00 0.00 C ATOM 540 C ASN A 33 1.831 -8.851 -7.627 1.00 0.00 C ATOM 541 O ASN A 33 1.252 -9.253 -6.620 1.00 0.00 O ATOM 542 CB ASN A 33 4.085 -9.986 -7.259 1.00 0.00 C ATOM 543 CG ASN A 33 3.791 -11.063 -8.280 1.00 0.00 C ATOM 544 OD1 ASN A 33 2.766 -11.729 -8.223 1.00 0.00 O ATOM 545 ND2 ASN A 33 4.646 -11.196 -9.269 1.00 0.00 N ATOM 0 H ASN A 33 4.340 -8.116 -5.859 1.00 0.00 H new ATOM 0 HA ASN A 33 3.625 -8.345 -8.613 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.160 -9.811 -7.211 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.772 -10.323 -6.271 1.00 0.00 H new ATOM 0 HD21 ASN A 33 4.463 -11.868 -10.015 1.00 0.00 H new ATOM 0 HD22 ASN A 33 5.493 -10.628 -9.291 1.00 0.00 H new ATOM 552 N ALA A 34 1.168 -8.612 -8.769 1.00 0.00 N ATOM 553 CA ALA A 34 -0.293 -8.785 -8.886 1.00 0.00 C ATOM 554 C ALA A 34 -0.739 -10.255 -9.058 1.00 0.00 C ATOM 555 O ALA A 34 -1.903 -10.576 -8.814 1.00 0.00 O ATOM 556 CB ALA A 34 -0.796 -7.931 -10.059 1.00 0.00 C ATOM 0 H ALA A 34 1.619 -8.298 -9.628 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.735 -8.457 -7.945 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -1.875 -8.049 -10.158 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.561 -6.883 -9.873 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -0.310 -8.254 -10.979 1.00 0.00 H new ATOM 562 N ARG A 35 0.173 -11.143 -9.487 1.00 0.00 N ATOM 563 CA ARG A 35 -0.119 -12.554 -9.800 1.00 0.00 C ATOM 564 C ARG A 35 -0.355 -13.403 -8.535 1.00 0.00 C ATOM 565 O ARG A 35 -1.264 -14.234 -8.521 1.00 0.00 O ATOM 566 CB ARG A 35 1.010 -13.163 -10.661 1.00 0.00 C ATOM 567 CG ARG A 35 1.439 -12.330 -11.886 1.00 0.00 C ATOM 568 CD ARG A 35 0.322 -12.077 -12.905 1.00 0.00 C ATOM 569 NE ARG A 35 -0.080 -13.316 -13.598 1.00 0.00 N ATOM 570 CZ ARG A 35 -1.048 -13.438 -14.501 1.00 0.00 C ATOM 571 NH1 ARG A 35 -1.804 -12.421 -14.863 1.00 0.00 N ATOM 572 NH2 ARG A 35 -1.267 -14.607 -15.063 1.00 0.00 N ATOM 0 H ARG A 35 1.153 -10.897 -9.629 1.00 0.00 H new ATOM 0 HA ARG A 35 -1.048 -12.568 -10.370 1.00 0.00 H new ATOM 0 HB2 ARG A 35 1.883 -13.318 -10.026 1.00 0.00 H new ATOM 0 HB3 ARG A 35 0.689 -14.145 -11.007 1.00 0.00 H new ATOM 0 HG2 ARG A 35 1.823 -11.370 -11.541 1.00 0.00 H new ATOM 0 HG3 ARG A 35 2.262 -12.841 -12.387 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -0.542 -11.648 -12.398 1.00 0.00 H new ATOM 0 HD3 ARG A 35 0.658 -11.344 -13.638 1.00 0.00 H new ATOM 0 HE ARG A 35 0.436 -14.163 -13.361 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -1.656 -11.502 -14.447 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -2.537 -12.553 -15.559 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -0.696 -15.412 -14.805 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -2.008 -14.709 -15.757 1.00 0.00 H new ATOM 586 N VAL A 36 0.435 -13.190 -7.474 1.00 0.00 N ATOM 587 CA VAL A 36 0.265 -13.865 -6.164 1.00 0.00 C ATOM 588 C VAL A 36 -0.946 -13.318 -5.390 1.00 0.00 C ATOM 589 O VAL A 36 -1.264 -12.132 -5.483 1.00 0.00 O ATOM 590 CB VAL A 36 1.535 -13.837 -5.275 1.00 0.00 C ATOM 591 CG1 VAL A 36 2.719 -14.524 -5.972 1.00 0.00 C ATOM 592 CG2 VAL A 36 1.931 -12.429 -4.801 1.00 0.00 C ATOM 0 H VAL A 36 1.220 -12.539 -7.493 1.00 0.00 H new ATOM 0 HA VAL A 36 0.080 -14.911 -6.408 1.00 0.00 H new ATOM 0 HB VAL A 36 1.274 -14.399 -4.378 1.00 0.00 H new ATOM 0 HG11 VAL A 36 3.594 -14.488 -5.323 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.465 -15.563 -6.181 1.00 0.00 H new ATOM 0 HG13 VAL A 36 2.939 -14.009 -6.907 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.828 -12.491 -4.185 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.128 -11.796 -5.666 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.118 -12.000 -4.216 1.00 0.00 H new ATOM 602 N GLU A 37 -1.601 -14.179 -4.602 1.00 0.00 N ATOM 603 CA GLU A 37 -2.863 -13.879 -3.903 1.00 0.00 C ATOM 604 C GLU A 37 -2.734 -12.733 -2.881 1.00 0.00 C ATOM 605 O GLU A 37 -3.598 -11.859 -2.804 1.00 0.00 O ATOM 606 CB GLU A 37 -3.342 -15.163 -3.204 1.00 0.00 C ATOM 607 CG GLU A 37 -4.755 -15.040 -2.619 1.00 0.00 C ATOM 608 CD GLU A 37 -5.232 -16.386 -2.055 1.00 0.00 C ATOM 609 OE1 GLU A 37 -4.958 -16.684 -0.867 1.00 0.00 O ATOM 610 OE2 GLU A 37 -5.891 -17.159 -2.792 1.00 0.00 O ATOM 0 H GLU A 37 -1.263 -15.125 -4.427 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.587 -13.540 -4.644 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.321 -15.987 -3.917 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -2.645 -15.416 -2.405 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -4.763 -14.287 -1.831 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -5.445 -14.700 -3.391 1.00 0.00 H new ATOM 617 N ASN A 38 -1.639 -12.718 -2.113 1.00 0.00 N ATOM 618 CA ASN A 38 -1.401 -11.742 -1.038 1.00 0.00 C ATOM 619 C ASN A 38 -0.953 -10.354 -1.545 1.00 0.00 C ATOM 620 O ASN A 38 -0.879 -9.416 -0.753 1.00 0.00 O ATOM 621 CB ASN A 38 -0.348 -12.330 -0.081 1.00 0.00 C ATOM 622 CG ASN A 38 -0.841 -13.576 0.655 1.00 0.00 C ATOM 623 OD1 ASN A 38 -1.925 -13.606 1.223 1.00 0.00 O ATOM 624 ND2 ASN A 38 -0.056 -14.641 0.666 1.00 0.00 N ATOM 0 H ASN A 38 -0.881 -13.392 -2.220 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.349 -11.571 -0.528 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.550 -12.580 -0.646 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -0.064 -11.572 0.649 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -0.354 -15.489 1.148 1.00 0.00 H new ATOM 0 HD22 ASN A 38 0.847 -14.614 0.192 1.00 0.00 H new ATOM 631 N CYS A 39 -0.602 -10.223 -2.834 1.00 0.00 N ATOM 632 CA CYS A 39 0.037 -9.037 -3.429 1.00 0.00 C ATOM 633 C CYS A 39 1.280 -8.592 -2.626 1.00 0.00 C ATOM 634 O CYS A 39 1.326 -7.501 -2.057 1.00 0.00 O ATOM 635 CB CYS A 39 -1.009 -7.930 -3.650 1.00 0.00 C ATOM 636 SG CYS A 39 -2.245 -8.480 -4.863 1.00 0.00 S ATOM 0 H CYS A 39 -0.761 -10.966 -3.515 1.00 0.00 H new ATOM 0 HA CYS A 39 0.427 -9.292 -4.414 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -1.497 -7.685 -2.707 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.521 -7.021 -4.002 1.00 0.00 H new ATOM 0 HG CYS A 39 -2.998 -7.476 -5.201 1.00 0.00 H new ATOM 642 N ALA A 40 2.272 -9.481 -2.520 1.00 0.00 N ATOM 643 CA ALA A 40 3.489 -9.253 -1.737 1.00 0.00 C ATOM 644 C ALA A 40 4.376 -8.152 -2.354 1.00 0.00 C ATOM 645 O ALA A 40 4.580 -8.138 -3.569 1.00 0.00 O ATOM 646 CB ALA A 40 4.237 -10.587 -1.596 1.00 0.00 C ATOM 0 H ALA A 40 2.252 -10.390 -2.981 1.00 0.00 H new ATOM 0 HA ALA A 40 3.217 -8.888 -0.747 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.147 -10.434 -1.015 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.599 -11.310 -1.088 1.00 0.00 H new ATOM 0 HB3 ALA A 40 4.497 -10.965 -2.585 1.00 0.00 H new ATOM 652 N VAL A 41 4.932 -7.259 -1.523 1.00 0.00 N ATOM 653 CA VAL A 41 5.904 -6.227 -1.955 1.00 0.00 C ATOM 654 C VAL A 41 7.171 -6.912 -2.473 1.00 0.00 C ATOM 655 O VAL A 41 7.794 -7.695 -1.753 1.00 0.00 O ATOM 656 CB VAL A 41 6.276 -5.209 -0.842 1.00 0.00 C ATOM 657 CG1 VAL A 41 7.195 -4.103 -1.372 1.00 0.00 C ATOM 658 CG2 VAL A 41 5.012 -4.548 -0.266 1.00 0.00 C ATOM 0 H VAL A 41 4.723 -7.227 -0.525 1.00 0.00 H new ATOM 0 HA VAL A 41 5.419 -5.651 -2.744 1.00 0.00 H new ATOM 0 HB VAL A 41 6.797 -5.769 -0.065 1.00 0.00 H new ATOM 0 HG11 VAL A 41 7.433 -3.410 -0.565 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.115 -4.546 -1.754 1.00 0.00 H new ATOM 0 HG13 VAL A 41 6.691 -3.565 -2.175 1.00 0.00 H new ATOM 0 HG21 VAL A 41 5.295 -3.839 0.512 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.482 -4.023 -1.061 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.363 -5.313 0.159 1.00 0.00 H new ATOM 668 N ILE A 42 7.543 -6.601 -3.716 1.00 0.00 N ATOM 669 CA ILE A 42 8.781 -7.073 -4.366 1.00 0.00 C ATOM 670 C ILE A 42 9.859 -5.983 -4.426 1.00 0.00 C ATOM 671 O ILE A 42 11.039 -6.300 -4.575 1.00 0.00 O ATOM 672 CB ILE A 42 8.495 -7.626 -5.783 1.00 0.00 C ATOM 673 CG1 ILE A 42 7.839 -6.589 -6.723 1.00 0.00 C ATOM 674 CG2 ILE A 42 7.649 -8.906 -5.673 1.00 0.00 C ATOM 675 CD1 ILE A 42 7.781 -7.037 -8.186 1.00 0.00 C ATOM 0 H ILE A 42 6.982 -5.999 -4.319 1.00 0.00 H new ATOM 0 HA ILE A 42 9.167 -7.883 -3.747 1.00 0.00 H new ATOM 0 HB ILE A 42 9.454 -7.864 -6.243 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.827 -6.384 -6.374 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.393 -5.653 -6.660 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.447 -9.296 -6.671 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.193 -9.653 -5.095 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.706 -8.678 -5.175 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.308 -6.260 -8.786 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.792 -7.214 -8.553 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.201 -7.957 -8.262 1.00 0.00 H new ATOM 687 N TYR A 43 9.461 -4.714 -4.292 1.00 0.00 N ATOM 688 CA TYR A 43 10.358 -3.560 -4.329 1.00 0.00 C ATOM 689 C TYR A 43 9.779 -2.371 -3.546 1.00 0.00 C ATOM 690 O TYR A 43 8.581 -2.106 -3.598 1.00 0.00 O ATOM 691 CB TYR A 43 10.619 -3.168 -5.792 1.00 0.00 C ATOM 692 CG TYR A 43 11.875 -2.342 -5.989 1.00 0.00 C ATOM 693 CD1 TYR A 43 13.113 -2.980 -6.199 1.00 0.00 C ATOM 694 CD2 TYR A 43 11.813 -0.938 -5.924 1.00 0.00 C ATOM 695 CE1 TYR A 43 14.284 -2.217 -6.370 1.00 0.00 C ATOM 696 CE2 TYR A 43 12.982 -0.171 -6.069 1.00 0.00 C ATOM 697 CZ TYR A 43 14.221 -0.806 -6.303 1.00 0.00 C ATOM 698 OH TYR A 43 15.345 -0.051 -6.450 1.00 0.00 O ATOM 0 H TYR A 43 8.484 -4.457 -4.152 1.00 0.00 H new ATOM 0 HA TYR A 43 11.298 -3.834 -3.851 1.00 0.00 H new ATOM 0 HB2 TYR A 43 10.693 -4.074 -6.394 1.00 0.00 H new ATOM 0 HB3 TYR A 43 9.763 -2.606 -6.166 1.00 0.00 H new ATOM 0 HD1 TYR A 43 13.164 -4.058 -6.229 1.00 0.00 H new ATOM 0 HD2 TYR A 43 10.864 -0.448 -5.762 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.228 -2.708 -6.552 1.00 0.00 H new ATOM 0 HE2 TYR A 43 12.932 0.906 -6.001 1.00 0.00 H new ATOM 0 HH TYR A 43 15.880 -0.402 -7.192 1.00 0.00 H new ATOM 708 N CYS A 44 10.632 -1.608 -2.872 1.00 0.00 N ATOM 709 CA CYS A 44 10.271 -0.371 -2.158 1.00 0.00 C ATOM 710 C CYS A 44 11.136 0.819 -2.613 1.00 0.00 C ATOM 711 O CYS A 44 12.257 0.601 -3.068 1.00 0.00 O ATOM 712 CB CYS A 44 10.416 -0.584 -0.639 1.00 0.00 C ATOM 713 SG CYS A 44 9.826 -2.204 -0.066 1.00 0.00 S ATOM 0 H CYS A 44 11.624 -1.832 -2.800 1.00 0.00 H new ATOM 0 HA CYS A 44 9.234 -0.135 -2.395 1.00 0.00 H new ATOM 0 HB2 CYS A 44 11.465 -0.472 -0.364 1.00 0.00 H new ATOM 0 HB3 CYS A 44 9.864 0.198 -0.118 1.00 0.00 H new ATOM 0 HG CYS A 44 10.178 -2.381 1.173 1.00 0.00 H new ATOM 719 N ASN A 45 10.669 2.059 -2.427 1.00 0.00 N ATOM 720 CA ASN A 45 11.517 3.257 -2.611 1.00 0.00 C ATOM 721 C ASN A 45 12.533 3.421 -1.438 1.00 0.00 C ATOM 722 O ASN A 45 12.916 2.439 -0.807 1.00 0.00 O ATOM 723 CB ASN A 45 10.607 4.492 -2.825 1.00 0.00 C ATOM 724 CG ASN A 45 11.316 5.668 -3.515 1.00 0.00 C ATOM 725 OD1 ASN A 45 12.510 5.640 -3.776 1.00 0.00 O ATOM 726 ND2 ASN A 45 10.625 6.759 -3.784 1.00 0.00 N ATOM 0 H ASN A 45 9.710 2.266 -2.149 1.00 0.00 H new ATOM 0 HA ASN A 45 12.133 3.145 -3.503 1.00 0.00 H new ATOM 0 HB2 ASN A 45 9.744 4.198 -3.423 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.227 4.824 -1.859 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.088 7.565 -4.204 1.00 0.00 H new ATOM 0 HD22 ASN A 45 9.628 6.797 -3.572 1.00 0.00 H new ATOM 733 N ASP A 46 12.932 4.651 -1.087 1.00 0.00 N ATOM 734 CA ASP A 46 13.600 5.000 0.182 1.00 0.00 C ATOM 735 C ASP A 46 12.777 5.967 1.058 1.00 0.00 C ATOM 736 O ASP A 46 12.999 6.040 2.267 1.00 0.00 O ATOM 737 CB ASP A 46 14.974 5.615 -0.123 1.00 0.00 C ATOM 738 CG ASP A 46 15.959 4.587 -0.702 1.00 0.00 C ATOM 739 OD1 ASP A 46 16.519 3.784 0.084 1.00 0.00 O ATOM 740 OD2 ASP A 46 16.200 4.603 -1.933 1.00 0.00 O ATOM 0 H ASP A 46 12.796 5.459 -1.695 1.00 0.00 H new ATOM 0 HA ASP A 46 13.707 4.078 0.754 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.853 6.436 -0.829 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.390 6.039 0.791 1.00 0.00 H new ATOM 745 N GLY A 47 11.794 6.679 0.486 1.00 0.00 N ATOM 746 CA GLY A 47 10.948 7.640 1.210 1.00 0.00 C ATOM 747 C GLY A 47 9.890 6.959 2.073 1.00 0.00 C ATOM 748 O GLY A 47 9.595 7.425 3.171 1.00 0.00 O ATOM 0 H GLY A 47 11.562 6.603 -0.504 1.00 0.00 H new ATOM 0 HA2 GLY A 47 11.577 8.268 1.841 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.458 8.298 0.493 1.00 0.00 H new ATOM 752 N PHE A 48 9.355 5.822 1.601 1.00 0.00 N ATOM 753 CA PHE A 48 8.372 4.995 2.317 1.00 0.00 C ATOM 754 C PHE A 48 8.887 4.581 3.716 1.00 0.00 C ATOM 755 O PHE A 48 8.144 4.625 4.692 1.00 0.00 O ATOM 756 CB PHE A 48 7.993 3.776 1.434 1.00 0.00 C ATOM 757 CG PHE A 48 8.930 2.583 1.564 1.00 0.00 C ATOM 758 CD1 PHE A 48 10.292 2.703 1.225 1.00 0.00 C ATOM 759 CD2 PHE A 48 8.478 1.408 2.189 1.00 0.00 C ATOM 760 CE1 PHE A 48 11.211 1.729 1.660 1.00 0.00 C ATOM 761 CE2 PHE A 48 9.394 0.417 2.579 1.00 0.00 C ATOM 762 CZ PHE A 48 10.766 0.594 2.351 1.00 0.00 C ATOM 0 H PHE A 48 9.601 5.443 0.687 1.00 0.00 H new ATOM 0 HA PHE A 48 7.470 5.580 2.498 1.00 0.00 H new ATOM 0 HB2 PHE A 48 6.983 3.458 1.692 1.00 0.00 H new ATOM 0 HB3 PHE A 48 7.971 4.092 0.391 1.00 0.00 H new ATOM 0 HD1 PHE A 48 10.631 3.540 0.633 1.00 0.00 H new ATOM 0 HD2 PHE A 48 7.423 1.267 2.370 1.00 0.00 H new ATOM 0 HE1 PHE A 48 12.265 1.857 1.460 1.00 0.00 H new ATOM 0 HE2 PHE A 48 9.040 -0.485 3.056 1.00 0.00 H new ATOM 0 HZ PHE A 48 11.475 -0.139 2.706 1.00 0.00 H new ATOM 772 N CYS A 49 10.186 4.258 3.820 1.00 0.00 N ATOM 773 CA CYS A 49 10.886 3.908 5.065 1.00 0.00 C ATOM 774 C CYS A 49 10.725 4.993 6.144 1.00 0.00 C ATOM 775 O CYS A 49 10.192 4.724 7.222 1.00 0.00 O ATOM 776 CB CYS A 49 12.348 3.602 4.690 1.00 0.00 C ATOM 777 SG CYS A 49 13.463 3.647 6.122 1.00 0.00 S ATOM 0 H CYS A 49 10.801 4.233 3.007 1.00 0.00 H new ATOM 0 HA CYS A 49 10.448 3.023 5.527 1.00 0.00 H new ATOM 0 HB2 CYS A 49 12.401 2.618 4.224 1.00 0.00 H new ATOM 0 HB3 CYS A 49 12.687 4.325 3.948 1.00 0.00 H new ATOM 0 HG CYS A 49 13.023 2.839 7.040 1.00 0.00 H new ATOM 783 N GLU A 50 11.118 6.231 5.830 1.00 0.00 N ATOM 784 CA GLU A 50 11.042 7.365 6.762 1.00 0.00 C ATOM 785 C GLU A 50 9.601 7.841 7.023 1.00 0.00 C ATOM 786 O GLU A 50 9.339 8.471 8.051 1.00 0.00 O ATOM 787 CB GLU A 50 11.901 8.526 6.241 1.00 0.00 C ATOM 788 CG GLU A 50 13.383 8.141 6.191 1.00 0.00 C ATOM 789 CD GLU A 50 14.264 9.366 5.906 1.00 0.00 C ATOM 790 OE1 GLU A 50 14.434 9.737 4.720 1.00 0.00 O ATOM 791 OE2 GLU A 50 14.797 9.971 6.867 1.00 0.00 O ATOM 0 H GLU A 50 11.500 6.478 4.917 1.00 0.00 H new ATOM 0 HA GLU A 50 11.429 7.015 7.719 1.00 0.00 H new ATOM 0 HB2 GLU A 50 11.563 8.813 5.245 1.00 0.00 H new ATOM 0 HB3 GLU A 50 11.770 9.396 6.885 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.677 7.691 7.139 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.540 7.388 5.418 1.00 0.00 H new ATOM 798 N LEU A 51 8.662 7.514 6.124 1.00 0.00 N ATOM 799 CA LEU A 51 7.231 7.799 6.272 1.00 0.00 C ATOM 800 C LEU A 51 6.680 7.186 7.569 1.00 0.00 C ATOM 801 O LEU A 51 6.099 7.905 8.380 1.00 0.00 O ATOM 802 CB LEU A 51 6.481 7.255 5.034 1.00 0.00 C ATOM 803 CG LEU A 51 5.253 8.058 4.574 1.00 0.00 C ATOM 804 CD1 LEU A 51 4.466 7.223 3.556 1.00 0.00 C ATOM 805 CD2 LEU A 51 4.304 8.470 5.695 1.00 0.00 C ATOM 0 H LEU A 51 8.884 7.032 5.253 1.00 0.00 H new ATOM 0 HA LEU A 51 7.080 8.877 6.338 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.185 7.201 4.204 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.162 6.235 5.248 1.00 0.00 H new ATOM 0 HG LEU A 51 5.643 8.981 4.145 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.592 7.784 3.223 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.102 7.000 2.699 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.144 6.291 4.021 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.469 9.031 5.277 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.927 7.580 6.198 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.837 9.094 6.412 1.00 0.00 H new ATOM 817 N CYS A 52 6.890 5.880 7.774 1.00 0.00 N ATOM 818 CA CYS A 52 6.330 5.107 8.894 1.00 0.00 C ATOM 819 C CYS A 52 7.347 4.769 10.003 1.00 0.00 C ATOM 820 O CYS A 52 6.951 4.691 11.164 1.00 0.00 O ATOM 821 CB CYS A 52 5.718 3.822 8.313 1.00 0.00 C ATOM 822 SG CYS A 52 4.336 4.229 7.202 1.00 0.00 S ATOM 0 H CYS A 52 7.468 5.316 7.151 1.00 0.00 H new ATOM 0 HA CYS A 52 5.579 5.726 9.385 1.00 0.00 H new ATOM 0 HB2 CYS A 52 6.479 3.262 7.769 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.367 3.180 9.121 1.00 0.00 H new ATOM 0 HG CYS A 52 3.831 3.133 6.718 1.00 0.00 H new ATOM 828 N GLY A 53 8.628 4.575 9.659 1.00 0.00 N ATOM 829 CA GLY A 53 9.748 4.246 10.552 1.00 0.00 C ATOM 830 C GLY A 53 10.312 2.824 10.426 1.00 0.00 C ATOM 831 O GLY A 53 11.245 2.486 11.154 1.00 0.00 O ATOM 0 H GLY A 53 8.929 4.648 8.687 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.556 4.954 10.366 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.423 4.397 11.581 1.00 0.00 H new ATOM 835 N TYR A 54 9.766 1.991 9.532 1.00 0.00 N ATOM 836 CA TYR A 54 10.240 0.620 9.283 1.00 0.00 C ATOM 837 C TYR A 54 11.498 0.583 8.372 1.00 0.00 C ATOM 838 O TYR A 54 12.165 1.599 8.189 1.00 0.00 O ATOM 839 CB TYR A 54 9.052 -0.222 8.762 1.00 0.00 C ATOM 840 CG TYR A 54 8.208 0.374 7.642 1.00 0.00 C ATOM 841 CD1 TYR A 54 8.808 0.998 6.532 1.00 0.00 C ATOM 842 CD2 TYR A 54 6.803 0.287 7.706 1.00 0.00 C ATOM 843 CE1 TYR A 54 8.014 1.551 5.515 1.00 0.00 C ATOM 844 CE2 TYR A 54 6.005 0.812 6.669 1.00 0.00 C ATOM 845 CZ TYR A 54 6.609 1.457 5.569 1.00 0.00 C ATOM 846 OH TYR A 54 5.848 1.978 4.563 1.00 0.00 O ATOM 0 H TYR A 54 8.970 2.253 8.951 1.00 0.00 H new ATOM 0 HA TYR A 54 10.586 0.171 10.214 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.443 -1.179 8.416 1.00 0.00 H new ATOM 0 HB3 TYR A 54 8.393 -0.433 9.605 1.00 0.00 H new ATOM 0 HD1 TYR A 54 9.884 1.052 6.462 1.00 0.00 H new ATOM 0 HD2 TYR A 54 6.334 -0.186 8.556 1.00 0.00 H new ATOM 0 HE1 TYR A 54 8.485 2.054 4.683 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.930 0.720 6.717 1.00 0.00 H new ATOM 0 HH TYR A 54 4.900 1.826 4.758 1.00 0.00 H new ATOM 856 N SER A 55 11.799 -0.565 7.752 1.00 0.00 N ATOM 857 CA SER A 55 12.893 -0.740 6.774 1.00 0.00 C ATOM 858 C SER A 55 12.487 -1.747 5.682 1.00 0.00 C ATOM 859 O SER A 55 11.602 -2.582 5.908 1.00 0.00 O ATOM 860 CB SER A 55 14.171 -1.243 7.481 1.00 0.00 C ATOM 861 OG SER A 55 14.660 -0.317 8.444 1.00 0.00 O ATOM 0 H SER A 55 11.276 -1.425 7.918 1.00 0.00 H new ATOM 0 HA SER A 55 13.091 0.228 6.313 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.962 -2.194 7.970 1.00 0.00 H new ATOM 0 HB3 SER A 55 14.945 -1.431 6.736 1.00 0.00 H new ATOM 0 HG SER A 55 15.467 -0.679 8.865 1.00 0.00 H new ATOM 867 N ARG A 56 13.168 -1.745 4.521 1.00 0.00 N ATOM 868 CA ARG A 56 12.903 -2.703 3.427 1.00 0.00 C ATOM 869 C ARG A 56 12.945 -4.156 3.923 1.00 0.00 C ATOM 870 O ARG A 56 12.017 -4.900 3.649 1.00 0.00 O ATOM 871 CB ARG A 56 13.860 -2.459 2.237 1.00 0.00 C ATOM 872 CG ARG A 56 13.587 -3.428 1.067 1.00 0.00 C ATOM 873 CD ARG A 56 14.548 -3.276 -0.116 1.00 0.00 C ATOM 874 NE ARG A 56 14.255 -2.089 -0.946 1.00 0.00 N ATOM 875 CZ ARG A 56 15.148 -1.429 -1.687 1.00 0.00 C ATOM 876 NH1 ARG A 56 16.424 -1.760 -1.704 1.00 0.00 N ATOM 877 NH2 ARG A 56 14.790 -0.418 -2.447 1.00 0.00 N ATOM 0 H ARG A 56 13.915 -1.082 4.313 1.00 0.00 H new ATOM 0 HA ARG A 56 11.889 -2.531 3.066 1.00 0.00 H new ATOM 0 HB2 ARG A 56 13.752 -1.432 1.890 1.00 0.00 H new ATOM 0 HB3 ARG A 56 14.891 -2.575 2.571 1.00 0.00 H new ATOM 0 HG2 ARG A 56 13.645 -4.451 1.437 1.00 0.00 H new ATOM 0 HG3 ARG A 56 12.567 -3.274 0.714 1.00 0.00 H new ATOM 0 HD2 ARG A 56 15.569 -3.208 0.259 1.00 0.00 H new ATOM 0 HD3 ARG A 56 14.495 -4.170 -0.738 1.00 0.00 H new ATOM 0 HE ARG A 56 13.294 -1.747 -0.953 1.00 0.00 H new ATOM 0 HH11 ARG A 56 16.756 -2.542 -1.139 1.00 0.00 H new ATOM 0 HH12 ARG A 56 17.080 -1.234 -2.282 1.00 0.00 H new ATOM 0 HH21 ARG A 56 13.814 -0.124 -2.478 1.00 0.00 H new ATOM 0 HH22 ARG A 56 15.488 0.073 -3.005 1.00 0.00 H new ATOM 891 N ALA A 57 13.925 -4.542 4.744 1.00 0.00 N ATOM 892 CA ALA A 57 14.019 -5.891 5.336 1.00 0.00 C ATOM 893 C ALA A 57 12.762 -6.325 6.133 1.00 0.00 C ATOM 894 O ALA A 57 12.482 -7.521 6.226 1.00 0.00 O ATOM 895 CB ALA A 57 15.275 -5.926 6.216 1.00 0.00 C ATOM 0 H ALA A 57 14.687 -3.924 5.023 1.00 0.00 H new ATOM 0 HA ALA A 57 14.085 -6.614 4.523 1.00 0.00 H new ATOM 0 HB1 ALA A 57 15.374 -6.912 6.670 1.00 0.00 H new ATOM 0 HB2 ALA A 57 16.153 -5.718 5.605 1.00 0.00 H new ATOM 0 HB3 ALA A 57 15.191 -5.173 7.000 1.00 0.00 H new ATOM 901 N GLU A 58 11.993 -5.366 6.665 1.00 0.00 N ATOM 902 CA GLU A 58 10.747 -5.600 7.412 1.00 0.00 C ATOM 903 C GLU A 58 9.510 -5.573 6.500 1.00 0.00 C ATOM 904 O GLU A 58 8.599 -6.380 6.691 1.00 0.00 O ATOM 905 CB GLU A 58 10.574 -4.530 8.505 1.00 0.00 C ATOM 906 CG GLU A 58 11.819 -4.316 9.370 1.00 0.00 C ATOM 907 CD GLU A 58 12.227 -5.578 10.147 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.445 -6.044 11.009 1.00 0.00 O ATOM 909 OE2 GLU A 58 13.343 -6.102 9.915 1.00 0.00 O ATOM 0 H GLU A 58 12.226 -4.376 6.586 1.00 0.00 H new ATOM 0 HA GLU A 58 10.827 -6.592 7.857 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.305 -3.585 8.034 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.741 -4.814 9.149 1.00 0.00 H new ATOM 0 HG2 GLU A 58 12.647 -4.002 8.735 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.632 -3.506 10.074 1.00 0.00 H new ATOM 916 N VAL A 59 9.474 -4.656 5.521 1.00 0.00 N ATOM 917 CA VAL A 59 8.359 -4.501 4.556 1.00 0.00 C ATOM 918 C VAL A 59 8.439 -5.522 3.400 1.00 0.00 C ATOM 919 O VAL A 59 7.444 -5.777 2.722 1.00 0.00 O ATOM 920 CB VAL A 59 8.264 -3.037 4.051 1.00 0.00 C ATOM 921 CG1 VAL A 59 7.162 -2.805 3.000 1.00 0.00 C ATOM 922 CG2 VAL A 59 7.977 -2.116 5.249 1.00 0.00 C ATOM 0 H VAL A 59 10.229 -3.987 5.370 1.00 0.00 H new ATOM 0 HA VAL A 59 7.432 -4.723 5.084 1.00 0.00 H new ATOM 0 HB VAL A 59 9.218 -2.817 3.572 1.00 0.00 H new ATOM 0 HG11 VAL A 59 7.161 -1.757 2.699 1.00 0.00 H new ATOM 0 HG12 VAL A 59 7.352 -3.433 2.129 1.00 0.00 H new ATOM 0 HG13 VAL A 59 6.192 -3.060 3.427 1.00 0.00 H new ATOM 0 HG21 VAL A 59 7.908 -1.084 4.906 1.00 0.00 H new ATOM 0 HG22 VAL A 59 7.035 -2.407 5.715 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.784 -2.203 5.977 1.00 0.00 H new ATOM 932 N MET A 60 9.591 -6.172 3.199 1.00 0.00 N ATOM 933 CA MET A 60 9.736 -7.282 2.244 1.00 0.00 C ATOM 934 C MET A 60 8.908 -8.502 2.675 1.00 0.00 C ATOM 935 O MET A 60 8.852 -8.842 3.857 1.00 0.00 O ATOM 936 CB MET A 60 11.217 -7.654 2.059 1.00 0.00 C ATOM 937 CG MET A 60 11.898 -6.692 1.074 1.00 0.00 C ATOM 938 SD MET A 60 11.423 -6.873 -0.670 1.00 0.00 S ATOM 939 CE MET A 60 12.292 -8.413 -1.071 1.00 0.00 C ATOM 0 H MET A 60 10.453 -5.944 3.695 1.00 0.00 H new ATOM 0 HA MET A 60 9.349 -6.947 1.282 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.729 -7.620 3.021 1.00 0.00 H new ATOM 0 HB3 MET A 60 11.297 -8.677 1.691 1.00 0.00 H new ATOM 0 HG2 MET A 60 11.681 -5.670 1.385 1.00 0.00 H new ATOM 0 HG3 MET A 60 12.977 -6.826 1.152 1.00 0.00 H new ATOM 0 HE1 MET A 60 12.196 -8.618 -2.137 1.00 0.00 H new ATOM 0 HE2 MET A 60 13.347 -8.313 -0.814 1.00 0.00 H new ATOM 0 HE3 MET A 60 11.856 -9.235 -0.503 1.00 0.00 H new ATOM 949 N GLN A 61 8.244 -9.134 1.697 1.00 0.00 N ATOM 950 CA GLN A 61 7.348 -10.299 1.853 1.00 0.00 C ATOM 951 C GLN A 61 5.989 -9.953 2.505 1.00 0.00 C ATOM 952 O GLN A 61 5.173 -10.839 2.762 1.00 0.00 O ATOM 953 CB GLN A 61 8.093 -11.458 2.565 1.00 0.00 C ATOM 954 CG GLN A 61 7.591 -12.877 2.239 1.00 0.00 C ATOM 955 CD GLN A 61 7.778 -13.258 0.767 1.00 0.00 C ATOM 956 OE1 GLN A 61 8.887 -13.375 0.261 1.00 0.00 O ATOM 957 NE2 GLN A 61 6.710 -13.438 0.014 1.00 0.00 N ATOM 0 H GLN A 61 8.318 -8.835 0.725 1.00 0.00 H new ATOM 0 HA GLN A 61 7.080 -10.640 0.853 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.150 -11.399 2.306 1.00 0.00 H new ATOM 0 HB3 GLN A 61 8.019 -11.305 3.642 1.00 0.00 H new ATOM 0 HG2 GLN A 61 8.121 -13.596 2.864 1.00 0.00 H new ATOM 0 HG3 GLN A 61 6.534 -12.950 2.495 1.00 0.00 H new ATOM 0 HE21 GLN A 61 5.779 -13.344 0.419 1.00 0.00 H new ATOM 0 HE22 GLN A 61 6.816 -13.671 -0.973 1.00 0.00 H new ATOM 966 N ARG A 62 5.714 -8.662 2.737 1.00 0.00 N ATOM 967 CA ARG A 62 4.442 -8.165 3.289 1.00 0.00 C ATOM 968 C ARG A 62 3.419 -7.928 2.173 1.00 0.00 C ATOM 969 O ARG A 62 3.832 -7.605 1.052 1.00 0.00 O ATOM 970 CB ARG A 62 4.629 -6.845 4.061 1.00 0.00 C ATOM 971 CG ARG A 62 5.594 -6.920 5.244 1.00 0.00 C ATOM 972 CD ARG A 62 5.148 -7.832 6.389 1.00 0.00 C ATOM 973 NE ARG A 62 6.277 -8.015 7.314 1.00 0.00 N ATOM 974 CZ ARG A 62 6.344 -8.825 8.362 1.00 0.00 C ATOM 975 NH1 ARG A 62 5.331 -9.582 8.734 1.00 0.00 N ATOM 976 NH2 ARG A 62 7.460 -8.878 9.056 1.00 0.00 N ATOM 0 H ARG A 62 6.383 -7.917 2.543 1.00 0.00 H new ATOM 0 HA ARG A 62 4.081 -8.932 3.974 1.00 0.00 H new ATOM 0 HB2 ARG A 62 4.986 -6.084 3.368 1.00 0.00 H new ATOM 0 HB3 ARG A 62 3.657 -6.514 4.425 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.562 -7.265 4.882 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.741 -5.914 5.637 1.00 0.00 H new ATOM 0 HD2 ARG A 62 4.298 -7.393 6.912 1.00 0.00 H new ATOM 0 HD3 ARG A 62 4.819 -8.795 5.999 1.00 0.00 H new ATOM 0 HE ARG A 62 7.107 -7.452 7.127 1.00 0.00 H new ATOM 0 HH11 ARG A 62 4.456 -9.558 8.210 1.00 0.00 H new ATOM 0 HH12 ARG A 62 5.422 -10.192 9.546 1.00 0.00 H new ATOM 0 HH21 ARG A 62 8.257 -8.302 8.785 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.529 -9.496 9.865 1.00 0.00 H new ATOM 990 N PRO A 63 2.107 -8.012 2.467 1.00 0.00 N ATOM 991 CA PRO A 63 1.056 -7.627 1.534 1.00 0.00 C ATOM 992 C PRO A 63 1.021 -6.101 1.380 1.00 0.00 C ATOM 993 O PRO A 63 1.096 -5.365 2.365 1.00 0.00 O ATOM 994 CB PRO A 63 -0.234 -8.193 2.134 1.00 0.00 C ATOM 995 CG PRO A 63 0.031 -8.222 3.638 1.00 0.00 C ATOM 996 CD PRO A 63 1.538 -8.443 3.742 1.00 0.00 C ATOM 0 HA PRO A 63 1.212 -8.017 0.528 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -1.093 -7.567 1.893 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -0.448 -9.190 1.748 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -0.270 -7.289 4.115 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -0.525 -9.023 4.126 1.00 0.00 H new ATOM 0 HD2 PRO A 63 1.958 -7.870 4.568 1.00 0.00 H new ATOM 0 HD3 PRO A 63 1.764 -9.492 3.934 1.00 0.00 H new ATOM 1004 N CYS A 64 0.894 -5.616 0.141 1.00 0.00 N ATOM 1005 CA CYS A 64 0.927 -4.182 -0.189 1.00 0.00 C ATOM 1006 C CYS A 64 -0.290 -3.383 0.321 1.00 0.00 C ATOM 1007 O CYS A 64 -0.295 -2.153 0.247 1.00 0.00 O ATOM 1008 CB CYS A 64 1.107 -4.065 -1.707 1.00 0.00 C ATOM 1009 SG CYS A 64 -0.399 -4.578 -2.586 1.00 0.00 S ATOM 0 H CYS A 64 0.763 -6.214 -0.675 1.00 0.00 H new ATOM 0 HA CYS A 64 1.765 -3.723 0.336 1.00 0.00 H new ATOM 0 HB2 CYS A 64 1.352 -3.036 -1.969 1.00 0.00 H new ATOM 0 HB3 CYS A 64 1.946 -4.683 -2.026 1.00 0.00 H new ATOM 0 HG CYS A 64 -0.213 -4.465 -3.868 1.00 0.00 H new ATOM 1015 N THR A 65 -1.307 -4.072 0.857 1.00 0.00 N ATOM 1016 CA THR A 65 -2.430 -3.480 1.601 1.00 0.00 C ATOM 1017 C THR A 65 -1.967 -2.769 2.873 1.00 0.00 C ATOM 1018 O THR A 65 -2.671 -1.874 3.344 1.00 0.00 O ATOM 1019 CB THR A 65 -3.451 -4.559 1.976 1.00 0.00 C ATOM 1020 OG1 THR A 65 -2.769 -5.586 2.668 1.00 0.00 O ATOM 1021 CG2 THR A 65 -4.130 -5.163 0.744 1.00 0.00 C ATOM 0 H THR A 65 -1.374 -5.087 0.783 1.00 0.00 H new ATOM 0 HA THR A 65 -2.890 -2.742 0.944 1.00 0.00 H new ATOM 0 HB THR A 65 -4.226 -4.101 2.591 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.404 -6.288 2.920 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.845 -5.923 1.059 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.651 -4.379 0.195 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.377 -5.618 0.100 1.00 0.00 H new ATOM 1029 N CYS A 66 -0.802 -3.155 3.416 1.00 0.00 N ATOM 1030 CA CYS A 66 -0.180 -2.570 4.609 1.00 0.00 C ATOM 1031 C CYS A 66 -1.088 -2.633 5.855 1.00 0.00 C ATOM 1032 O CYS A 66 -1.073 -1.739 6.703 1.00 0.00 O ATOM 1033 CB CYS A 66 0.370 -1.170 4.282 1.00 0.00 C ATOM 1034 SG CYS A 66 1.765 -1.319 3.126 1.00 0.00 S ATOM 0 H CYS A 66 -0.247 -3.913 3.019 1.00 0.00 H new ATOM 0 HA CYS A 66 0.675 -3.183 4.894 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -0.414 -0.553 3.844 1.00 0.00 H new ATOM 0 HB3 CYS A 66 0.693 -0.672 5.196 1.00 0.00 H new ATOM 0 HG CYS A 66 1.319 -1.630 1.945 1.00 0.00 H new ATOM 1040 N ASP A 67 -1.852 -3.724 5.992 1.00 0.00 N ATOM 1041 CA ASP A 67 -2.733 -3.991 7.136 1.00 0.00 C ATOM 1042 C ASP A 67 -1.973 -3.962 8.477 1.00 0.00 C ATOM 1043 O ASP A 67 -2.524 -3.550 9.497 1.00 0.00 O ATOM 1044 CB ASP A 67 -3.408 -5.352 6.918 1.00 0.00 C ATOM 1045 CG ASP A 67 -4.396 -5.700 8.044 1.00 0.00 C ATOM 1046 OD1 ASP A 67 -5.482 -5.076 8.105 1.00 0.00 O ATOM 1047 OD2 ASP A 67 -4.097 -6.622 8.841 1.00 0.00 O ATOM 0 H ASP A 67 -1.875 -4.465 5.292 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.483 -3.203 7.195 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -3.935 -5.345 5.964 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.645 -6.128 6.855 1.00 0.00 H new ATOM 1052 N PHE A 68 -0.679 -4.312 8.457 1.00 0.00 N ATOM 1053 CA PHE A 68 0.221 -4.253 9.609 1.00 0.00 C ATOM 1054 C PHE A 68 0.403 -2.838 10.204 1.00 0.00 C ATOM 1055 O PHE A 68 0.898 -2.716 11.326 1.00 0.00 O ATOM 1056 CB PHE A 68 1.564 -4.905 9.227 1.00 0.00 C ATOM 1057 CG PHE A 68 2.347 -4.225 8.112 1.00 0.00 C ATOM 1058 CD1 PHE A 68 3.251 -3.189 8.416 1.00 0.00 C ATOM 1059 CD2 PHE A 68 2.205 -4.653 6.776 1.00 0.00 C ATOM 1060 CE1 PHE A 68 4.003 -2.582 7.393 1.00 0.00 C ATOM 1061 CE2 PHE A 68 2.953 -4.038 5.753 1.00 0.00 C ATOM 1062 CZ PHE A 68 3.851 -3.003 6.062 1.00 0.00 C ATOM 0 H PHE A 68 -0.220 -4.653 7.612 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.245 -4.815 10.418 1.00 0.00 H new ATOM 0 HB2 PHE A 68 2.194 -4.940 10.116 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.373 -5.937 8.932 1.00 0.00 H new ATOM 0 HD1 PHE A 68 3.368 -2.859 9.438 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.521 -5.454 6.537 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.698 -1.791 7.632 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.836 -4.363 4.730 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.424 -2.532 5.277 1.00 0.00 H new ATOM 1072 N LEU A 69 -0.015 -1.777 9.497 1.00 0.00 N ATOM 1073 CA LEU A 69 -0.016 -0.387 9.978 1.00 0.00 C ATOM 1074 C LEU A 69 -1.322 0.028 10.680 1.00 0.00 C ATOM 1075 O LEU A 69 -1.423 1.178 11.107 1.00 0.00 O ATOM 1076 CB LEU A 69 0.284 0.570 8.804 1.00 0.00 C ATOM 1077 CG LEU A 69 1.629 0.335 8.090 1.00 0.00 C ATOM 1078 CD1 LEU A 69 1.778 1.355 6.953 1.00 0.00 C ATOM 1079 CD2 LEU A 69 2.816 0.460 9.062 1.00 0.00 C ATOM 0 H LEU A 69 -0.373 -1.865 8.546 1.00 0.00 H new ATOM 0 HA LEU A 69 0.766 -0.320 10.734 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.518 0.482 8.071 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.264 1.594 9.177 1.00 0.00 H new ATOM 0 HG LEU A 69 1.634 -0.679 7.690 1.00 0.00 H new ATOM 0 HD11 LEU A 69 2.728 1.195 6.443 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.960 1.231 6.244 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.752 2.364 7.364 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.748 0.288 8.523 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.827 1.460 9.496 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.715 -0.279 9.857 1.00 0.00 H new ATOM 1091 N HIS A 70 -2.327 -0.845 10.793 1.00 0.00 N ATOM 1092 CA HIS A 70 -3.601 -0.504 11.420 1.00 0.00 C ATOM 1093 C HIS A 70 -3.544 -0.320 12.958 1.00 0.00 C ATOM 1094 O HIS A 70 -2.653 -0.822 13.654 1.00 0.00 O ATOM 1095 CB HIS A 70 -4.685 -1.525 11.017 1.00 0.00 C ATOM 1096 CG HIS A 70 -4.790 -2.759 11.889 1.00 0.00 C ATOM 1097 ND1 HIS A 70 -5.959 -3.284 12.395 1.00 0.00 N ATOM 1098 CD2 HIS A 70 -3.769 -3.549 12.352 1.00 0.00 C ATOM 1099 CE1 HIS A 70 -5.650 -4.359 13.140 1.00 0.00 C ATOM 1100 NE2 HIS A 70 -4.318 -4.562 13.149 1.00 0.00 N ATOM 0 H HIS A 70 -2.278 -1.805 10.452 1.00 0.00 H new ATOM 0 HA HIS A 70 -3.863 0.482 11.037 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -5.651 -1.020 11.019 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -4.493 -1.843 9.992 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -2.719 -3.413 12.138 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -6.369 -4.975 13.659 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -3.813 -5.302 13.636 1.00 0.00 H new ATOM 1108 N GLY A 71 -4.573 0.353 13.482 1.00 0.00 N ATOM 1109 CA GLY A 71 -4.935 0.442 14.900 1.00 0.00 C ATOM 1110 C GLY A 71 -6.398 0.886 15.070 1.00 0.00 C ATOM 1111 O GLY A 71 -7.147 0.853 14.088 1.00 0.00 O ATOM 0 H GLY A 71 -5.214 0.882 12.892 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -4.788 -0.527 15.378 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -4.276 1.149 15.403 1.00 0.00 H new ATOM 1115 N PRO A 72 -6.830 1.324 16.269 1.00 0.00 N ATOM 1116 CA PRO A 72 -8.223 1.701 16.529 1.00 0.00 C ATOM 1117 C PRO A 72 -8.722 2.909 15.712 1.00 0.00 C ATOM 1118 O PRO A 72 -9.933 3.044 15.534 1.00 0.00 O ATOM 1119 CB PRO A 72 -8.307 1.951 18.040 1.00 0.00 C ATOM 1120 CG PRO A 72 -6.868 2.266 18.448 1.00 0.00 C ATOM 1121 CD PRO A 72 -6.048 1.397 17.496 1.00 0.00 C ATOM 0 HA PRO A 72 -8.887 0.899 16.206 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -8.977 2.780 18.270 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -8.688 1.077 18.568 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -6.637 3.325 18.330 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -6.679 2.013 19.491 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -5.067 1.834 17.311 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -5.881 0.405 17.915 1.00 0.00 H new ATOM 1129 N ARG A 73 -7.827 3.759 15.182 1.00 0.00 N ATOM 1130 CA ARG A 73 -8.181 4.893 14.308 1.00 0.00 C ATOM 1131 C ARG A 73 -8.237 4.518 12.817 1.00 0.00 C ATOM 1132 O ARG A 73 -8.672 5.341 12.005 1.00 0.00 O ATOM 1133 CB ARG A 73 -7.198 6.060 14.543 1.00 0.00 C ATOM 1134 CG ARG A 73 -7.206 6.604 15.986 1.00 0.00 C ATOM 1135 CD ARG A 73 -8.496 7.356 16.344 1.00 0.00 C ATOM 1136 NE ARG A 73 -8.572 7.648 17.789 1.00 0.00 N ATOM 1137 CZ ARG A 73 -7.940 8.605 18.462 1.00 0.00 C ATOM 1138 NH1 ARG A 73 -7.115 9.452 17.881 1.00 0.00 N ATOM 1139 NH2 ARG A 73 -8.138 8.722 19.758 1.00 0.00 N ATOM 0 H ARG A 73 -6.824 3.678 15.350 1.00 0.00 H new ATOM 0 HA ARG A 73 -9.191 5.202 14.578 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -6.190 5.728 14.296 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.443 6.872 13.858 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -7.072 5.775 16.680 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -6.355 7.272 16.120 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -8.543 8.288 15.781 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.359 6.761 16.047 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.183 7.043 18.337 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -6.941 9.388 16.878 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -6.650 10.172 18.434 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -8.771 8.082 20.237 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -7.658 9.453 20.283 1.00 0.00 H new ATOM 1153 N THR A 74 -7.809 3.308 12.424 1.00 0.00 N ATOM 1154 CA THR A 74 -7.811 2.847 11.022 1.00 0.00 C ATOM 1155 C THR A 74 -9.244 2.536 10.589 1.00 0.00 C ATOM 1156 O THR A 74 -9.993 1.896 11.325 1.00 0.00 O ATOM 1157 CB THR A 74 -6.851 1.667 10.825 1.00 0.00 C ATOM 1158 OG1 THR A 74 -5.607 2.063 11.342 1.00 0.00 O ATOM 1159 CG2 THR A 74 -6.653 1.318 9.352 1.00 0.00 C ATOM 0 H THR A 74 -7.447 2.612 13.076 1.00 0.00 H new ATOM 0 HA THR A 74 -7.438 3.641 10.375 1.00 0.00 H new ATOM 0 HB THR A 74 -7.266 0.791 11.324 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.179 2.688 10.721 1.00 0.00 H new ATOM 0 HG21 THR A 74 -5.965 0.477 9.267 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.612 1.049 8.910 1.00 0.00 H new ATOM 0 HG23 THR A 74 -6.240 2.179 8.826 1.00 0.00 H new ATOM 1167 N GLN A 75 -9.642 3.036 9.415 1.00 0.00 N ATOM 1168 CA GLN A 75 -11.037 3.013 8.959 1.00 0.00 C ATOM 1169 C GLN A 75 -11.326 1.687 8.237 1.00 0.00 C ATOM 1170 O GLN A 75 -10.689 1.384 7.224 1.00 0.00 O ATOM 1171 CB GLN A 75 -11.320 4.214 8.033 1.00 0.00 C ATOM 1172 CG GLN A 75 -10.971 5.599 8.606 1.00 0.00 C ATOM 1173 CD GLN A 75 -11.816 6.011 9.812 1.00 0.00 C ATOM 1174 OE1 GLN A 75 -13.026 6.183 9.734 1.00 0.00 O ATOM 1175 NE2 GLN A 75 -11.214 6.193 10.970 1.00 0.00 N ATOM 0 H GLN A 75 -9.002 3.471 8.750 1.00 0.00 H new ATOM 0 HA GLN A 75 -11.696 3.091 9.824 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -10.762 4.074 7.107 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.378 4.206 7.772 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -9.920 5.606 8.894 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.091 6.345 7.821 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -10.207 6.053 11.049 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -11.755 6.474 11.788 1.00 0.00 H new ATOM 1184 N ARG A 76 -12.315 0.917 8.710 1.00 0.00 N ATOM 1185 CA ARG A 76 -12.644 -0.417 8.173 1.00 0.00 C ATOM 1186 C ARG A 76 -13.006 -0.380 6.678 1.00 0.00 C ATOM 1187 O ARG A 76 -12.563 -1.236 5.912 1.00 0.00 O ATOM 1188 CB ARG A 76 -13.793 -1.040 8.994 1.00 0.00 C ATOM 1189 CG ARG A 76 -13.451 -1.308 10.474 1.00 0.00 C ATOM 1190 CD ARG A 76 -12.358 -2.363 10.697 1.00 0.00 C ATOM 1191 NE ARG A 76 -12.784 -3.698 10.235 1.00 0.00 N ATOM 1192 CZ ARG A 76 -12.018 -4.777 10.113 1.00 0.00 C ATOM 1193 NH1 ARG A 76 -10.733 -4.761 10.403 1.00 0.00 N ATOM 1194 NH2 ARG A 76 -12.546 -5.906 9.692 1.00 0.00 N ATOM 0 H ARG A 76 -12.916 1.202 9.483 1.00 0.00 H new ATOM 0 HA ARG A 76 -11.751 -1.036 8.262 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -14.656 -0.376 8.948 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -14.088 -1.979 8.527 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -13.134 -0.373 10.935 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -14.356 -1.627 10.990 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -11.453 -2.066 10.167 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -12.107 -2.408 11.757 1.00 0.00 H new ATOM 0 HE ARG A 76 -13.767 -3.803 9.984 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -10.295 -3.901 10.733 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -10.176 -5.609 10.297 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -13.539 -5.950 9.461 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -11.963 -6.737 9.596 1.00 0.00 H new ATOM 1208 N ARG A 77 -13.742 0.653 6.239 1.00 0.00 N ATOM 1209 CA ARG A 77 -14.095 0.861 4.823 1.00 0.00 C ATOM 1210 C ARG A 77 -12.874 1.210 3.964 1.00 0.00 C ATOM 1211 O ARG A 77 -12.777 0.758 2.829 1.00 0.00 O ATOM 1212 CB ARG A 77 -15.186 1.943 4.704 1.00 0.00 C ATOM 1213 CG ARG A 77 -15.968 1.799 3.384 1.00 0.00 C ATOM 1214 CD ARG A 77 -16.699 3.080 2.971 1.00 0.00 C ATOM 1215 NE ARG A 77 -17.694 3.513 3.970 1.00 0.00 N ATOM 1216 CZ ARG A 77 -18.322 4.685 3.995 1.00 0.00 C ATOM 1217 NH1 ARG A 77 -18.109 5.614 3.085 1.00 0.00 N ATOM 1218 NH2 ARG A 77 -19.190 4.940 4.950 1.00 0.00 N ATOM 0 H ARG A 77 -14.112 1.373 6.860 1.00 0.00 H new ATOM 0 HA ARG A 77 -14.486 -0.080 4.437 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -15.872 1.866 5.547 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -14.729 2.931 4.754 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -15.278 1.510 2.591 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -16.693 0.992 3.485 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -15.971 3.877 2.820 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -17.197 2.918 2.015 1.00 0.00 H new ATOM 0 HE ARG A 77 -17.922 2.851 4.712 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -17.444 5.445 2.330 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -18.609 6.502 3.136 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -19.379 4.240 5.668 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -19.674 5.838 4.973 1.00 0.00 H new ATOM 1232 N ALA A 78 -11.908 1.964 4.489 1.00 0.00 N ATOM 1233 CA ALA A 78 -10.691 2.338 3.757 1.00 0.00 C ATOM 1234 C ALA A 78 -9.738 1.148 3.568 1.00 0.00 C ATOM 1235 O ALA A 78 -9.258 0.911 2.461 1.00 0.00 O ATOM 1236 CB ALA A 78 -10.016 3.490 4.505 1.00 0.00 C ATOM 0 H ALA A 78 -11.945 2.336 5.438 1.00 0.00 H new ATOM 0 HA ALA A 78 -10.962 2.660 2.751 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.108 3.784 3.978 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -10.697 4.339 4.556 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -9.761 3.168 5.515 1.00 0.00 H new ATOM 1242 N ALA A 79 -9.545 0.337 4.616 1.00 0.00 N ATOM 1243 CA ALA A 79 -8.801 -0.926 4.528 1.00 0.00 C ATOM 1244 C ALA A 79 -9.392 -1.867 3.456 1.00 0.00 C ATOM 1245 O ALA A 79 -8.651 -2.561 2.757 1.00 0.00 O ATOM 1246 CB ALA A 79 -8.799 -1.565 5.923 1.00 0.00 C ATOM 0 H ALA A 79 -9.901 0.539 5.550 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.776 -0.735 4.211 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.252 -2.508 5.891 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -8.318 -0.891 6.631 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -9.825 -1.751 6.239 1.00 0.00 H new ATOM 1252 N ALA A 80 -10.717 -1.824 3.271 1.00 0.00 N ATOM 1253 CA ALA A 80 -11.433 -2.528 2.206 1.00 0.00 C ATOM 1254 C ALA A 80 -11.198 -1.895 0.833 1.00 0.00 C ATOM 1255 O ALA A 80 -10.883 -2.612 -0.113 1.00 0.00 O ATOM 1256 CB ALA A 80 -12.928 -2.530 2.542 1.00 0.00 C ATOM 0 H ALA A 80 -11.335 -1.283 3.876 1.00 0.00 H new ATOM 0 HA ALA A 80 -11.053 -3.548 2.149 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.477 -3.051 1.757 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -13.086 -3.037 3.494 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.286 -1.503 2.614 1.00 0.00 H new ATOM 1262 N GLN A 81 -11.317 -0.568 0.702 1.00 0.00 N ATOM 1263 CA GLN A 81 -11.127 0.102 -0.584 1.00 0.00 C ATOM 1264 C GLN A 81 -9.702 -0.087 -1.119 1.00 0.00 C ATOM 1265 O GLN A 81 -9.548 -0.245 -2.325 1.00 0.00 O ATOM 1266 CB GLN A 81 -11.491 1.592 -0.489 1.00 0.00 C ATOM 1267 CG GLN A 81 -12.956 1.951 -0.182 1.00 0.00 C ATOM 1268 CD GLN A 81 -13.987 0.924 -0.652 1.00 0.00 C ATOM 1269 OE1 GLN A 81 -14.317 0.823 -1.826 1.00 0.00 O ATOM 1270 NE2 GLN A 81 -14.499 0.102 0.244 1.00 0.00 N ATOM 0 H GLN A 81 -11.544 0.060 1.473 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.805 -0.366 -1.298 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -10.866 2.042 0.283 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -11.220 2.065 -1.433 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -13.063 2.084 0.894 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -13.184 2.910 -0.646 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -14.227 0.182 1.224 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -15.167 -0.614 -0.043 1.00 0.00 H new ATOM 1279 N ILE A 82 -8.665 -0.148 -0.270 1.00 0.00 N ATOM 1280 CA ILE A 82 -7.307 -0.508 -0.735 1.00 0.00 C ATOM 1281 C ILE A 82 -7.266 -1.931 -1.308 1.00 0.00 C ATOM 1282 O ILE A 82 -6.654 -2.136 -2.352 1.00 0.00 O ATOM 1283 CB ILE A 82 -6.271 -0.284 0.390 1.00 0.00 C ATOM 1284 CG1 ILE A 82 -6.159 1.232 0.645 1.00 0.00 C ATOM 1285 CG2 ILE A 82 -4.883 -0.852 0.027 1.00 0.00 C ATOM 1286 CD1 ILE A 82 -5.431 1.598 1.933 1.00 0.00 C ATOM 0 H ILE A 82 -8.733 0.043 0.730 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.036 0.155 -1.557 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.609 -0.811 1.283 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.640 1.693 -0.196 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.161 1.659 0.674 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.189 -0.670 0.848 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.964 -1.925 -0.149 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.514 -0.363 -0.874 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -5.396 2.683 2.036 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.960 1.170 2.784 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -4.415 1.204 1.901 1.00 0.00 H new ATOM 1298 N ALA A 83 -7.958 -2.901 -0.701 1.00 0.00 N ATOM 1299 CA ALA A 83 -8.064 -4.256 -1.251 1.00 0.00 C ATOM 1300 C ALA A 83 -8.886 -4.297 -2.558 1.00 0.00 C ATOM 1301 O ALA A 83 -8.524 -5.018 -3.486 1.00 0.00 O ATOM 1302 CB ALA A 83 -8.637 -5.183 -0.171 1.00 0.00 C ATOM 0 H ALA A 83 -8.457 -2.770 0.179 1.00 0.00 H new ATOM 0 HA ALA A 83 -7.070 -4.606 -1.529 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -8.721 -6.195 -0.567 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -7.975 -5.186 0.695 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -9.623 -4.827 0.128 1.00 0.00 H new ATOM 1308 N GLN A 84 -9.951 -3.492 -2.669 1.00 0.00 N ATOM 1309 CA GLN A 84 -10.726 -3.342 -3.911 1.00 0.00 C ATOM 1310 C GLN A 84 -9.914 -2.646 -5.018 1.00 0.00 C ATOM 1311 O GLN A 84 -10.070 -2.990 -6.187 1.00 0.00 O ATOM 1312 CB GLN A 84 -12.031 -2.562 -3.657 1.00 0.00 C ATOM 1313 CG GLN A 84 -13.040 -3.242 -2.712 1.00 0.00 C ATOM 1314 CD GLN A 84 -13.526 -4.603 -3.218 1.00 0.00 C ATOM 1315 OE1 GLN A 84 -14.240 -4.715 -4.208 1.00 0.00 O ATOM 1316 NE2 GLN A 84 -13.152 -5.688 -2.567 1.00 0.00 N ATOM 0 H GLN A 84 -10.302 -2.924 -1.898 1.00 0.00 H new ATOM 0 HA GLN A 84 -10.970 -4.348 -4.251 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -11.775 -1.586 -3.245 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -12.520 -2.385 -4.615 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.579 -3.370 -1.732 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.899 -2.585 -2.577 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -12.558 -5.608 -1.742 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.457 -6.607 -2.889 1.00 0.00 H new ATOM 1325 N ALA A 85 -9.003 -1.725 -4.680 1.00 0.00 N ATOM 1326 CA ALA A 85 -8.122 -1.063 -5.646 1.00 0.00 C ATOM 1327 C ALA A 85 -7.159 -2.048 -6.351 1.00 0.00 C ATOM 1328 O ALA A 85 -6.706 -1.768 -7.462 1.00 0.00 O ATOM 1329 CB ALA A 85 -7.378 0.075 -4.933 1.00 0.00 C ATOM 0 H ALA A 85 -8.857 -1.417 -3.719 1.00 0.00 H new ATOM 0 HA ALA A 85 -8.730 -0.646 -6.449 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -6.718 0.577 -5.640 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -8.100 0.791 -4.539 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -6.788 -0.334 -4.113 1.00 0.00 H new ATOM 1335 N LEU A 86 -6.894 -3.217 -5.745 1.00 0.00 N ATOM 1336 CA LEU A 86 -6.137 -4.331 -6.340 1.00 0.00 C ATOM 1337 C LEU A 86 -7.002 -5.241 -7.237 1.00 0.00 C ATOM 1338 O LEU A 86 -6.463 -6.032 -8.010 1.00 0.00 O ATOM 1339 CB LEU A 86 -5.491 -5.174 -5.224 1.00 0.00 C ATOM 1340 CG LEU A 86 -4.684 -4.390 -4.170 1.00 0.00 C ATOM 1341 CD1 LEU A 86 -4.204 -5.341 -3.067 1.00 0.00 C ATOM 1342 CD2 LEU A 86 -3.489 -3.635 -4.762 1.00 0.00 C ATOM 0 H LEU A 86 -7.211 -3.419 -4.797 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.373 -3.887 -6.978 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.278 -5.729 -4.712 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.832 -5.909 -5.686 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.356 -3.639 -3.756 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.634 -4.780 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.065 -5.806 -2.587 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.571 -6.114 -3.503 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.964 -3.104 -3.968 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.810 -4.343 -5.236 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.842 -2.919 -5.504 1.00 0.00 H new ATOM 1354 N LEU A 87 -8.335 -5.145 -7.156 1.00 0.00 N ATOM 1355 CA LEU A 87 -9.266 -5.819 -8.075 1.00 0.00 C ATOM 1356 C LEU A 87 -9.600 -4.947 -9.301 1.00 0.00 C ATOM 1357 O LEU A 87 -10.080 -5.465 -10.312 1.00 0.00 O ATOM 1358 CB LEU A 87 -10.546 -6.224 -7.316 1.00 0.00 C ATOM 1359 CG LEU A 87 -10.328 -7.123 -6.080 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -11.689 -7.457 -5.454 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -9.587 -8.427 -6.417 1.00 0.00 C ATOM 0 H LEU A 87 -8.805 -4.590 -6.441 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.778 -6.717 -8.454 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -11.061 -5.318 -6.998 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.210 -6.742 -8.008 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.703 -6.569 -5.379 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.542 -8.092 -4.580 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -12.187 -6.535 -5.153 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -12.306 -7.981 -6.184 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.462 -9.019 -5.510 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.165 -8.996 -7.145 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.608 -8.192 -6.835 1.00 0.00 H new ATOM 1373 N GLY A 88 -9.327 -3.637 -9.228 1.00 0.00 N ATOM 1374 CA GLY A 88 -9.518 -2.672 -10.317 1.00 0.00 C ATOM 1375 C GLY A 88 -8.342 -2.655 -11.298 1.00 0.00 C ATOM 1376 O GLY A 88 -7.185 -2.811 -10.904 1.00 0.00 O ATOM 0 H GLY A 88 -8.955 -3.207 -8.381 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.434 -2.914 -10.856 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -9.650 -1.675 -9.896 1.00 0.00 H new ATOM 1380 N ALA A 89 -8.638 -2.430 -12.582 1.00 0.00 N ATOM 1381 CA ALA A 89 -7.645 -2.394 -13.667 1.00 0.00 C ATOM 1382 C ALA A 89 -7.057 -0.995 -13.949 1.00 0.00 C ATOM 1383 O ALA A 89 -6.165 -0.859 -14.787 1.00 0.00 O ATOM 1384 CB ALA A 89 -8.306 -2.974 -14.920 1.00 0.00 C ATOM 0 H ALA A 89 -9.591 -2.264 -12.905 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.787 -2.989 -13.355 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.594 -2.962 -15.746 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.618 -4.000 -14.725 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -9.177 -2.374 -15.183 1.00 0.00 H new ATOM 1390 N GLU A 90 -7.563 0.036 -13.266 1.00 0.00 N ATOM 1391 CA GLU A 90 -7.174 1.446 -13.399 1.00 0.00 C ATOM 1392 C GLU A 90 -6.771 2.031 -12.029 1.00 0.00 C ATOM 1393 O GLU A 90 -7.105 1.469 -10.982 1.00 0.00 O ATOM 1394 CB GLU A 90 -8.352 2.232 -14.000 1.00 0.00 C ATOM 1395 CG GLU A 90 -8.625 1.913 -15.479 1.00 0.00 C ATOM 1396 CD GLU A 90 -7.455 2.265 -16.419 1.00 0.00 C ATOM 1397 OE1 GLU A 90 -6.759 3.284 -16.192 1.00 0.00 O ATOM 1398 OE2 GLU A 90 -7.250 1.543 -17.424 1.00 0.00 O ATOM 0 H GLU A 90 -8.294 -0.096 -12.567 1.00 0.00 H new ATOM 0 HA GLU A 90 -6.310 1.525 -14.059 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -9.251 2.020 -13.421 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -8.153 3.299 -13.900 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -8.850 0.851 -15.576 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.513 2.457 -15.800 1.00 0.00 H new ATOM 1405 N GLU A 91 -6.034 3.150 -12.029 1.00 0.00 N ATOM 1406 CA GLU A 91 -5.526 3.777 -10.796 1.00 0.00 C ATOM 1407 C GLU A 91 -6.644 4.314 -9.877 1.00 0.00 C ATOM 1408 O GLU A 91 -7.705 4.746 -10.344 1.00 0.00 O ATOM 1409 CB GLU A 91 -4.448 4.836 -11.093 1.00 0.00 C ATOM 1410 CG GLU A 91 -4.902 5.970 -12.016 1.00 0.00 C ATOM 1411 CD GLU A 91 -3.803 7.029 -12.192 1.00 0.00 C ATOM 1412 OE1 GLU A 91 -2.834 6.781 -12.948 1.00 0.00 O ATOM 1413 OE2 GLU A 91 -3.918 8.130 -11.604 1.00 0.00 O ATOM 0 H GLU A 91 -5.772 3.647 -12.880 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.044 2.980 -10.229 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.111 5.266 -10.150 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.587 4.342 -11.543 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.174 5.561 -12.989 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -5.797 6.438 -11.606 1.00 0.00 H new ATOM 1420 N ARG A 92 -6.403 4.260 -8.557 1.00 0.00 N ATOM 1421 CA ARG A 92 -7.430 4.415 -7.511 1.00 0.00 C ATOM 1422 C ARG A 92 -6.809 4.902 -6.192 1.00 0.00 C ATOM 1423 O ARG A 92 -5.925 4.245 -5.633 1.00 0.00 O ATOM 1424 CB ARG A 92 -8.179 3.070 -7.356 1.00 0.00 C ATOM 1425 CG ARG A 92 -9.656 3.158 -6.931 1.00 0.00 C ATOM 1426 CD ARG A 92 -9.897 3.756 -5.540 1.00 0.00 C ATOM 1427 NE ARG A 92 -11.266 3.470 -5.069 1.00 0.00 N ATOM 1428 CZ ARG A 92 -12.350 4.227 -5.224 1.00 0.00 C ATOM 1429 NH1 ARG A 92 -12.321 5.386 -5.853 1.00 0.00 N ATOM 1430 NH2 ARG A 92 -13.505 3.819 -4.744 1.00 0.00 N ATOM 0 H ARG A 92 -5.469 4.104 -8.178 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.149 5.181 -7.801 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -8.127 2.538 -8.306 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.647 2.465 -6.622 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.194 3.757 -7.665 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -10.086 2.157 -6.959 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.174 3.347 -4.835 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.738 4.834 -5.571 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.397 2.592 -4.567 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.445 5.733 -6.243 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.175 5.935 -5.950 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -13.567 2.926 -4.255 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -14.338 4.396 -4.860 1.00 0.00 H new ATOM 1444 N LYS A 93 -7.309 6.029 -5.667 1.00 0.00 N ATOM 1445 CA LYS A 93 -6.902 6.620 -4.380 1.00 0.00 C ATOM 1446 C LYS A 93 -7.858 6.251 -3.225 1.00 0.00 C ATOM 1447 O LYS A 93 -9.072 6.211 -3.413 1.00 0.00 O ATOM 1448 CB LYS A 93 -6.785 8.153 -4.517 1.00 0.00 C ATOM 1449 CG LYS A 93 -5.875 8.575 -5.684 1.00 0.00 C ATOM 1450 CD LYS A 93 -5.443 10.047 -5.635 1.00 0.00 C ATOM 1451 CE LYS A 93 -6.649 11.001 -5.640 1.00 0.00 C ATOM 1452 NZ LYS A 93 -6.235 12.427 -5.770 1.00 0.00 N ATOM 0 H LYS A 93 -8.031 6.573 -6.139 1.00 0.00 H new ATOM 0 HA LYS A 93 -5.929 6.201 -4.126 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -7.778 8.578 -4.663 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.394 8.568 -3.588 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.985 7.945 -5.684 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.396 8.391 -6.623 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.847 10.220 -4.739 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -4.804 10.266 -6.490 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.314 10.740 -6.464 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.217 10.871 -4.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -7.079 13.035 -5.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -5.622 12.685 -4.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.715 12.558 -6.661 1.00 0.00 H new ATOM 1466 N VAL A 94 -7.311 6.009 -2.028 1.00 0.00 N ATOM 1467 CA VAL A 94 -8.040 5.748 -0.767 1.00 0.00 C ATOM 1468 C VAL A 94 -7.333 6.484 0.370 1.00 0.00 C ATOM 1469 O VAL A 94 -6.103 6.484 0.427 1.00 0.00 O ATOM 1470 CB VAL A 94 -8.111 4.235 -0.435 1.00 0.00 C ATOM 1471 CG1 VAL A 94 -8.910 3.983 0.849 1.00 0.00 C ATOM 1472 CG2 VAL A 94 -8.717 3.453 -1.598 1.00 0.00 C ATOM 0 H VAL A 94 -6.299 5.987 -1.899 1.00 0.00 H new ATOM 0 HA VAL A 94 -9.063 6.105 -0.886 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.091 3.885 -0.273 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.941 2.913 1.054 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.432 4.498 1.682 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -9.926 4.358 0.725 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.757 2.394 -1.343 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -9.725 3.817 -1.795 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -8.102 3.589 -2.488 1.00 0.00 H new ATOM 1482 N GLU A 95 -8.100 7.097 1.272 1.00 0.00 N ATOM 1483 CA GLU A 95 -7.585 7.791 2.453 1.00 0.00 C ATOM 1484 C GLU A 95 -7.762 6.925 3.714 1.00 0.00 C ATOM 1485 O GLU A 95 -8.855 6.419 3.965 1.00 0.00 O ATOM 1486 CB GLU A 95 -8.309 9.142 2.567 1.00 0.00 C ATOM 1487 CG GLU A 95 -7.815 10.006 3.728 1.00 0.00 C ATOM 1488 CD GLU A 95 -8.586 11.335 3.790 1.00 0.00 C ATOM 1489 OE1 GLU A 95 -8.507 12.141 2.833 1.00 0.00 O ATOM 1490 OE2 GLU A 95 -9.288 11.583 4.800 1.00 0.00 O ATOM 0 H GLU A 95 -9.117 7.126 1.201 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.514 7.971 2.355 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.181 9.693 1.635 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -9.377 8.963 2.687 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.938 9.466 4.667 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.750 10.204 3.611 1.00 0.00 H new ATOM 1497 N ILE A 96 -6.702 6.744 4.515 1.00 0.00 N ATOM 1498 CA ILE A 96 -6.641 5.761 5.619 1.00 0.00 C ATOM 1499 C ILE A 96 -5.661 6.198 6.721 1.00 0.00 C ATOM 1500 O ILE A 96 -4.668 6.858 6.433 1.00 0.00 O ATOM 1501 CB ILE A 96 -6.288 4.358 5.046 1.00 0.00 C ATOM 1502 CG1 ILE A 96 -6.394 3.262 6.130 1.00 0.00 C ATOM 1503 CG2 ILE A 96 -4.913 4.332 4.353 1.00 0.00 C ATOM 1504 CD1 ILE A 96 -6.392 1.832 5.577 1.00 0.00 C ATOM 0 H ILE A 96 -5.843 7.285 4.416 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.621 5.705 6.093 1.00 0.00 H new ATOM 0 HB ILE A 96 -7.029 4.140 4.277 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -5.562 3.372 6.825 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.309 3.418 6.701 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -4.717 3.330 3.972 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.909 5.042 3.526 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.139 4.605 5.070 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.469 1.123 6.401 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -7.240 1.701 4.905 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.465 1.654 5.031 1.00 0.00 H new ATOM 1516 N ALA A 97 -5.915 5.853 7.990 1.00 0.00 N ATOM 1517 CA ALA A 97 -4.996 6.165 9.092 1.00 0.00 C ATOM 1518 C ALA A 97 -3.938 5.060 9.274 1.00 0.00 C ATOM 1519 O ALA A 97 -4.282 3.914 9.567 1.00 0.00 O ATOM 1520 CB ALA A 97 -5.800 6.431 10.370 1.00 0.00 C ATOM 0 H ALA A 97 -6.756 5.354 8.280 1.00 0.00 H new ATOM 0 HA ALA A 97 -4.440 7.071 8.851 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.117 6.663 11.188 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -6.472 7.274 10.208 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -6.383 5.546 10.624 1.00 0.00 H new ATOM 1526 N PHE A 98 -2.664 5.424 9.118 1.00 0.00 N ATOM 1527 CA PHE A 98 -1.493 4.579 9.355 1.00 0.00 C ATOM 1528 C PHE A 98 -0.772 4.992 10.645 1.00 0.00 C ATOM 1529 O PHE A 98 -0.599 6.178 10.935 1.00 0.00 O ATOM 1530 CB PHE A 98 -0.527 4.702 8.162 1.00 0.00 C ATOM 1531 CG PHE A 98 -0.888 4.002 6.859 1.00 0.00 C ATOM 1532 CD1 PHE A 98 -1.957 3.085 6.762 1.00 0.00 C ATOM 1533 CD2 PHE A 98 -0.076 4.230 5.729 1.00 0.00 C ATOM 1534 CE1 PHE A 98 -2.186 2.387 5.562 1.00 0.00 C ATOM 1535 CE2 PHE A 98 -0.314 3.543 4.525 1.00 0.00 C ATOM 1536 CZ PHE A 98 -1.363 2.612 4.446 1.00 0.00 C ATOM 0 H PHE A 98 -2.409 6.362 8.808 1.00 0.00 H new ATOM 0 HA PHE A 98 -1.824 3.546 9.462 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -0.402 5.763 7.945 1.00 0.00 H new ATOM 0 HB3 PHE A 98 0.445 4.326 8.482 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -2.602 2.919 7.612 1.00 0.00 H new ATOM 0 HD2 PHE A 98 0.737 4.939 5.789 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -2.997 1.676 5.499 1.00 0.00 H new ATOM 0 HE2 PHE A 98 0.309 3.731 3.663 1.00 0.00 H new ATOM 0 HZ PHE A 98 -1.537 2.070 3.528 1.00 0.00 H new ATOM 1546 N TYR A 99 -0.306 3.995 11.402 1.00 0.00 N ATOM 1547 CA TYR A 99 0.464 4.191 12.631 1.00 0.00 C ATOM 1548 C TYR A 99 1.986 4.196 12.388 1.00 0.00 C ATOM 1549 O TYR A 99 2.518 3.422 11.586 1.00 0.00 O ATOM 1550 CB TYR A 99 0.060 3.137 13.671 1.00 0.00 C ATOM 1551 CG TYR A 99 -1.278 3.421 14.339 1.00 0.00 C ATOM 1552 CD1 TYR A 99 -2.487 3.269 13.628 1.00 0.00 C ATOM 1553 CD2 TYR A 99 -1.310 3.865 15.676 1.00 0.00 C ATOM 1554 CE1 TYR A 99 -3.717 3.559 14.243 1.00 0.00 C ATOM 1555 CE2 TYR A 99 -2.538 4.141 16.304 1.00 0.00 C ATOM 1556 CZ TYR A 99 -3.745 3.986 15.588 1.00 0.00 C ATOM 1557 OH TYR A 99 -4.937 4.229 16.197 1.00 0.00 O ATOM 0 H TYR A 99 -0.456 3.012 11.173 1.00 0.00 H new ATOM 0 HA TYR A 99 0.224 5.181 13.018 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.016 2.161 13.188 1.00 0.00 H new ATOM 0 HB3 TYR A 99 0.834 3.079 14.437 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.467 2.927 12.604 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -0.387 3.994 16.221 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -4.638 3.455 13.688 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.558 4.471 17.332 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.780 4.514 17.121 1.00 0.00 H new ATOM 1567 N ARG A 100 2.685 5.065 13.125 1.00 0.00 N ATOM 1568 CA ARG A 100 4.146 5.189 13.181 1.00 0.00 C ATOM 1569 C ARG A 100 4.740 4.115 14.107 1.00 0.00 C ATOM 1570 O ARG A 100 4.072 3.654 15.034 1.00 0.00 O ATOM 1571 CB ARG A 100 4.468 6.624 13.649 1.00 0.00 C ATOM 1572 CG ARG A 100 5.969 6.966 13.676 1.00 0.00 C ATOM 1573 CD ARG A 100 6.262 8.471 13.812 1.00 0.00 C ATOM 1574 NE ARG A 100 5.705 9.249 12.686 1.00 0.00 N ATOM 1575 CZ ARG A 100 6.053 9.157 11.406 1.00 0.00 C ATOM 1576 NH1 ARG A 100 7.110 8.484 11.005 1.00 0.00 N ATOM 1577 NH2 ARG A 100 5.319 9.727 10.480 1.00 0.00 N ATOM 0 H ARG A 100 2.220 5.739 13.733 1.00 0.00 H new ATOM 0 HA ARG A 100 4.598 5.024 12.203 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.959 7.329 12.992 1.00 0.00 H new ATOM 0 HB3 ARG A 100 4.058 6.767 14.649 1.00 0.00 H new ATOM 0 HG2 ARG A 100 6.437 6.438 14.507 1.00 0.00 H new ATOM 0 HG3 ARG A 100 6.433 6.596 12.761 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.843 8.838 14.749 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.340 8.627 13.862 1.00 0.00 H new ATOM 0 HE ARG A 100 4.978 9.927 12.914 1.00 0.00 H new ATOM 0 HH11 ARG A 100 7.699 8.006 11.687 1.00 0.00 H new ATOM 0 HH12 ARG A 100 7.340 8.440 10.012 1.00 0.00 H new ATOM 0 HH21 ARG A 100 4.479 10.243 10.741 1.00 0.00 H new ATOM 0 HH22 ARG A 100 5.589 9.655 9.499 1.00 0.00 H new ATOM 1591 N LYS A 101 6.018 3.759 13.925 1.00 0.00 N ATOM 1592 CA LYS A 101 6.726 2.787 14.787 1.00 0.00 C ATOM 1593 C LYS A 101 6.758 3.181 16.284 1.00 0.00 C ATOM 1594 O LYS A 101 6.818 2.314 17.156 1.00 0.00 O ATOM 1595 CB LYS A 101 8.164 2.588 14.272 1.00 0.00 C ATOM 1596 CG LYS A 101 8.334 2.062 12.851 1.00 0.00 C ATOM 1597 CD LYS A 101 7.417 0.978 12.304 1.00 0.00 C ATOM 1598 CE LYS A 101 7.687 -0.375 12.984 1.00 0.00 C ATOM 1599 NZ LYS A 101 6.757 -1.442 12.516 1.00 0.00 N ATOM 0 H LYS A 101 6.598 4.135 13.175 1.00 0.00 H new ATOM 0 HA LYS A 101 6.160 1.857 14.728 1.00 0.00 H new ATOM 0 HB2 LYS A 101 8.682 3.545 14.341 1.00 0.00 H new ATOM 0 HB3 LYS A 101 8.672 1.901 14.949 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.252 2.918 12.181 1.00 0.00 H new ATOM 0 HG3 LYS A 101 9.355 1.689 12.768 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.377 1.265 12.460 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.564 0.883 11.228 1.00 0.00 H new ATOM 0 HE2 LYS A 101 8.715 -0.680 12.785 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.591 -0.261 14.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 6.979 -2.334 13.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 5.777 -1.166 12.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 6.865 -1.571 11.490 1.00 0.00 H new ATOM 1613 N ASP A 102 6.679 4.483 16.581 1.00 0.00 N ATOM 1614 CA ASP A 102 6.644 5.053 17.939 1.00 0.00 C ATOM 1615 C ASP A 102 5.261 4.955 18.627 1.00 0.00 C ATOM 1616 O ASP A 102 5.133 5.319 19.799 1.00 0.00 O ATOM 1617 CB ASP A 102 7.091 6.523 17.862 1.00 0.00 C ATOM 1618 CG ASP A 102 8.539 6.671 17.371 1.00 0.00 C ATOM 1619 OD1 ASP A 102 9.473 6.463 18.182 1.00 0.00 O ATOM 1620 OD2 ASP A 102 8.736 7.000 16.177 1.00 0.00 O ATOM 0 H ASP A 102 6.636 5.199 15.856 1.00 0.00 H new ATOM 0 HA ASP A 102 7.321 4.462 18.556 1.00 0.00 H new ATOM 0 HB2 ASP A 102 6.426 7.067 17.192 1.00 0.00 H new ATOM 0 HB3 ASP A 102 6.996 6.981 18.847 1.00 0.00 H new ATOM 1625 N GLY A 103 4.223 4.494 17.913 1.00 0.00 N ATOM 1626 CA GLY A 103 2.834 4.408 18.398 1.00 0.00 C ATOM 1627 C GLY A 103 1.975 5.640 18.086 1.00 0.00 C ATOM 1628 O GLY A 103 0.805 5.676 18.464 1.00 0.00 O ATOM 0 H GLY A 103 4.328 4.161 16.955 1.00 0.00 H new ATOM 0 HA2 GLY A 103 2.362 3.530 17.957 1.00 0.00 H new ATOM 0 HA3 GLY A 103 2.848 4.254 19.477 1.00 0.00 H new ATOM 1632 N SER A 104 2.530 6.642 17.397 1.00 0.00 N ATOM 1633 CA SER A 104 1.770 7.791 16.870 1.00 0.00 C ATOM 1634 C SER A 104 0.986 7.421 15.588 1.00 0.00 C ATOM 1635 O SER A 104 1.069 6.290 15.104 1.00 0.00 O ATOM 1636 CB SER A 104 2.719 8.981 16.654 1.00 0.00 C ATOM 1637 OG SER A 104 1.991 10.187 16.453 1.00 0.00 O ATOM 0 H SER A 104 3.527 6.683 17.185 1.00 0.00 H new ATOM 0 HA SER A 104 1.019 8.084 17.604 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.375 9.088 17.518 1.00 0.00 H new ATOM 0 HB3 SER A 104 3.357 8.789 15.791 1.00 0.00 H new ATOM 0 HG SER A 104 2.617 10.929 16.320 1.00 0.00 H new ATOM 1643 N CYS A 105 0.223 8.359 15.014 1.00 0.00 N ATOM 1644 CA CYS A 105 -0.723 8.114 13.917 1.00 0.00 C ATOM 1645 C CYS A 105 -0.916 9.353 13.021 1.00 0.00 C ATOM 1646 O CYS A 105 -0.735 10.492 13.458 1.00 0.00 O ATOM 1647 CB CYS A 105 -2.035 7.610 14.552 1.00 0.00 C ATOM 1648 SG CYS A 105 -3.227 7.059 13.298 1.00 0.00 S ATOM 0 H CYS A 105 0.247 9.336 15.307 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.332 7.356 13.238 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -1.816 6.786 15.232 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -2.479 8.407 15.149 1.00 0.00 H new ATOM 0 HG CYS A 105 -3.497 5.800 13.480 1.00 0.00 H new ATOM 1654 N PHE A 106 -1.304 9.121 11.763 1.00 0.00 N ATOM 1655 CA PHE A 106 -1.568 10.134 10.737 1.00 0.00 C ATOM 1656 C PHE A 106 -2.467 9.569 9.629 1.00 0.00 C ATOM 1657 O PHE A 106 -2.476 8.365 9.370 1.00 0.00 O ATOM 1658 CB PHE A 106 -0.244 10.658 10.146 1.00 0.00 C ATOM 1659 CG PHE A 106 0.676 9.578 9.598 1.00 0.00 C ATOM 1660 CD1 PHE A 106 1.621 8.960 10.443 1.00 0.00 C ATOM 1661 CD2 PHE A 106 0.575 9.171 8.252 1.00 0.00 C ATOM 1662 CE1 PHE A 106 2.447 7.933 9.952 1.00 0.00 C ATOM 1663 CE2 PHE A 106 1.405 8.148 7.761 1.00 0.00 C ATOM 1664 CZ PHE A 106 2.336 7.527 8.612 1.00 0.00 C ATOM 0 H PHE A 106 -1.450 8.173 11.415 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.092 10.967 11.206 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.472 11.363 9.346 1.00 0.00 H new ATOM 0 HB3 PHE A 106 0.289 11.213 10.918 1.00 0.00 H new ATOM 0 HD1 PHE A 106 1.711 9.277 11.472 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -0.141 9.646 7.597 1.00 0.00 H new ATOM 0 HE1 PHE A 106 3.165 7.458 10.604 1.00 0.00 H new ATOM 0 HE2 PHE A 106 1.327 7.839 6.729 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.967 6.736 8.235 1.00 0.00 H new ATOM 1674 N LEU A 107 -3.202 10.449 8.947 1.00 0.00 N ATOM 1675 CA LEU A 107 -3.952 10.113 7.739 1.00 0.00 C ATOM 1676 C LEU A 107 -3.025 10.112 6.517 1.00 0.00 C ATOM 1677 O LEU A 107 -2.380 11.113 6.188 1.00 0.00 O ATOM 1678 CB LEU A 107 -5.124 11.096 7.543 1.00 0.00 C ATOM 1679 CG LEU A 107 -6.510 10.667 8.073 1.00 0.00 C ATOM 1680 CD1 LEU A 107 -6.950 9.287 7.573 1.00 0.00 C ATOM 1681 CD2 LEU A 107 -6.572 10.698 9.604 1.00 0.00 C ATOM 0 H LEU A 107 -3.293 11.427 9.223 1.00 0.00 H new ATOM 0 HA LEU A 107 -4.366 9.111 7.851 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -4.857 12.038 8.023 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -5.219 11.297 6.476 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.206 11.403 7.670 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.931 9.047 7.983 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -7.003 9.294 6.484 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -6.229 8.536 7.896 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.564 10.389 9.934 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.825 10.017 10.012 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.371 11.710 9.956 1.00 0.00 H new ATOM 1693 N CYS A 108 -3.019 8.987 5.810 1.00 0.00 N ATOM 1694 CA CYS A 108 -2.277 8.736 4.584 1.00 0.00 C ATOM 1695 C CYS A 108 -3.233 8.597 3.385 1.00 0.00 C ATOM 1696 O CYS A 108 -4.298 7.982 3.485 1.00 0.00 O ATOM 1697 CB CYS A 108 -1.444 7.465 4.809 1.00 0.00 C ATOM 1698 SG CYS A 108 -0.308 7.225 3.415 1.00 0.00 S ATOM 0 H CYS A 108 -3.567 8.176 6.098 1.00 0.00 H new ATOM 0 HA CYS A 108 -1.617 9.571 4.348 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.882 7.547 5.739 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -2.101 6.601 4.909 1.00 0.00 H new ATOM 0 HG CYS A 108 -0.126 8.358 2.804 1.00 0.00 H new ATOM 1704 N LEU A 109 -2.839 9.144 2.237 1.00 0.00 N ATOM 1705 CA LEU A 109 -3.439 8.878 0.934 1.00 0.00 C ATOM 1706 C LEU A 109 -2.652 7.741 0.268 1.00 0.00 C ATOM 1707 O LEU A 109 -1.473 7.912 -0.032 1.00 0.00 O ATOM 1708 CB LEU A 109 -3.388 10.178 0.098 1.00 0.00 C ATOM 1709 CG LEU A 109 -4.305 10.186 -1.146 1.00 0.00 C ATOM 1710 CD1 LEU A 109 -5.794 10.089 -0.778 1.00 0.00 C ATOM 1711 CD2 LEU A 109 -4.063 11.488 -1.920 1.00 0.00 C ATOM 0 H LEU A 109 -2.066 9.808 2.188 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.481 8.571 1.023 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.662 11.016 0.739 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.360 10.346 -0.225 1.00 0.00 H new ATOM 0 HG LEU A 109 -4.061 9.312 -1.750 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -6.395 10.099 -1.687 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.975 9.162 -0.233 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -6.070 10.937 -0.152 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -4.703 11.511 -2.802 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.296 12.340 -1.281 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.019 11.540 -2.228 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.304 6.601 0.041 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.768 5.478 -0.749 1.00 0.00 C ATOM 1725 C VAL A 110 -3.367 5.560 -2.153 1.00 0.00 C ATOM 1726 O VAL A 110 -4.583 5.457 -2.296 1.00 0.00 O ATOM 1727 CB VAL A 110 -3.095 4.108 -0.109 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -2.556 2.953 -0.945 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -2.561 4.017 1.330 1.00 0.00 C ATOM 0 H VAL A 110 -4.240 6.422 0.406 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.681 5.557 -0.784 1.00 0.00 H new ATOM 0 HB VAL A 110 -4.181 4.026 -0.078 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.805 2.008 -0.463 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.003 2.983 -1.938 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.473 3.041 -1.032 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.808 3.042 1.749 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.479 4.146 1.325 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -3.017 4.799 1.937 1.00 0.00 H new ATOM 1739 N ASP A 111 -2.543 5.731 -3.185 1.00 0.00 N ATOM 1740 CA ASP A 111 -2.918 5.668 -4.592 1.00 0.00 C ATOM 1741 C ASP A 111 -2.315 4.400 -5.196 1.00 0.00 C ATOM 1742 O ASP A 111 -1.104 4.324 -5.366 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.386 6.927 -5.296 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.672 6.951 -6.810 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -3.662 6.327 -7.258 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -1.912 7.638 -7.533 1.00 0.00 O ATOM 0 H ASP A 111 -1.550 5.926 -3.055 1.00 0.00 H new ATOM 0 HA ASP A 111 -4.001 5.633 -4.714 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.834 7.808 -4.836 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.310 6.996 -5.136 1.00 0.00 H new ATOM 1751 N VAL A 112 -3.131 3.401 -5.524 1.00 0.00 N ATOM 1752 CA VAL A 112 -2.650 2.261 -6.322 1.00 0.00 C ATOM 1753 C VAL A 112 -2.602 2.718 -7.775 1.00 0.00 C ATOM 1754 O VAL A 112 -3.603 3.205 -8.295 1.00 0.00 O ATOM 1755 CB VAL A 112 -3.582 1.047 -6.237 1.00 0.00 C ATOM 1756 CG1 VAL A 112 -3.216 -0.087 -7.210 1.00 0.00 C ATOM 1757 CG2 VAL A 112 -3.683 0.440 -4.836 1.00 0.00 C ATOM 0 H VAL A 112 -4.114 3.351 -5.258 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.676 1.957 -5.938 1.00 0.00 H new ATOM 0 HB VAL A 112 -4.546 1.470 -6.519 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.920 -0.910 -7.091 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -3.261 0.284 -8.234 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.207 -0.439 -6.996 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.360 -0.414 -4.857 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -2.696 0.112 -4.509 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.065 1.189 -4.142 1.00 0.00 H new ATOM 1767 N VAL A 113 -1.477 2.482 -8.442 1.00 0.00 N ATOM 1768 CA VAL A 113 -1.348 2.620 -9.896 1.00 0.00 C ATOM 1769 C VAL A 113 -1.015 1.230 -10.454 1.00 0.00 C ATOM 1770 O VAL A 113 0.067 0.716 -10.155 1.00 0.00 O ATOM 1771 CB VAL A 113 -0.292 3.680 -10.278 1.00 0.00 C ATOM 1772 CG1 VAL A 113 -0.054 3.728 -11.797 1.00 0.00 C ATOM 1773 CG2 VAL A 113 -0.702 5.078 -9.790 1.00 0.00 C ATOM 0 H VAL A 113 -0.615 2.185 -7.985 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.280 2.980 -10.332 1.00 0.00 H new ATOM 0 HB VAL A 113 0.634 3.384 -9.786 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.695 4.486 -12.024 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.298 2.755 -12.141 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.987 3.976 -12.304 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.062 5.801 -10.075 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.653 5.357 -10.244 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.806 5.069 -8.705 1.00 0.00 H new ATOM 1783 N PRO A 114 -1.930 0.585 -11.204 1.00 0.00 N ATOM 1784 CA PRO A 114 -1.690 -0.728 -11.781 1.00 0.00 C ATOM 1785 C PRO A 114 -0.725 -0.609 -12.961 1.00 0.00 C ATOM 1786 O PRO A 114 -0.886 0.250 -13.827 1.00 0.00 O ATOM 1787 CB PRO A 114 -3.061 -1.256 -12.208 1.00 0.00 C ATOM 1788 CG PRO A 114 -3.874 0.006 -12.470 1.00 0.00 C ATOM 1789 CD PRO A 114 -3.285 1.028 -11.502 1.00 0.00 C ATOM 0 HA PRO A 114 -1.225 -1.415 -11.074 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -2.990 -1.878 -13.100 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -3.514 -1.868 -11.428 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -3.779 0.335 -13.505 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -4.935 -0.156 -12.283 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -3.278 2.023 -11.946 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -3.882 1.089 -10.592 1.00 0.00 H new ATOM 1797 N VAL A 115 0.268 -1.497 -12.992 1.00 0.00 N ATOM 1798 CA VAL A 115 1.207 -1.636 -14.114 1.00 0.00 C ATOM 1799 C VAL A 115 0.642 -2.680 -15.070 1.00 0.00 C ATOM 1800 O VAL A 115 0.480 -3.839 -14.684 1.00 0.00 O ATOM 1801 CB VAL A 115 2.616 -2.072 -13.650 1.00 0.00 C ATOM 1802 CG1 VAL A 115 3.616 -2.104 -14.816 1.00 0.00 C ATOM 1803 CG2 VAL A 115 3.162 -1.161 -12.542 1.00 0.00 C ATOM 0 H VAL A 115 0.449 -2.151 -12.230 1.00 0.00 H new ATOM 0 HA VAL A 115 1.316 -0.666 -14.599 1.00 0.00 H new ATOM 0 HB VAL A 115 2.504 -3.081 -13.252 1.00 0.00 H new ATOM 0 HG11 VAL A 115 4.594 -2.415 -14.448 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.271 -2.810 -15.572 1.00 0.00 H new ATOM 0 HG13 VAL A 115 3.693 -1.110 -15.256 1.00 0.00 H new ATOM 0 HG21 VAL A 115 4.154 -1.503 -12.246 1.00 0.00 H new ATOM 0 HG22 VAL A 115 3.226 -0.137 -12.911 1.00 0.00 H new ATOM 0 HG23 VAL A 115 2.494 -1.195 -11.681 1.00 0.00 H new ATOM 1813 N LYS A 116 0.376 -2.290 -16.317 1.00 0.00 N ATOM 1814 CA LYS A 116 0.084 -3.235 -17.397 1.00 0.00 C ATOM 1815 C LYS A 116 1.339 -3.622 -18.189 1.00 0.00 C ATOM 1816 O LYS A 116 2.293 -2.851 -18.306 1.00 0.00 O ATOM 1817 CB LYS A 116 -1.010 -2.697 -18.332 1.00 0.00 C ATOM 1818 CG LYS A 116 -2.371 -2.650 -17.631 1.00 0.00 C ATOM 1819 CD LYS A 116 -3.480 -2.194 -18.587 1.00 0.00 C ATOM 1820 CE LYS A 116 -4.808 -2.806 -18.128 1.00 0.00 C ATOM 1821 NZ LYS A 116 -5.941 -2.388 -19.001 1.00 0.00 N ATOM 0 H LYS A 116 0.357 -1.312 -16.607 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.289 -4.143 -16.924 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.740 -1.698 -18.673 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -1.077 -3.329 -19.218 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.612 -3.637 -17.236 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -2.320 -1.970 -16.780 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -3.548 -1.106 -18.595 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -3.252 -2.507 -19.606 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -4.728 -3.893 -18.132 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -5.011 -2.505 -17.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -6.822 -2.822 -18.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -6.034 -1.352 -18.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -5.759 -2.697 -19.977 1.00 0.00 H new ATOM 1835 N ASN A 117 1.308 -4.831 -18.750 1.00 0.00 N ATOM 1836 CA ASN A 117 2.355 -5.351 -19.628 1.00 0.00 C ATOM 1837 C ASN A 117 2.054 -5.057 -21.109 1.00 0.00 C ATOM 1838 O ASN A 117 1.065 -4.405 -21.447 1.00 0.00 O ATOM 1839 CB ASN A 117 2.570 -6.847 -19.331 1.00 0.00 C ATOM 1840 CG ASN A 117 1.569 -7.770 -20.014 1.00 0.00 C ATOM 1841 OD1 ASN A 117 1.886 -8.401 -21.009 1.00 0.00 O ATOM 1842 ND2 ASN A 117 0.332 -7.836 -19.559 1.00 0.00 N ATOM 0 H ASN A 117 0.541 -5.487 -18.604 1.00 0.00 H new ATOM 0 HA ASN A 117 3.293 -4.835 -19.423 1.00 0.00 H new ATOM 0 HB2 ASN A 117 3.576 -7.127 -19.643 1.00 0.00 H new ATOM 0 HB3 ASN A 117 2.515 -7.003 -18.254 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -0.358 -8.414 -20.039 1.00 0.00 H new ATOM 0 HD22 ASN A 117 0.066 -7.309 -18.727 1.00 0.00 H new ATOM 1849 N GLU A 118 2.890 -5.605 -21.985 1.00 0.00 N ATOM 1850 CA GLU A 118 2.785 -5.479 -23.447 1.00 0.00 C ATOM 1851 C GLU A 118 1.477 -6.046 -24.049 1.00 0.00 C ATOM 1852 O GLU A 118 1.084 -5.631 -25.140 1.00 0.00 O ATOM 1853 CB GLU A 118 4.016 -6.119 -24.113 1.00 0.00 C ATOM 1854 CG GLU A 118 4.225 -7.593 -23.740 1.00 0.00 C ATOM 1855 CD GLU A 118 5.357 -8.214 -24.573 1.00 0.00 C ATOM 1856 OE1 GLU A 118 5.095 -8.700 -25.699 1.00 0.00 O ATOM 1857 OE2 GLU A 118 6.522 -8.221 -24.108 1.00 0.00 O ATOM 0 H GLU A 118 3.688 -6.169 -21.694 1.00 0.00 H new ATOM 0 HA GLU A 118 2.753 -4.410 -23.659 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.915 -6.038 -25.195 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.905 -5.553 -23.833 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.462 -7.674 -22.679 1.00 0.00 H new ATOM 0 HG3 GLU A 118 3.301 -8.148 -23.903 1.00 0.00 H new ATOM 1864 N ASP A 119 0.776 -6.951 -23.349 1.00 0.00 N ATOM 1865 CA ASP A 119 -0.514 -7.523 -23.782 1.00 0.00 C ATOM 1866 C ASP A 119 -1.736 -6.765 -23.212 1.00 0.00 C ATOM 1867 O ASP A 119 -2.880 -7.134 -23.489 1.00 0.00 O ATOM 1868 CB ASP A 119 -0.572 -9.016 -23.410 1.00 0.00 C ATOM 1869 CG ASP A 119 0.402 -9.876 -24.235 1.00 0.00 C ATOM 1870 OD1 ASP A 119 0.285 -9.890 -25.485 1.00 0.00 O ATOM 1871 OD2 ASP A 119 1.247 -10.584 -23.635 1.00 0.00 O ATOM 0 H ASP A 119 1.093 -7.314 -22.450 1.00 0.00 H new ATOM 0 HA ASP A 119 -0.569 -7.413 -24.865 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -0.342 -9.131 -22.351 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -1.588 -9.383 -23.558 1.00 0.00 H new ATOM 1876 N GLY A 120 -1.510 -5.715 -22.409 1.00 0.00 N ATOM 1877 CA GLY A 120 -2.570 -4.889 -21.811 1.00 0.00 C ATOM 1878 C GLY A 120 -3.267 -5.527 -20.603 1.00 0.00 C ATOM 1879 O GLY A 120 -4.366 -5.102 -20.251 1.00 0.00 O ATOM 0 H GLY A 120 -0.571 -5.411 -22.153 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.141 -3.935 -21.505 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -3.318 -4.672 -22.574 1.00 0.00 H new ATOM 1883 N ALA A 121 -2.638 -6.516 -19.957 1.00 0.00 N ATOM 1884 CA ALA A 121 -3.101 -7.126 -18.704 1.00 0.00 C ATOM 1885 C ALA A 121 -2.341 -6.510 -17.528 1.00 0.00 C ATOM 1886 O ALA A 121 -1.160 -6.191 -17.673 1.00 0.00 O ATOM 1887 CB ALA A 121 -2.892 -8.651 -18.743 1.00 0.00 C ATOM 0 H ALA A 121 -1.769 -6.925 -20.300 1.00 0.00 H new ATOM 0 HA ALA A 121 -4.167 -6.932 -18.581 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -3.240 -9.090 -17.808 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -3.456 -9.074 -19.574 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -1.832 -8.870 -18.875 1.00 0.00 H new ATOM 1893 N VAL A 122 -2.986 -6.378 -16.372 1.00 0.00 N ATOM 1894 CA VAL A 122 -2.351 -5.856 -15.146 1.00 0.00 C ATOM 1895 C VAL A 122 -1.478 -6.952 -14.524 1.00 0.00 C ATOM 1896 O VAL A 122 -1.932 -8.075 -14.314 1.00 0.00 O ATOM 1897 CB VAL A 122 -3.389 -5.325 -14.130 1.00 0.00 C ATOM 1898 CG1 VAL A 122 -2.740 -4.836 -12.824 1.00 0.00 C ATOM 1899 CG2 VAL A 122 -4.177 -4.154 -14.736 1.00 0.00 C ATOM 0 H VAL A 122 -3.967 -6.628 -16.250 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.727 -5.005 -15.418 1.00 0.00 H new ATOM 0 HB VAL A 122 -4.048 -6.162 -13.900 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.513 -4.474 -12.147 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.203 -5.660 -12.354 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.043 -4.027 -13.045 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.904 -3.790 -14.010 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.490 -3.349 -14.996 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -4.697 -4.491 -15.633 1.00 0.00 H new ATOM 1909 N ILE A 123 -0.213 -6.615 -14.249 1.00 0.00 N ATOM 1910 CA ILE A 123 0.830 -7.573 -13.819 1.00 0.00 C ATOM 1911 C ILE A 123 1.495 -7.221 -12.477 1.00 0.00 C ATOM 1912 O ILE A 123 1.991 -8.110 -11.786 1.00 0.00 O ATOM 1913 CB ILE A 123 1.884 -7.713 -14.945 1.00 0.00 C ATOM 1914 CG1 ILE A 123 2.464 -6.347 -15.394 1.00 0.00 C ATOM 1915 CG2 ILE A 123 1.273 -8.472 -16.134 1.00 0.00 C ATOM 1916 CD1 ILE A 123 3.942 -6.388 -15.767 1.00 0.00 C ATOM 0 H ILE A 123 0.127 -5.656 -14.318 1.00 0.00 H new ATOM 0 HA ILE A 123 0.334 -8.528 -13.642 1.00 0.00 H new ATOM 0 HB ILE A 123 2.723 -8.282 -14.545 1.00 0.00 H new ATOM 0 HG12 ILE A 123 1.894 -5.987 -16.251 1.00 0.00 H new ATOM 0 HG13 ILE A 123 2.323 -5.624 -14.591 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.017 -8.569 -16.925 1.00 0.00 H new ATOM 0 HG22 ILE A 123 0.957 -9.463 -15.809 1.00 0.00 H new ATOM 0 HG23 ILE A 123 0.411 -7.922 -16.512 1.00 0.00 H new ATOM 0 HD11 ILE A 123 4.269 -5.393 -16.069 1.00 0.00 H new ATOM 0 HD12 ILE A 123 4.525 -6.716 -14.907 1.00 0.00 H new ATOM 0 HD13 ILE A 123 4.090 -7.085 -16.592 1.00 0.00 H new ATOM 1928 N MET A 124 1.462 -5.950 -12.071 1.00 0.00 N ATOM 1929 CA MET A 124 2.014 -5.433 -10.805 1.00 0.00 C ATOM 1930 C MET A 124 1.221 -4.212 -10.334 1.00 0.00 C ATOM 1931 O MET A 124 0.616 -3.511 -11.145 1.00 0.00 O ATOM 1932 CB MET A 124 3.494 -5.040 -10.974 1.00 0.00 C ATOM 1933 CG MET A 124 4.429 -6.224 -11.247 1.00 0.00 C ATOM 1934 SD MET A 124 6.182 -5.790 -11.376 1.00 0.00 S ATOM 1935 CE MET A 124 6.115 -4.685 -12.806 1.00 0.00 C ATOM 0 H MET A 124 1.033 -5.217 -12.636 1.00 0.00 H new ATOM 0 HA MET A 124 1.937 -6.225 -10.060 1.00 0.00 H new ATOM 0 HB2 MET A 124 3.578 -4.328 -11.795 1.00 0.00 H new ATOM 0 HB3 MET A 124 3.828 -4.528 -10.072 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.308 -6.956 -10.449 1.00 0.00 H new ATOM 0 HG3 MET A 124 4.119 -6.708 -12.173 1.00 0.00 H new ATOM 0 HE1 MET A 124 7.086 -4.671 -13.301 1.00 0.00 H new ATOM 0 HE2 MET A 124 5.357 -5.039 -13.504 1.00 0.00 H new ATOM 0 HE3 MET A 124 5.862 -3.678 -12.476 1.00 0.00 H new ATOM 1945 N PHE A 125 1.276 -3.918 -9.038 1.00 0.00 N ATOM 1946 CA PHE A 125 0.704 -2.715 -8.432 1.00 0.00 C ATOM 1947 C PHE A 125 1.813 -1.844 -7.858 1.00 0.00 C ATOM 1948 O PHE A 125 2.665 -2.329 -7.121 1.00 0.00 O ATOM 1949 CB PHE A 125 -0.283 -3.141 -7.336 1.00 0.00 C ATOM 1950 CG PHE A 125 -1.482 -3.879 -7.887 1.00 0.00 C ATOM 1951 CD1 PHE A 125 -2.398 -3.196 -8.707 1.00 0.00 C ATOM 1952 CD2 PHE A 125 -1.661 -5.249 -7.618 1.00 0.00 C ATOM 1953 CE1 PHE A 125 -3.481 -3.889 -9.277 1.00 0.00 C ATOM 1954 CE2 PHE A 125 -2.746 -5.937 -8.185 1.00 0.00 C ATOM 1955 CZ PHE A 125 -3.637 -5.263 -9.035 1.00 0.00 C ATOM 0 H PHE A 125 1.733 -4.527 -8.359 1.00 0.00 H new ATOM 0 HA PHE A 125 0.175 -2.129 -9.184 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.232 -3.778 -6.617 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -0.622 -2.258 -6.795 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.270 -2.141 -8.899 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.965 -5.770 -6.977 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -4.191 -3.365 -9.900 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -2.895 -6.984 -7.967 1.00 0.00 H new ATOM 0 HZ PHE A 125 -4.446 -5.804 -9.505 1.00 0.00 H new ATOM 1965 N ILE A 126 1.773 -0.547 -8.161 1.00 0.00 N ATOM 1966 CA ILE A 126 2.548 0.474 -7.446 1.00 0.00 C ATOM 1967 C ILE A 126 1.591 1.074 -6.421 1.00 0.00 C ATOM 1968 O ILE A 126 0.601 1.680 -6.826 1.00 0.00 O ATOM 1969 CB ILE A 126 3.097 1.562 -8.404 1.00 0.00 C ATOM 1970 CG1 ILE A 126 3.854 0.961 -9.609 1.00 0.00 C ATOM 1971 CG2 ILE A 126 4.005 2.519 -7.606 1.00 0.00 C ATOM 1972 CD1 ILE A 126 4.229 1.990 -10.682 1.00 0.00 C ATOM 0 H ILE A 126 1.199 -0.169 -8.915 1.00 0.00 H new ATOM 0 HA ILE A 126 3.426 0.036 -6.971 1.00 0.00 H new ATOM 0 HB ILE A 126 2.251 2.111 -8.819 1.00 0.00 H new ATOM 0 HG12 ILE A 126 4.762 0.477 -9.250 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.237 0.185 -10.063 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.396 3.289 -8.271 1.00 0.00 H new ATOM 0 HG22 ILE A 126 3.428 2.988 -6.809 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.833 1.958 -7.173 1.00 0.00 H new ATOM 0 HD11 ILE A 126 4.757 1.492 -11.495 1.00 0.00 H new ATOM 0 HD12 ILE A 126 3.324 2.457 -11.070 1.00 0.00 H new ATOM 0 HD13 ILE A 126 4.873 2.753 -10.245 1.00 0.00 H new ATOM 1984 N LEU A 127 1.847 0.900 -5.127 1.00 0.00 N ATOM 1985 CA LEU A 127 1.109 1.585 -4.064 1.00 0.00 C ATOM 1986 C LEU A 127 1.895 2.845 -3.746 1.00 0.00 C ATOM 1987 O LEU A 127 3.048 2.746 -3.330 1.00 0.00 O ATOM 1988 CB LEU A 127 1.011 0.697 -2.808 1.00 0.00 C ATOM 1989 CG LEU A 127 -0.096 -0.367 -2.777 1.00 0.00 C ATOM 1990 CD1 LEU A 127 -1.425 0.249 -2.356 1.00 0.00 C ATOM 1991 CD2 LEU A 127 -0.207 -1.184 -4.072 1.00 0.00 C ATOM 0 H LEU A 127 2.577 0.276 -4.782 1.00 0.00 H new ATOM 0 HA LEU A 127 0.091 1.813 -4.381 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.968 0.191 -2.678 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.875 1.349 -1.945 1.00 0.00 H new ATOM 0 HG LEU A 127 0.192 -1.096 -2.019 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.195 -0.522 -2.341 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.326 0.683 -1.361 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.706 1.028 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -1.010 -1.914 -3.974 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.424 -0.516 -4.906 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.734 -1.702 -4.257 1.00 0.00 H new ATOM 2003 N ASN A 128 1.293 4.016 -3.950 1.00 0.00 N ATOM 2004 CA ASN A 128 1.959 5.291 -3.635 1.00 0.00 C ATOM 2005 C ASN A 128 1.346 5.938 -2.389 1.00 0.00 C ATOM 2006 O ASN A 128 0.130 6.082 -2.320 1.00 0.00 O ATOM 2007 CB ASN A 128 1.946 6.288 -4.804 1.00 0.00 C ATOM 2008 CG ASN A 128 2.208 5.694 -6.185 1.00 0.00 C ATOM 2009 OD1 ASN A 128 3.287 5.820 -6.747 1.00 0.00 O ATOM 2010 ND2 ASN A 128 1.215 5.063 -6.783 1.00 0.00 N ATOM 0 H ASN A 128 0.351 4.114 -4.329 1.00 0.00 H new ATOM 0 HA ASN A 128 3.002 5.042 -3.439 1.00 0.00 H new ATOM 0 HB2 ASN A 128 0.977 6.786 -4.821 1.00 0.00 H new ATOM 0 HB3 ASN A 128 2.696 7.055 -4.611 1.00 0.00 H new ATOM 0 HD21 ASN A 128 1.345 4.678 -7.718 1.00 0.00 H new ATOM 0 HD22 ASN A 128 0.317 4.961 -6.310 1.00 0.00 H new ATOM 2017 N PHE A 129 2.175 6.338 -1.423 1.00 0.00 N ATOM 2018 CA PHE A 129 1.761 6.911 -0.144 1.00 0.00 C ATOM 2019 C PHE A 129 2.088 8.412 -0.054 1.00 0.00 C ATOM 2020 O PHE A 129 3.152 8.852 -0.489 1.00 0.00 O ATOM 2021 CB PHE A 129 2.455 6.139 0.991 1.00 0.00 C ATOM 2022 CG PHE A 129 2.356 4.623 0.973 1.00 0.00 C ATOM 2023 CD1 PHE A 129 1.193 3.975 0.516 1.00 0.00 C ATOM 2024 CD2 PHE A 129 3.433 3.856 1.456 1.00 0.00 C ATOM 2025 CE1 PHE A 129 1.098 2.574 0.568 1.00 0.00 C ATOM 2026 CE2 PHE A 129 3.343 2.453 1.496 1.00 0.00 C ATOM 2027 CZ PHE A 129 2.173 1.813 1.055 1.00 0.00 C ATOM 0 H PHE A 129 3.189 6.269 -1.515 1.00 0.00 H new ATOM 0 HA PHE A 129 0.679 6.818 -0.054 1.00 0.00 H new ATOM 0 HB2 PHE A 129 3.512 6.407 0.983 1.00 0.00 H new ATOM 0 HB3 PHE A 129 2.044 6.491 1.937 1.00 0.00 H new ATOM 0 HD1 PHE A 129 0.371 4.556 0.124 1.00 0.00 H new ATOM 0 HD2 PHE A 129 4.332 4.347 1.797 1.00 0.00 H new ATOM 0 HE1 PHE A 129 0.197 2.082 0.233 1.00 0.00 H new ATOM 0 HE2 PHE A 129 4.173 1.868 1.865 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.100 0.736 1.090 1.00 0.00 H new ATOM 2037 N GLU A 130 1.208 9.188 0.580 1.00 0.00 N ATOM 2038 CA GLU A 130 1.390 10.605 0.912 1.00 0.00 C ATOM 2039 C GLU A 130 0.702 10.884 2.253 1.00 0.00 C ATOM 2040 O GLU A 130 -0.333 10.291 2.535 1.00 0.00 O ATOM 2041 CB GLU A 130 0.793 11.493 -0.202 1.00 0.00 C ATOM 2042 CG GLU A 130 1.786 11.696 -1.360 1.00 0.00 C ATOM 2043 CD GLU A 130 1.375 12.839 -2.304 1.00 0.00 C ATOM 2044 OE1 GLU A 130 0.270 12.780 -2.894 1.00 0.00 O ATOM 2045 OE2 GLU A 130 2.172 13.792 -2.477 1.00 0.00 O ATOM 0 H GLU A 130 0.305 8.830 0.892 1.00 0.00 H new ATOM 0 HA GLU A 130 2.452 10.837 0.992 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.121 11.036 -0.582 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.516 12.462 0.214 1.00 0.00 H new ATOM 0 HG2 GLU A 130 2.775 11.906 -0.952 1.00 0.00 H new ATOM 0 HG3 GLU A 130 1.866 10.771 -1.930 1.00 0.00 H new ATOM 2052 N VAL A 131 1.239 11.773 3.091 1.00 0.00 N ATOM 2053 CA VAL A 131 0.575 12.183 4.347 1.00 0.00 C ATOM 2054 C VAL A 131 -0.415 13.299 4.010 1.00 0.00 C ATOM 2055 O VAL A 131 -0.003 14.365 3.552 1.00 0.00 O ATOM 2056 CB VAL A 131 1.570 12.642 5.442 1.00 0.00 C ATOM 2057 CG1 VAL A 131 0.828 13.053 6.728 1.00 0.00 C ATOM 2058 CG2 VAL A 131 2.558 11.520 5.787 1.00 0.00 C ATOM 0 H VAL A 131 2.137 12.229 2.928 1.00 0.00 H new ATOM 0 HA VAL A 131 0.062 11.318 4.766 1.00 0.00 H new ATOM 0 HB VAL A 131 2.111 13.500 5.044 1.00 0.00 H new ATOM 0 HG11 VAL A 131 1.551 13.371 7.479 1.00 0.00 H new ATOM 0 HG12 VAL A 131 0.148 13.876 6.508 1.00 0.00 H new ATOM 0 HG13 VAL A 131 0.260 12.204 7.107 1.00 0.00 H new ATOM 0 HG21 VAL A 131 3.247 11.866 6.558 1.00 0.00 H new ATOM 0 HG22 VAL A 131 2.010 10.652 6.153 1.00 0.00 H new ATOM 0 HG23 VAL A 131 3.121 11.244 4.895 1.00 0.00 H new ATOM 2068 N VAL A 132 -1.710 13.050 4.232 1.00 0.00 N ATOM 2069 CA VAL A 132 -2.777 14.030 3.938 1.00 0.00 C ATOM 2070 C VAL A 132 -3.137 14.900 5.154 1.00 0.00 C ATOM 2071 O VAL A 132 -3.575 16.037 4.978 1.00 0.00 O ATOM 2072 CB VAL A 132 -4.017 13.358 3.299 1.00 0.00 C ATOM 2073 CG1 VAL A 132 -4.927 12.633 4.281 1.00 0.00 C ATOM 2074 CG2 VAL A 132 -4.828 14.349 2.449 1.00 0.00 C ATOM 0 H VAL A 132 -2.053 12.171 4.618 1.00 0.00 H new ATOM 0 HA VAL A 132 -2.373 14.716 3.193 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.601 12.586 2.652 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -5.767 12.194 3.743 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -4.366 11.844 4.783 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -5.300 13.340 5.022 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -5.689 13.839 2.018 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -5.170 15.172 3.077 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.200 14.740 1.648 1.00 0.00 H new ATOM 2084 N MET A 133 -2.914 14.397 6.379 1.00 0.00 N ATOM 2085 CA MET A 133 -3.196 15.101 7.640 1.00 0.00 C ATOM 2086 C MET A 133 -2.497 14.406 8.820 1.00 0.00 C ATOM 2087 O MET A 133 -2.720 13.221 9.060 1.00 0.00 O ATOM 2088 CB MET A 133 -4.724 15.190 7.839 1.00 0.00 C ATOM 2089 CG MET A 133 -5.148 15.783 9.187 1.00 0.00 C ATOM 2090 SD MET A 133 -4.510 17.440 9.569 1.00 0.00 S ATOM 2091 CE MET A 133 -5.323 18.408 8.271 1.00 0.00 C ATOM 0 H MET A 133 -2.523 13.466 6.523 1.00 0.00 H new ATOM 0 HA MET A 133 -2.797 16.114 7.594 1.00 0.00 H new ATOM 0 HB2 MET A 133 -5.149 15.796 7.039 1.00 0.00 H new ATOM 0 HB3 MET A 133 -5.150 14.191 7.744 1.00 0.00 H new ATOM 0 HG2 MET A 133 -6.237 15.819 9.218 1.00 0.00 H new ATOM 0 HG3 MET A 133 -4.829 15.102 9.976 1.00 0.00 H new ATOM 0 HE1 MET A 133 -5.122 19.468 8.427 1.00 0.00 H new ATOM 0 HE2 MET A 133 -4.939 18.105 7.297 1.00 0.00 H new ATOM 0 HE3 MET A 133 -6.398 18.234 8.307 1.00 0.00 H new ATOM 2101 N GLU A 134 -1.667 15.127 9.575 1.00 0.00 N ATOM 2102 CA GLU A 134 -1.039 14.610 10.796 1.00 0.00 C ATOM 2103 C GLU A 134 -2.000 14.776 11.988 1.00 0.00 C ATOM 2104 O GLU A 134 -2.475 15.882 12.270 1.00 0.00 O ATOM 2105 CB GLU A 134 0.305 15.314 11.030 1.00 0.00 C ATOM 2106 CG GLU A 134 1.095 14.694 12.187 1.00 0.00 C ATOM 2107 CD GLU A 134 2.454 15.389 12.352 1.00 0.00 C ATOM 2108 OE1 GLU A 134 2.536 16.410 13.075 1.00 0.00 O ATOM 2109 OE2 GLU A 134 3.456 14.920 11.760 1.00 0.00 O ATOM 0 H GLU A 134 -1.409 16.090 9.358 1.00 0.00 H new ATOM 0 HA GLU A 134 -0.834 13.545 10.687 1.00 0.00 H new ATOM 0 HB2 GLU A 134 0.901 15.265 10.119 1.00 0.00 H new ATOM 0 HB3 GLU A 134 0.128 16.369 11.239 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.523 14.779 13.111 1.00 0.00 H new ATOM 0 HG3 GLU A 134 1.245 13.630 12.002 1.00 0.00 H new ATOM 2116 N LYS A 135 -2.307 13.661 12.666 1.00 0.00 N ATOM 2117 CA LYS A 135 -3.346 13.579 13.707 1.00 0.00 C ATOM 2118 C LYS A 135 -2.895 13.969 15.122 1.00 0.00 C ATOM 2119 O LYS A 135 -3.810 14.303 15.913 1.00 0.00 O ATOM 2120 CB LYS A 135 -3.979 12.175 13.691 1.00 0.00 C ATOM 2121 CG LYS A 135 -5.059 12.028 12.609 1.00 0.00 C ATOM 2122 CD LYS A 135 -6.298 12.916 12.797 1.00 0.00 C ATOM 2123 CE LYS A 135 -6.934 12.798 14.187 1.00 0.00 C ATOM 2124 NZ LYS A 135 -6.525 13.885 15.126 1.00 0.00 N ATOM 2125 OXT LYS A 135 -1.684 13.926 15.447 1.00 0.00 O ATOM 0 H LYS A 135 -1.832 12.773 12.504 1.00 0.00 H new ATOM 0 HA LYS A 135 -4.086 14.337 13.450 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -3.200 11.431 13.525 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.417 11.966 14.667 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -4.613 12.254 11.640 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -5.379 10.987 12.577 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -6.020 13.955 12.621 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -7.041 12.653 12.044 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -8.019 12.808 14.083 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -6.665 11.835 14.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -7.017 13.763 16.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -5.497 13.842 15.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -6.775 14.808 14.718 1.00 0.00 H new