USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 903 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 94 ASN : amide:sc= -1.35 X(o=-1.3,f=-0.94) USER MOD Set 1.2: A 113 SER OG : rot 170:sc= 0.0788 USER MOD Set 2.1: A 60 THR OG1 : rot -80:sc= 0.49! USER MOD Set 2.2: A 62 SER OG : rot -54:sc= -0.965 USER MOD Single : A 14 HIS : no HE2:sc= -0.45 K(o=-0.45,f=-4.4!) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -2.52 K(o=-2.5,f=-8.1!) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -0.301 X(o=-0.3,f=-0.065) USER MOD Single : A 35 LYS NZ :NH3+ 175:sc= 0.1 (180deg=0.024) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot -28:sc= 0.0784! USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 135:sc= -3.38 (180deg=-5.09!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 159:sc= 0.939 (180deg=0.667) USER MOD Single : A 59 MET CE :methyl 133:sc= -4.44! (180deg=-9.51!) USER MOD Single : A 66 CYS SG : rot 24:sc= -0.686 USER MOD Single : A 70 THR OG1 : rot -170:sc= -1.12 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 83 HIS : no HD1:sc= -4.03! C(o=-4!,f=-4.4!) USER MOD Single : A 99 GLN : amide:sc= -1.37 K(o=-1.4,f=-1.9) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.18 USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -0.276 K(o=-0.28,f=-1.5) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= -0.212 X(o=-0.21,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -5:sc= 0.983 USER MOD ----------------------------------------------------------------- ATOM 156 N HIS A 14 -14.931 2.294 -15.489 1.00 0.00 N ATOM 157 CA HIS A 14 -13.590 1.741 -15.586 1.00 0.00 C ATOM 158 C HIS A 14 -12.879 1.880 -14.239 1.00 0.00 C ATOM 159 O HIS A 14 -12.662 2.992 -13.759 1.00 0.00 O ATOM 160 CB HIS A 14 -12.817 2.392 -16.735 1.00 0.00 C ATOM 161 CG HIS A 14 -12.961 3.894 -16.799 1.00 0.00 C ATOM 162 ND1 HIS A 14 -12.510 4.734 -15.796 1.00 0.00 N ATOM 163 CD2 HIS A 14 -13.509 4.696 -17.757 1.00 0.00 C ATOM 164 CE1 HIS A 14 -12.781 5.983 -16.144 1.00 0.00 C ATOM 165 NE2 HIS A 14 -13.400 5.958 -17.359 1.00 0.00 N ATOM 0 HA HIS A 14 -13.646 0.678 -15.819 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -11.761 2.142 -16.636 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -13.159 1.964 -17.678 1.00 0.00 H new ATOM 0 HD1 HIS A 14 -12.048 4.441 -14.935 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -13.955 4.361 -18.682 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -12.552 6.867 -15.567 1.00 0.00 H new ATOM 173 N PRO A 15 -12.527 0.705 -13.651 1.00 0.00 N ATOM 174 CA PRO A 15 -11.844 0.685 -12.369 1.00 0.00 C ATOM 175 C PRO A 15 -10.376 1.088 -12.522 1.00 0.00 C ATOM 176 O PRO A 15 -9.811 1.734 -11.641 1.00 0.00 O ATOM 177 CB PRO A 15 -12.019 -0.734 -11.852 1.00 0.00 C ATOM 178 CG PRO A 15 -12.387 -1.576 -13.063 1.00 0.00 C ATOM 179 CD PRO A 15 -12.768 -0.630 -14.191 1.00 0.00 C ATOM 0 HA PRO A 15 -12.255 1.406 -11.663 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -11.102 -1.097 -11.388 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -12.800 -0.780 -11.093 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -11.548 -2.205 -13.360 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -13.217 -2.242 -12.827 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -12.166 -0.812 -15.081 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -13.811 -0.758 -14.480 1.00 0.00 H new ATOM 187 N VAL A 16 -9.801 0.690 -13.648 1.00 0.00 N ATOM 188 CA VAL A 16 -8.410 1.002 -13.928 1.00 0.00 C ATOM 189 C VAL A 16 -8.341 2.073 -15.019 1.00 0.00 C ATOM 190 O VAL A 16 -9.154 2.077 -15.942 1.00 0.00 O ATOM 191 CB VAL A 16 -7.651 -0.274 -14.295 1.00 0.00 C ATOM 192 CG1 VAL A 16 -8.160 -1.468 -13.484 1.00 0.00 C ATOM 193 CG2 VAL A 16 -7.742 -0.553 -15.797 1.00 0.00 C ATOM 0 H VAL A 16 -10.273 0.155 -14.376 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.925 1.409 -13.041 1.00 0.00 H new ATOM 0 HB VAL A 16 -6.601 -0.123 -14.045 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -7.603 -2.362 -13.765 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -8.020 -1.272 -12.421 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -9.220 -1.621 -13.688 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.194 -1.466 -16.031 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -8.787 -0.674 -16.082 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -7.310 0.282 -16.349 1.00 0.00 H new ATOM 203 N THR A 17 -7.364 2.956 -14.876 1.00 0.00 N ATOM 204 CA THR A 17 -7.179 4.030 -15.837 1.00 0.00 C ATOM 205 C THR A 17 -5.698 4.399 -15.946 1.00 0.00 C ATOM 206 O THR A 17 -5.052 4.690 -14.941 1.00 0.00 O ATOM 207 CB THR A 17 -8.068 5.201 -15.415 1.00 0.00 C ATOM 208 OG1 THR A 17 -8.240 5.019 -14.012 1.00 0.00 O ATOM 209 CG2 THR A 17 -9.485 5.094 -15.981 1.00 0.00 C ATOM 0 H THR A 17 -6.692 2.950 -14.109 1.00 0.00 H new ATOM 0 HA THR A 17 -7.479 3.721 -16.838 1.00 0.00 H new ATOM 0 HB THR A 17 -7.616 6.137 -15.744 1.00 0.00 H new ATOM 0 HG1 THR A 17 -8.804 5.737 -13.656 1.00 0.00 H new ATOM 0 HG21 THR A 17 -10.074 5.950 -15.651 1.00 0.00 H new ATOM 0 HG22 THR A 17 -9.442 5.081 -17.070 1.00 0.00 H new ATOM 0 HG23 THR A 17 -9.950 4.175 -15.626 1.00 0.00 H new ATOM 217 N TRP A 18 -5.204 4.375 -17.175 1.00 0.00 N ATOM 218 CA TRP A 18 -3.811 4.703 -17.428 1.00 0.00 C ATOM 219 C TRP A 18 -3.772 5.994 -18.249 1.00 0.00 C ATOM 220 O TRP A 18 -4.134 5.997 -19.425 1.00 0.00 O ATOM 221 CB TRP A 18 -3.088 3.539 -18.108 1.00 0.00 C ATOM 222 CG TRP A 18 -2.876 2.324 -17.203 1.00 0.00 C ATOM 223 CD1 TRP A 18 -3.710 1.297 -16.992 1.00 0.00 C ATOM 224 CD2 TRP A 18 -1.715 2.049 -16.391 1.00 0.00 C ATOM 225 NE1 TRP A 18 -3.175 0.384 -16.106 1.00 0.00 N ATOM 226 CE2 TRP A 18 -1.923 0.856 -15.729 1.00 0.00 C ATOM 227 CE3 TRP A 18 -0.529 2.784 -16.221 1.00 0.00 C ATOM 228 CZ2 TRP A 18 -0.988 0.293 -14.853 1.00 0.00 C ATOM 229 CZ3 TRP A 18 0.395 2.208 -15.341 1.00 0.00 C ATOM 230 CH2 TRP A 18 0.202 1.008 -14.668 1.00 0.00 C ATOM 0 H TRP A 18 -5.743 4.134 -18.006 1.00 0.00 H new ATOM 0 HA TRP A 18 -3.277 4.869 -16.492 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -3.660 3.232 -18.984 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -2.119 3.886 -18.466 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.680 1.196 -17.457 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -3.617 -0.478 -15.787 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -0.345 3.719 -16.729 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -1.174 -0.643 -14.347 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 1.323 2.734 -15.173 1.00 0.00 H new ATOM 0 HH2 TRP A 18 0.966 0.628 -14.005 1.00 0.00 H new ATOM 241 N GLN A 19 -3.329 7.059 -17.597 1.00 0.00 N ATOM 242 CA GLN A 19 -3.237 8.353 -18.253 1.00 0.00 C ATOM 243 C GLN A 19 -1.915 9.035 -17.898 1.00 0.00 C ATOM 244 O GLN A 19 -1.368 8.814 -16.819 1.00 0.00 O ATOM 245 CB GLN A 19 -4.428 9.240 -17.884 1.00 0.00 C ATOM 246 CG GLN A 19 -5.676 8.397 -17.612 1.00 0.00 C ATOM 247 CD GLN A 19 -5.776 8.027 -16.131 1.00 0.00 C ATOM 248 OE1 GLN A 19 -4.862 7.475 -15.540 1.00 0.00 O ATOM 249 NE2 GLN A 19 -6.933 8.360 -15.567 1.00 0.00 N ATOM 0 H GLN A 19 -3.030 7.053 -16.622 1.00 0.00 H new ATOM 0 HA GLN A 19 -3.264 8.195 -19.331 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -4.185 9.832 -17.002 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -4.628 9.942 -18.694 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.566 8.950 -17.913 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -5.645 7.490 -18.216 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -7.656 8.820 -16.120 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.098 8.155 -14.581 1.00 0.00 H new ATOM 258 N PRO A 20 -1.426 9.872 -18.852 1.00 0.00 N ATOM 259 CA PRO A 20 -0.177 10.588 -18.651 1.00 0.00 C ATOM 260 C PRO A 20 -0.364 11.752 -17.675 1.00 0.00 C ATOM 261 O PRO A 20 -1.478 12.240 -17.492 1.00 0.00 O ATOM 262 CB PRO A 20 0.246 11.039 -20.039 1.00 0.00 C ATOM 263 CG PRO A 20 -1.005 10.965 -20.901 1.00 0.00 C ATOM 264 CD PRO A 20 -2.046 10.158 -20.142 1.00 0.00 C ATOM 0 HA PRO A 20 0.595 9.968 -18.196 1.00 0.00 H new ATOM 0 HB2 PRO A 20 0.645 12.053 -20.015 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.032 10.397 -20.436 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -1.380 11.966 -21.116 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -0.782 10.495 -21.859 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -2.972 10.721 -20.020 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -2.299 9.240 -20.672 1.00 0.00 H new ATOM 272 N SER A 21 0.744 12.163 -17.075 1.00 0.00 N ATOM 273 CA SER A 21 0.716 13.260 -16.124 1.00 0.00 C ATOM 274 C SER A 21 0.618 14.595 -16.866 1.00 0.00 C ATOM 275 O SER A 21 0.682 14.632 -18.094 1.00 0.00 O ATOM 276 CB SER A 21 1.955 13.242 -15.226 1.00 0.00 C ATOM 277 OG SER A 21 1.612 13.242 -13.843 1.00 0.00 O ATOM 0 H SER A 21 1.666 11.756 -17.229 1.00 0.00 H new ATOM 0 HA SER A 21 -0.162 13.139 -15.489 1.00 0.00 H new ATOM 0 HB2 SER A 21 2.553 12.359 -15.451 1.00 0.00 H new ATOM 0 HB3 SER A 21 2.575 14.111 -15.446 1.00 0.00 H new ATOM 0 HG SER A 21 2.430 13.229 -13.303 1.00 0.00 H new ATOM 283 N LYS A 22 0.466 15.657 -16.090 1.00 0.00 N ATOM 284 CA LYS A 22 0.358 16.990 -16.658 1.00 0.00 C ATOM 285 C LYS A 22 1.410 17.157 -17.756 1.00 0.00 C ATOM 286 O LYS A 22 1.079 17.493 -18.893 1.00 0.00 O ATOM 287 CB LYS A 22 0.444 18.050 -15.558 1.00 0.00 C ATOM 288 CG LYS A 22 -0.949 18.547 -15.166 1.00 0.00 C ATOM 289 CD LYS A 22 -1.153 18.469 -13.652 1.00 0.00 C ATOM 290 CE LYS A 22 -1.884 19.709 -13.133 1.00 0.00 C ATOM 291 NZ LYS A 22 -3.291 19.711 -13.593 1.00 0.00 N ATOM 0 H LYS A 22 0.415 15.622 -15.072 1.00 0.00 H new ATOM 0 HA LYS A 22 -0.617 17.128 -17.125 1.00 0.00 H new ATOM 0 HB2 LYS A 22 0.944 17.633 -14.684 1.00 0.00 H new ATOM 0 HB3 LYS A 22 1.050 18.888 -15.902 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -1.080 19.576 -15.502 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.708 17.948 -15.670 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -1.725 17.575 -13.404 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.187 18.377 -13.155 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -1.851 19.729 -12.044 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.379 20.609 -13.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -3.773 20.559 -13.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -3.316 19.714 -14.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -3.774 18.861 -13.238 1.00 0.00 H new ATOM 305 N ASP A 23 2.657 16.916 -17.379 1.00 0.00 N ATOM 306 CA ASP A 23 3.760 17.036 -18.318 1.00 0.00 C ATOM 307 C ASP A 23 3.571 16.026 -19.451 1.00 0.00 C ATOM 308 O ASP A 23 3.540 16.401 -20.623 1.00 0.00 O ATOM 309 CB ASP A 23 5.097 16.738 -17.637 1.00 0.00 C ATOM 310 CG ASP A 23 6.290 17.528 -18.181 1.00 0.00 C ATOM 311 OD1 ASP A 23 6.386 17.627 -19.423 1.00 0.00 O ATOM 312 OD2 ASP A 23 7.078 18.015 -17.341 1.00 0.00 O ATOM 0 H ASP A 23 2.928 16.638 -16.436 1.00 0.00 H new ATOM 0 HA ASP A 23 3.769 18.057 -18.700 1.00 0.00 H new ATOM 0 HB2 ASP A 23 4.999 16.945 -16.571 1.00 0.00 H new ATOM 0 HB3 ASP A 23 5.309 15.674 -17.737 1.00 0.00 H new ATOM 317 N GLY A 24 3.449 14.765 -19.064 1.00 0.00 N ATOM 318 CA GLY A 24 3.263 13.699 -20.033 1.00 0.00 C ATOM 319 C GLY A 24 4.383 12.662 -19.928 1.00 0.00 C ATOM 320 O GLY A 24 4.145 11.467 -20.095 1.00 0.00 O ATOM 0 H GLY A 24 3.475 14.458 -18.092 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.299 13.217 -19.868 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.242 14.117 -21.039 1.00 0.00 H new ATOM 324 N ASP A 25 5.581 13.157 -19.653 1.00 0.00 N ATOM 325 CA ASP A 25 6.738 12.288 -19.524 1.00 0.00 C ATOM 326 C ASP A 25 6.398 11.129 -18.585 1.00 0.00 C ATOM 327 O ASP A 25 6.872 10.010 -18.778 1.00 0.00 O ATOM 328 CB ASP A 25 7.930 13.043 -18.931 1.00 0.00 C ATOM 329 CG ASP A 25 8.915 13.605 -19.958 1.00 0.00 C ATOM 330 OD1 ASP A 25 8.549 13.609 -21.153 1.00 0.00 O ATOM 331 OD2 ASP A 25 10.013 14.018 -19.524 1.00 0.00 O ATOM 0 H ASP A 25 5.775 14.149 -19.516 1.00 0.00 H new ATOM 0 HA ASP A 25 6.999 11.924 -20.518 1.00 0.00 H new ATOM 0 HB2 ASP A 25 7.554 13.866 -18.323 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.469 12.372 -18.262 1.00 0.00 H new ATOM 336 N ARG A 26 5.580 11.436 -17.589 1.00 0.00 N ATOM 337 CA ARG A 26 5.171 10.434 -16.620 1.00 0.00 C ATOM 338 C ARG A 26 3.820 9.835 -17.014 1.00 0.00 C ATOM 339 O ARG A 26 3.003 10.500 -17.650 1.00 0.00 O ATOM 340 CB ARG A 26 5.065 11.035 -15.217 1.00 0.00 C ATOM 341 CG ARG A 26 6.428 11.044 -14.521 1.00 0.00 C ATOM 342 CD ARG A 26 6.854 9.627 -14.132 1.00 0.00 C ATOM 343 NE ARG A 26 8.295 9.437 -14.414 1.00 0.00 N ATOM 344 CZ ARG A 26 9.279 10.036 -13.729 1.00 0.00 C ATOM 345 NH1 ARG A 26 8.984 10.866 -12.720 1.00 0.00 N ATOM 346 NH2 ARG A 26 10.558 9.805 -14.055 1.00 0.00 N ATOM 0 H ARG A 26 5.189 12.365 -17.432 1.00 0.00 H new ATOM 0 HA ARG A 26 5.930 9.652 -16.611 1.00 0.00 H new ATOM 0 HB2 ARG A 26 4.679 12.052 -15.281 1.00 0.00 H new ATOM 0 HB3 ARG A 26 4.353 10.461 -14.624 1.00 0.00 H new ATOM 0 HG2 ARG A 26 7.175 11.484 -15.182 1.00 0.00 H new ATOM 0 HG3 ARG A 26 6.382 11.671 -13.631 1.00 0.00 H new ATOM 0 HD2 ARG A 26 6.656 9.456 -13.074 1.00 0.00 H new ATOM 0 HD3 ARG A 26 6.267 8.896 -14.688 1.00 0.00 H new ATOM 0 HE ARG A 26 8.555 8.812 -15.177 1.00 0.00 H new ATOM 0 HH11 ARG A 26 8.010 11.042 -12.473 1.00 0.00 H new ATOM 0 HH12 ARG A 26 9.733 11.322 -12.199 1.00 0.00 H new ATOM 0 HH21 ARG A 26 10.782 9.174 -14.824 1.00 0.00 H new ATOM 0 HH22 ARG A 26 11.307 10.261 -13.534 1.00 0.00 H new ATOM 360 N LEU A 27 3.625 8.585 -16.621 1.00 0.00 N ATOM 361 CA LEU A 27 2.386 7.889 -16.925 1.00 0.00 C ATOM 362 C LEU A 27 1.701 7.481 -15.619 1.00 0.00 C ATOM 363 O LEU A 27 2.229 6.666 -14.865 1.00 0.00 O ATOM 364 CB LEU A 27 2.649 6.717 -17.873 1.00 0.00 C ATOM 365 CG LEU A 27 1.653 6.546 -19.021 1.00 0.00 C ATOM 366 CD1 LEU A 27 0.293 7.150 -18.662 1.00 0.00 C ATOM 367 CD2 LEU A 27 2.211 7.127 -20.322 1.00 0.00 C ATOM 0 H LEU A 27 4.304 8.036 -16.094 1.00 0.00 H new ATOM 0 HA LEU A 27 1.698 8.549 -17.453 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.646 6.836 -18.298 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.660 5.798 -17.288 1.00 0.00 H new ATOM 0 HG LEU A 27 1.500 5.479 -19.183 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.397 7.015 -19.495 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.104 6.652 -17.778 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.410 8.214 -18.457 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.483 6.992 -21.122 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.412 8.190 -20.189 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.136 6.613 -20.583 1.00 0.00 H new ATOM 379 N ILE A 28 0.535 8.069 -15.391 1.00 0.00 N ATOM 380 CA ILE A 28 -0.227 7.777 -14.189 1.00 0.00 C ATOM 381 C ILE A 28 -1.171 6.604 -14.461 1.00 0.00 C ATOM 382 O ILE A 28 -2.055 6.699 -15.311 1.00 0.00 O ATOM 383 CB ILE A 28 -0.939 9.036 -13.688 1.00 0.00 C ATOM 384 CG1 ILE A 28 0.002 10.243 -13.709 1.00 0.00 C ATOM 385 CG2 ILE A 28 -1.546 8.807 -12.302 1.00 0.00 C ATOM 386 CD1 ILE A 28 1.336 9.910 -13.039 1.00 0.00 C ATOM 0 H ILE A 28 0.100 8.746 -16.018 1.00 0.00 H new ATOM 0 HA ILE A 28 0.438 7.471 -13.381 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.762 9.257 -14.368 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.176 10.555 -14.739 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.467 11.083 -13.196 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.046 9.717 -11.969 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.269 7.993 -12.351 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -0.756 8.548 -11.597 1.00 0.00 H new ATOM 0 HD11 ILE A 28 1.986 10.785 -13.068 1.00 0.00 H new ATOM 0 HD12 ILE A 28 1.161 9.622 -12.002 1.00 0.00 H new ATOM 0 HD13 ILE A 28 1.814 9.086 -13.569 1.00 0.00 H new ATOM 398 N GLY A 29 -0.952 5.526 -13.724 1.00 0.00 N ATOM 399 CA GLY A 29 -1.772 4.336 -13.875 1.00 0.00 C ATOM 400 C GLY A 29 -2.606 4.082 -12.618 1.00 0.00 C ATOM 401 O GLY A 29 -2.123 4.259 -11.501 1.00 0.00 O ATOM 0 H GLY A 29 -0.218 5.451 -13.020 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.431 4.451 -14.736 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.135 3.474 -14.074 1.00 0.00 H new ATOM 405 N ARG A 30 -3.846 3.672 -12.842 1.00 0.00 N ATOM 406 CA ARG A 30 -4.753 3.392 -11.742 1.00 0.00 C ATOM 407 C ARG A 30 -5.238 1.943 -11.810 1.00 0.00 C ATOM 408 O ARG A 30 -5.521 1.429 -12.892 1.00 0.00 O ATOM 409 CB ARG A 30 -5.961 4.330 -11.772 1.00 0.00 C ATOM 410 CG ARG A 30 -6.069 5.125 -10.469 1.00 0.00 C ATOM 411 CD ARG A 30 -7.484 5.677 -10.280 1.00 0.00 C ATOM 412 NE ARG A 30 -7.577 7.039 -10.851 1.00 0.00 N ATOM 413 CZ ARG A 30 -7.156 8.147 -10.225 1.00 0.00 C ATOM 414 NH1 ARG A 30 -6.612 8.060 -9.003 1.00 0.00 N ATOM 415 NH2 ARG A 30 -7.280 9.341 -10.820 1.00 0.00 N ATOM 0 H ARG A 30 -4.244 3.527 -13.770 1.00 0.00 H new ATOM 0 HA ARG A 30 -4.207 3.552 -10.812 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -5.873 5.016 -12.615 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -6.872 3.751 -11.926 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -5.809 4.485 -9.626 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -5.353 5.946 -10.479 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -8.207 5.021 -10.764 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -7.735 5.700 -9.220 1.00 0.00 H new ATOM 0 HE ARG A 30 -7.987 7.141 -11.779 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -6.519 7.151 -8.550 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -6.291 8.903 -8.526 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -7.695 9.407 -11.749 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -6.960 10.184 -10.343 1.00 0.00 H new ATOM 429 N ILE A 31 -5.321 1.324 -10.641 1.00 0.00 N ATOM 430 CA ILE A 31 -5.768 -0.056 -10.555 1.00 0.00 C ATOM 431 C ILE A 31 -6.724 -0.205 -9.369 1.00 0.00 C ATOM 432 O ILE A 31 -6.308 -0.102 -8.216 1.00 0.00 O ATOM 433 CB ILE A 31 -4.569 -1.005 -10.501 1.00 0.00 C ATOM 434 CG1 ILE A 31 -3.902 -1.125 -11.873 1.00 0.00 C ATOM 435 CG2 ILE A 31 -4.974 -2.369 -9.939 1.00 0.00 C ATOM 436 CD1 ILE A 31 -2.794 -0.083 -12.037 1.00 0.00 C ATOM 0 H ILE A 31 -5.086 1.753 -9.746 1.00 0.00 H new ATOM 0 HA ILE A 31 -6.324 -0.333 -11.450 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.830 -0.583 -9.820 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.486 -2.125 -11.993 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -4.648 -0.994 -12.657 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.103 -3.024 -9.911 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -5.367 -2.245 -8.930 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -5.741 -2.811 -10.575 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -2.336 -0.190 -13.020 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.218 0.917 -11.941 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -2.037 -0.232 -11.267 1.00 0.00 H new ATOM 448 N LEU A 32 -7.986 -0.444 -9.694 1.00 0.00 N ATOM 449 CA LEU A 32 -9.004 -0.607 -8.671 1.00 0.00 C ATOM 450 C LEU A 32 -9.527 -2.045 -8.703 1.00 0.00 C ATOM 451 O LEU A 32 -9.762 -2.600 -9.775 1.00 0.00 O ATOM 452 CB LEU A 32 -10.099 0.449 -8.831 1.00 0.00 C ATOM 453 CG LEU A 32 -11.367 0.232 -8.002 1.00 0.00 C ATOM 454 CD1 LEU A 32 -12.073 -1.063 -8.410 1.00 0.00 C ATOM 455 CD2 LEU A 32 -11.056 0.268 -6.505 1.00 0.00 C ATOM 0 H LEU A 32 -8.326 -0.529 -10.652 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.578 -0.444 -7.681 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -9.680 1.421 -8.570 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -10.380 0.496 -9.883 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.055 1.052 -8.207 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -12.971 -1.194 -7.806 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -12.349 -1.011 -9.463 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.403 -1.908 -8.252 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -11.974 0.111 -5.939 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.341 -0.519 -6.263 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.630 1.237 -6.245 1.00 0.00 H new ATOM 467 N LEU A 33 -9.693 -2.607 -7.515 1.00 0.00 N ATOM 468 CA LEU A 33 -10.183 -3.969 -7.393 1.00 0.00 C ATOM 469 C LEU A 33 -11.431 -3.980 -6.508 1.00 0.00 C ATOM 470 O LEU A 33 -11.537 -3.193 -5.568 1.00 0.00 O ATOM 471 CB LEU A 33 -9.071 -4.897 -6.899 1.00 0.00 C ATOM 472 CG LEU A 33 -7.831 -4.990 -7.790 1.00 0.00 C ATOM 473 CD1 LEU A 33 -8.222 -5.088 -9.266 1.00 0.00 C ATOM 474 CD2 LEU A 33 -6.878 -3.823 -7.526 1.00 0.00 C ATOM 0 H LEU A 33 -9.497 -2.143 -6.628 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.479 -4.356 -8.368 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.759 -4.563 -5.909 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -9.486 -5.898 -6.781 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.297 -5.906 -7.537 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -7.322 -5.153 -9.877 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -8.832 -5.978 -9.423 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.791 -4.203 -9.551 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.005 -3.913 -8.172 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -7.388 -2.882 -7.734 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.561 -3.841 -6.483 1.00 0.00 H new ATOM 486 N ASN A 34 -12.345 -4.880 -6.840 1.00 0.00 N ATOM 487 CA ASN A 34 -13.581 -5.004 -6.087 1.00 0.00 C ATOM 488 C ASN A 34 -13.695 -6.425 -5.530 1.00 0.00 C ATOM 489 O ASN A 34 -13.271 -7.383 -6.174 1.00 0.00 O ATOM 490 CB ASN A 34 -14.798 -4.748 -6.979 1.00 0.00 C ATOM 491 CG ASN A 34 -16.068 -4.588 -6.142 1.00 0.00 C ATOM 492 OD1 ASN A 34 -16.262 -3.608 -5.441 1.00 0.00 O ATOM 493 ND2 ASN A 34 -16.920 -5.603 -6.253 1.00 0.00 N ATOM 0 H ASN A 34 -12.254 -5.530 -7.621 1.00 0.00 H new ATOM 0 HA ASN A 34 -13.561 -4.268 -5.284 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -14.635 -3.849 -7.574 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -14.921 -5.575 -7.678 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -17.798 -5.591 -5.733 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -16.696 -6.393 -6.858 1.00 0.00 H new ATOM 500 N LYS A 35 -14.269 -6.516 -4.340 1.00 0.00 N ATOM 501 CA LYS A 35 -14.443 -7.803 -3.689 1.00 0.00 C ATOM 502 C LYS A 35 -15.934 -8.141 -3.627 1.00 0.00 C ATOM 503 O LYS A 35 -16.340 -9.245 -3.984 1.00 0.00 O ATOM 504 CB LYS A 35 -13.753 -7.812 -2.324 1.00 0.00 C ATOM 505 CG LYS A 35 -12.266 -7.475 -2.459 1.00 0.00 C ATOM 506 CD LYS A 35 -11.703 -6.941 -1.140 1.00 0.00 C ATOM 507 CE LYS A 35 -10.223 -6.583 -1.281 1.00 0.00 C ATOM 508 NZ LYS A 35 -9.803 -5.674 -0.191 1.00 0.00 N ATOM 0 H LYS A 35 -14.620 -5.719 -3.809 1.00 0.00 H new ATOM 0 HA LYS A 35 -13.961 -8.590 -4.268 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -14.235 -7.090 -1.664 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -13.867 -8.792 -1.861 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -11.714 -8.365 -2.761 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -12.128 -6.732 -3.245 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -12.266 -6.061 -0.830 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -11.827 -7.690 -0.358 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -9.620 -7.490 -1.258 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -10.048 -6.108 -2.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -8.778 -5.509 -0.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -10.306 -4.768 -0.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -10.029 -6.106 0.728 1.00 0.00 H new ATOM 522 N ARG A 36 -16.709 -7.168 -3.170 1.00 0.00 N ATOM 523 CA ARG A 36 -18.147 -7.348 -3.056 1.00 0.00 C ATOM 524 C ARG A 36 -18.667 -8.208 -4.209 1.00 0.00 C ATOM 525 O ARG A 36 -18.606 -7.801 -5.368 1.00 0.00 O ATOM 526 CB ARG A 36 -18.873 -6.002 -3.065 1.00 0.00 C ATOM 527 CG ARG A 36 -18.677 -5.264 -1.739 1.00 0.00 C ATOM 528 CD ARG A 36 -19.102 -3.799 -1.859 1.00 0.00 C ATOM 529 NE ARG A 36 -19.491 -3.275 -0.530 1.00 0.00 N ATOM 530 CZ ARG A 36 -20.159 -2.128 -0.341 1.00 0.00 C ATOM 531 NH1 ARG A 36 -20.516 -1.379 -1.393 1.00 0.00 N ATOM 532 NH2 ARG A 36 -20.470 -1.731 0.900 1.00 0.00 N ATOM 0 H ARG A 36 -16.369 -6.253 -2.874 1.00 0.00 H new ATOM 0 HA ARG A 36 -18.344 -7.848 -2.108 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -18.499 -5.389 -3.885 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -19.937 -6.160 -3.244 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -19.259 -5.752 -0.957 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -17.631 -5.319 -1.439 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -18.283 -3.206 -2.267 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -19.938 -3.710 -2.553 1.00 0.00 H new ATOM 0 HE ARG A 36 -19.235 -3.821 0.293 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -20.280 -1.681 -2.338 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -21.024 -0.506 -1.249 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -20.199 -2.301 1.701 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -20.978 -0.858 1.044 1.00 0.00 H new ATOM 546 N LEU A 37 -19.167 -9.382 -3.851 1.00 0.00 N ATOM 547 CA LEU A 37 -19.698 -10.303 -4.842 1.00 0.00 C ATOM 548 C LEU A 37 -20.915 -9.671 -5.519 1.00 0.00 C ATOM 549 O LEU A 37 -21.185 -8.484 -5.338 1.00 0.00 O ATOM 550 CB LEU A 37 -19.985 -11.665 -4.207 1.00 0.00 C ATOM 551 CG LEU A 37 -18.813 -12.327 -3.480 1.00 0.00 C ATOM 552 CD1 LEU A 37 -19.287 -13.043 -2.213 1.00 0.00 C ATOM 553 CD2 LEU A 37 -18.047 -13.265 -4.415 1.00 0.00 C ATOM 0 H LEU A 37 -19.216 -9.716 -2.889 1.00 0.00 H new ATOM 0 HA LEU A 37 -18.961 -10.490 -5.623 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -20.806 -11.548 -3.500 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -20.331 -12.342 -4.988 1.00 0.00 H new ATOM 0 HG LEU A 37 -18.120 -11.546 -3.168 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -18.434 -13.505 -1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -19.753 -12.323 -1.541 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -20.012 -13.812 -2.479 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -17.219 -13.722 -3.873 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -18.717 -14.044 -4.778 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -17.658 -12.698 -5.261 1.00 0.00 H new ATOM 565 N LYS A 38 -21.619 -10.492 -6.285 1.00 0.00 N ATOM 566 CA LYS A 38 -22.802 -10.028 -6.990 1.00 0.00 C ATOM 567 C LYS A 38 -23.817 -9.494 -5.978 1.00 0.00 C ATOM 568 O LYS A 38 -24.501 -8.506 -6.241 1.00 0.00 O ATOM 569 CB LYS A 38 -23.355 -11.132 -7.892 1.00 0.00 C ATOM 570 CG LYS A 38 -23.700 -10.586 -9.279 1.00 0.00 C ATOM 571 CD LYS A 38 -23.395 -11.618 -10.367 1.00 0.00 C ATOM 572 CE LYS A 38 -24.057 -11.231 -11.691 1.00 0.00 C ATOM 573 NZ LYS A 38 -23.060 -11.224 -12.785 1.00 0.00 N ATOM 0 H LYS A 38 -21.393 -11.476 -6.433 1.00 0.00 H new ATOM 0 HA LYS A 38 -22.550 -9.202 -7.655 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -22.621 -11.932 -7.985 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -24.245 -11.567 -7.437 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -24.755 -10.316 -9.315 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -23.131 -9.675 -9.467 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -22.317 -11.698 -10.505 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -23.750 -12.599 -10.052 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -24.857 -11.934 -11.924 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -24.515 -10.246 -11.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -23.525 -10.959 -13.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -22.311 -10.536 -12.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -22.642 -12.172 -12.880 1.00 0.00 H new ATOM 587 N ASP A 39 -23.883 -10.171 -4.841 1.00 0.00 N ATOM 588 CA ASP A 39 -24.804 -9.777 -3.788 1.00 0.00 C ATOM 589 C ASP A 39 -24.445 -8.371 -3.302 1.00 0.00 C ATOM 590 O ASP A 39 -25.326 -7.537 -3.101 1.00 0.00 O ATOM 591 CB ASP A 39 -24.713 -10.728 -2.592 1.00 0.00 C ATOM 592 CG ASP A 39 -25.181 -12.158 -2.866 1.00 0.00 C ATOM 593 OD1 ASP A 39 -26.373 -12.309 -3.212 1.00 0.00 O ATOM 594 OD2 ASP A 39 -24.336 -13.069 -2.724 1.00 0.00 O ATOM 0 H ASP A 39 -23.314 -10.990 -4.626 1.00 0.00 H new ATOM 0 HA ASP A 39 -25.814 -9.806 -4.196 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -23.679 -10.760 -2.250 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -25.306 -10.318 -1.775 1.00 0.00 H new ATOM 599 N GLY A 40 -23.150 -8.153 -3.128 1.00 0.00 N ATOM 600 CA GLY A 40 -22.664 -6.862 -2.669 1.00 0.00 C ATOM 601 C GLY A 40 -22.084 -6.964 -1.257 1.00 0.00 C ATOM 602 O GLY A 40 -22.496 -6.232 -0.359 1.00 0.00 O ATOM 0 H GLY A 40 -22.422 -8.848 -3.296 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -21.900 -6.493 -3.354 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -23.479 -6.138 -2.680 1.00 0.00 H new ATOM 606 N SER A 41 -21.138 -7.879 -1.106 1.00 0.00 N ATOM 607 CA SER A 41 -20.497 -8.087 0.182 1.00 0.00 C ATOM 608 C SER A 41 -19.204 -8.884 0.000 1.00 0.00 C ATOM 609 O SER A 41 -19.225 -9.999 -0.518 1.00 0.00 O ATOM 610 CB SER A 41 -21.433 -8.809 1.153 1.00 0.00 C ATOM 611 OG SER A 41 -22.750 -8.263 1.130 1.00 0.00 O ATOM 0 H SER A 41 -20.800 -8.485 -1.854 1.00 0.00 H new ATOM 0 HA SER A 41 -20.259 -7.112 0.607 1.00 0.00 H new ATOM 0 HB2 SER A 41 -21.475 -9.868 0.897 1.00 0.00 H new ATOM 0 HB3 SER A 41 -21.030 -8.741 2.163 1.00 0.00 H new ATOM 0 HG SER A 41 -22.708 -7.318 0.873 1.00 0.00 H new ATOM 617 N VAL A 42 -18.108 -8.280 0.437 1.00 0.00 N ATOM 618 CA VAL A 42 -16.808 -8.919 0.329 1.00 0.00 C ATOM 619 C VAL A 42 -16.865 -10.297 0.992 1.00 0.00 C ATOM 620 O VAL A 42 -17.364 -10.432 2.108 1.00 0.00 O ATOM 621 CB VAL A 42 -15.728 -8.013 0.924 1.00 0.00 C ATOM 622 CG1 VAL A 42 -14.359 -8.695 0.888 1.00 0.00 C ATOM 623 CG2 VAL A 42 -15.688 -6.663 0.206 1.00 0.00 C ATOM 0 H VAL A 42 -18.094 -7.355 0.866 1.00 0.00 H new ATOM 0 HA VAL A 42 -16.544 -9.072 -0.717 1.00 0.00 H new ATOM 0 HB VAL A 42 -15.983 -7.829 1.968 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -13.610 -8.030 1.317 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -14.397 -9.619 1.466 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -14.093 -8.923 -0.144 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -14.912 -6.038 0.648 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -15.470 -6.819 -0.850 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -16.654 -6.168 0.308 1.00 0.00 H new ATOM 633 N PRO A 43 -16.333 -11.311 0.258 1.00 0.00 N ATOM 634 CA PRO A 43 -16.319 -12.673 0.763 1.00 0.00 C ATOM 635 C PRO A 43 -15.249 -12.846 1.843 1.00 0.00 C ATOM 636 O PRO A 43 -14.598 -11.880 2.238 1.00 0.00 O ATOM 637 CB PRO A 43 -16.077 -13.543 -0.459 1.00 0.00 C ATOM 638 CG PRO A 43 -15.503 -12.620 -1.521 1.00 0.00 C ATOM 639 CD PRO A 43 -15.733 -11.187 -1.067 1.00 0.00 C ATOM 0 HA PRO A 43 -17.252 -12.950 1.253 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -15.385 -14.353 -0.230 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -17.004 -14.003 -0.801 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -14.439 -12.811 -1.658 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -15.985 -12.798 -2.482 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -14.798 -10.629 -1.028 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -16.393 -10.655 -1.753 1.00 0.00 H new ATOM 647 N ARG A 44 -15.099 -14.085 2.289 1.00 0.00 N ATOM 648 CA ARG A 44 -14.118 -14.397 3.315 1.00 0.00 C ATOM 649 C ARG A 44 -12.858 -13.552 3.119 1.00 0.00 C ATOM 650 O ARG A 44 -12.324 -12.996 4.079 1.00 0.00 O ATOM 651 CB ARG A 44 -13.740 -15.879 3.282 1.00 0.00 C ATOM 652 CG ARG A 44 -14.759 -16.723 4.050 1.00 0.00 C ATOM 653 CD ARG A 44 -14.321 -16.924 5.502 1.00 0.00 C ATOM 654 NE ARG A 44 -13.946 -18.337 5.727 1.00 0.00 N ATOM 655 CZ ARG A 44 -13.738 -18.877 6.936 1.00 0.00 C ATOM 656 NH1 ARG A 44 -13.869 -18.124 8.036 1.00 0.00 N ATOM 657 NH2 ARG A 44 -13.400 -20.169 7.044 1.00 0.00 N ATOM 0 H ARG A 44 -15.640 -14.884 1.959 1.00 0.00 H new ATOM 0 HA ARG A 44 -14.566 -14.169 4.282 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -13.685 -16.221 2.248 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -12.749 -16.015 3.716 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -15.733 -16.235 4.025 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -14.875 -17.692 3.564 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -13.476 -16.274 5.729 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -15.129 -16.642 6.177 1.00 0.00 H new ATOM 0 HE ARG A 44 -13.839 -18.939 4.910 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -14.127 -17.141 7.953 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -13.711 -18.534 8.957 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -13.301 -20.742 6.206 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -13.242 -20.580 7.964 1.00 0.00 H new ATOM 671 N ASP A 45 -12.419 -13.481 1.871 1.00 0.00 N ATOM 672 CA ASP A 45 -11.232 -12.712 1.538 1.00 0.00 C ATOM 673 C ASP A 45 -10.923 -12.879 0.049 1.00 0.00 C ATOM 674 O ASP A 45 -10.096 -13.707 -0.328 1.00 0.00 O ATOM 675 CB ASP A 45 -10.018 -13.203 2.330 1.00 0.00 C ATOM 676 CG ASP A 45 -8.878 -12.191 2.459 1.00 0.00 C ATOM 677 OD1 ASP A 45 -8.440 -11.691 1.401 1.00 0.00 O ATOM 678 OD2 ASP A 45 -8.470 -11.940 3.614 1.00 0.00 O ATOM 0 H ASP A 45 -12.864 -13.943 1.078 1.00 0.00 H new ATOM 0 HA ASP A 45 -11.426 -11.668 1.785 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -10.346 -13.487 3.330 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -9.632 -14.104 1.853 1.00 0.00 H new ATOM 683 N SER A 46 -11.604 -12.077 -0.757 1.00 0.00 N ATOM 684 CA SER A 46 -11.413 -12.125 -2.196 1.00 0.00 C ATOM 685 C SER A 46 -10.013 -11.623 -2.556 1.00 0.00 C ATOM 686 O SER A 46 -9.868 -10.569 -3.174 1.00 0.00 O ATOM 687 CB SER A 46 -12.477 -11.298 -2.921 1.00 0.00 C ATOM 688 OG SER A 46 -12.879 -11.902 -4.147 1.00 0.00 O ATOM 0 H SER A 46 -12.289 -11.390 -0.440 1.00 0.00 H new ATOM 0 HA SER A 46 -11.514 -13.161 -2.520 1.00 0.00 H new ATOM 0 HB2 SER A 46 -13.346 -11.178 -2.274 1.00 0.00 H new ATOM 0 HB3 SER A 46 -12.087 -10.300 -3.119 1.00 0.00 H new ATOM 0 HG SER A 46 -13.560 -11.345 -4.578 1.00 0.00 H new ATOM 694 N GLY A 47 -9.019 -12.400 -2.153 1.00 0.00 N ATOM 695 CA GLY A 47 -7.636 -12.046 -2.424 1.00 0.00 C ATOM 696 C GLY A 47 -7.323 -10.634 -1.927 1.00 0.00 C ATOM 697 O GLY A 47 -7.115 -9.722 -2.726 1.00 0.00 O ATOM 0 H GLY A 47 -9.143 -13.273 -1.641 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.972 -12.761 -1.939 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.444 -12.109 -3.495 1.00 0.00 H new ATOM 701 N ALA A 48 -7.300 -10.496 -0.609 1.00 0.00 N ATOM 702 CA ALA A 48 -7.016 -9.210 0.004 1.00 0.00 C ATOM 703 C ALA A 48 -5.795 -8.585 -0.673 1.00 0.00 C ATOM 704 O ALA A 48 -5.853 -7.448 -1.139 1.00 0.00 O ATOM 705 CB ALA A 48 -6.817 -9.395 1.510 1.00 0.00 C ATOM 0 H ALA A 48 -7.473 -11.254 0.051 1.00 0.00 H new ATOM 0 HA ALA A 48 -7.854 -8.527 -0.133 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -6.604 -8.430 1.970 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.723 -9.814 1.948 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -5.982 -10.073 1.686 1.00 0.00 H new ATOM 711 N MET A 49 -4.718 -9.356 -0.707 1.00 0.00 N ATOM 712 CA MET A 49 -3.485 -8.892 -1.320 1.00 0.00 C ATOM 713 C MET A 49 -3.722 -8.456 -2.767 1.00 0.00 C ATOM 714 O MET A 49 -2.897 -7.755 -3.351 1.00 0.00 O ATOM 715 CB MET A 49 -2.445 -10.015 -1.289 1.00 0.00 C ATOM 716 CG MET A 49 -1.391 -9.756 -0.210 1.00 0.00 C ATOM 717 SD MET A 49 0.240 -9.763 -0.936 1.00 0.00 S ATOM 718 CE MET A 49 0.832 -8.172 -0.383 1.00 0.00 C ATOM 0 H MET A 49 -4.674 -10.299 -0.320 1.00 0.00 H new ATOM 0 HA MET A 49 -3.122 -8.033 -0.756 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.939 -10.968 -1.099 1.00 0.00 H new ATOM 0 HB3 MET A 49 -1.962 -10.095 -2.263 1.00 0.00 H new ATOM 0 HG2 MET A 49 -1.580 -8.796 0.271 1.00 0.00 H new ATOM 0 HG3 MET A 49 -1.456 -10.520 0.565 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.851 -8.273 -0.008 1.00 0.00 H new ATOM 0 HE2 MET A 49 0.820 -7.469 -1.216 1.00 0.00 H new ATOM 0 HE3 MET A 49 0.188 -7.801 0.414 1.00 0.00 H new ATOM 728 N LEU A 50 -4.853 -8.889 -3.304 1.00 0.00 N ATOM 729 CA LEU A 50 -5.209 -8.552 -4.672 1.00 0.00 C ATOM 730 C LEU A 50 -4.323 -9.344 -5.635 1.00 0.00 C ATOM 731 O LEU A 50 -4.414 -9.175 -6.850 1.00 0.00 O ATOM 732 CB LEU A 50 -5.148 -7.038 -4.884 1.00 0.00 C ATOM 733 CG LEU A 50 -5.924 -6.187 -3.877 1.00 0.00 C ATOM 734 CD1 LEU A 50 -4.972 -5.431 -2.948 1.00 0.00 C ATOM 735 CD2 LEU A 50 -6.898 -5.246 -4.589 1.00 0.00 C ATOM 0 H LEU A 50 -5.535 -9.470 -2.817 1.00 0.00 H new ATOM 0 HA LEU A 50 -6.240 -8.838 -4.879 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.103 -6.730 -4.861 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.524 -6.816 -5.883 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.519 -6.854 -3.254 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -5.550 -4.834 -2.242 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -4.355 -6.144 -2.401 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.332 -4.776 -3.538 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -7.437 -4.653 -3.850 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.343 -4.583 -5.253 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -7.609 -5.831 -5.172 1.00 0.00 H new ATOM 747 N GLY A 51 -3.485 -10.192 -5.056 1.00 0.00 N ATOM 748 CA GLY A 51 -2.583 -11.011 -5.848 1.00 0.00 C ATOM 749 C GLY A 51 -1.352 -10.210 -6.280 1.00 0.00 C ATOM 750 O GLY A 51 -0.872 -10.360 -7.403 1.00 0.00 O ATOM 0 H GLY A 51 -3.412 -10.329 -4.048 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.271 -11.880 -5.268 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.105 -11.386 -6.728 1.00 0.00 H new ATOM 754 N LEU A 52 -0.877 -9.378 -5.366 1.00 0.00 N ATOM 755 CA LEU A 52 0.289 -8.554 -5.638 1.00 0.00 C ATOM 756 C LEU A 52 1.003 -8.237 -4.322 1.00 0.00 C ATOM 757 O LEU A 52 0.382 -8.235 -3.260 1.00 0.00 O ATOM 758 CB LEU A 52 -0.109 -7.310 -6.437 1.00 0.00 C ATOM 759 CG LEU A 52 -0.216 -6.008 -5.641 1.00 0.00 C ATOM 760 CD1 LEU A 52 1.153 -5.574 -5.112 1.00 0.00 C ATOM 761 CD2 LEU A 52 -0.883 -4.911 -6.472 1.00 0.00 C ATOM 0 H LEU A 52 -1.278 -9.256 -4.436 1.00 0.00 H new ATOM 0 HA LEU A 52 0.999 -9.094 -6.264 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.620 -7.166 -7.235 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -1.070 -7.501 -6.914 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.853 -6.189 -4.775 1.00 0.00 H new ATOM 0 HD11 LEU A 52 1.048 -4.646 -4.550 1.00 0.00 H new ATOM 0 HD12 LEU A 52 1.554 -6.350 -4.460 1.00 0.00 H new ATOM 0 HD13 LEU A 52 1.833 -5.417 -5.949 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -0.947 -3.996 -5.883 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -0.293 -4.724 -7.369 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.886 -5.229 -6.757 1.00 0.00 H new ATOM 773 N LYS A 53 2.297 -7.977 -4.436 1.00 0.00 N ATOM 774 CA LYS A 53 3.102 -7.660 -3.269 1.00 0.00 C ATOM 775 C LYS A 53 3.617 -6.224 -3.385 1.00 0.00 C ATOM 776 O LYS A 53 3.814 -5.719 -4.489 1.00 0.00 O ATOM 777 CB LYS A 53 4.210 -8.698 -3.084 1.00 0.00 C ATOM 778 CG LYS A 53 4.208 -9.254 -1.658 1.00 0.00 C ATOM 779 CD LYS A 53 5.572 -9.059 -0.992 1.00 0.00 C ATOM 780 CE LYS A 53 5.596 -7.777 -0.158 1.00 0.00 C ATOM 781 NZ LYS A 53 6.282 -8.011 1.132 1.00 0.00 N ATOM 0 H LYS A 53 2.808 -7.979 -5.319 1.00 0.00 H new ATOM 0 HA LYS A 53 2.497 -7.710 -2.364 1.00 0.00 H new ATOM 0 HB2 LYS A 53 4.073 -9.512 -3.796 1.00 0.00 H new ATOM 0 HB3 LYS A 53 5.178 -8.245 -3.300 1.00 0.00 H new ATOM 0 HG2 LYS A 53 3.438 -8.755 -1.070 1.00 0.00 H new ATOM 0 HG3 LYS A 53 3.957 -10.315 -1.678 1.00 0.00 H new ATOM 0 HD2 LYS A 53 5.796 -9.915 -0.356 1.00 0.00 H new ATOM 0 HD3 LYS A 53 6.350 -9.016 -1.754 1.00 0.00 H new ATOM 0 HE2 LYS A 53 6.105 -6.987 -0.710 1.00 0.00 H new ATOM 0 HE3 LYS A 53 4.577 -7.434 0.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 6.290 -7.131 1.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 5.779 -8.750 1.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 7.260 -8.317 0.955 1.00 0.00 H new ATOM 795 N VAL A 54 3.822 -5.607 -2.230 1.00 0.00 N ATOM 796 CA VAL A 54 4.311 -4.240 -2.189 1.00 0.00 C ATOM 797 C VAL A 54 5.305 -4.093 -1.035 1.00 0.00 C ATOM 798 O VAL A 54 5.079 -4.616 0.055 1.00 0.00 O ATOM 799 CB VAL A 54 3.135 -3.266 -2.092 1.00 0.00 C ATOM 800 CG1 VAL A 54 3.627 -1.823 -1.961 1.00 0.00 C ATOM 801 CG2 VAL A 54 2.196 -3.419 -3.290 1.00 0.00 C ATOM 0 H VAL A 54 3.658 -6.029 -1.316 1.00 0.00 H new ATOM 0 HA VAL A 54 4.842 -3.997 -3.109 1.00 0.00 H new ATOM 0 HB VAL A 54 2.571 -3.510 -1.192 1.00 0.00 H new ATOM 0 HG11 VAL A 54 2.771 -1.151 -1.894 1.00 0.00 H new ATOM 0 HG12 VAL A 54 4.236 -1.726 -1.062 1.00 0.00 H new ATOM 0 HG13 VAL A 54 4.225 -1.562 -2.834 1.00 0.00 H new ATOM 0 HG21 VAL A 54 1.369 -2.715 -3.196 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.744 -3.215 -4.210 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.805 -4.436 -3.319 1.00 0.00 H new ATOM 811 N VAL A 55 6.386 -3.379 -1.315 1.00 0.00 N ATOM 812 CA VAL A 55 7.416 -3.157 -0.314 1.00 0.00 C ATOM 813 C VAL A 55 7.630 -1.653 -0.133 1.00 0.00 C ATOM 814 O VAL A 55 8.119 -0.979 -1.039 1.00 0.00 O ATOM 815 CB VAL A 55 8.695 -3.900 -0.705 1.00 0.00 C ATOM 816 CG1 VAL A 55 9.928 -3.220 -0.108 1.00 0.00 C ATOM 817 CG2 VAL A 55 8.624 -5.371 -0.289 1.00 0.00 C ATOM 0 H VAL A 55 6.571 -2.947 -2.220 1.00 0.00 H new ATOM 0 HA VAL A 55 7.104 -3.559 0.650 1.00 0.00 H new ATOM 0 HB VAL A 55 8.785 -3.863 -1.791 1.00 0.00 H new ATOM 0 HG11 VAL A 55 10.823 -3.768 -0.401 1.00 0.00 H new ATOM 0 HG12 VAL A 55 9.993 -2.196 -0.476 1.00 0.00 H new ATOM 0 HG13 VAL A 55 9.848 -3.211 0.979 1.00 0.00 H new ATOM 0 HG21 VAL A 55 9.546 -5.876 -0.579 1.00 0.00 H new ATOM 0 HG22 VAL A 55 8.498 -5.438 0.792 1.00 0.00 H new ATOM 0 HG23 VAL A 55 7.778 -5.848 -0.783 1.00 0.00 H new ATOM 827 N GLY A 56 7.253 -1.171 1.042 1.00 0.00 N ATOM 828 CA GLY A 56 7.397 0.241 1.353 1.00 0.00 C ATOM 829 C GLY A 56 8.625 0.486 2.233 1.00 0.00 C ATOM 830 O GLY A 56 9.449 -0.408 2.417 1.00 0.00 O ATOM 0 H GLY A 56 6.848 -1.733 1.790 1.00 0.00 H new ATOM 0 HA2 GLY A 56 7.487 0.813 0.430 1.00 0.00 H new ATOM 0 HA3 GLY A 56 6.502 0.598 1.863 1.00 0.00 H new ATOM 834 N GLY A 57 8.707 1.702 2.753 1.00 0.00 N ATOM 835 CA GLY A 57 9.820 2.076 3.609 1.00 0.00 C ATOM 836 C GLY A 57 11.157 1.859 2.897 1.00 0.00 C ATOM 837 O GLY A 57 12.207 1.828 3.536 1.00 0.00 O ATOM 0 H GLY A 57 8.021 2.441 2.598 1.00 0.00 H new ATOM 0 HA2 GLY A 57 9.724 3.122 3.899 1.00 0.00 H new ATOM 0 HA3 GLY A 57 9.792 1.487 4.526 1.00 0.00 H new ATOM 841 N LYS A 58 11.074 1.714 1.582 1.00 0.00 N ATOM 842 CA LYS A 58 12.264 1.501 0.777 1.00 0.00 C ATOM 843 C LYS A 58 13.038 2.815 0.660 1.00 0.00 C ATOM 844 O LYS A 58 12.478 3.837 0.265 1.00 0.00 O ATOM 845 CB LYS A 58 11.893 0.884 -0.573 1.00 0.00 C ATOM 846 CG LYS A 58 13.068 0.095 -1.157 1.00 0.00 C ATOM 847 CD LYS A 58 13.309 0.474 -2.620 1.00 0.00 C ATOM 848 CE LYS A 58 12.880 -0.656 -3.557 1.00 0.00 C ATOM 849 NZ LYS A 58 12.903 -0.200 -4.964 1.00 0.00 N ATOM 0 H LYS A 58 10.201 1.740 1.055 1.00 0.00 H new ATOM 0 HA LYS A 58 12.927 0.783 1.259 1.00 0.00 H new ATOM 0 HB2 LYS A 58 11.033 0.226 -0.452 1.00 0.00 H new ATOM 0 HB3 LYS A 58 11.597 1.670 -1.267 1.00 0.00 H new ATOM 0 HG2 LYS A 58 13.968 0.291 -0.574 1.00 0.00 H new ATOM 0 HG3 LYS A 58 12.866 -0.974 -1.083 1.00 0.00 H new ATOM 0 HD2 LYS A 58 12.754 1.381 -2.860 1.00 0.00 H new ATOM 0 HD3 LYS A 58 14.365 0.696 -2.772 1.00 0.00 H new ATOM 0 HE2 LYS A 58 13.546 -1.510 -3.435 1.00 0.00 H new ATOM 0 HE3 LYS A 58 11.877 -0.993 -3.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 12.963 -1.024 -5.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 12.033 0.331 -5.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 13.728 0.414 -5.116 1.00 0.00 H new ATOM 863 N MET A 59 14.313 2.747 1.012 1.00 0.00 N ATOM 864 CA MET A 59 15.170 3.919 0.952 1.00 0.00 C ATOM 865 C MET A 59 15.577 4.228 -0.491 1.00 0.00 C ATOM 866 O MET A 59 16.260 3.430 -1.131 1.00 0.00 O ATOM 867 CB MET A 59 16.424 3.680 1.795 1.00 0.00 C ATOM 868 CG MET A 59 16.421 4.563 3.044 1.00 0.00 C ATOM 869 SD MET A 59 16.804 6.249 2.600 1.00 0.00 S ATOM 870 CE MET A 59 15.300 7.057 3.121 1.00 0.00 C ATOM 0 H MET A 59 14.774 1.898 1.340 1.00 0.00 H new ATOM 0 HA MET A 59 14.615 4.771 1.344 1.00 0.00 H new ATOM 0 HB2 MET A 59 16.476 2.631 2.087 1.00 0.00 H new ATOM 0 HB3 MET A 59 17.312 3.889 1.199 1.00 0.00 H new ATOM 0 HG2 MET A 59 15.446 4.518 3.529 1.00 0.00 H new ATOM 0 HG3 MET A 59 17.152 4.193 3.763 1.00 0.00 H new ATOM 0 HE1 MET A 59 15.547 7.950 3.695 1.00 0.00 H new ATOM 0 HE2 MET A 59 14.716 7.339 2.245 1.00 0.00 H new ATOM 0 HE3 MET A 59 14.717 6.376 3.741 1.00 0.00 H new ATOM 880 N THR A 60 15.139 5.387 -0.960 1.00 0.00 N ATOM 881 CA THR A 60 15.449 5.811 -2.315 1.00 0.00 C ATOM 882 C THR A 60 16.803 6.523 -2.355 1.00 0.00 C ATOM 883 O THR A 60 17.516 6.563 -1.354 1.00 0.00 O ATOM 884 CB THR A 60 14.292 6.677 -2.816 1.00 0.00 C ATOM 885 OG1 THR A 60 14.207 7.730 -1.860 1.00 0.00 O ATOM 886 CG2 THR A 60 12.940 5.967 -2.709 1.00 0.00 C ATOM 0 H THR A 60 14.572 6.046 -0.426 1.00 0.00 H new ATOM 0 HA THR A 60 15.547 4.956 -2.984 1.00 0.00 H new ATOM 0 HB THR A 60 14.473 6.959 -3.853 1.00 0.00 H new ATOM 0 HG1 THR A 60 13.721 7.415 -1.069 1.00 0.00 H new ATOM 0 HG21 THR A 60 12.153 6.625 -3.078 1.00 0.00 H new ATOM 0 HG22 THR A 60 12.960 5.055 -3.306 1.00 0.00 H new ATOM 0 HG23 THR A 60 12.743 5.714 -1.667 1.00 0.00 H new ATOM 894 N GLU A 61 17.115 7.066 -3.522 1.00 0.00 N ATOM 895 CA GLU A 61 18.371 7.775 -3.705 1.00 0.00 C ATOM 896 C GLU A 61 18.248 9.212 -3.197 1.00 0.00 C ATOM 897 O GLU A 61 19.246 9.922 -3.084 1.00 0.00 O ATOM 898 CB GLU A 61 18.807 7.747 -5.171 1.00 0.00 C ATOM 899 CG GLU A 61 17.911 8.645 -6.027 1.00 0.00 C ATOM 900 CD GLU A 61 18.113 8.360 -7.517 1.00 0.00 C ATOM 901 OE1 GLU A 61 17.636 7.293 -7.960 1.00 0.00 O ATOM 902 OE2 GLU A 61 18.738 9.216 -8.179 1.00 0.00 O ATOM 0 H GLU A 61 16.521 7.030 -4.350 1.00 0.00 H new ATOM 0 HA GLU A 61 19.140 7.269 -3.121 1.00 0.00 H new ATOM 0 HB2 GLU A 61 19.843 8.077 -5.252 1.00 0.00 H new ATOM 0 HB3 GLU A 61 18.768 6.724 -5.546 1.00 0.00 H new ATOM 0 HG2 GLU A 61 16.867 8.483 -5.760 1.00 0.00 H new ATOM 0 HG3 GLU A 61 18.134 9.692 -5.820 1.00 0.00 H new ATOM 909 N SER A 62 17.015 9.599 -2.904 1.00 0.00 N ATOM 910 CA SER A 62 16.749 10.940 -2.411 1.00 0.00 C ATOM 911 C SER A 62 16.542 10.908 -0.895 1.00 0.00 C ATOM 912 O SER A 62 16.144 11.907 -0.298 1.00 0.00 O ATOM 913 CB SER A 62 15.526 11.548 -3.101 1.00 0.00 C ATOM 914 OG SER A 62 14.305 11.057 -2.554 1.00 0.00 O ATOM 0 H SER A 62 16.189 9.008 -2.998 1.00 0.00 H new ATOM 0 HA SER A 62 17.611 11.567 -2.641 1.00 0.00 H new ATOM 0 HB2 SER A 62 15.557 12.633 -3.003 1.00 0.00 H new ATOM 0 HB3 SER A 62 15.562 11.323 -4.167 1.00 0.00 H new ATOM 0 HG SER A 62 14.306 10.077 -2.578 1.00 0.00 H new ATOM 920 N GLY A 63 16.821 9.750 -0.316 1.00 0.00 N ATOM 921 CA GLY A 63 16.670 9.574 1.118 1.00 0.00 C ATOM 922 C GLY A 63 15.193 9.571 1.518 1.00 0.00 C ATOM 923 O GLY A 63 14.859 9.821 2.675 1.00 0.00 O ATOM 0 H GLY A 63 17.151 8.924 -0.814 1.00 0.00 H new ATOM 0 HA2 GLY A 63 17.135 8.637 1.424 1.00 0.00 H new ATOM 0 HA3 GLY A 63 17.191 10.375 1.643 1.00 0.00 H new ATOM 927 N ARG A 64 14.349 9.284 0.538 1.00 0.00 N ATOM 928 CA ARG A 64 12.915 9.244 0.773 1.00 0.00 C ATOM 929 C ARG A 64 12.411 7.801 0.735 1.00 0.00 C ATOM 930 O ARG A 64 13.131 6.899 0.310 1.00 0.00 O ATOM 931 CB ARG A 64 12.163 10.069 -0.273 1.00 0.00 C ATOM 932 CG ARG A 64 11.772 11.439 0.286 1.00 0.00 C ATOM 933 CD ARG A 64 10.990 12.250 -0.749 1.00 0.00 C ATOM 934 NE ARG A 64 10.808 13.639 -0.271 1.00 0.00 N ATOM 935 CZ ARG A 64 10.304 14.631 -1.018 1.00 0.00 C ATOM 936 NH1 ARG A 64 9.931 14.393 -2.283 1.00 0.00 N ATOM 937 NH2 ARG A 64 10.175 15.860 -0.500 1.00 0.00 N ATOM 0 H ARG A 64 14.630 9.077 -0.420 1.00 0.00 H new ATOM 0 HA ARG A 64 12.728 9.671 1.758 1.00 0.00 H new ATOM 0 HB2 ARG A 64 12.787 10.198 -1.157 1.00 0.00 H new ATOM 0 HB3 ARG A 64 11.268 9.533 -0.590 1.00 0.00 H new ATOM 0 HG2 ARG A 64 11.168 11.310 1.184 1.00 0.00 H new ATOM 0 HG3 ARG A 64 12.668 11.985 0.580 1.00 0.00 H new ATOM 0 HD2 ARG A 64 11.522 12.251 -1.700 1.00 0.00 H new ATOM 0 HD3 ARG A 64 10.019 11.788 -0.927 1.00 0.00 H new ATOM 0 HE ARG A 64 11.083 13.855 0.687 1.00 0.00 H new ATOM 0 HH11 ARG A 64 10.031 13.457 -2.677 1.00 0.00 H new ATOM 0 HH12 ARG A 64 9.547 15.148 -2.852 1.00 0.00 H new ATOM 0 HH21 ARG A 64 10.460 16.040 0.463 1.00 0.00 H new ATOM 0 HH22 ARG A 64 9.791 16.615 -1.068 1.00 0.00 H new ATOM 951 N LEU A 65 11.176 7.626 1.184 1.00 0.00 N ATOM 952 CA LEU A 65 10.567 6.308 1.205 1.00 0.00 C ATOM 953 C LEU A 65 9.499 6.226 0.113 1.00 0.00 C ATOM 954 O LEU A 65 8.743 7.174 -0.093 1.00 0.00 O ATOM 955 CB LEU A 65 10.042 5.983 2.605 1.00 0.00 C ATOM 956 CG LEU A 65 11.059 6.083 3.744 1.00 0.00 C ATOM 957 CD1 LEU A 65 10.360 6.092 5.105 1.00 0.00 C ATOM 958 CD2 LEU A 65 12.105 4.971 3.644 1.00 0.00 C ATOM 0 H LEU A 65 10.581 8.376 1.536 1.00 0.00 H new ATOM 0 HA LEU A 65 11.310 5.542 0.982 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.213 6.655 2.825 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.638 4.971 2.594 1.00 0.00 H new ATOM 0 HG LEU A 65 11.587 7.032 3.648 1.00 0.00 H new ATOM 0 HD11 LEU A 65 11.106 6.164 5.897 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.686 6.947 5.162 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.789 5.172 5.227 1.00 0.00 H new ATOM 0 HD21 LEU A 65 12.816 5.065 4.465 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.611 4.001 3.701 1.00 0.00 H new ATOM 0 HD23 LEU A 65 12.634 5.054 2.695 1.00 0.00 H new ATOM 970 N CYS A 66 9.470 5.084 -0.558 1.00 0.00 N ATOM 971 CA CYS A 66 8.507 4.866 -1.623 1.00 0.00 C ATOM 972 C CYS A 66 8.268 3.361 -1.755 1.00 0.00 C ATOM 973 O CYS A 66 9.191 2.565 -1.586 1.00 0.00 O ATOM 974 CB CYS A 66 8.972 5.488 -2.942 1.00 0.00 C ATOM 975 SG CYS A 66 8.706 7.298 -2.908 1.00 0.00 S ATOM 0 H CYS A 66 10.099 4.300 -0.384 1.00 0.00 H new ATOM 0 HA CYS A 66 7.568 5.361 -1.374 1.00 0.00 H new ATOM 0 HB2 CYS A 66 10.028 5.270 -3.104 1.00 0.00 H new ATOM 0 HB3 CYS A 66 8.424 5.047 -3.775 1.00 0.00 H new ATOM 0 HG CYS A 66 8.674 7.709 -1.675 1.00 0.00 H new ATOM 981 N ALA A 67 7.025 3.015 -2.057 1.00 0.00 N ATOM 982 CA ALA A 67 6.654 1.619 -2.213 1.00 0.00 C ATOM 983 C ALA A 67 6.834 1.209 -3.676 1.00 0.00 C ATOM 984 O ALA A 67 6.795 2.052 -4.570 1.00 0.00 O ATOM 985 CB ALA A 67 5.219 1.414 -1.722 1.00 0.00 C ATOM 0 H ALA A 67 6.262 3.677 -2.198 1.00 0.00 H new ATOM 0 HA ALA A 67 7.299 0.980 -1.610 1.00 0.00 H new ATOM 0 HB1 ALA A 67 4.941 0.367 -1.839 1.00 0.00 H new ATOM 0 HB2 ALA A 67 5.151 1.692 -0.670 1.00 0.00 H new ATOM 0 HB3 ALA A 67 4.542 2.037 -2.307 1.00 0.00 H new ATOM 991 N PHE A 68 7.027 -0.087 -3.875 1.00 0.00 N ATOM 992 CA PHE A 68 7.213 -0.619 -5.214 1.00 0.00 C ATOM 993 C PHE A 68 6.755 -2.077 -5.293 1.00 0.00 C ATOM 994 O PHE A 68 6.939 -2.841 -4.347 1.00 0.00 O ATOM 995 CB PHE A 68 8.710 -0.550 -5.519 1.00 0.00 C ATOM 996 CG PHE A 68 9.310 0.851 -5.379 1.00 0.00 C ATOM 997 CD1 PHE A 68 9.034 1.805 -6.308 1.00 0.00 C ATOM 998 CD2 PHE A 68 10.118 1.142 -4.325 1.00 0.00 C ATOM 999 CE1 PHE A 68 9.590 3.105 -6.178 1.00 0.00 C ATOM 1000 CE2 PHE A 68 10.674 2.443 -4.195 1.00 0.00 C ATOM 1001 CZ PHE A 68 10.399 3.396 -5.124 1.00 0.00 C ATOM 0 H PHE A 68 7.059 -0.784 -3.131 1.00 0.00 H new ATOM 0 HA PHE A 68 6.625 -0.042 -5.928 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.238 -1.229 -4.850 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.880 -0.907 -6.535 1.00 0.00 H new ATOM 0 HD1 PHE A 68 8.392 1.574 -7.145 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.337 0.385 -3.587 1.00 0.00 H new ATOM 0 HE1 PHE A 68 9.371 3.863 -6.916 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.315 2.675 -3.358 1.00 0.00 H new ATOM 0 HZ PHE A 68 10.823 4.384 -5.025 1.00 0.00 H new ATOM 1011 N ILE A 69 6.168 -2.419 -6.430 1.00 0.00 N ATOM 1012 CA ILE A 69 5.683 -3.772 -6.645 1.00 0.00 C ATOM 1013 C ILE A 69 6.875 -4.718 -6.797 1.00 0.00 C ATOM 1014 O ILE A 69 7.737 -4.506 -7.649 1.00 0.00 O ATOM 1015 CB ILE A 69 4.712 -3.811 -7.827 1.00 0.00 C ATOM 1016 CG1 ILE A 69 3.473 -2.958 -7.547 1.00 0.00 C ATOM 1017 CG2 ILE A 69 4.346 -5.252 -8.188 1.00 0.00 C ATOM 1018 CD1 ILE A 69 2.611 -2.815 -8.803 1.00 0.00 C ATOM 0 H ILE A 69 6.017 -1.783 -7.213 1.00 0.00 H new ATOM 0 HA ILE A 69 5.112 -4.114 -5.782 1.00 0.00 H new ATOM 0 HB ILE A 69 5.211 -3.379 -8.694 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.886 -3.413 -6.749 1.00 0.00 H new ATOM 0 HG13 ILE A 69 3.778 -1.972 -7.196 1.00 0.00 H new ATOM 0 HG21 ILE A 69 3.655 -5.252 -9.031 1.00 0.00 H new ATOM 0 HG22 ILE A 69 5.249 -5.800 -8.459 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.873 -5.733 -7.332 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.737 -2.204 -8.577 1.00 0.00 H new ATOM 0 HD12 ILE A 69 3.193 -2.338 -9.591 1.00 0.00 H new ATOM 0 HD13 ILE A 69 2.288 -3.801 -9.137 1.00 0.00 H new ATOM 1030 N THR A 70 6.887 -5.743 -5.957 1.00 0.00 N ATOM 1031 CA THR A 70 7.960 -6.723 -5.988 1.00 0.00 C ATOM 1032 C THR A 70 7.553 -7.932 -6.832 1.00 0.00 C ATOM 1033 O THR A 70 8.315 -8.381 -7.687 1.00 0.00 O ATOM 1034 CB THR A 70 8.313 -7.082 -4.543 1.00 0.00 C ATOM 1035 OG1 THR A 70 7.049 -7.261 -3.911 1.00 0.00 O ATOM 1036 CG2 THR A 70 8.945 -5.912 -3.787 1.00 0.00 C ATOM 0 H THR A 70 6.171 -5.916 -5.251 1.00 0.00 H new ATOM 0 HA THR A 70 8.852 -6.318 -6.465 1.00 0.00 H new ATOM 0 HB THR A 70 8.997 -7.930 -4.537 1.00 0.00 H new ATOM 0 HG1 THR A 70 7.176 -7.340 -2.942 1.00 0.00 H new ATOM 0 HG21 THR A 70 9.176 -6.220 -2.767 1.00 0.00 H new ATOM 0 HG22 THR A 70 9.862 -5.606 -4.290 1.00 0.00 H new ATOM 0 HG23 THR A 70 8.248 -5.075 -3.764 1.00 0.00 H new ATOM 1044 N LYS A 71 6.353 -8.426 -6.563 1.00 0.00 N ATOM 1045 CA LYS A 71 5.837 -9.574 -7.288 1.00 0.00 C ATOM 1046 C LYS A 71 4.316 -9.453 -7.409 1.00 0.00 C ATOM 1047 O LYS A 71 3.663 -8.892 -6.531 1.00 0.00 O ATOM 1048 CB LYS A 71 6.300 -10.875 -6.630 1.00 0.00 C ATOM 1049 CG LYS A 71 5.996 -12.080 -7.523 1.00 0.00 C ATOM 1050 CD LYS A 71 7.136 -13.099 -7.475 1.00 0.00 C ATOM 1051 CE LYS A 71 8.127 -12.868 -8.618 1.00 0.00 C ATOM 1052 NZ LYS A 71 9.424 -12.389 -8.090 1.00 0.00 N ATOM 0 H LYS A 71 5.724 -8.052 -5.853 1.00 0.00 H new ATOM 0 HA LYS A 71 6.237 -9.597 -8.302 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.371 -10.826 -6.432 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.803 -10.997 -5.667 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.068 -12.552 -7.200 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.844 -11.747 -8.550 1.00 0.00 H new ATOM 0 HD2 LYS A 71 7.654 -13.025 -6.519 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.729 -14.108 -7.540 1.00 0.00 H new ATOM 0 HE2 LYS A 71 8.273 -13.795 -9.173 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.720 -12.138 -9.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 10.085 -12.237 -8.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.282 -11.494 -7.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.818 -13.099 -7.440 1.00 0.00 H new ATOM 1066 N VAL A 72 3.798 -9.990 -8.504 1.00 0.00 N ATOM 1067 CA VAL A 72 2.366 -9.949 -8.751 1.00 0.00 C ATOM 1068 C VAL A 72 1.936 -11.244 -9.442 1.00 0.00 C ATOM 1069 O VAL A 72 2.386 -11.542 -10.548 1.00 0.00 O ATOM 1070 CB VAL A 72 2.009 -8.696 -9.554 1.00 0.00 C ATOM 1071 CG1 VAL A 72 3.109 -8.359 -10.563 1.00 0.00 C ATOM 1072 CG2 VAL A 72 0.657 -8.858 -10.250 1.00 0.00 C ATOM 0 H VAL A 72 4.343 -10.455 -9.230 1.00 0.00 H new ATOM 0 HA VAL A 72 1.818 -9.884 -7.811 1.00 0.00 H new ATOM 0 HB VAL A 72 1.929 -7.863 -8.856 1.00 0.00 H new ATOM 0 HG11 VAL A 72 2.830 -7.465 -11.120 1.00 0.00 H new ATOM 0 HG12 VAL A 72 4.045 -8.180 -10.034 1.00 0.00 H new ATOM 0 HG13 VAL A 72 3.236 -9.192 -11.254 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.427 -7.954 -10.814 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.697 -9.709 -10.930 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.119 -9.027 -9.503 1.00 0.00 H new ATOM 1082 N LYS A 73 1.069 -11.980 -8.763 1.00 0.00 N ATOM 1083 CA LYS A 73 0.572 -13.237 -9.297 1.00 0.00 C ATOM 1084 C LYS A 73 -0.010 -12.998 -10.692 1.00 0.00 C ATOM 1085 O LYS A 73 -0.792 -12.070 -10.892 1.00 0.00 O ATOM 1086 CB LYS A 73 -0.414 -13.882 -8.322 1.00 0.00 C ATOM 1087 CG LYS A 73 -0.739 -15.318 -8.739 1.00 0.00 C ATOM 1088 CD LYS A 73 0.203 -16.313 -8.057 1.00 0.00 C ATOM 1089 CE LYS A 73 0.420 -17.549 -8.931 1.00 0.00 C ATOM 1090 NZ LYS A 73 1.178 -18.582 -8.190 1.00 0.00 N ATOM 0 H LYS A 73 0.697 -11.730 -7.847 1.00 0.00 H new ATOM 0 HA LYS A 73 1.387 -13.952 -9.408 1.00 0.00 H new ATOM 0 HB2 LYS A 73 0.008 -13.878 -7.317 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -1.331 -13.294 -8.285 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -1.771 -15.552 -8.478 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -0.654 -15.414 -9.821 1.00 0.00 H new ATOM 0 HD2 LYS A 73 1.161 -15.833 -7.855 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -0.213 -16.612 -7.095 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -0.542 -17.952 -9.246 1.00 0.00 H new ATOM 0 HE3 LYS A 73 0.961 -17.271 -9.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 1.316 -19.414 -8.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 2.104 -18.200 -7.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 0.647 -18.859 -7.340 1.00 0.00 H new ATOM 1104 N LYS A 74 0.395 -13.852 -11.621 1.00 0.00 N ATOM 1105 CA LYS A 74 -0.076 -13.745 -12.992 1.00 0.00 C ATOM 1106 C LYS A 74 -1.425 -14.456 -13.119 1.00 0.00 C ATOM 1107 O LYS A 74 -1.483 -15.685 -13.138 1.00 0.00 O ATOM 1108 CB LYS A 74 0.986 -14.261 -13.965 1.00 0.00 C ATOM 1109 CG LYS A 74 0.394 -14.475 -15.359 1.00 0.00 C ATOM 1110 CD LYS A 74 1.218 -13.747 -16.423 1.00 0.00 C ATOM 1111 CE LYS A 74 1.551 -14.679 -17.591 1.00 0.00 C ATOM 1112 NZ LYS A 74 2.557 -14.056 -18.480 1.00 0.00 N ATOM 0 H LYS A 74 1.044 -14.621 -11.451 1.00 0.00 H new ATOM 0 HA LYS A 74 -0.239 -12.701 -13.259 1.00 0.00 H new ATOM 0 HB2 LYS A 74 1.810 -13.549 -14.021 1.00 0.00 H new ATOM 0 HB3 LYS A 74 1.400 -15.199 -13.594 1.00 0.00 H new ATOM 0 HG2 LYS A 74 0.363 -15.541 -15.585 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -0.634 -14.114 -15.381 1.00 0.00 H new ATOM 0 HD2 LYS A 74 0.664 -12.883 -16.789 1.00 0.00 H new ATOM 0 HD3 LYS A 74 2.140 -13.370 -15.980 1.00 0.00 H new ATOM 0 HE2 LYS A 74 1.931 -15.627 -17.211 1.00 0.00 H new ATOM 0 HE3 LYS A 74 0.646 -14.902 -18.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 2.772 -14.701 -19.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 2.181 -13.163 -18.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 3.426 -13.866 -17.941 1.00 0.00 H new ATOM 1126 N GLY A 75 -2.475 -13.654 -13.203 1.00 0.00 N ATOM 1127 CA GLY A 75 -3.820 -14.191 -13.329 1.00 0.00 C ATOM 1128 C GLY A 75 -4.674 -13.820 -12.115 1.00 0.00 C ATOM 1129 O GLY A 75 -5.685 -14.466 -11.842 1.00 0.00 O ATOM 0 H GLY A 75 -2.422 -12.635 -13.186 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.285 -13.807 -14.237 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -3.775 -15.275 -13.429 1.00 0.00 H new ATOM 1133 N SER A 76 -4.236 -12.782 -11.419 1.00 0.00 N ATOM 1134 CA SER A 76 -4.948 -12.317 -10.240 1.00 0.00 C ATOM 1135 C SER A 76 -5.500 -10.911 -10.483 1.00 0.00 C ATOM 1136 O SER A 76 -5.116 -10.247 -11.444 1.00 0.00 O ATOM 1137 CB SER A 76 -4.040 -12.326 -9.009 1.00 0.00 C ATOM 1138 OG SER A 76 -4.113 -13.559 -8.300 1.00 0.00 O ATOM 0 H SER A 76 -3.397 -12.249 -11.648 1.00 0.00 H new ATOM 0 HA SER A 76 -5.778 -12.998 -10.050 1.00 0.00 H new ATOM 0 HB2 SER A 76 -3.010 -12.146 -9.317 1.00 0.00 H new ATOM 0 HB3 SER A 76 -4.322 -11.509 -8.345 1.00 0.00 H new ATOM 0 HG SER A 76 -3.518 -13.525 -7.522 1.00 0.00 H new ATOM 1144 N LEU A 77 -6.392 -10.498 -9.594 1.00 0.00 N ATOM 1145 CA LEU A 77 -7.000 -9.183 -9.700 1.00 0.00 C ATOM 1146 C LEU A 77 -5.945 -8.173 -10.153 1.00 0.00 C ATOM 1147 O LEU A 77 -6.031 -7.632 -11.255 1.00 0.00 O ATOM 1148 CB LEU A 77 -7.690 -8.805 -8.387 1.00 0.00 C ATOM 1149 CG LEU A 77 -9.133 -9.287 -8.225 1.00 0.00 C ATOM 1150 CD1 LEU A 77 -9.393 -9.769 -6.796 1.00 0.00 C ATOM 1151 CD2 LEU A 77 -10.125 -8.203 -8.653 1.00 0.00 C ATOM 0 H LEU A 77 -6.708 -11.051 -8.797 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.784 -9.186 -10.457 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.100 -9.203 -7.562 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.678 -7.719 -8.293 1.00 0.00 H new ATOM 0 HG LEU A 77 -9.284 -10.141 -8.886 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -10.426 -10.106 -6.708 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.721 -10.595 -6.562 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.218 -8.950 -6.098 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.143 -8.572 -8.528 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -9.982 -7.315 -8.037 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -9.957 -7.949 -9.700 1.00 0.00 H new ATOM 1163 N ALA A 78 -4.974 -7.948 -9.280 1.00 0.00 N ATOM 1164 CA ALA A 78 -3.903 -7.011 -9.577 1.00 0.00 C ATOM 1165 C ALA A 78 -2.977 -7.620 -10.633 1.00 0.00 C ATOM 1166 O ALA A 78 -1.786 -7.803 -10.387 1.00 0.00 O ATOM 1167 CB ALA A 78 -3.162 -6.657 -8.287 1.00 0.00 C ATOM 0 H ALA A 78 -4.906 -8.398 -8.367 1.00 0.00 H new ATOM 0 HA ALA A 78 -4.306 -6.085 -9.986 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.359 -5.954 -8.510 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.857 -6.202 -7.581 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.741 -7.562 -7.849 1.00 0.00 H new ATOM 1173 N ASP A 79 -3.560 -7.917 -11.785 1.00 0.00 N ATOM 1174 CA ASP A 79 -2.803 -8.501 -12.878 1.00 0.00 C ATOM 1175 C ASP A 79 -3.743 -8.781 -14.052 1.00 0.00 C ATOM 1176 O ASP A 79 -3.393 -8.536 -15.206 1.00 0.00 O ATOM 1177 CB ASP A 79 -2.162 -9.825 -12.459 1.00 0.00 C ATOM 1178 CG ASP A 79 -0.974 -10.269 -13.315 1.00 0.00 C ATOM 1179 OD1 ASP A 79 0.150 -9.823 -13.001 1.00 0.00 O ATOM 1180 OD2 ASP A 79 -1.218 -11.044 -14.265 1.00 0.00 O ATOM 0 H ASP A 79 -4.548 -7.764 -11.985 1.00 0.00 H new ATOM 0 HA ASP A 79 -2.021 -7.796 -13.161 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -1.832 -9.740 -11.424 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -2.923 -10.605 -12.488 1.00 0.00 H new ATOM 1185 N THR A 80 -4.919 -9.291 -13.718 1.00 0.00 N ATOM 1186 CA THR A 80 -5.913 -9.608 -14.730 1.00 0.00 C ATOM 1187 C THR A 80 -6.749 -8.370 -15.061 1.00 0.00 C ATOM 1188 O THR A 80 -6.911 -8.020 -16.229 1.00 0.00 O ATOM 1189 CB THR A 80 -6.746 -10.786 -14.222 1.00 0.00 C ATOM 1190 OG1 THR A 80 -7.116 -10.406 -12.900 1.00 0.00 O ATOM 1191 CG2 THR A 80 -5.910 -12.053 -14.025 1.00 0.00 C ATOM 0 H THR A 80 -5.206 -9.493 -12.760 1.00 0.00 H new ATOM 0 HA THR A 80 -5.443 -9.905 -15.668 1.00 0.00 H new ATOM 0 HB THR A 80 -7.553 -10.989 -14.926 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.660 -11.114 -12.496 1.00 0.00 H new ATOM 0 HG21 THR A 80 -6.549 -12.858 -13.664 1.00 0.00 H new ATOM 0 HG22 THR A 80 -5.461 -12.344 -14.975 1.00 0.00 H new ATOM 0 HG23 THR A 80 -5.123 -11.860 -13.296 1.00 0.00 H new ATOM 1199 N VAL A 81 -7.260 -7.742 -14.012 1.00 0.00 N ATOM 1200 CA VAL A 81 -8.076 -6.552 -14.177 1.00 0.00 C ATOM 1201 C VAL A 81 -7.200 -5.310 -14.002 1.00 0.00 C ATOM 1202 O VAL A 81 -7.396 -4.306 -14.686 1.00 0.00 O ATOM 1203 CB VAL A 81 -9.259 -6.590 -13.207 1.00 0.00 C ATOM 1204 CG1 VAL A 81 -10.301 -7.617 -13.654 1.00 0.00 C ATOM 1205 CG2 VAL A 81 -8.788 -6.871 -11.779 1.00 0.00 C ATOM 0 H VAL A 81 -7.124 -8.035 -13.045 1.00 0.00 H new ATOM 0 HA VAL A 81 -8.497 -6.514 -15.182 1.00 0.00 H new ATOM 0 HB VAL A 81 -9.732 -5.608 -13.216 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -11.131 -7.624 -12.948 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -10.670 -7.353 -14.645 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -9.845 -8.607 -13.688 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -9.648 -6.893 -11.110 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.279 -7.834 -11.747 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -8.101 -6.087 -11.461 1.00 0.00 H new ATOM 1215 N GLY A 82 -6.252 -5.418 -13.083 1.00 0.00 N ATOM 1216 CA GLY A 82 -5.345 -4.316 -12.810 1.00 0.00 C ATOM 1217 C GLY A 82 -4.224 -4.259 -13.850 1.00 0.00 C ATOM 1218 O GLY A 82 -3.878 -3.183 -14.336 1.00 0.00 O ATOM 0 H GLY A 82 -6.092 -6.252 -12.518 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -5.897 -3.376 -12.813 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -4.917 -4.431 -11.814 1.00 0.00 H new ATOM 1222 N HIS A 83 -3.687 -5.430 -14.160 1.00 0.00 N ATOM 1223 CA HIS A 83 -2.612 -5.526 -15.133 1.00 0.00 C ATOM 1224 C HIS A 83 -1.360 -4.838 -14.585 1.00 0.00 C ATOM 1225 O HIS A 83 -0.707 -4.074 -15.293 1.00 0.00 O ATOM 1226 CB HIS A 83 -3.053 -4.964 -16.486 1.00 0.00 C ATOM 1227 CG HIS A 83 -4.221 -5.695 -17.104 1.00 0.00 C ATOM 1228 ND1 HIS A 83 -4.115 -6.973 -17.624 1.00 0.00 N ATOM 1229 CD2 HIS A 83 -5.519 -5.315 -17.278 1.00 0.00 C ATOM 1230 CE1 HIS A 83 -5.302 -7.335 -18.088 1.00 0.00 C ATOM 1231 NE2 HIS A 83 -6.171 -6.306 -17.873 1.00 0.00 N ATOM 0 H HIS A 83 -3.976 -6.320 -13.755 1.00 0.00 H new ATOM 0 HA HIS A 83 -2.363 -6.573 -15.303 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -3.319 -3.914 -16.362 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -2.209 -5.000 -17.175 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -5.945 -4.368 -16.982 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -5.540 -8.279 -18.555 1.00 0.00 H new ATOM 0 HE2 HIS A 83 -7.159 -6.299 -18.127 1.00 0.00 H new ATOM 1239 N LEU A 84 -1.064 -5.134 -13.328 1.00 0.00 N ATOM 1240 CA LEU A 84 0.098 -4.554 -12.677 1.00 0.00 C ATOM 1241 C LEU A 84 1.333 -5.397 -13.001 1.00 0.00 C ATOM 1242 O LEU A 84 1.225 -6.444 -13.638 1.00 0.00 O ATOM 1243 CB LEU A 84 -0.156 -4.387 -11.177 1.00 0.00 C ATOM 1244 CG LEU A 84 -1.376 -3.548 -10.793 1.00 0.00 C ATOM 1245 CD1 LEU A 84 -2.068 -4.122 -9.555 1.00 0.00 C ATOM 1246 CD2 LEU A 84 -0.995 -2.078 -10.607 1.00 0.00 C ATOM 0 H LEU A 84 -1.609 -5.768 -12.743 1.00 0.00 H new ATOM 0 HA LEU A 84 0.287 -3.551 -13.059 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.267 -5.377 -10.735 1.00 0.00 H new ATOM 0 HB3 LEU A 84 0.728 -3.934 -10.727 1.00 0.00 H new ATOM 0 HG LEU A 84 -2.093 -3.593 -11.613 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.932 -3.507 -9.303 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.395 -5.141 -9.761 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.370 -4.127 -8.718 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.881 -1.504 -10.334 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.250 -1.993 -9.816 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.583 -1.688 -11.538 1.00 0.00 H new ATOM 1258 N ARG A 85 2.479 -4.909 -12.548 1.00 0.00 N ATOM 1259 CA ARG A 85 3.733 -5.604 -12.782 1.00 0.00 C ATOM 1260 C ARG A 85 4.740 -5.269 -11.680 1.00 0.00 C ATOM 1261 O ARG A 85 4.692 -4.185 -11.100 1.00 0.00 O ATOM 1262 CB ARG A 85 4.328 -5.224 -14.140 1.00 0.00 C ATOM 1263 CG ARG A 85 3.843 -6.174 -15.236 1.00 0.00 C ATOM 1264 CD ARG A 85 3.409 -5.398 -16.481 1.00 0.00 C ATOM 1265 NE ARG A 85 3.687 -6.195 -17.697 1.00 0.00 N ATOM 1266 CZ ARG A 85 2.960 -7.252 -18.085 1.00 0.00 C ATOM 1267 NH1 ARG A 85 1.906 -7.644 -17.356 1.00 0.00 N ATOM 1268 NH2 ARG A 85 3.285 -7.915 -19.203 1.00 0.00 N ATOM 0 H ARG A 85 2.565 -4.040 -12.020 1.00 0.00 H new ATOM 0 HA ARG A 85 3.525 -6.674 -12.775 1.00 0.00 H new ATOM 0 HB2 ARG A 85 4.048 -4.201 -14.390 1.00 0.00 H new ATOM 0 HB3 ARG A 85 5.416 -5.252 -14.085 1.00 0.00 H new ATOM 0 HG2 ARG A 85 4.639 -6.871 -15.497 1.00 0.00 H new ATOM 0 HG3 ARG A 85 3.008 -6.768 -14.864 1.00 0.00 H new ATOM 0 HD2 ARG A 85 2.345 -5.167 -16.423 1.00 0.00 H new ATOM 0 HD3 ARG A 85 3.940 -4.447 -16.530 1.00 0.00 H new ATOM 0 HE ARG A 85 4.482 -5.923 -18.276 1.00 0.00 H new ATOM 0 HH11 ARG A 85 1.657 -7.138 -16.506 1.00 0.00 H new ATOM 0 HH12 ARG A 85 1.353 -8.448 -17.651 1.00 0.00 H new ATOM 0 HH21 ARG A 85 4.086 -7.615 -19.759 1.00 0.00 H new ATOM 0 HH22 ARG A 85 2.732 -8.719 -19.498 1.00 0.00 H new ATOM 1282 N PRO A 86 5.651 -6.244 -11.417 1.00 0.00 N ATOM 1283 CA PRO A 86 6.667 -6.063 -10.395 1.00 0.00 C ATOM 1284 C PRO A 86 7.768 -5.116 -10.877 1.00 0.00 C ATOM 1285 O PRO A 86 8.683 -5.533 -11.585 1.00 0.00 O ATOM 1286 CB PRO A 86 7.177 -7.463 -10.095 1.00 0.00 C ATOM 1287 CG PRO A 86 6.764 -8.320 -11.280 1.00 0.00 C ATOM 1288 CD PRO A 86 5.737 -7.540 -12.084 1.00 0.00 C ATOM 0 HA PRO A 86 6.276 -5.594 -9.492 1.00 0.00 H new ATOM 0 HB2 PRO A 86 8.260 -7.466 -9.970 1.00 0.00 H new ATOM 0 HB3 PRO A 86 6.748 -7.845 -9.169 1.00 0.00 H new ATOM 0 HG2 PRO A 86 7.630 -8.560 -11.897 1.00 0.00 H new ATOM 0 HG3 PRO A 86 6.343 -9.266 -10.939 1.00 0.00 H new ATOM 0 HD2 PRO A 86 6.047 -7.431 -13.123 1.00 0.00 H new ATOM 0 HD3 PRO A 86 4.772 -8.047 -12.091 1.00 0.00 H new ATOM 1296 N GLY A 87 7.642 -3.860 -10.475 1.00 0.00 N ATOM 1297 CA GLY A 87 8.615 -2.851 -10.857 1.00 0.00 C ATOM 1298 C GLY A 87 8.008 -1.449 -10.783 1.00 0.00 C ATOM 1299 O GLY A 87 8.729 -0.464 -10.626 1.00 0.00 O ATOM 0 H GLY A 87 6.881 -3.518 -9.889 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.483 -2.911 -10.200 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.968 -3.046 -11.870 1.00 0.00 H new ATOM 1303 N ASP A 88 6.689 -1.402 -10.901 1.00 0.00 N ATOM 1304 CA ASP A 88 5.978 -0.136 -10.849 1.00 0.00 C ATOM 1305 C ASP A 88 6.143 0.480 -9.459 1.00 0.00 C ATOM 1306 O ASP A 88 6.853 -0.064 -8.615 1.00 0.00 O ATOM 1307 CB ASP A 88 4.482 -0.335 -11.103 1.00 0.00 C ATOM 1308 CG ASP A 88 4.031 -0.077 -12.542 1.00 0.00 C ATOM 1309 OD1 ASP A 88 4.199 1.077 -12.991 1.00 0.00 O ATOM 1310 OD2 ASP A 88 3.528 -1.040 -13.160 1.00 0.00 O ATOM 0 H ASP A 88 6.094 -2.220 -11.032 1.00 0.00 H new ATOM 0 HA ASP A 88 6.392 0.515 -11.619 1.00 0.00 H new ATOM 0 HB2 ASP A 88 4.215 -1.357 -10.832 1.00 0.00 H new ATOM 0 HB3 ASP A 88 3.925 0.326 -10.439 1.00 0.00 H new ATOM 1315 N GLU A 89 5.476 1.608 -9.264 1.00 0.00 N ATOM 1316 CA GLU A 89 5.540 2.305 -7.990 1.00 0.00 C ATOM 1317 C GLU A 89 4.148 2.786 -7.577 1.00 0.00 C ATOM 1318 O GLU A 89 3.626 3.746 -8.142 1.00 0.00 O ATOM 1319 CB GLU A 89 6.527 3.472 -8.053 1.00 0.00 C ATOM 1320 CG GLU A 89 6.467 4.311 -6.775 1.00 0.00 C ATOM 1321 CD GLU A 89 7.207 5.638 -6.954 1.00 0.00 C ATOM 1322 OE1 GLU A 89 7.187 6.150 -8.094 1.00 0.00 O ATOM 1323 OE2 GLU A 89 7.777 6.110 -5.947 1.00 0.00 O ATOM 0 H GLU A 89 4.888 2.057 -9.967 1.00 0.00 H new ATOM 0 HA GLU A 89 5.900 1.607 -7.234 1.00 0.00 H new ATOM 0 HB2 GLU A 89 7.538 3.090 -8.195 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.299 4.099 -8.915 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.427 4.503 -6.511 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.908 3.753 -5.949 1.00 0.00 H new ATOM 1330 N VAL A 90 3.585 2.096 -6.596 1.00 0.00 N ATOM 1331 CA VAL A 90 2.263 2.441 -6.101 1.00 0.00 C ATOM 1332 C VAL A 90 2.342 3.754 -5.319 1.00 0.00 C ATOM 1333 O VAL A 90 2.865 3.786 -4.206 1.00 0.00 O ATOM 1334 CB VAL A 90 1.696 1.286 -5.274 1.00 0.00 C ATOM 1335 CG1 VAL A 90 0.252 1.567 -4.856 1.00 0.00 C ATOM 1336 CG2 VAL A 90 1.799 -0.037 -6.036 1.00 0.00 C ATOM 0 H VAL A 90 4.020 1.300 -6.131 1.00 0.00 H new ATOM 0 HA VAL A 90 1.574 2.598 -6.931 1.00 0.00 H new ATOM 0 HB VAL A 90 2.295 1.198 -4.368 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.126 0.730 -4.269 1.00 0.00 H new ATOM 0 HG12 VAL A 90 0.217 2.476 -4.255 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.366 1.696 -5.745 1.00 0.00 H new ATOM 0 HG21 VAL A 90 1.389 -0.841 -5.425 1.00 0.00 H new ATOM 0 HG22 VAL A 90 1.237 0.035 -6.967 1.00 0.00 H new ATOM 0 HG23 VAL A 90 2.845 -0.248 -6.259 1.00 0.00 H new ATOM 1346 N LEU A 91 1.816 4.804 -5.932 1.00 0.00 N ATOM 1347 CA LEU A 91 1.821 6.115 -5.307 1.00 0.00 C ATOM 1348 C LEU A 91 0.819 6.128 -4.151 1.00 0.00 C ATOM 1349 O LEU A 91 1.191 6.375 -3.005 1.00 0.00 O ATOM 1350 CB LEU A 91 1.570 7.207 -6.350 1.00 0.00 C ATOM 1351 CG LEU A 91 2.694 7.438 -7.362 1.00 0.00 C ATOM 1352 CD1 LEU A 91 2.331 8.559 -8.337 1.00 0.00 C ATOM 1353 CD2 LEU A 91 4.024 7.703 -6.653 1.00 0.00 C ATOM 0 H LEU A 91 1.383 4.773 -6.855 1.00 0.00 H new ATOM 0 HA LEU A 91 2.802 6.331 -4.882 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.661 6.957 -6.897 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.380 8.144 -5.827 1.00 0.00 H new ATOM 0 HG LEU A 91 2.818 6.528 -7.949 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.147 8.703 -9.046 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.423 8.291 -8.878 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.164 9.483 -7.783 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.806 7.864 -7.395 1.00 0.00 H new ATOM 0 HD22 LEU A 91 3.931 8.589 -6.025 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.283 6.845 -6.033 1.00 0.00 H new ATOM 1365 N GLU A 92 -0.433 5.859 -4.491 1.00 0.00 N ATOM 1366 CA GLU A 92 -1.491 5.836 -3.496 1.00 0.00 C ATOM 1367 C GLU A 92 -2.116 4.442 -3.417 1.00 0.00 C ATOM 1368 O GLU A 92 -1.905 3.613 -4.301 1.00 0.00 O ATOM 1369 CB GLU A 92 -2.552 6.896 -3.799 1.00 0.00 C ATOM 1370 CG GLU A 92 -2.008 8.304 -3.544 1.00 0.00 C ATOM 1371 CD GLU A 92 -2.844 9.355 -4.278 1.00 0.00 C ATOM 1372 OE1 GLU A 92 -2.526 9.608 -5.460 1.00 0.00 O ATOM 1373 OE2 GLU A 92 -3.781 9.881 -3.640 1.00 0.00 O ATOM 0 H GLU A 92 -0.738 5.655 -5.443 1.00 0.00 H new ATOM 0 HA GLU A 92 -1.055 6.073 -2.525 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -2.873 6.809 -4.837 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -3.431 6.724 -3.178 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -2.014 8.512 -2.474 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.971 8.363 -3.875 1.00 0.00 H new ATOM 1380 N TRP A 93 -2.872 4.226 -2.351 1.00 0.00 N ATOM 1381 CA TRP A 93 -3.529 2.947 -2.145 1.00 0.00 C ATOM 1382 C TRP A 93 -4.849 3.205 -1.414 1.00 0.00 C ATOM 1383 O TRP A 93 -4.884 3.248 -0.186 1.00 0.00 O ATOM 1384 CB TRP A 93 -2.614 1.974 -1.400 1.00 0.00 C ATOM 1385 CG TRP A 93 -3.231 0.593 -1.166 1.00 0.00 C ATOM 1386 CD1 TRP A 93 -4.194 0.257 -0.297 1.00 0.00 C ATOM 1387 CD2 TRP A 93 -2.887 -0.630 -1.851 1.00 0.00 C ATOM 1388 NE1 TRP A 93 -4.494 -1.088 -0.371 1.00 0.00 N ATOM 1389 CE2 TRP A 93 -3.674 -1.644 -1.346 1.00 0.00 C ATOM 1390 CE3 TRP A 93 -1.943 -0.870 -2.864 1.00 0.00 C ATOM 1391 CZ2 TRP A 93 -3.597 -2.969 -1.792 1.00 0.00 C ATOM 1392 CZ3 TRP A 93 -1.877 -2.199 -3.299 1.00 0.00 C ATOM 1393 CH2 TRP A 93 -2.663 -3.232 -2.801 1.00 0.00 C ATOM 0 H TRP A 93 -3.044 4.916 -1.620 1.00 0.00 H new ATOM 0 HA TRP A 93 -3.747 2.468 -3.099 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -1.689 1.856 -1.965 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -2.346 2.409 -0.437 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -4.675 0.951 0.376 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -5.190 -1.583 0.187 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -1.318 -0.091 -3.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -4.224 -3.746 -1.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -1.166 -2.439 -4.076 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -2.553 -4.233 -3.191 1.00 0.00 H new ATOM 1404 N ASN A 94 -5.902 3.370 -2.201 1.00 0.00 N ATOM 1405 CA ASN A 94 -7.220 3.623 -1.644 1.00 0.00 C ATOM 1406 C ASN A 94 -7.264 5.041 -1.073 1.00 0.00 C ATOM 1407 O ASN A 94 -7.913 5.285 -0.057 1.00 0.00 O ATOM 1408 CB ASN A 94 -7.535 2.646 -0.510 1.00 0.00 C ATOM 1409 CG ASN A 94 -8.913 2.009 -0.701 1.00 0.00 C ATOM 1410 OD1 ASN A 94 -9.794 2.556 -1.344 1.00 0.00 O ATOM 1411 ND2 ASN A 94 -9.049 0.826 -0.109 1.00 0.00 N ATOM 0 H ASN A 94 -5.869 3.333 -3.220 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.953 3.498 -2.441 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -6.773 1.868 -0.474 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -7.502 3.170 0.445 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -9.932 0.320 -0.178 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -8.271 0.425 0.414 1.00 0.00 H new ATOM 1418 N GLY A 95 -6.565 5.940 -1.751 1.00 0.00 N ATOM 1419 CA GLY A 95 -6.517 7.328 -1.323 1.00 0.00 C ATOM 1420 C GLY A 95 -5.375 7.556 -0.331 1.00 0.00 C ATOM 1421 O GLY A 95 -5.088 8.693 0.040 1.00 0.00 O ATOM 0 H GLY A 95 -6.028 5.734 -2.593 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -6.385 7.975 -2.190 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -7.465 7.603 -0.861 1.00 0.00 H new ATOM 1425 N ARG A 96 -4.754 6.457 0.071 1.00 0.00 N ATOM 1426 CA ARG A 96 -3.649 6.523 1.013 1.00 0.00 C ATOM 1427 C ARG A 96 -2.317 6.596 0.264 1.00 0.00 C ATOM 1428 O ARG A 96 -1.931 5.648 -0.418 1.00 0.00 O ATOM 1429 CB ARG A 96 -3.641 5.304 1.937 1.00 0.00 C ATOM 1430 CG ARG A 96 -4.640 5.478 3.083 1.00 0.00 C ATOM 1431 CD ARG A 96 -3.926 5.866 4.379 1.00 0.00 C ATOM 1432 NE ARG A 96 -4.857 5.751 5.524 1.00 0.00 N ATOM 1433 CZ ARG A 96 -5.776 6.673 5.840 1.00 0.00 C ATOM 1434 NH1 ARG A 96 -5.893 7.783 5.100 1.00 0.00 N ATOM 1435 NH2 ARG A 96 -6.578 6.484 6.897 1.00 0.00 N ATOM 0 H ARG A 96 -4.995 5.515 -0.238 1.00 0.00 H new ATOM 0 HA ARG A 96 -3.780 7.421 1.616 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -3.889 4.409 1.366 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -2.640 5.157 2.342 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -5.369 6.245 2.821 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -5.193 4.551 3.232 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -3.062 5.220 4.536 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -3.551 6.887 4.306 1.00 0.00 H new ATOM 0 HE ARG A 96 -4.795 4.918 6.109 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -5.282 7.926 4.296 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -6.593 8.485 5.341 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -6.488 5.638 7.460 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -7.278 7.186 7.138 1.00 0.00 H new ATOM 1449 N LEU A 97 -1.650 7.730 0.417 1.00 0.00 N ATOM 1450 CA LEU A 97 -0.369 7.939 -0.236 1.00 0.00 C ATOM 1451 C LEU A 97 0.689 7.060 0.434 1.00 0.00 C ATOM 1452 O LEU A 97 0.799 7.038 1.659 1.00 0.00 O ATOM 1453 CB LEU A 97 -0.012 9.427 -0.251 1.00 0.00 C ATOM 1454 CG LEU A 97 1.329 9.788 -0.894 1.00 0.00 C ATOM 1455 CD1 LEU A 97 1.126 10.685 -2.118 1.00 0.00 C ATOM 1456 CD2 LEU A 97 2.275 10.420 0.129 1.00 0.00 C ATOM 0 H LEU A 97 -1.973 8.514 0.984 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.420 7.636 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.801 9.964 -0.777 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.009 9.790 0.777 1.00 0.00 H new ATOM 0 HG LEU A 97 1.800 8.869 -1.243 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.094 10.927 -2.556 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.515 10.163 -2.854 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.624 11.604 -1.816 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.221 10.667 -0.354 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.824 11.328 0.529 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.455 9.716 0.941 1.00 0.00 H new ATOM 1468 N LEU A 98 1.442 6.357 -0.400 1.00 0.00 N ATOM 1469 CA LEU A 98 2.487 5.478 0.096 1.00 0.00 C ATOM 1470 C LEU A 98 3.825 6.221 0.074 1.00 0.00 C ATOM 1471 O LEU A 98 4.748 5.866 0.805 1.00 0.00 O ATOM 1472 CB LEU A 98 2.500 4.164 -0.688 1.00 0.00 C ATOM 1473 CG LEU A 98 1.139 3.498 -0.901 1.00 0.00 C ATOM 1474 CD1 LEU A 98 1.302 2.099 -1.499 1.00 0.00 C ATOM 1475 CD2 LEU A 98 0.330 3.475 0.397 1.00 0.00 C ATOM 0 H LEU A 98 1.349 6.379 -1.416 1.00 0.00 H new ATOM 0 HA LEU A 98 2.292 5.201 1.132 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.948 4.350 -1.664 1.00 0.00 H new ATOM 0 HB3 LEU A 98 3.150 3.460 -0.168 1.00 0.00 H new ATOM 0 HG LEU A 98 0.576 4.093 -1.620 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.320 1.647 -1.641 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.810 2.171 -2.461 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.892 1.481 -0.822 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.633 2.996 0.217 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.877 2.916 1.157 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.169 4.496 0.743 1.00 0.00 H new ATOM 1487 N GLN A 99 3.887 7.238 -0.774 1.00 0.00 N ATOM 1488 CA GLN A 99 5.096 8.033 -0.901 1.00 0.00 C ATOM 1489 C GLN A 99 5.496 8.612 0.457 1.00 0.00 C ATOM 1490 O GLN A 99 4.780 9.442 1.017 1.00 0.00 O ATOM 1491 CB GLN A 99 4.915 9.143 -1.939 1.00 0.00 C ATOM 1492 CG GLN A 99 5.311 8.658 -3.335 1.00 0.00 C ATOM 1493 CD GLN A 99 5.294 9.810 -4.341 1.00 0.00 C ATOM 1494 OE1 GLN A 99 4.502 10.734 -4.253 1.00 0.00 O ATOM 1495 NE2 GLN A 99 6.210 9.705 -5.300 1.00 0.00 N ATOM 0 H GLN A 99 3.119 7.529 -1.379 1.00 0.00 H new ATOM 0 HA GLN A 99 5.900 7.384 -1.248 1.00 0.00 H new ATOM 0 HB2 GLN A 99 3.876 9.473 -1.946 1.00 0.00 H new ATOM 0 HB3 GLN A 99 5.522 10.006 -1.664 1.00 0.00 H new ATOM 0 HG2 GLN A 99 6.306 8.215 -3.301 1.00 0.00 H new ATOM 0 HG3 GLN A 99 4.625 7.876 -3.660 1.00 0.00 H new ATOM 0 HE21 GLN A 99 6.843 8.905 -5.315 1.00 0.00 H new ATOM 0 HE22 GLN A 99 6.280 10.424 -6.020 1.00 0.00 H new ATOM 1504 N GLY A 100 6.637 8.153 0.948 1.00 0.00 N ATOM 1505 CA GLY A 100 7.141 8.615 2.230 1.00 0.00 C ATOM 1506 C GLY A 100 6.739 7.658 3.354 1.00 0.00 C ATOM 1507 O GLY A 100 7.439 7.548 4.360 1.00 0.00 O ATOM 0 H GLY A 100 7.228 7.465 0.481 1.00 0.00 H new ATOM 0 HA2 GLY A 100 8.227 8.698 2.189 1.00 0.00 H new ATOM 0 HA3 GLY A 100 6.753 9.612 2.440 1.00 0.00 H new ATOM 1511 N ALA A 101 5.614 6.990 3.146 1.00 0.00 N ATOM 1512 CA ALA A 101 5.111 6.046 4.129 1.00 0.00 C ATOM 1513 C ALA A 101 6.180 4.987 4.407 1.00 0.00 C ATOM 1514 O ALA A 101 6.910 4.584 3.502 1.00 0.00 O ATOM 1515 CB ALA A 101 3.802 5.434 3.627 1.00 0.00 C ATOM 0 H ALA A 101 5.036 7.084 2.311 1.00 0.00 H new ATOM 0 HA ALA A 101 4.895 6.552 5.070 1.00 0.00 H new ATOM 0 HB1 ALA A 101 3.425 4.726 4.365 1.00 0.00 H new ATOM 0 HB2 ALA A 101 3.067 6.224 3.473 1.00 0.00 H new ATOM 0 HB3 ALA A 101 3.980 4.916 2.685 1.00 0.00 H new ATOM 1521 N THR A 102 6.240 4.567 5.662 1.00 0.00 N ATOM 1522 CA THR A 102 7.207 3.563 6.070 1.00 0.00 C ATOM 1523 C THR A 102 6.733 2.167 5.660 1.00 0.00 C ATOM 1524 O THR A 102 5.599 1.999 5.213 1.00 0.00 O ATOM 1525 CB THR A 102 7.435 3.709 7.576 1.00 0.00 C ATOM 1526 OG1 THR A 102 6.314 3.053 8.162 1.00 0.00 O ATOM 1527 CG2 THR A 102 7.307 5.159 8.048 1.00 0.00 C ATOM 0 H THR A 102 5.634 4.904 6.410 1.00 0.00 H new ATOM 0 HA THR A 102 8.163 3.708 5.567 1.00 0.00 H new ATOM 0 HB THR A 102 8.424 3.329 7.833 1.00 0.00 H new ATOM 0 HG1 THR A 102 6.382 3.099 9.139 1.00 0.00 H new ATOM 0 HG21 THR A 102 7.478 5.208 9.123 1.00 0.00 H new ATOM 0 HG22 THR A 102 8.045 5.775 7.535 1.00 0.00 H new ATOM 0 HG23 THR A 102 6.307 5.528 7.822 1.00 0.00 H new ATOM 1535 N PHE A 103 7.624 1.201 5.827 1.00 0.00 N ATOM 1536 CA PHE A 103 7.311 -0.175 5.481 1.00 0.00 C ATOM 1537 C PHE A 103 6.044 -0.646 6.198 1.00 0.00 C ATOM 1538 O PHE A 103 5.212 -1.333 5.609 1.00 0.00 O ATOM 1539 CB PHE A 103 8.492 -1.032 5.940 1.00 0.00 C ATOM 1540 CG PHE A 103 8.277 -2.536 5.756 1.00 0.00 C ATOM 1541 CD1 PHE A 103 7.598 -3.245 6.697 1.00 0.00 C ATOM 1542 CD2 PHE A 103 8.767 -3.163 4.653 1.00 0.00 C ATOM 1543 CE1 PHE A 103 7.399 -4.641 6.527 1.00 0.00 C ATOM 1544 CE2 PHE A 103 8.568 -4.559 4.483 1.00 0.00 C ATOM 1545 CZ PHE A 103 7.888 -5.268 5.423 1.00 0.00 C ATOM 0 H PHE A 103 8.563 1.344 6.198 1.00 0.00 H new ATOM 0 HA PHE A 103 7.141 -0.259 4.408 1.00 0.00 H new ATOM 0 HB2 PHE A 103 9.382 -0.732 5.387 1.00 0.00 H new ATOM 0 HB3 PHE A 103 8.688 -0.829 6.993 1.00 0.00 H new ATOM 0 HD1 PHE A 103 7.210 -2.747 7.573 1.00 0.00 H new ATOM 0 HD2 PHE A 103 9.307 -2.600 3.907 1.00 0.00 H new ATOM 0 HE1 PHE A 103 6.860 -5.205 7.274 1.00 0.00 H new ATOM 0 HE2 PHE A 103 8.957 -5.057 3.607 1.00 0.00 H new ATOM 0 HZ PHE A 103 7.736 -6.329 5.293 1.00 0.00 H new ATOM 1555 N GLU A 104 5.939 -0.258 7.460 1.00 0.00 N ATOM 1556 CA GLU A 104 4.788 -0.632 8.265 1.00 0.00 C ATOM 1557 C GLU A 104 3.536 0.096 7.772 1.00 0.00 C ATOM 1558 O GLU A 104 2.467 -0.502 7.664 1.00 0.00 O ATOM 1559 CB GLU A 104 5.039 -0.348 9.747 1.00 0.00 C ATOM 1560 CG GLU A 104 5.976 -1.395 10.355 1.00 0.00 C ATOM 1561 CD GLU A 104 5.331 -2.069 11.567 1.00 0.00 C ATOM 1562 OE1 GLU A 104 4.277 -2.711 11.366 1.00 0.00 O ATOM 1563 OE2 GLU A 104 5.907 -1.928 12.668 1.00 0.00 O ATOM 0 H GLU A 104 6.632 0.312 7.945 1.00 0.00 H new ATOM 0 HA GLU A 104 4.627 -1.705 8.157 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.474 0.645 9.862 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.092 -0.346 10.286 1.00 0.00 H new ATOM 0 HG2 GLU A 104 6.223 -2.146 9.605 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.912 -0.922 10.653 1.00 0.00 H new ATOM 1570 N GLU A 105 3.711 1.378 7.485 1.00 0.00 N ATOM 1571 CA GLU A 105 2.608 2.195 7.006 1.00 0.00 C ATOM 1572 C GLU A 105 2.030 1.603 5.719 1.00 0.00 C ATOM 1573 O GLU A 105 0.848 1.266 5.662 1.00 0.00 O ATOM 1574 CB GLU A 105 3.052 3.643 6.792 1.00 0.00 C ATOM 1575 CG GLU A 105 2.896 4.459 8.077 1.00 0.00 C ATOM 1576 CD GLU A 105 3.128 5.948 7.813 1.00 0.00 C ATOM 1577 OE1 GLU A 105 2.530 6.452 6.838 1.00 0.00 O ATOM 1578 OE2 GLU A 105 3.899 6.549 8.592 1.00 0.00 O ATOM 0 H GLU A 105 4.599 1.871 7.575 1.00 0.00 H new ATOM 0 HA GLU A 105 1.826 2.198 7.765 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.092 3.664 6.467 1.00 0.00 H new ATOM 0 HB3 GLU A 105 2.460 4.095 5.996 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.897 4.310 8.487 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.604 4.104 8.826 1.00 0.00 H new ATOM 1585 N VAL A 106 2.890 1.495 4.716 1.00 0.00 N ATOM 1586 CA VAL A 106 2.479 0.950 3.433 1.00 0.00 C ATOM 1587 C VAL A 106 1.659 -0.321 3.663 1.00 0.00 C ATOM 1588 O VAL A 106 0.653 -0.545 2.991 1.00 0.00 O ATOM 1589 CB VAL A 106 3.704 0.718 2.547 1.00 0.00 C ATOM 1590 CG1 VAL A 106 3.351 -0.155 1.341 1.00 0.00 C ATOM 1591 CG2 VAL A 106 4.317 2.047 2.100 1.00 0.00 C ATOM 0 H VAL A 106 3.869 1.776 4.766 1.00 0.00 H new ATOM 0 HA VAL A 106 1.841 1.658 2.904 1.00 0.00 H new ATOM 0 HB VAL A 106 4.449 0.187 3.139 1.00 0.00 H new ATOM 0 HG11 VAL A 106 4.239 -0.304 0.728 1.00 0.00 H new ATOM 0 HG12 VAL A 106 2.982 -1.121 1.686 1.00 0.00 H new ATOM 0 HG13 VAL A 106 2.580 0.337 0.749 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.186 1.854 1.471 1.00 0.00 H new ATOM 0 HG22 VAL A 106 3.579 2.616 1.534 1.00 0.00 H new ATOM 0 HG23 VAL A 106 4.623 2.619 2.976 1.00 0.00 H new ATOM 1601 N TYR A 107 2.118 -1.120 4.615 1.00 0.00 N ATOM 1602 CA TYR A 107 1.440 -2.362 4.942 1.00 0.00 C ATOM 1603 C TYR A 107 0.125 -2.092 5.676 1.00 0.00 C ATOM 1604 O TYR A 107 -0.928 -2.582 5.270 1.00 0.00 O ATOM 1605 CB TYR A 107 2.383 -3.125 5.874 1.00 0.00 C ATOM 1606 CG TYR A 107 1.800 -4.433 6.415 1.00 0.00 C ATOM 1607 CD1 TYR A 107 0.786 -4.401 7.351 1.00 0.00 C ATOM 1608 CD2 TYR A 107 2.289 -5.643 5.967 1.00 0.00 C ATOM 1609 CE1 TYR A 107 0.238 -5.631 7.860 1.00 0.00 C ATOM 1610 CE2 TYR A 107 1.740 -6.874 6.476 1.00 0.00 C ATOM 1611 CZ TYR A 107 0.741 -6.807 7.397 1.00 0.00 C ATOM 1612 OH TYR A 107 0.223 -7.969 7.878 1.00 0.00 O ATOM 0 H TYR A 107 2.952 -0.931 5.171 1.00 0.00 H new ATOM 0 HA TYR A 107 1.205 -2.921 4.036 1.00 0.00 H new ATOM 0 HB2 TYR A 107 3.307 -3.345 5.339 1.00 0.00 H new ATOM 0 HB3 TYR A 107 2.646 -2.482 6.714 1.00 0.00 H new ATOM 0 HD1 TYR A 107 0.404 -3.454 7.701 1.00 0.00 H new ATOM 0 HD2 TYR A 107 3.083 -5.667 5.235 1.00 0.00 H new ATOM 0 HE1 TYR A 107 -0.555 -5.620 8.593 1.00 0.00 H new ATOM 0 HE2 TYR A 107 2.113 -7.828 6.134 1.00 0.00 H new ATOM 0 HH TYR A 107 0.678 -8.729 7.458 1.00 0.00 H new ATOM 1622 N ASN A 108 0.229 -1.314 6.743 1.00 0.00 N ATOM 1623 CA ASN A 108 -0.939 -0.973 7.537 1.00 0.00 C ATOM 1624 C ASN A 108 -2.087 -0.578 6.605 1.00 0.00 C ATOM 1625 O ASN A 108 -3.253 -0.811 6.919 1.00 0.00 O ATOM 1626 CB ASN A 108 -0.650 0.213 8.460 1.00 0.00 C ATOM 1627 CG ASN A 108 0.277 -0.198 9.606 1.00 0.00 C ATOM 1628 OD1 ASN A 108 0.651 -1.349 9.754 1.00 0.00 O ATOM 1629 ND2 ASN A 108 0.625 0.806 10.406 1.00 0.00 N ATOM 0 H ASN A 108 1.104 -0.910 7.076 1.00 0.00 H new ATOM 0 HA ASN A 108 -1.203 -1.843 8.139 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -0.192 1.020 7.888 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -1.585 0.600 8.865 1.00 0.00 H new ATOM 0 HD21 ASN A 108 1.241 0.635 11.201 1.00 0.00 H new ATOM 0 HD22 ASN A 108 0.276 1.747 10.225 1.00 0.00 H new ATOM 1636 N ILE A 109 -1.715 0.012 5.479 1.00 0.00 N ATOM 1637 CA ILE A 109 -2.699 0.441 4.499 1.00 0.00 C ATOM 1638 C ILE A 109 -3.366 -0.789 3.880 1.00 0.00 C ATOM 1639 O ILE A 109 -4.549 -1.036 4.103 1.00 0.00 O ATOM 1640 CB ILE A 109 -2.059 1.377 3.472 1.00 0.00 C ATOM 1641 CG1 ILE A 109 -1.563 2.663 4.136 1.00 0.00 C ATOM 1642 CG2 ILE A 109 -3.021 1.663 2.317 1.00 0.00 C ATOM 1643 CD1 ILE A 109 -0.466 3.324 3.299 1.00 0.00 C ATOM 0 H ILE A 109 -0.746 0.203 5.223 1.00 0.00 H new ATOM 0 HA ILE A 109 -3.486 1.023 4.979 1.00 0.00 H new ATOM 0 HB ILE A 109 -1.188 0.876 3.050 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -2.395 3.355 4.263 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -1.180 2.438 5.132 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -2.542 2.331 1.601 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -3.283 0.728 1.822 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -3.924 2.134 2.704 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -0.131 4.236 3.793 1.00 0.00 H new ATOM 0 HD12 ILE A 109 0.375 2.638 3.194 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -0.859 3.569 2.312 1.00 0.00 H new ATOM 1655 N ILE A 110 -2.576 -1.527 3.113 1.00 0.00 N ATOM 1656 CA ILE A 110 -3.075 -2.725 2.460 1.00 0.00 C ATOM 1657 C ILE A 110 -3.810 -3.591 3.484 1.00 0.00 C ATOM 1658 O ILE A 110 -4.786 -4.260 3.150 1.00 0.00 O ATOM 1659 CB ILE A 110 -1.939 -3.454 1.739 1.00 0.00 C ATOM 1660 CG1 ILE A 110 -1.380 -2.604 0.596 1.00 0.00 C ATOM 1661 CG2 ILE A 110 -2.392 -4.834 1.258 1.00 0.00 C ATOM 1662 CD1 ILE A 110 0.149 -2.660 0.569 1.00 0.00 C ATOM 0 H ILE A 110 -1.595 -1.318 2.930 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.798 -2.465 1.686 1.00 0.00 H new ATOM 0 HB ILE A 110 -1.128 -3.611 2.450 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -1.777 -2.960 -0.355 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -1.708 -1.571 0.712 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -1.566 -5.331 0.749 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -2.704 -5.433 2.113 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -3.229 -4.722 0.568 1.00 0.00 H new ATOM 0 HD11 ILE A 110 0.521 -2.048 -0.252 1.00 0.00 H new ATOM 0 HD12 ILE A 110 0.544 -2.281 1.512 1.00 0.00 H new ATOM 0 HD13 ILE A 110 0.473 -3.691 0.428 1.00 0.00 H new ATOM 1674 N LEU A 111 -3.312 -3.551 4.712 1.00 0.00 N ATOM 1675 CA LEU A 111 -3.909 -4.324 5.787 1.00 0.00 C ATOM 1676 C LEU A 111 -5.183 -3.625 6.266 1.00 0.00 C ATOM 1677 O LEU A 111 -6.159 -4.282 6.625 1.00 0.00 O ATOM 1678 CB LEU A 111 -2.888 -4.571 6.900 1.00 0.00 C ATOM 1679 CG LEU A 111 -3.397 -5.346 8.117 1.00 0.00 C ATOM 1680 CD1 LEU A 111 -4.086 -4.410 9.113 1.00 0.00 C ATOM 1681 CD2 LEU A 111 -4.307 -6.500 7.692 1.00 0.00 C ATOM 0 H LEU A 111 -2.502 -2.995 4.986 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.202 -5.311 5.429 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.042 -5.113 6.477 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.510 -3.607 7.240 1.00 0.00 H new ATOM 0 HG LEU A 111 -2.539 -5.784 8.626 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.439 -4.985 9.969 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.378 -3.654 9.451 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -4.933 -3.923 8.629 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.655 -7.034 8.576 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -5.164 -6.105 7.146 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.752 -7.184 7.050 1.00 0.00 H new ATOM 1693 N GLU A 112 -5.132 -2.301 6.256 1.00 0.00 N ATOM 1694 CA GLU A 112 -6.270 -1.505 6.685 1.00 0.00 C ATOM 1695 C GLU A 112 -7.374 -1.543 5.626 1.00 0.00 C ATOM 1696 O GLU A 112 -8.538 -1.289 5.929 1.00 0.00 O ATOM 1697 CB GLU A 112 -5.850 -0.065 6.987 1.00 0.00 C ATOM 1698 CG GLU A 112 -5.317 0.062 8.416 1.00 0.00 C ATOM 1699 CD GLU A 112 -6.230 0.948 9.265 1.00 0.00 C ATOM 1700 OE1 GLU A 112 -7.456 0.709 9.218 1.00 0.00 O ATOM 1701 OE2 GLU A 112 -5.682 1.845 9.941 1.00 0.00 O ATOM 0 H GLU A 112 -4.321 -1.759 5.958 1.00 0.00 H new ATOM 0 HA GLU A 112 -6.662 -1.935 7.607 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -5.083 0.250 6.280 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -6.701 0.602 6.852 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.240 -0.927 8.869 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -4.312 0.483 8.397 1.00 0.00 H new ATOM 1708 N SER A 113 -6.968 -1.862 4.406 1.00 0.00 N ATOM 1709 CA SER A 113 -7.908 -1.937 3.300 1.00 0.00 C ATOM 1710 C SER A 113 -8.203 -3.400 2.962 1.00 0.00 C ATOM 1711 O SER A 113 -8.574 -3.717 1.833 1.00 0.00 O ATOM 1712 CB SER A 113 -7.369 -1.206 2.069 1.00 0.00 C ATOM 1713 OG SER A 113 -7.138 0.177 2.328 1.00 0.00 O ATOM 0 H SER A 113 -6.001 -2.072 4.159 1.00 0.00 H new ATOM 0 HA SER A 113 -8.833 -1.447 3.604 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.439 -1.675 1.747 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.078 -1.308 1.248 1.00 0.00 H new ATOM 0 HG SER A 113 -6.647 0.573 1.578 1.00 0.00 H new ATOM 1719 N LYS A 114 -8.026 -4.252 3.960 1.00 0.00 N ATOM 1720 CA LYS A 114 -8.268 -5.674 3.783 1.00 0.00 C ATOM 1721 C LYS A 114 -9.776 -5.928 3.739 1.00 0.00 C ATOM 1722 O LYS A 114 -10.267 -6.620 2.848 1.00 0.00 O ATOM 1723 CB LYS A 114 -7.539 -6.480 4.859 1.00 0.00 C ATOM 1724 CG LYS A 114 -7.056 -7.823 4.306 1.00 0.00 C ATOM 1725 CD LYS A 114 -5.939 -8.404 5.175 1.00 0.00 C ATOM 1726 CE LYS A 114 -4.620 -8.466 4.403 1.00 0.00 C ATOM 1727 NZ LYS A 114 -4.136 -9.862 4.315 1.00 0.00 N ATOM 0 H LYS A 114 -7.718 -3.985 4.895 1.00 0.00 H new ATOM 0 HA LYS A 114 -7.859 -6.015 2.832 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -6.689 -5.909 5.232 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -8.205 -6.649 5.705 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -7.890 -8.524 4.263 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -6.697 -7.692 3.285 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.813 -7.793 6.069 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -6.216 -9.404 5.509 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.759 -8.059 3.401 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -3.872 -7.846 4.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -3.240 -9.886 3.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -3.985 -10.238 5.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -4.843 -10.444 3.822 1.00 0.00 H new ATOM 1741 N PRO A 115 -10.487 -5.340 4.738 1.00 0.00 N ATOM 1742 CA PRO A 115 -11.929 -5.496 4.822 1.00 0.00 C ATOM 1743 C PRO A 115 -12.636 -4.640 3.768 1.00 0.00 C ATOM 1744 O PRO A 115 -13.751 -4.953 3.355 1.00 0.00 O ATOM 1745 CB PRO A 115 -12.286 -5.099 6.245 1.00 0.00 C ATOM 1746 CG PRO A 115 -11.104 -4.296 6.762 1.00 0.00 C ATOM 1747 CD PRO A 115 -9.939 -4.514 5.809 1.00 0.00 C ATOM 0 HA PRO A 115 -12.254 -6.515 4.613 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -13.201 -4.506 6.267 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -12.461 -5.979 6.864 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -11.357 -3.237 6.819 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -10.838 -4.615 7.770 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -9.559 -3.567 5.424 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -9.107 -5.012 6.307 1.00 0.00 H new ATOM 1755 N GLU A 116 -11.956 -3.577 3.362 1.00 0.00 N ATOM 1756 CA GLU A 116 -12.505 -2.674 2.365 1.00 0.00 C ATOM 1757 C GLU A 116 -13.148 -3.469 1.226 1.00 0.00 C ATOM 1758 O GLU A 116 -12.728 -4.586 0.930 1.00 0.00 O ATOM 1759 CB GLU A 116 -11.428 -1.727 1.832 1.00 0.00 C ATOM 1760 CG GLU A 116 -11.406 -0.420 2.627 1.00 0.00 C ATOM 1761 CD GLU A 116 -11.528 0.790 1.698 1.00 0.00 C ATOM 1762 OE1 GLU A 116 -12.318 0.687 0.734 1.00 0.00 O ATOM 1763 OE2 GLU A 116 -10.829 1.789 1.972 1.00 0.00 O ATOM 0 H GLU A 116 -11.030 -3.321 3.706 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.276 -2.066 2.838 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.452 -2.210 1.891 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.615 -1.514 0.779 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.225 -0.414 3.347 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.480 -0.353 3.197 1.00 0.00 H new ATOM 1770 N PRO A 117 -14.183 -2.845 0.603 1.00 0.00 N ATOM 1771 CA PRO A 117 -14.888 -3.482 -0.496 1.00 0.00 C ATOM 1772 C PRO A 117 -14.052 -3.448 -1.777 1.00 0.00 C ATOM 1773 O PRO A 117 -14.047 -4.409 -2.545 1.00 0.00 O ATOM 1774 CB PRO A 117 -16.196 -2.717 -0.621 1.00 0.00 C ATOM 1775 CG PRO A 117 -15.976 -1.396 0.099 1.00 0.00 C ATOM 1776 CD PRO A 117 -14.708 -1.522 0.927 1.00 0.00 C ATOM 0 HA PRO A 117 -15.076 -4.541 -0.317 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -16.454 -2.553 -1.667 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -17.019 -3.274 -0.173 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -15.884 -0.581 -0.619 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -16.828 -1.163 0.738 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -13.992 -0.740 0.676 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -14.920 -1.430 1.992 1.00 0.00 H new ATOM 1784 N GLN A 118 -13.364 -2.331 -1.967 1.00 0.00 N ATOM 1785 CA GLN A 118 -12.526 -2.160 -3.142 1.00 0.00 C ATOM 1786 C GLN A 118 -11.159 -1.600 -2.741 1.00 0.00 C ATOM 1787 O GLN A 118 -11.013 -1.020 -1.667 1.00 0.00 O ATOM 1788 CB GLN A 118 -13.206 -1.259 -4.174 1.00 0.00 C ATOM 1789 CG GLN A 118 -13.286 0.185 -3.674 1.00 0.00 C ATOM 1790 CD GLN A 118 -14.539 0.882 -4.209 1.00 0.00 C ATOM 1791 OE1 GLN A 118 -15.336 1.437 -3.470 1.00 0.00 O ATOM 1792 NE2 GLN A 118 -14.667 0.823 -5.532 1.00 0.00 N ATOM 0 H GLN A 118 -13.370 -1.536 -1.328 1.00 0.00 H new ATOM 0 HA GLN A 118 -12.377 -3.136 -3.603 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -12.652 -1.292 -5.112 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -14.209 -1.631 -4.382 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -13.297 0.196 -2.584 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -12.398 0.733 -3.990 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -13.963 0.342 -6.092 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -15.469 1.259 -5.987 1.00 0.00 H new ATOM 1801 N VAL A 119 -10.193 -1.795 -3.627 1.00 0.00 N ATOM 1802 CA VAL A 119 -8.844 -1.317 -3.379 1.00 0.00 C ATOM 1803 C VAL A 119 -8.349 -0.543 -4.603 1.00 0.00 C ATOM 1804 O VAL A 119 -8.123 -1.127 -5.662 1.00 0.00 O ATOM 1805 CB VAL A 119 -7.934 -2.489 -3.005 1.00 0.00 C ATOM 1806 CG1 VAL A 119 -6.509 -2.008 -2.722 1.00 0.00 C ATOM 1807 CG2 VAL A 119 -8.499 -3.262 -1.811 1.00 0.00 C ATOM 0 H VAL A 119 -10.318 -2.277 -4.517 1.00 0.00 H new ATOM 0 HA VAL A 119 -8.832 -0.630 -2.533 1.00 0.00 H new ATOM 0 HB VAL A 119 -7.895 -3.168 -3.856 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.883 -2.860 -2.459 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.106 -1.522 -3.611 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.522 -1.298 -1.895 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -7.834 -4.090 -1.566 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -8.581 -2.596 -0.952 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -9.485 -3.652 -2.064 1.00 0.00 H new ATOM 1817 N GLU A 120 -8.194 0.759 -4.417 1.00 0.00 N ATOM 1818 CA GLU A 120 -7.730 1.619 -5.492 1.00 0.00 C ATOM 1819 C GLU A 120 -6.215 1.812 -5.401 1.00 0.00 C ATOM 1820 O GLU A 120 -5.696 2.189 -4.352 1.00 0.00 O ATOM 1821 CB GLU A 120 -8.457 2.965 -5.470 1.00 0.00 C ATOM 1822 CG GLU A 120 -7.868 3.923 -6.508 1.00 0.00 C ATOM 1823 CD GLU A 120 -7.387 5.218 -5.849 1.00 0.00 C ATOM 1824 OE1 GLU A 120 -6.682 5.105 -4.823 1.00 0.00 O ATOM 1825 OE2 GLU A 120 -7.736 6.291 -6.386 1.00 0.00 O ATOM 0 H GLU A 120 -8.382 1.240 -3.537 1.00 0.00 H new ATOM 0 HA GLU A 120 -7.958 1.136 -6.442 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -9.518 2.813 -5.671 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -8.381 3.407 -4.477 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -7.036 3.441 -7.022 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -8.619 4.153 -7.264 1.00 0.00 H new ATOM 1832 N LEU A 121 -5.548 1.546 -6.515 1.00 0.00 N ATOM 1833 CA LEU A 121 -4.103 1.685 -6.574 1.00 0.00 C ATOM 1834 C LEU A 121 -3.740 2.746 -7.615 1.00 0.00 C ATOM 1835 O LEU A 121 -4.557 3.090 -8.467 1.00 0.00 O ATOM 1836 CB LEU A 121 -3.443 0.328 -6.823 1.00 0.00 C ATOM 1837 CG LEU A 121 -3.222 -0.547 -5.587 1.00 0.00 C ATOM 1838 CD1 LEU A 121 -4.405 -0.442 -4.622 1.00 0.00 C ATOM 1839 CD2 LEU A 121 -2.935 -1.996 -5.986 1.00 0.00 C ATOM 0 H LEU A 121 -5.982 1.235 -7.384 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.714 2.031 -5.616 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.057 -0.228 -7.532 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.478 0.498 -7.301 1.00 0.00 H new ATOM 0 HG LEU A 121 -2.343 -0.178 -5.060 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -4.222 -1.073 -3.752 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -4.522 0.593 -4.301 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -5.315 -0.771 -5.124 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -2.782 -2.597 -5.089 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -3.780 -2.393 -6.548 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -2.038 -2.032 -6.605 1.00 0.00 H new ATOM 1851 N VAL A 122 -2.513 3.235 -7.512 1.00 0.00 N ATOM 1852 CA VAL A 122 -2.031 4.249 -8.434 1.00 0.00 C ATOM 1853 C VAL A 122 -0.528 4.062 -8.652 1.00 0.00 C ATOM 1854 O VAL A 122 0.254 4.145 -7.706 1.00 0.00 O ATOM 1855 CB VAL A 122 -2.391 5.642 -7.914 1.00 0.00 C ATOM 1856 CG1 VAL A 122 -2.236 6.695 -9.013 1.00 0.00 C ATOM 1857 CG2 VAL A 122 -3.806 5.662 -7.331 1.00 0.00 C ATOM 0 H VAL A 122 -1.838 2.948 -6.804 1.00 0.00 H new ATOM 0 HA VAL A 122 -2.515 4.144 -9.405 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.695 5.890 -7.112 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -2.498 7.676 -8.617 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.203 6.708 -9.361 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.896 6.452 -9.846 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.036 6.664 -6.969 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -4.522 5.382 -8.104 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -3.869 4.954 -6.505 1.00 0.00 H new ATOM 1867 N VAL A 123 -0.171 3.813 -9.903 1.00 0.00 N ATOM 1868 CA VAL A 123 1.224 3.613 -10.257 1.00 0.00 C ATOM 1869 C VAL A 123 1.667 4.721 -11.215 1.00 0.00 C ATOM 1870 O VAL A 123 0.884 5.174 -12.049 1.00 0.00 O ATOM 1871 CB VAL A 123 1.423 2.210 -10.833 1.00 0.00 C ATOM 1872 CG1 VAL A 123 1.839 1.223 -9.741 1.00 0.00 C ATOM 1873 CG2 VAL A 123 0.161 1.730 -11.554 1.00 0.00 C ATOM 0 H VAL A 123 -0.823 3.745 -10.684 1.00 0.00 H new ATOM 0 HA VAL A 123 1.855 3.678 -9.371 1.00 0.00 H new ATOM 0 HB VAL A 123 2.229 2.259 -11.565 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.974 0.233 -10.177 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.776 1.552 -9.291 1.00 0.00 H new ATOM 0 HG13 VAL A 123 1.064 1.180 -8.975 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.329 0.730 -11.954 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -0.672 1.705 -10.851 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -0.074 2.413 -12.370 1.00 0.00 H new ATOM 1883 N SER A 124 2.919 5.125 -11.064 1.00 0.00 N ATOM 1884 CA SER A 124 3.475 6.172 -11.905 1.00 0.00 C ATOM 1885 C SER A 124 4.765 5.682 -12.566 1.00 0.00 C ATOM 1886 O SER A 124 5.770 5.469 -11.889 1.00 0.00 O ATOM 1887 CB SER A 124 3.741 7.444 -11.099 1.00 0.00 C ATOM 1888 OG SER A 124 4.629 8.329 -11.776 1.00 0.00 O ATOM 0 H SER A 124 3.565 4.746 -10.372 1.00 0.00 H new ATOM 0 HA SER A 124 2.746 6.412 -12.679 1.00 0.00 H new ATOM 0 HB2 SER A 124 2.798 7.955 -10.906 1.00 0.00 H new ATOM 0 HB3 SER A 124 4.163 7.178 -10.130 1.00 0.00 H new ATOM 0 HG SER A 124 4.772 9.130 -11.230 1.00 0.00 H new ATOM 1894 N ARG A 125 4.695 5.517 -13.878 1.00 0.00 N ATOM 1895 CA ARG A 125 5.845 5.057 -14.638 1.00 0.00 C ATOM 1896 C ARG A 125 6.317 6.148 -15.600 1.00 0.00 C ATOM 1897 O ARG A 125 5.561 7.061 -15.929 1.00 0.00 O ATOM 1898 CB ARG A 125 5.509 3.794 -15.434 1.00 0.00 C ATOM 1899 CG ARG A 125 4.245 3.994 -16.271 1.00 0.00 C ATOM 1900 CD ARG A 125 3.925 2.741 -17.089 1.00 0.00 C ATOM 1901 NE ARG A 125 3.693 1.592 -16.185 1.00 0.00 N ATOM 1902 CZ ARG A 125 3.136 0.435 -16.569 1.00 0.00 C ATOM 1903 NH1 ARG A 125 2.752 0.266 -17.841 1.00 0.00 N ATOM 1904 NH2 ARG A 125 2.964 -0.553 -15.680 1.00 0.00 N ATOM 0 H ARG A 125 3.859 5.694 -14.435 1.00 0.00 H new ATOM 0 HA ARG A 125 6.640 4.825 -13.929 1.00 0.00 H new ATOM 0 HB2 ARG A 125 6.344 3.538 -16.086 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.369 2.956 -14.751 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.405 4.230 -15.617 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.378 4.845 -16.939 1.00 0.00 H new ATOM 0 HD2 ARG A 125 3.042 2.914 -17.704 1.00 0.00 H new ATOM 0 HD3 ARG A 125 4.749 2.520 -17.768 1.00 0.00 H new ATOM 0 HE ARG A 125 3.975 1.687 -15.209 1.00 0.00 H new ATOM 0 HH11 ARG A 125 2.883 1.018 -18.518 1.00 0.00 H new ATOM 0 HH12 ARG A 125 2.328 -0.615 -18.133 1.00 0.00 H new ATOM 0 HH21 ARG A 125 3.257 -0.424 -14.711 1.00 0.00 H new ATOM 0 HH22 ARG A 125 2.540 -1.434 -15.972 1.00 0.00 H new ATOM 1918 N SER A 126 7.565 6.019 -16.025 1.00 0.00 N ATOM 1919 CA SER A 126 8.147 6.982 -16.943 1.00 0.00 C ATOM 1920 C SER A 126 7.892 6.549 -18.388 1.00 0.00 C ATOM 1921 O SER A 126 8.440 5.547 -18.845 1.00 0.00 O ATOM 1922 CB SER A 126 9.649 7.143 -16.695 1.00 0.00 C ATOM 1923 OG SER A 126 10.406 6.108 -17.315 1.00 0.00 O ATOM 0 H SER A 126 8.190 5.261 -15.750 1.00 0.00 H new ATOM 0 HA SER A 126 7.672 7.948 -16.770 1.00 0.00 H new ATOM 0 HB2 SER A 126 9.978 8.110 -17.075 1.00 0.00 H new ATOM 0 HB3 SER A 126 9.842 7.140 -15.622 1.00 0.00 H new ATOM 0 HG SER A 126 9.797 5.454 -17.717 1.00 0.00 H new