USER MOD reduce.3.24.130724 H: found=0, std=0, add=591, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 590 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 98 HIS : no HD1:sc= -0.144 K(o=-0.14,f=-1.6!) USER MOD Set 1.2: A 144 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 140 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 96 HIS : no HD1:sc= -0.0351 X(o=0.15,f=-0.1) USER MOD Set 3.2: A 124 SER OG : rot 170:sc= 0.188 USER MOD Single : A 105 SER OG : rot -134:sc= 1.5 USER MOD Single : A 109 THR OG1 : rot 180:sc=-0.00553 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 134 THR OG1 : rot -99:sc= 0.911 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 173:sc= 0.799 USER MOD Single : A 147 ASN : amide:sc= -0.331 X(o=-0.33,f=-0.065) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 ASN : amide:sc= -0.0624 K(o=-0.062,f=-0.98) USER MOD Single : A 156 GLN : amide:sc= -0.519 K(o=-0.52,f=0) USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 158 MET CE :methyl -145:sc= -0.444 (180deg=-1.99) USER MOD Single : A 161 GLN : amide:sc= 0.405 K(o=0.41,f=-0.53) USER MOD Single : A 167 GLN : amide:sc= 0.834 K(o=0.83,f=0) USER MOD Single : A 170 THR OG1 : rot 87:sc= 0.116 USER MOD Single : A 171 ASN : amide:sc= -1.25 X(o=-1.2,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 178 N HIS A 96 1.539 13.053 -6.511 1.00 0.00 N ATOM 179 CA HIS A 96 0.619 11.935 -6.713 1.00 0.00 C ATOM 180 C HIS A 96 -0.460 11.869 -5.634 1.00 0.00 C ATOM 181 O HIS A 96 -0.362 12.564 -4.619 1.00 0.00 O ATOM 182 CB HIS A 96 1.451 10.649 -6.769 1.00 0.00 C ATOM 183 CG HIS A 96 2.550 10.757 -7.798 1.00 0.00 C ATOM 184 ND1 HIS A 96 3.907 10.580 -7.546 1.00 0.00 N ATOM 185 CD2 HIS A 96 2.389 11.211 -9.076 1.00 0.00 C ATOM 186 CE1 HIS A 96 4.525 10.850 -8.707 1.00 0.00 C ATOM 187 NE2 HIS A 96 3.644 11.261 -9.632 1.00 0.00 N ATOM 0 HA HIS A 96 0.079 12.071 -7.650 1.00 0.00 H new ATOM 0 HB2 HIS A 96 1.885 10.450 -5.789 1.00 0.00 H new ATOM 0 HB3 HIS A 96 0.805 9.805 -7.009 1.00 0.00 H new ATOM 0 HD2 HIS A 96 1.459 11.478 -9.555 1.00 0.00 H new ATOM 0 HE1 HIS A 96 5.587 10.750 -8.874 1.00 0.00 H new ATOM 0 HE2 HIS A 96 3.867 11.558 -10.582 1.00 0.00 H new ATOM 195 N PHE A 97 -1.480 11.038 -5.860 1.00 0.00 N ATOM 196 CA PHE A 97 -2.617 10.821 -4.973 1.00 0.00 C ATOM 197 C PHE A 97 -2.470 9.364 -4.528 1.00 0.00 C ATOM 198 O PHE A 97 -2.869 8.443 -5.245 1.00 0.00 O ATOM 199 CB PHE A 97 -3.935 11.123 -5.732 1.00 0.00 C ATOM 200 CG PHE A 97 -3.941 12.396 -6.576 1.00 0.00 C ATOM 201 CD1 PHE A 97 -3.272 12.439 -7.819 1.00 0.00 C ATOM 202 CD2 PHE A 97 -4.620 13.542 -6.127 1.00 0.00 C ATOM 203 CE1 PHE A 97 -3.236 13.622 -8.575 1.00 0.00 C ATOM 204 CE2 PHE A 97 -4.607 14.719 -6.899 1.00 0.00 C ATOM 205 CZ PHE A 97 -3.908 14.765 -8.115 1.00 0.00 C ATOM 0 H PHE A 97 -1.535 10.473 -6.708 1.00 0.00 H new ATOM 0 HA PHE A 97 -2.645 11.477 -4.103 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -4.159 10.278 -6.383 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -4.744 11.189 -5.004 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.782 11.552 -8.193 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -5.153 13.519 -5.188 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -2.693 13.652 -9.508 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -5.139 15.593 -6.553 1.00 0.00 H new ATOM 0 HZ PHE A 97 -3.887 15.676 -8.694 1.00 0.00 H new ATOM 215 N HIS A 98 -1.923 9.156 -3.335 1.00 0.00 N ATOM 216 CA HIS A 98 -1.654 7.839 -2.785 1.00 0.00 C ATOM 217 C HIS A 98 -2.903 7.132 -2.273 1.00 0.00 C ATOM 218 O HIS A 98 -3.657 7.653 -1.446 1.00 0.00 O ATOM 219 CB HIS A 98 -0.578 7.910 -1.692 1.00 0.00 C ATOM 220 CG HIS A 98 0.619 8.780 -2.018 1.00 0.00 C ATOM 221 ND1 HIS A 98 0.589 10.125 -2.413 1.00 0.00 N ATOM 222 CD2 HIS A 98 1.913 8.360 -2.004 1.00 0.00 C ATOM 223 CE1 HIS A 98 1.854 10.446 -2.716 1.00 0.00 C ATOM 224 NE2 HIS A 98 2.676 9.423 -2.436 1.00 0.00 N ATOM 0 H HIS A 98 -1.650 9.917 -2.713 1.00 0.00 H new ATOM 0 HA HIS A 98 -1.279 7.235 -3.611 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -1.038 8.281 -0.776 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -0.226 6.899 -1.485 1.00 0.00 H new ATOM 0 HD2 HIS A 98 2.272 7.384 -1.712 1.00 0.00 H new ATOM 0 HE1 HIS A 98 2.168 11.394 -3.127 1.00 0.00 H new ATOM 0 HE2 HIS A 98 3.692 9.431 -2.527 1.00 0.00 H new ATOM 232 N VAL A 99 -3.084 5.911 -2.756 1.00 0.00 N ATOM 233 CA VAL A 99 -4.163 5.007 -2.438 1.00 0.00 C ATOM 234 C VAL A 99 -3.638 3.973 -1.441 1.00 0.00 C ATOM 235 O VAL A 99 -2.453 3.627 -1.426 1.00 0.00 O ATOM 236 CB VAL A 99 -4.640 4.312 -3.737 1.00 0.00 C ATOM 237 CG1 VAL A 99 -5.822 3.372 -3.476 1.00 0.00 C ATOM 238 CG2 VAL A 99 -5.058 5.316 -4.818 1.00 0.00 C ATOM 0 H VAL A 99 -2.431 5.505 -3.426 1.00 0.00 H new ATOM 0 HA VAL A 99 -5.005 5.543 -2.000 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.782 3.741 -4.092 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -6.128 2.903 -4.411 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -5.524 2.602 -2.765 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -6.656 3.941 -3.066 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -5.384 4.778 -5.708 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.877 5.931 -4.446 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -4.210 5.954 -5.070 1.00 0.00 H new ATOM 248 N PHE A 100 -4.536 3.522 -0.577 1.00 0.00 N ATOM 249 CA PHE A 100 -4.398 2.513 0.450 1.00 0.00 C ATOM 250 C PHE A 100 -5.103 1.267 -0.056 1.00 0.00 C ATOM 251 O PHE A 100 -6.209 1.359 -0.592 1.00 0.00 O ATOM 252 CB PHE A 100 -5.032 2.994 1.767 1.00 0.00 C ATOM 253 CG PHE A 100 -5.452 1.856 2.684 1.00 0.00 C ATOM 254 CD1 PHE A 100 -4.560 1.114 3.481 1.00 0.00 C ATOM 255 CD2 PHE A 100 -6.805 1.474 2.636 1.00 0.00 C ATOM 256 CE1 PHE A 100 -5.031 -0.005 4.201 1.00 0.00 C ATOM 257 CE2 PHE A 100 -7.278 0.381 3.369 1.00 0.00 C ATOM 258 CZ PHE A 100 -6.385 -0.389 4.127 1.00 0.00 C ATOM 0 H PHE A 100 -5.483 3.901 -0.584 1.00 0.00 H new ATOM 0 HA PHE A 100 -3.347 2.308 0.653 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -4.321 3.631 2.293 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -5.903 3.608 1.540 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -3.520 1.400 3.541 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -7.492 2.036 2.021 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -4.347 -0.573 4.815 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -8.328 0.131 3.351 1.00 0.00 H new ATOM 0 HZ PHE A 100 -6.731 -1.268 4.650 1.00 0.00 H new ATOM 268 N VAL A 101 -4.466 0.118 0.137 1.00 0.00 N ATOM 269 CA VAL A 101 -4.986 -1.182 -0.242 1.00 0.00 C ATOM 270 C VAL A 101 -4.845 -2.037 1.016 1.00 0.00 C ATOM 271 O VAL A 101 -3.860 -1.897 1.749 1.00 0.00 O ATOM 272 CB VAL A 101 -4.246 -1.765 -1.466 1.00 0.00 C ATOM 273 CG1 VAL A 101 -5.028 -2.953 -2.044 1.00 0.00 C ATOM 274 CG2 VAL A 101 -4.033 -0.733 -2.582 1.00 0.00 C ATOM 0 H VAL A 101 -3.546 0.068 0.575 1.00 0.00 H new ATOM 0 HA VAL A 101 -6.025 -1.136 -0.569 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.267 -2.083 -1.108 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.495 -3.354 -2.906 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.125 -3.729 -1.284 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -6.019 -2.621 -2.352 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.508 -1.201 -3.415 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.999 -0.362 -2.924 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.440 0.098 -2.201 1.00 0.00 H new ATOM 284 N GLY A 102 -5.798 -2.918 1.291 1.00 0.00 N ATOM 285 CA GLY A 102 -5.765 -3.778 2.460 1.00 0.00 C ATOM 286 C GLY A 102 -6.469 -5.092 2.187 1.00 0.00 C ATOM 287 O GLY A 102 -6.967 -5.313 1.084 1.00 0.00 O ATOM 0 H GLY A 102 -6.620 -3.055 0.703 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.731 -3.968 2.747 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.242 -3.274 3.301 1.00 0.00 H new ATOM 291 N ASP A 103 -6.509 -5.937 3.216 1.00 0.00 N ATOM 292 CA ASP A 103 -7.111 -7.274 3.260 1.00 0.00 C ATOM 293 C ASP A 103 -6.393 -8.321 2.397 1.00 0.00 C ATOM 294 O ASP A 103 -6.783 -9.488 2.377 1.00 0.00 O ATOM 295 CB ASP A 103 -8.621 -7.196 2.973 1.00 0.00 C ATOM 296 CG ASP A 103 -9.402 -8.137 3.879 1.00 0.00 C ATOM 297 OD1 ASP A 103 -9.349 -7.920 5.114 1.00 0.00 O ATOM 298 OD2 ASP A 103 -10.151 -9.005 3.388 1.00 0.00 O ATOM 0 H ASP A 103 -6.089 -5.688 4.112 1.00 0.00 H new ATOM 0 HA ASP A 103 -6.976 -7.640 4.278 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -8.969 -6.174 3.119 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -8.809 -7.451 1.930 1.00 0.00 H new ATOM 303 N LEU A 104 -5.299 -7.909 1.751 1.00 0.00 N ATOM 304 CA LEU A 104 -4.446 -8.680 0.857 1.00 0.00 C ATOM 305 C LEU A 104 -4.002 -10.022 1.438 1.00 0.00 C ATOM 306 O LEU A 104 -3.776 -10.162 2.649 1.00 0.00 O ATOM 307 CB LEU A 104 -3.141 -7.902 0.576 1.00 0.00 C ATOM 308 CG LEU A 104 -3.233 -6.445 0.090 1.00 0.00 C ATOM 309 CD1 LEU A 104 -1.836 -5.811 0.100 1.00 0.00 C ATOM 310 CD2 LEU A 104 -3.821 -6.352 -1.315 1.00 0.00 C ATOM 0 H LEU A 104 -4.965 -6.951 1.851 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.049 -8.850 -0.035 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.551 -7.907 1.492 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.577 -8.463 -0.169 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.896 -5.909 0.769 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.902 -4.779 -0.244 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.435 -5.830 1.113 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -1.177 -6.373 -0.562 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.869 -5.307 -1.621 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.190 -6.905 -2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.825 -6.777 -1.318 1.00 0.00 H new ATOM 322 N SER A 105 -3.804 -10.992 0.544 1.00 0.00 N ATOM 323 CA SER A 105 -3.316 -12.317 0.897 1.00 0.00 C ATOM 324 C SER A 105 -1.843 -12.113 1.341 1.00 0.00 C ATOM 325 O SER A 105 -1.223 -11.090 1.005 1.00 0.00 O ATOM 326 CB SER A 105 -3.474 -13.240 -0.327 1.00 0.00 C ATOM 327 OG SER A 105 -3.854 -14.546 0.032 1.00 0.00 O ATOM 0 H SER A 105 -3.981 -10.874 -0.454 1.00 0.00 H new ATOM 0 HA SER A 105 -3.868 -12.795 1.707 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.220 -12.820 -1.002 1.00 0.00 H new ATOM 0 HB3 SER A 105 -2.533 -13.276 -0.875 1.00 0.00 H new ATOM 0 HG SER A 105 -3.307 -15.193 -0.461 1.00 0.00 H new ATOM 333 N PRO A 106 -1.217 -13.051 2.065 1.00 0.00 N ATOM 334 CA PRO A 106 0.159 -12.863 2.517 1.00 0.00 C ATOM 335 C PRO A 106 1.182 -12.962 1.384 1.00 0.00 C ATOM 336 O PRO A 106 2.234 -12.318 1.434 1.00 0.00 O ATOM 337 CB PRO A 106 0.385 -13.966 3.547 1.00 0.00 C ATOM 338 CG PRO A 106 -0.576 -15.076 3.125 1.00 0.00 C ATOM 339 CD PRO A 106 -1.762 -14.312 2.545 1.00 0.00 C ATOM 0 HA PRO A 106 0.296 -11.862 2.927 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.419 -14.311 3.541 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.171 -13.617 4.557 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -0.125 -15.739 2.387 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -0.872 -15.695 3.972 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -2.230 -14.871 1.735 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -2.529 -14.145 3.301 1.00 0.00 H new ATOM 347 N GLU A 107 0.869 -13.747 0.358 1.00 0.00 N ATOM 348 CA GLU A 107 1.707 -14.005 -0.806 1.00 0.00 C ATOM 349 C GLU A 107 1.814 -12.827 -1.771 1.00 0.00 C ATOM 350 O GLU A 107 2.727 -12.798 -2.598 1.00 0.00 O ATOM 351 CB GLU A 107 1.123 -15.224 -1.532 1.00 0.00 C ATOM 352 CG GLU A 107 -0.266 -14.979 -2.156 1.00 0.00 C ATOM 353 CD GLU A 107 -1.170 -16.199 -2.002 1.00 0.00 C ATOM 354 OE1 GLU A 107 -0.752 -17.304 -2.425 1.00 0.00 O ATOM 355 OE2 GLU A 107 -2.261 -16.064 -1.403 1.00 0.00 O ATOM 0 H GLU A 107 -0.020 -14.245 0.315 1.00 0.00 H new ATOM 0 HA GLU A 107 2.723 -14.182 -0.454 1.00 0.00 H new ATOM 0 HB2 GLU A 107 1.813 -15.531 -2.318 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.052 -16.053 -0.828 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.733 -14.116 -1.681 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -0.154 -14.739 -3.213 1.00 0.00 H new ATOM 362 N ILE A 108 0.905 -11.860 -1.661 1.00 0.00 N ATOM 363 CA ILE A 108 0.840 -10.688 -2.513 1.00 0.00 C ATOM 364 C ILE A 108 2.126 -9.895 -2.407 1.00 0.00 C ATOM 365 O ILE A 108 2.511 -9.448 -1.321 1.00 0.00 O ATOM 366 CB ILE A 108 -0.432 -9.871 -2.190 1.00 0.00 C ATOM 367 CG1 ILE A 108 -1.683 -10.760 -2.344 1.00 0.00 C ATOM 368 CG2 ILE A 108 -0.605 -8.614 -3.059 1.00 0.00 C ATOM 369 CD1 ILE A 108 -1.809 -11.471 -3.699 1.00 0.00 C ATOM 0 H ILE A 108 0.172 -11.877 -0.951 1.00 0.00 H new ATOM 0 HA ILE A 108 0.754 -10.983 -3.559 1.00 0.00 H new ATOM 0 HB ILE A 108 -0.313 -9.532 -1.161 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.676 -11.512 -1.555 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -2.569 -10.145 -2.189 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -1.520 -8.096 -2.771 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.248 -7.951 -2.914 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.666 -8.903 -4.108 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -2.719 -12.071 -3.712 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -1.853 -10.729 -4.496 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.945 -12.118 -3.852 1.00 0.00 H new ATOM 381 N THR A 109 2.818 -9.787 -3.535 1.00 0.00 N ATOM 382 CA THR A 109 4.057 -9.033 -3.626 1.00 0.00 C ATOM 383 C THR A 109 3.712 -7.676 -4.253 1.00 0.00 C ATOM 384 O THR A 109 2.593 -7.434 -4.708 1.00 0.00 O ATOM 385 CB THR A 109 5.160 -9.854 -4.331 1.00 0.00 C ATOM 386 OG1 THR A 109 6.375 -9.133 -4.355 1.00 0.00 O ATOM 387 CG2 THR A 109 4.828 -10.282 -5.758 1.00 0.00 C ATOM 0 H THR A 109 2.533 -10.222 -4.413 1.00 0.00 H new ATOM 0 HA THR A 109 4.499 -8.832 -2.650 1.00 0.00 H new ATOM 0 HB THR A 109 5.246 -10.765 -3.738 1.00 0.00 H new ATOM 0 HG1 THR A 109 7.064 -9.667 -4.803 1.00 0.00 H new ATOM 0 HG21 THR A 109 5.661 -10.852 -6.170 1.00 0.00 H new ATOM 0 HG22 THR A 109 3.931 -10.902 -5.753 1.00 0.00 H new ATOM 0 HG23 THR A 109 4.655 -9.398 -6.372 1.00 0.00 H new ATOM 395 N THR A 110 4.668 -6.755 -4.262 1.00 0.00 N ATOM 396 CA THR A 110 4.507 -5.422 -4.828 1.00 0.00 C ATOM 397 C THR A 110 4.047 -5.483 -6.290 1.00 0.00 C ATOM 398 O THR A 110 3.325 -4.608 -6.766 1.00 0.00 O ATOM 399 CB THR A 110 5.867 -4.728 -4.696 1.00 0.00 C ATOM 400 OG1 THR A 110 6.285 -4.665 -3.344 1.00 0.00 O ATOM 401 CG2 THR A 110 5.848 -3.329 -5.298 1.00 0.00 C ATOM 0 H THR A 110 5.595 -6.917 -3.868 1.00 0.00 H new ATOM 0 HA THR A 110 3.734 -4.866 -4.298 1.00 0.00 H new ATOM 0 HB THR A 110 6.582 -5.331 -5.255 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.156 -4.219 -3.291 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.830 -2.871 -5.184 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.597 -3.392 -6.357 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.103 -2.722 -4.784 1.00 0.00 H new ATOM 409 N GLU A 111 4.453 -6.532 -6.995 1.00 0.00 N ATOM 410 CA GLU A 111 4.134 -6.745 -8.392 1.00 0.00 C ATOM 411 C GLU A 111 2.683 -7.164 -8.582 1.00 0.00 C ATOM 412 O GLU A 111 2.089 -6.793 -9.589 1.00 0.00 O ATOM 413 CB GLU A 111 5.084 -7.800 -8.956 1.00 0.00 C ATOM 414 CG GLU A 111 6.527 -7.391 -8.653 1.00 0.00 C ATOM 415 CD GLU A 111 7.571 -8.182 -9.422 1.00 0.00 C ATOM 416 OE1 GLU A 111 7.382 -8.467 -10.629 1.00 0.00 O ATOM 417 OE2 GLU A 111 8.632 -8.457 -8.815 1.00 0.00 O ATOM 0 H GLU A 111 5.028 -7.274 -6.596 1.00 0.00 H new ATOM 0 HA GLU A 111 4.261 -5.806 -8.931 1.00 0.00 H new ATOM 0 HB2 GLU A 111 4.869 -8.773 -8.515 1.00 0.00 H new ATOM 0 HB3 GLU A 111 4.940 -7.899 -10.032 1.00 0.00 H new ATOM 0 HG2 GLU A 111 6.649 -6.332 -8.881 1.00 0.00 H new ATOM 0 HG3 GLU A 111 6.710 -7.510 -7.585 1.00 0.00 H new ATOM 424 N ASP A 112 2.115 -7.919 -7.636 1.00 0.00 N ATOM 425 CA ASP A 112 0.719 -8.361 -7.705 1.00 0.00 C ATOM 426 C ASP A 112 -0.144 -7.111 -7.718 1.00 0.00 C ATOM 427 O ASP A 112 -1.052 -6.974 -8.540 1.00 0.00 O ATOM 428 CB ASP A 112 0.303 -9.192 -6.490 1.00 0.00 C ATOM 429 CG ASP A 112 0.669 -10.663 -6.596 1.00 0.00 C ATOM 430 OD1 ASP A 112 -0.063 -11.441 -7.240 1.00 0.00 O ATOM 431 OD2 ASP A 112 1.696 -11.059 -5.999 1.00 0.00 O ATOM 0 H ASP A 112 2.609 -8.240 -6.803 1.00 0.00 H new ATOM 0 HA ASP A 112 0.599 -8.981 -8.593 1.00 0.00 H new ATOM 0 HB2 ASP A 112 0.771 -8.774 -5.599 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -0.775 -9.105 -6.354 1.00 0.00 H new ATOM 436 N ILE A 113 0.163 -6.202 -6.785 1.00 0.00 N ATOM 437 CA ILE A 113 -0.528 -4.940 -6.639 1.00 0.00 C ATOM 438 C ILE A 113 -0.338 -4.154 -7.937 1.00 0.00 C ATOM 439 O ILE A 113 -1.328 -3.769 -8.555 1.00 0.00 O ATOM 440 CB ILE A 113 -0.042 -4.174 -5.386 1.00 0.00 C ATOM 441 CG1 ILE A 113 -0.269 -4.960 -4.074 1.00 0.00 C ATOM 442 CG2 ILE A 113 -0.783 -2.839 -5.282 1.00 0.00 C ATOM 443 CD1 ILE A 113 -0.030 -4.115 -2.810 1.00 0.00 C ATOM 0 H ILE A 113 0.912 -6.336 -6.106 1.00 0.00 H new ATOM 0 HA ILE A 113 -1.594 -5.099 -6.476 1.00 0.00 H new ATOM 0 HB ILE A 113 1.031 -4.025 -5.507 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -1.290 -5.342 -4.060 1.00 0.00 H new ATOM 0 HG13 ILE A 113 0.395 -5.824 -4.056 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -0.440 -2.300 -4.399 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -0.583 -2.242 -6.172 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -1.854 -3.023 -5.201 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -0.206 -4.726 -1.925 1.00 0.00 H new ATOM 0 HD12 ILE A 113 0.998 -3.754 -2.803 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -0.713 -3.265 -2.806 1.00 0.00 H new ATOM 455 N LYS A 114 0.898 -3.915 -8.387 1.00 0.00 N ATOM 456 CA LYS A 114 1.102 -3.164 -9.621 1.00 0.00 C ATOM 457 C LYS A 114 0.292 -3.724 -10.777 1.00 0.00 C ATOM 458 O LYS A 114 -0.405 -2.963 -11.429 1.00 0.00 O ATOM 459 CB LYS A 114 2.588 -3.040 -9.957 1.00 0.00 C ATOM 460 CG LYS A 114 3.105 -1.708 -9.410 1.00 0.00 C ATOM 461 CD LYS A 114 4.603 -1.559 -9.645 1.00 0.00 C ATOM 462 CE LYS A 114 5.376 -1.953 -8.391 1.00 0.00 C ATOM 463 NZ LYS A 114 6.823 -1.696 -8.547 1.00 0.00 N ATOM 0 H LYS A 114 1.753 -4.225 -7.924 1.00 0.00 H new ATOM 0 HA LYS A 114 0.726 -2.155 -9.451 1.00 0.00 H new ATOM 0 HB2 LYS A 114 3.145 -3.869 -9.520 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.737 -3.089 -11.036 1.00 0.00 H new ATOM 0 HG2 LYS A 114 2.575 -0.885 -9.890 1.00 0.00 H new ATOM 0 HG3 LYS A 114 2.894 -1.644 -8.343 1.00 0.00 H new ATOM 0 HD2 LYS A 114 4.911 -2.185 -10.482 1.00 0.00 H new ATOM 0 HD3 LYS A 114 4.835 -0.529 -9.915 1.00 0.00 H new ATOM 0 HE2 LYS A 114 4.996 -1.394 -7.536 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.213 -3.010 -8.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 7.321 -1.974 -7.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 7.189 -2.249 -9.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 6.978 -0.683 -8.726 1.00 0.00 H new ATOM 477 N ALA A 115 0.322 -5.030 -10.999 1.00 0.00 N ATOM 478 CA ALA A 115 -0.413 -5.682 -12.075 1.00 0.00 C ATOM 479 C ALA A 115 -1.931 -5.519 -11.920 1.00 0.00 C ATOM 480 O ALA A 115 -2.650 -5.469 -12.922 1.00 0.00 O ATOM 481 CB ALA A 115 -0.017 -7.162 -12.136 1.00 0.00 C ATOM 0 H ALA A 115 0.866 -5.677 -10.428 1.00 0.00 H new ATOM 0 HA ALA A 115 -0.147 -5.198 -13.015 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.565 -7.653 -12.940 1.00 0.00 H new ATOM 0 HB2 ALA A 115 1.054 -7.245 -12.324 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -0.257 -7.642 -11.187 1.00 0.00 H new ATOM 487 N ALA A 116 -2.432 -5.435 -10.685 1.00 0.00 N ATOM 488 CA ALA A 116 -3.848 -5.276 -10.381 1.00 0.00 C ATOM 489 C ALA A 116 -4.346 -3.870 -10.697 1.00 0.00 C ATOM 490 O ALA A 116 -5.424 -3.710 -11.267 1.00 0.00 O ATOM 491 CB ALA A 116 -4.080 -5.551 -8.894 1.00 0.00 C ATOM 0 H ALA A 116 -1.846 -5.477 -9.851 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.399 -5.983 -11.002 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -5.139 -5.433 -8.663 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.769 -6.569 -8.659 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -3.498 -4.847 -8.299 1.00 0.00 H new ATOM 497 N PHE A 117 -3.564 -2.857 -10.321 1.00 0.00 N ATOM 498 CA PHE A 117 -3.877 -1.451 -10.514 1.00 0.00 C ATOM 499 C PHE A 117 -3.354 -0.900 -11.855 1.00 0.00 C ATOM 500 O PHE A 117 -3.750 0.183 -12.272 1.00 0.00 O ATOM 501 CB PHE A 117 -3.359 -0.709 -9.273 1.00 0.00 C ATOM 502 CG PHE A 117 -4.166 -1.033 -8.019 1.00 0.00 C ATOM 503 CD1 PHE A 117 -5.355 -0.337 -7.740 1.00 0.00 C ATOM 504 CD2 PHE A 117 -3.788 -2.084 -7.164 1.00 0.00 C ATOM 505 CE1 PHE A 117 -6.160 -0.707 -6.644 1.00 0.00 C ATOM 506 CE2 PHE A 117 -4.581 -2.457 -6.070 1.00 0.00 C ATOM 507 CZ PHE A 117 -5.771 -1.769 -5.807 1.00 0.00 C ATOM 0 H PHE A 117 -2.667 -3.004 -9.859 1.00 0.00 H new ATOM 0 HA PHE A 117 -4.953 -1.298 -10.599 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -2.314 -0.971 -9.107 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -3.393 0.365 -9.455 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -5.654 0.488 -8.370 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -2.867 -2.615 -7.355 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -7.078 -0.174 -6.446 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -4.275 -3.273 -5.432 1.00 0.00 H new ATOM 0 HZ PHE A 117 -6.387 -2.052 -4.966 1.00 0.00 H new ATOM 517 N ALA A 118 -2.536 -1.661 -12.579 1.00 0.00 N ATOM 518 CA ALA A 118 -1.946 -1.321 -13.870 1.00 0.00 C ATOM 519 C ALA A 118 -2.984 -0.934 -14.928 1.00 0.00 C ATOM 520 O ALA A 118 -2.734 0.049 -15.627 1.00 0.00 O ATOM 521 CB ALA A 118 -1.083 -2.477 -14.395 1.00 0.00 C ATOM 0 H ALA A 118 -2.251 -2.587 -12.260 1.00 0.00 H new ATOM 0 HA ALA A 118 -1.324 -0.444 -13.693 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -0.653 -2.202 -15.358 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -0.282 -2.684 -13.686 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -1.701 -3.367 -14.514 1.00 0.00 H new ATOM 527 N PRO A 119 -4.123 -1.646 -15.095 1.00 0.00 N ATOM 528 CA PRO A 119 -5.113 -1.273 -16.096 1.00 0.00 C ATOM 529 C PRO A 119 -5.875 -0.001 -15.706 1.00 0.00 C ATOM 530 O PRO A 119 -6.721 0.441 -16.486 1.00 0.00 O ATOM 531 CB PRO A 119 -6.037 -2.483 -16.243 1.00 0.00 C ATOM 532 CG PRO A 119 -5.998 -3.134 -14.868 1.00 0.00 C ATOM 533 CD PRO A 119 -4.586 -2.832 -14.377 1.00 0.00 C ATOM 0 HA PRO A 119 -4.639 -1.028 -17.047 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -7.049 -2.184 -16.516 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -5.686 -3.164 -17.019 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -6.753 -2.715 -14.203 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -6.183 -4.207 -14.925 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -4.582 -2.656 -13.301 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -3.924 -3.678 -14.564 1.00 0.00 H new ATOM 541 N PHE A 120 -5.588 0.599 -14.545 1.00 0.00 N ATOM 542 CA PHE A 120 -6.266 1.821 -14.103 1.00 0.00 C ATOM 543 C PHE A 120 -5.421 3.052 -14.403 1.00 0.00 C ATOM 544 O PHE A 120 -5.965 4.142 -14.605 1.00 0.00 O ATOM 545 CB PHE A 120 -6.615 1.762 -12.613 1.00 0.00 C ATOM 546 CG PHE A 120 -7.699 0.756 -12.323 1.00 0.00 C ATOM 547 CD1 PHE A 120 -7.398 -0.611 -12.181 1.00 0.00 C ATOM 548 CD2 PHE A 120 -9.033 1.191 -12.286 1.00 0.00 C ATOM 549 CE1 PHE A 120 -8.442 -1.534 -12.019 1.00 0.00 C ATOM 550 CE2 PHE A 120 -10.072 0.268 -12.111 1.00 0.00 C ATOM 551 CZ PHE A 120 -9.776 -1.096 -11.967 1.00 0.00 C ATOM 0 H PHE A 120 -4.885 0.254 -13.891 1.00 0.00 H new ATOM 0 HA PHE A 120 -7.198 1.896 -14.663 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -5.722 1.507 -12.042 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -6.937 2.748 -12.277 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -6.372 -0.947 -12.197 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -9.259 2.242 -12.393 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -8.219 -2.587 -11.934 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -11.098 0.605 -12.087 1.00 0.00 H new ATOM 0 HZ PHE A 120 -10.573 -1.809 -11.816 1.00 0.00 H new ATOM 561 N GLY A 121 -4.101 2.912 -14.505 1.00 0.00 N ATOM 562 CA GLY A 121 -3.241 4.027 -14.804 1.00 0.00 C ATOM 563 C GLY A 121 -1.792 3.677 -14.569 1.00 0.00 C ATOM 564 O GLY A 121 -1.462 2.593 -14.085 1.00 0.00 O ATOM 0 H GLY A 121 -3.612 2.025 -14.382 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -3.381 4.330 -15.842 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -3.517 4.879 -14.183 1.00 0.00 H new ATOM 568 N ARG A 122 -0.922 4.597 -14.970 1.00 0.00 N ATOM 569 CA ARG A 122 0.508 4.457 -14.821 1.00 0.00 C ATOM 570 C ARG A 122 0.825 4.764 -13.368 1.00 0.00 C ATOM 571 O ARG A 122 0.541 5.854 -12.864 1.00 0.00 O ATOM 572 CB ARG A 122 1.231 5.389 -15.784 1.00 0.00 C ATOM 573 CG ARG A 122 1.092 4.924 -17.236 1.00 0.00 C ATOM 574 CD ARG A 122 1.438 6.031 -18.242 1.00 0.00 C ATOM 575 NE ARG A 122 2.887 6.181 -18.433 1.00 0.00 N ATOM 576 CZ ARG A 122 3.520 7.299 -18.806 1.00 0.00 C ATOM 577 NH1 ARG A 122 2.863 8.412 -19.092 1.00 0.00 N ATOM 578 NH2 ARG A 122 4.836 7.323 -18.896 1.00 0.00 N ATOM 0 H ARG A 122 -1.202 5.472 -15.414 1.00 0.00 H new ATOM 0 HA ARG A 122 0.847 3.450 -15.066 1.00 0.00 H new ATOM 0 HB2 ARG A 122 0.829 6.397 -15.685 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.287 5.439 -15.518 1.00 0.00 H new ATOM 0 HG2 ARG A 122 1.745 4.067 -17.404 1.00 0.00 H new ATOM 0 HG3 ARG A 122 0.071 4.585 -17.410 1.00 0.00 H new ATOM 0 HD2 ARG A 122 0.969 5.807 -19.200 1.00 0.00 H new ATOM 0 HD3 ARG A 122 1.020 6.976 -17.896 1.00 0.00 H new ATOM 0 HE ARG A 122 3.464 5.356 -18.266 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.845 8.433 -19.031 1.00 0.00 H new ATOM 0 HH12 ARG A 122 3.375 9.248 -19.374 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.377 6.486 -18.681 1.00 0.00 H new ATOM 0 HH22 ARG A 122 5.312 8.179 -19.181 1.00 0.00 H new ATOM 592 N ILE A 123 1.351 3.756 -12.695 1.00 0.00 N ATOM 593 CA ILE A 123 1.727 3.802 -11.297 1.00 0.00 C ATOM 594 C ILE A 123 3.165 4.302 -11.242 1.00 0.00 C ATOM 595 O ILE A 123 3.978 4.024 -12.131 1.00 0.00 O ATOM 596 CB ILE A 123 1.587 2.390 -10.681 1.00 0.00 C ATOM 597 CG1 ILE A 123 0.171 1.790 -10.926 1.00 0.00 C ATOM 598 CG2 ILE A 123 1.868 2.410 -9.172 1.00 0.00 C ATOM 599 CD1 ILE A 123 0.074 0.268 -10.801 1.00 0.00 C ATOM 0 H ILE A 123 1.534 2.850 -13.125 1.00 0.00 H new ATOM 0 HA ILE A 123 1.084 4.469 -10.722 1.00 0.00 H new ATOM 0 HB ILE A 123 2.326 1.762 -11.178 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.524 2.241 -10.218 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.160 2.078 -11.924 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.762 1.403 -8.769 1.00 0.00 H new ATOM 0 HG22 ILE A 123 2.883 2.766 -8.996 1.00 0.00 H new ATOM 0 HG23 ILE A 123 1.159 3.075 -8.679 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.952 -0.048 -10.990 1.00 0.00 H new ATOM 0 HD12 ILE A 123 0.737 -0.200 -11.528 1.00 0.00 H new ATOM 0 HD13 ILE A 123 0.367 -0.034 -9.796 1.00 0.00 H new ATOM 611 N SER A 124 3.471 5.066 -10.204 1.00 0.00 N ATOM 612 CA SER A 124 4.785 5.607 -9.947 1.00 0.00 C ATOM 613 C SER A 124 5.361 4.676 -8.883 1.00 0.00 C ATOM 614 O SER A 124 6.203 3.821 -9.168 1.00 0.00 O ATOM 615 CB SER A 124 4.690 7.088 -9.540 1.00 0.00 C ATOM 616 OG SER A 124 3.646 7.335 -8.616 1.00 0.00 O ATOM 0 H SER A 124 2.784 5.332 -9.498 1.00 0.00 H new ATOM 0 HA SER A 124 5.444 5.631 -10.815 1.00 0.00 H new ATOM 0 HB2 SER A 124 5.638 7.402 -9.103 1.00 0.00 H new ATOM 0 HB3 SER A 124 4.533 7.696 -10.431 1.00 0.00 H new ATOM 0 HG SER A 124 3.723 8.249 -8.272 1.00 0.00 H new ATOM 622 N ASP A 125 4.973 4.926 -7.639 1.00 0.00 N ATOM 623 CA ASP A 125 5.360 4.181 -6.449 1.00 0.00 C ATOM 624 C ASP A 125 4.239 3.256 -5.989 1.00 0.00 C ATOM 625 O ASP A 125 3.068 3.625 -6.064 1.00 0.00 O ATOM 626 CB ASP A 125 5.831 5.100 -5.317 1.00 0.00 C ATOM 627 CG ASP A 125 6.374 4.274 -4.148 1.00 0.00 C ATOM 628 OD1 ASP A 125 7.076 3.266 -4.402 1.00 0.00 O ATOM 629 OD2 ASP A 125 6.095 4.638 -2.984 1.00 0.00 O ATOM 0 H ASP A 125 4.344 5.699 -7.422 1.00 0.00 H new ATOM 0 HA ASP A 125 6.213 3.561 -6.724 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.605 5.773 -5.685 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.003 5.722 -4.977 1.00 0.00 H new ATOM 634 N ALA A 126 4.588 2.062 -5.529 1.00 0.00 N ATOM 635 CA ALA A 126 3.707 1.030 -5.016 1.00 0.00 C ATOM 636 C ALA A 126 4.559 0.008 -4.272 1.00 0.00 C ATOM 637 O ALA A 126 5.667 -0.300 -4.725 1.00 0.00 O ATOM 638 CB ALA A 126 2.984 0.334 -6.169 1.00 0.00 C ATOM 0 H ALA A 126 5.566 1.772 -5.504 1.00 0.00 H new ATOM 0 HA ALA A 126 2.965 1.474 -4.352 1.00 0.00 H new ATOM 0 HB1 ALA A 126 2.326 -0.439 -5.772 1.00 0.00 H new ATOM 0 HB2 ALA A 126 2.394 1.065 -6.722 1.00 0.00 H new ATOM 0 HB3 ALA A 126 3.716 -0.121 -6.836 1.00 0.00 H new ATOM 644 N ARG A 127 4.061 -0.522 -3.154 1.00 0.00 N ATOM 645 CA ARG A 127 4.732 -1.538 -2.340 1.00 0.00 C ATOM 646 C ARG A 127 3.709 -2.208 -1.436 1.00 0.00 C ATOM 647 O ARG A 127 2.570 -1.738 -1.323 1.00 0.00 O ATOM 648 CB ARG A 127 5.927 -0.960 -1.540 1.00 0.00 C ATOM 649 CG ARG A 127 5.587 0.063 -0.438 1.00 0.00 C ATOM 650 CD ARG A 127 5.901 -0.419 0.990 1.00 0.00 C ATOM 651 NE ARG A 127 7.349 -0.432 1.269 1.00 0.00 N ATOM 652 CZ ARG A 127 8.138 -1.476 1.550 1.00 0.00 C ATOM 653 NH1 ARG A 127 7.684 -2.715 1.678 1.00 0.00 N ATOM 654 NH2 ARG A 127 9.436 -1.273 1.717 1.00 0.00 N ATOM 0 H ARG A 127 3.153 -0.249 -2.778 1.00 0.00 H new ATOM 0 HA ARG A 127 5.163 -2.287 -3.004 1.00 0.00 H new ATOM 0 HB2 ARG A 127 6.464 -1.790 -1.081 1.00 0.00 H new ATOM 0 HB3 ARG A 127 6.612 -0.488 -2.244 1.00 0.00 H new ATOM 0 HG2 ARG A 127 6.140 0.983 -0.629 1.00 0.00 H new ATOM 0 HG3 ARG A 127 4.527 0.309 -0.501 1.00 0.00 H new ATOM 0 HD2 ARG A 127 5.400 0.230 1.709 1.00 0.00 H new ATOM 0 HD3 ARG A 127 5.497 -1.422 1.130 1.00 0.00 H new ATOM 0 HE ARG A 127 7.811 0.477 1.245 1.00 0.00 H new ATOM 0 HH11 ARG A 127 6.689 -2.908 1.561 1.00 0.00 H new ATOM 0 HH12 ARG A 127 8.329 -3.475 1.893 1.00 0.00 H new ATOM 0 HH21 ARG A 127 9.820 -0.332 1.631 1.00 0.00 H new ATOM 0 HH22 ARG A 127 10.051 -2.058 1.932 1.00 0.00 H new ATOM 668 N VAL A 128 4.118 -3.296 -0.791 1.00 0.00 N ATOM 669 CA VAL A 128 3.310 -4.057 0.154 1.00 0.00 C ATOM 670 C VAL A 128 3.966 -3.770 1.494 1.00 0.00 C ATOM 671 O VAL A 128 5.187 -3.923 1.616 1.00 0.00 O ATOM 672 CB VAL A 128 3.323 -5.567 -0.149 1.00 0.00 C ATOM 673 CG1 VAL A 128 2.411 -6.334 0.815 1.00 0.00 C ATOM 674 CG2 VAL A 128 2.848 -5.883 -1.561 1.00 0.00 C ATOM 0 H VAL A 128 5.053 -3.685 -0.917 1.00 0.00 H new ATOM 0 HA VAL A 128 2.259 -3.772 0.115 1.00 0.00 H new ATOM 0 HB VAL A 128 4.362 -5.876 -0.034 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.441 -7.397 0.576 1.00 0.00 H new ATOM 0 HG12 VAL A 128 2.754 -6.182 1.839 1.00 0.00 H new ATOM 0 HG13 VAL A 128 1.389 -5.969 0.717 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.877 -6.961 -1.722 1.00 0.00 H new ATOM 0 HG22 VAL A 128 1.827 -5.524 -1.690 1.00 0.00 H new ATOM 0 HG23 VAL A 128 3.500 -5.391 -2.283 1.00 0.00 H new ATOM 684 N VAL A 129 3.211 -3.284 2.472 1.00 0.00 N ATOM 685 CA VAL A 129 3.759 -2.998 3.783 1.00 0.00 C ATOM 686 C VAL A 129 4.202 -4.321 4.398 1.00 0.00 C ATOM 687 O VAL A 129 3.548 -5.357 4.247 1.00 0.00 O ATOM 688 CB VAL A 129 2.725 -2.285 4.676 1.00 0.00 C ATOM 689 CG1 VAL A 129 3.356 -1.930 6.033 1.00 0.00 C ATOM 690 CG2 VAL A 129 2.253 -0.979 4.019 1.00 0.00 C ATOM 0 H VAL A 129 2.216 -3.081 2.377 1.00 0.00 H new ATOM 0 HA VAL A 129 4.610 -2.322 3.695 1.00 0.00 H new ATOM 0 HB VAL A 129 1.880 -2.960 4.812 1.00 0.00 H new ATOM 0 HG11 VAL A 129 2.618 -1.427 6.657 1.00 0.00 H new ATOM 0 HG12 VAL A 129 3.689 -2.842 6.529 1.00 0.00 H new ATOM 0 HG13 VAL A 129 4.209 -1.270 5.876 1.00 0.00 H new ATOM 0 HG21 VAL A 129 1.523 -0.490 4.664 1.00 0.00 H new ATOM 0 HG22 VAL A 129 3.106 -0.318 3.870 1.00 0.00 H new ATOM 0 HG23 VAL A 129 1.794 -1.202 3.056 1.00 0.00 H new ATOM 700 N LYS A 130 5.337 -4.298 5.088 1.00 0.00 N ATOM 701 CA LYS A 130 5.891 -5.454 5.765 1.00 0.00 C ATOM 702 C LYS A 130 6.315 -4.992 7.144 1.00 0.00 C ATOM 703 O LYS A 130 6.650 -3.818 7.327 1.00 0.00 O ATOM 704 CB LYS A 130 7.048 -6.072 4.971 1.00 0.00 C ATOM 705 CG LYS A 130 6.551 -6.900 3.781 1.00 0.00 C ATOM 706 CD LYS A 130 7.695 -7.238 2.830 1.00 0.00 C ATOM 707 CE LYS A 130 7.141 -8.047 1.652 1.00 0.00 C ATOM 708 NZ LYS A 130 8.142 -8.288 0.591 1.00 0.00 N ATOM 0 H LYS A 130 5.905 -3.457 5.191 1.00 0.00 H new ATOM 0 HA LYS A 130 5.150 -6.249 5.850 1.00 0.00 H new ATOM 0 HB2 LYS A 130 7.705 -5.280 4.612 1.00 0.00 H new ATOM 0 HB3 LYS A 130 7.642 -6.705 5.630 1.00 0.00 H new ATOM 0 HG2 LYS A 130 6.090 -7.820 4.141 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.780 -6.346 3.245 1.00 0.00 H new ATOM 0 HD2 LYS A 130 8.168 -6.324 2.470 1.00 0.00 H new ATOM 0 HD3 LYS A 130 8.462 -7.810 3.352 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.772 -9.005 2.019 1.00 0.00 H new ATOM 0 HE3 LYS A 130 6.288 -7.519 1.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 7.708 -8.839 -0.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 8.478 -7.377 0.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 8.946 -8.817 0.986 1.00 0.00 H new ATOM 722 N ASP A 131 6.236 -5.877 8.129 1.00 0.00 N ATOM 723 CA ASP A 131 6.616 -5.572 9.505 1.00 0.00 C ATOM 724 C ASP A 131 8.077 -5.150 9.500 1.00 0.00 C ATOM 725 O ASP A 131 8.901 -5.812 8.870 1.00 0.00 O ATOM 726 CB ASP A 131 6.402 -6.810 10.370 1.00 0.00 C ATOM 727 CG ASP A 131 6.811 -6.643 11.841 1.00 0.00 C ATOM 728 OD1 ASP A 131 7.239 -5.547 12.267 1.00 0.00 O ATOM 729 OD2 ASP A 131 6.731 -7.638 12.590 1.00 0.00 O ATOM 0 H ASP A 131 5.905 -6.833 7.997 1.00 0.00 H new ATOM 0 HA ASP A 131 6.008 -4.766 9.916 1.00 0.00 H new ATOM 0 HB2 ASP A 131 5.349 -7.088 10.329 1.00 0.00 H new ATOM 0 HB3 ASP A 131 6.967 -7.638 9.942 1.00 0.00 H new ATOM 734 N MET A 132 8.415 -4.035 10.142 1.00 0.00 N ATOM 735 CA MET A 132 9.790 -3.567 10.172 1.00 0.00 C ATOM 736 C MET A 132 10.739 -4.591 10.812 1.00 0.00 C ATOM 737 O MET A 132 11.893 -4.695 10.381 1.00 0.00 O ATOM 738 CB MET A 132 9.848 -2.207 10.887 1.00 0.00 C ATOM 739 CG MET A 132 11.258 -1.608 10.865 1.00 0.00 C ATOM 740 SD MET A 132 12.030 -1.574 9.223 1.00 0.00 S ATOM 741 CE MET A 132 13.685 -1.052 9.701 1.00 0.00 C ATOM 0 H MET A 132 7.755 -3.443 10.646 1.00 0.00 H new ATOM 0 HA MET A 132 10.137 -3.443 9.146 1.00 0.00 H new ATOM 0 HB2 MET A 132 9.153 -1.516 10.410 1.00 0.00 H new ATOM 0 HB3 MET A 132 9.520 -2.326 11.920 1.00 0.00 H new ATOM 0 HG2 MET A 132 11.214 -0.591 11.254 1.00 0.00 H new ATOM 0 HG3 MET A 132 11.894 -2.180 11.541 1.00 0.00 H new ATOM 0 HE1 MET A 132 14.313 -0.974 8.813 1.00 0.00 H new ATOM 0 HE2 MET A 132 13.632 -0.081 10.194 1.00 0.00 H new ATOM 0 HE3 MET A 132 14.114 -1.784 10.385 1.00 0.00 H new ATOM 751 N ALA A 133 10.256 -5.400 11.762 1.00 0.00 N ATOM 752 CA ALA A 133 11.086 -6.379 12.450 1.00 0.00 C ATOM 753 C ALA A 133 11.083 -7.792 11.872 1.00 0.00 C ATOM 754 O ALA A 133 12.141 -8.419 11.813 1.00 0.00 O ATOM 755 CB ALA A 133 10.652 -6.429 13.908 1.00 0.00 C ATOM 0 H ALA A 133 9.284 -5.390 12.070 1.00 0.00 H new ATOM 0 HA ALA A 133 12.113 -6.036 12.322 1.00 0.00 H new ATOM 0 HB1 ALA A 133 11.261 -7.157 14.444 1.00 0.00 H new ATOM 0 HB2 ALA A 133 10.781 -5.445 14.360 1.00 0.00 H new ATOM 0 HB3 ALA A 133 9.603 -6.721 13.966 1.00 0.00 H new ATOM 761 N THR A 134 9.937 -8.317 11.452 1.00 0.00 N ATOM 762 CA THR A 134 9.853 -9.684 10.911 1.00 0.00 C ATOM 763 C THR A 134 9.923 -9.726 9.389 1.00 0.00 C ATOM 764 O THR A 134 10.152 -10.775 8.789 1.00 0.00 O ATOM 765 CB THR A 134 8.587 -10.374 11.439 1.00 0.00 C ATOM 766 OG1 THR A 134 7.417 -9.708 11.018 1.00 0.00 O ATOM 767 CG2 THR A 134 8.582 -10.391 12.959 1.00 0.00 C ATOM 0 H THR A 134 9.046 -7.821 11.473 1.00 0.00 H new ATOM 0 HA THR A 134 10.729 -10.232 11.260 1.00 0.00 H new ATOM 0 HB THR A 134 8.596 -11.388 11.040 1.00 0.00 H new ATOM 0 HG1 THR A 134 7.088 -9.135 11.742 1.00 0.00 H new ATOM 0 HG21 THR A 134 7.677 -10.884 13.314 1.00 0.00 H new ATOM 0 HG22 THR A 134 9.456 -10.933 13.320 1.00 0.00 H new ATOM 0 HG23 THR A 134 8.609 -9.368 13.334 1.00 0.00 H new ATOM 775 N GLY A 135 9.718 -8.570 8.763 1.00 0.00 N ATOM 776 CA GLY A 135 9.736 -8.406 7.314 1.00 0.00 C ATOM 777 C GLY A 135 8.592 -9.149 6.625 1.00 0.00 C ATOM 778 O GLY A 135 8.601 -9.315 5.407 1.00 0.00 O ATOM 0 H GLY A 135 9.530 -7.701 9.263 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.674 -7.345 7.071 1.00 0.00 H new ATOM 0 HA3 GLY A 135 10.687 -8.767 6.923 1.00 0.00 H new ATOM 782 N LYS A 136 7.603 -9.619 7.381 1.00 0.00 N ATOM 783 CA LYS A 136 6.456 -10.361 6.883 1.00 0.00 C ATOM 784 C LYS A 136 5.404 -9.416 6.343 1.00 0.00 C ATOM 785 O LYS A 136 5.303 -8.275 6.794 1.00 0.00 O ATOM 786 CB LYS A 136 5.897 -11.248 8.000 1.00 0.00 C ATOM 787 CG LYS A 136 6.898 -12.300 8.518 1.00 0.00 C ATOM 788 CD LYS A 136 7.612 -13.094 7.413 1.00 0.00 C ATOM 789 CE LYS A 136 8.587 -14.087 8.040 1.00 0.00 C ATOM 790 NZ LYS A 136 9.476 -14.687 7.025 1.00 0.00 N ATOM 0 H LYS A 136 7.581 -9.487 8.392 1.00 0.00 H new ATOM 0 HA LYS A 136 6.769 -11.002 6.059 1.00 0.00 H new ATOM 0 HB2 LYS A 136 5.585 -10.616 8.832 1.00 0.00 H new ATOM 0 HB3 LYS A 136 5.005 -11.757 7.635 1.00 0.00 H new ATOM 0 HG2 LYS A 136 7.647 -11.800 9.131 1.00 0.00 H new ATOM 0 HG3 LYS A 136 6.369 -12.998 9.167 1.00 0.00 H new ATOM 0 HD2 LYS A 136 6.881 -13.624 6.802 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.147 -12.413 6.751 1.00 0.00 H new ATOM 0 HE2 LYS A 136 9.186 -13.581 8.797 1.00 0.00 H new ATOM 0 HE3 LYS A 136 8.030 -14.874 8.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 10.126 -15.357 7.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 8.904 -15.190 6.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 10.025 -13.937 6.558 1.00 0.00 H new ATOM 804 N SER A 137 4.659 -9.900 5.357 1.00 0.00 N ATOM 805 CA SER A 137 3.595 -9.219 4.642 1.00 0.00 C ATOM 806 C SER A 137 2.548 -8.731 5.646 1.00 0.00 C ATOM 807 O SER A 137 1.846 -9.542 6.247 1.00 0.00 O ATOM 808 CB SER A 137 3.054 -10.255 3.639 1.00 0.00 C ATOM 809 OG SER A 137 2.508 -9.722 2.451 1.00 0.00 O ATOM 0 H SER A 137 4.796 -10.850 5.013 1.00 0.00 H new ATOM 0 HA SER A 137 3.922 -8.329 4.104 1.00 0.00 H new ATOM 0 HB2 SER A 137 3.863 -10.935 3.373 1.00 0.00 H new ATOM 0 HB3 SER A 137 2.288 -10.850 4.136 1.00 0.00 H new ATOM 0 HG SER A 137 2.291 -10.452 1.835 1.00 0.00 H new ATOM 815 N LYS A 138 2.446 -7.417 5.868 1.00 0.00 N ATOM 816 CA LYS A 138 1.469 -6.877 6.826 1.00 0.00 C ATOM 817 C LYS A 138 0.021 -7.054 6.377 1.00 0.00 C ATOM 818 O LYS A 138 -0.875 -7.038 7.222 1.00 0.00 O ATOM 819 CB LYS A 138 1.723 -5.398 7.142 1.00 0.00 C ATOM 820 CG LYS A 138 2.870 -5.195 8.146 1.00 0.00 C ATOM 821 CD LYS A 138 2.447 -4.226 9.257 1.00 0.00 C ATOM 822 CE LYS A 138 3.501 -4.127 10.360 1.00 0.00 C ATOM 823 NZ LYS A 138 3.025 -3.307 11.490 1.00 0.00 N ATOM 0 H LYS A 138 3.020 -6.712 5.405 1.00 0.00 H new ATOM 0 HA LYS A 138 1.615 -7.466 7.731 1.00 0.00 H new ATOM 0 HB2 LYS A 138 1.956 -4.868 6.218 1.00 0.00 H new ATOM 0 HB3 LYS A 138 0.812 -4.954 7.543 1.00 0.00 H new ATOM 0 HG2 LYS A 138 3.155 -6.153 8.580 1.00 0.00 H new ATOM 0 HG3 LYS A 138 3.748 -4.805 7.630 1.00 0.00 H new ATOM 0 HD2 LYS A 138 2.274 -3.238 8.830 1.00 0.00 H new ATOM 0 HD3 LYS A 138 1.502 -4.557 9.687 1.00 0.00 H new ATOM 0 HE2 LYS A 138 3.753 -5.126 10.715 1.00 0.00 H new ATOM 0 HE3 LYS A 138 4.415 -3.693 9.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 3.764 -3.260 12.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 2.808 -2.347 11.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 2.167 -3.735 11.892 1.00 0.00 H new ATOM 837 N GLY A 139 -0.226 -7.199 5.077 1.00 0.00 N ATOM 838 CA GLY A 139 -1.570 -7.367 4.536 1.00 0.00 C ATOM 839 C GLY A 139 -2.070 -6.078 3.896 1.00 0.00 C ATOM 840 O GLY A 139 -3.126 -6.078 3.269 1.00 0.00 O ATOM 0 H GLY A 139 0.506 -7.203 4.366 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -1.570 -8.167 3.796 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -2.251 -7.669 5.332 1.00 0.00 H new ATOM 844 N TYR A 140 -1.470 -4.927 4.221 1.00 0.00 N ATOM 845 CA TYR A 140 -1.818 -3.646 3.625 1.00 0.00 C ATOM 846 C TYR A 140 -0.760 -3.254 2.588 1.00 0.00 C ATOM 847 O TYR A 140 0.382 -3.712 2.654 1.00 0.00 O ATOM 848 CB TYR A 140 -2.229 -2.592 4.660 1.00 0.00 C ATOM 849 CG TYR A 140 -1.332 -2.312 5.854 1.00 0.00 C ATOM 850 CD1 TYR A 140 -1.396 -3.092 7.026 1.00 0.00 C ATOM 851 CD2 TYR A 140 -0.542 -1.153 5.847 1.00 0.00 C ATOM 852 CE1 TYR A 140 -0.690 -2.704 8.182 1.00 0.00 C ATOM 853 CE2 TYR A 140 0.168 -0.756 6.990 1.00 0.00 C ATOM 854 CZ TYR A 140 0.102 -1.533 8.164 1.00 0.00 C ATOM 855 OH TYR A 140 0.810 -1.135 9.253 1.00 0.00 O ATOM 0 H TYR A 140 -0.723 -4.865 4.913 1.00 0.00 H new ATOM 0 HA TYR A 140 -2.743 -3.734 3.055 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -2.365 -1.650 4.128 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -3.205 -2.882 5.048 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -1.990 -3.994 7.038 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -0.479 -0.557 4.948 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -0.754 -3.300 9.080 1.00 0.00 H new ATOM 0 HE2 TYR A 140 0.765 0.144 6.970 1.00 0.00 H new ATOM 0 HH TYR A 140 1.293 -0.308 9.045 1.00 0.00 H new ATOM 865 N GLY A 141 -1.116 -2.384 1.646 1.00 0.00 N ATOM 866 CA GLY A 141 -0.259 -1.896 0.579 1.00 0.00 C ATOM 867 C GLY A 141 -0.588 -0.446 0.230 1.00 0.00 C ATOM 868 O GLY A 141 -1.490 0.150 0.828 1.00 0.00 O ATOM 0 H GLY A 141 -2.054 -1.984 1.608 1.00 0.00 H new ATOM 0 HA2 GLY A 141 0.785 -1.972 0.883 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -0.380 -2.523 -0.305 1.00 0.00 H new ATOM 872 N PHE A 142 0.178 0.142 -0.690 1.00 0.00 N ATOM 873 CA PHE A 142 0.014 1.517 -1.157 1.00 0.00 C ATOM 874 C PHE A 142 0.262 1.564 -2.660 1.00 0.00 C ATOM 875 O PHE A 142 1.067 0.768 -3.150 1.00 0.00 O ATOM 876 CB PHE A 142 1.050 2.459 -0.519 1.00 0.00 C ATOM 877 CG PHE A 142 0.962 2.710 0.970 1.00 0.00 C ATOM 878 CD1 PHE A 142 -0.115 3.443 1.501 1.00 0.00 C ATOM 879 CD2 PHE A 142 2.024 2.327 1.812 1.00 0.00 C ATOM 880 CE1 PHE A 142 -0.132 3.778 2.867 1.00 0.00 C ATOM 881 CE2 PHE A 142 1.990 2.629 3.182 1.00 0.00 C ATOM 882 CZ PHE A 142 0.915 3.360 3.708 1.00 0.00 C ATOM 0 H PHE A 142 0.953 -0.341 -1.144 1.00 0.00 H new ATOM 0 HA PHE A 142 -0.994 1.834 -0.889 1.00 0.00 H new ATOM 0 HB2 PHE A 142 2.041 2.058 -0.732 1.00 0.00 H new ATOM 0 HB3 PHE A 142 0.981 3.422 -1.024 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -0.929 3.748 0.860 1.00 0.00 H new ATOM 0 HD2 PHE A 142 2.870 1.797 1.400 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -0.950 4.357 3.270 1.00 0.00 H new ATOM 0 HE2 PHE A 142 2.789 2.299 3.829 1.00 0.00 H new ATOM 0 HZ PHE A 142 0.891 3.602 4.760 1.00 0.00 H new ATOM 892 N VAL A 143 -0.361 2.518 -3.359 1.00 0.00 N ATOM 893 CA VAL A 143 -0.226 2.726 -4.799 1.00 0.00 C ATOM 894 C VAL A 143 -0.354 4.232 -5.076 1.00 0.00 C ATOM 895 O VAL A 143 -1.295 4.864 -4.608 1.00 0.00 O ATOM 896 CB VAL A 143 -1.313 1.927 -5.553 1.00 0.00 C ATOM 897 CG1 VAL A 143 -1.174 2.079 -7.073 1.00 0.00 C ATOM 898 CG2 VAL A 143 -1.285 0.422 -5.228 1.00 0.00 C ATOM 0 H VAL A 143 -0.994 3.187 -2.921 1.00 0.00 H new ATOM 0 HA VAL A 143 0.744 2.372 -5.149 1.00 0.00 H new ATOM 0 HB VAL A 143 -2.259 2.348 -5.213 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -1.955 1.503 -7.569 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -1.270 3.130 -7.344 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -0.197 1.711 -7.388 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -2.071 -0.086 -5.787 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -0.316 0.008 -5.506 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.448 0.277 -4.160 1.00 0.00 H new ATOM 908 N SER A 144 0.567 4.813 -5.840 1.00 0.00 N ATOM 909 CA SER A 144 0.617 6.220 -6.232 1.00 0.00 C ATOM 910 C SER A 144 0.525 6.263 -7.764 1.00 0.00 C ATOM 911 O SER A 144 1.290 5.560 -8.427 1.00 0.00 O ATOM 912 CB SER A 144 1.941 6.831 -5.741 1.00 0.00 C ATOM 913 OG SER A 144 2.269 6.412 -4.428 1.00 0.00 O ATOM 0 H SER A 144 1.347 4.281 -6.226 1.00 0.00 H new ATOM 0 HA SER A 144 -0.200 6.793 -5.794 1.00 0.00 H new ATOM 0 HB2 SER A 144 2.744 6.549 -6.422 1.00 0.00 H new ATOM 0 HB3 SER A 144 1.869 7.918 -5.766 1.00 0.00 H new ATOM 0 HG SER A 144 3.117 6.822 -4.156 1.00 0.00 H new ATOM 919 N PHE A 145 -0.389 7.039 -8.350 1.00 0.00 N ATOM 920 CA PHE A 145 -0.569 7.149 -9.800 1.00 0.00 C ATOM 921 C PHE A 145 -0.196 8.556 -10.263 1.00 0.00 C ATOM 922 O PHE A 145 -0.088 9.479 -9.457 1.00 0.00 O ATOM 923 CB PHE A 145 -2.035 6.861 -10.172 1.00 0.00 C ATOM 924 CG PHE A 145 -2.572 5.492 -9.830 1.00 0.00 C ATOM 925 CD1 PHE A 145 -3.082 5.236 -8.543 1.00 0.00 C ATOM 926 CD2 PHE A 145 -2.669 4.511 -10.833 1.00 0.00 C ATOM 927 CE1 PHE A 145 -3.743 4.027 -8.279 1.00 0.00 C ATOM 928 CE2 PHE A 145 -3.333 3.303 -10.569 1.00 0.00 C ATOM 929 CZ PHE A 145 -3.891 3.076 -9.301 1.00 0.00 C ATOM 0 H PHE A 145 -1.038 7.620 -7.820 1.00 0.00 H new ATOM 0 HA PHE A 145 0.077 6.421 -10.291 1.00 0.00 H new ATOM 0 HB2 PHE A 145 -2.662 7.604 -9.679 1.00 0.00 H new ATOM 0 HB3 PHE A 145 -2.148 7.011 -11.246 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -2.964 5.970 -7.759 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -2.233 4.687 -11.805 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -4.137 3.829 -7.293 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -3.414 2.550 -11.339 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.437 2.164 -9.111 1.00 0.00 H new ATOM 939 N PHE A 146 -0.020 8.747 -11.571 1.00 0.00 N ATOM 940 CA PHE A 146 0.316 10.068 -12.108 1.00 0.00 C ATOM 941 C PHE A 146 -0.886 11.026 -12.109 1.00 0.00 C ATOM 942 O PHE A 146 -0.706 12.207 -12.412 1.00 0.00 O ATOM 943 CB PHE A 146 0.853 9.954 -13.537 1.00 0.00 C ATOM 944 CG PHE A 146 2.139 9.171 -13.725 1.00 0.00 C ATOM 945 CD1 PHE A 146 3.174 9.171 -12.766 1.00 0.00 C ATOM 946 CD2 PHE A 146 2.308 8.451 -14.917 1.00 0.00 C ATOM 947 CE1 PHE A 146 4.338 8.411 -12.984 1.00 0.00 C ATOM 948 CE2 PHE A 146 3.449 7.663 -15.111 1.00 0.00 C ATOM 949 CZ PHE A 146 4.456 7.622 -14.137 1.00 0.00 C ATOM 0 H PHE A 146 -0.103 8.012 -12.273 1.00 0.00 H new ATOM 0 HA PHE A 146 1.082 10.477 -11.450 1.00 0.00 H new ATOM 0 HB2 PHE A 146 0.082 9.493 -14.154 1.00 0.00 H new ATOM 0 HB3 PHE A 146 1.009 10.962 -13.922 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.073 9.755 -11.863 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.554 8.505 -15.689 1.00 0.00 H new ATOM 0 HE1 PHE A 146 5.141 8.435 -12.262 1.00 0.00 H new ATOM 0 HE2 PHE A 146 3.554 7.083 -16.016 1.00 0.00 H new ATOM 0 HZ PHE A 146 5.318 6.986 -14.274 1.00 0.00 H new ATOM 959 N ASN A 147 -2.108 10.554 -11.832 1.00 0.00 N ATOM 960 CA ASN A 147 -3.316 11.375 -11.803 1.00 0.00 C ATOM 961 C ASN A 147 -4.316 10.889 -10.755 1.00 0.00 C ATOM 962 O ASN A 147 -4.209 9.783 -10.225 1.00 0.00 O ATOM 963 CB ASN A 147 -3.971 11.420 -13.201 1.00 0.00 C ATOM 964 CG ASN A 147 -3.393 12.519 -14.084 1.00 0.00 C ATOM 965 OD1 ASN A 147 -3.067 12.305 -15.245 1.00 0.00 O ATOM 966 ND2 ASN A 147 -3.253 13.736 -13.585 1.00 0.00 N ATOM 0 H ASN A 147 -2.284 9.572 -11.618 1.00 0.00 H new ATOM 0 HA ASN A 147 -3.018 12.384 -11.519 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -3.837 10.456 -13.692 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -5.044 11.575 -13.090 1.00 0.00 H new ATOM 0 HD21 ASN A 147 -2.877 14.485 -14.166 1.00 0.00 H new ATOM 0 HD22 ASN A 147 -3.521 13.925 -12.619 1.00 0.00 H new ATOM 973 N LYS A 148 -5.300 11.746 -10.463 1.00 0.00 N ATOM 974 CA LYS A 148 -6.359 11.497 -9.495 1.00 0.00 C ATOM 975 C LYS A 148 -7.378 10.501 -10.026 1.00 0.00 C ATOM 976 O LYS A 148 -7.716 9.573 -9.310 1.00 0.00 O ATOM 977 CB LYS A 148 -7.036 12.829 -9.120 1.00 0.00 C ATOM 978 CG LYS A 148 -8.319 12.618 -8.302 1.00 0.00 C ATOM 979 CD LYS A 148 -8.785 13.873 -7.557 1.00 0.00 C ATOM 980 CE LYS A 148 -8.251 13.811 -6.125 1.00 0.00 C ATOM 981 NZ LYS A 148 -8.753 14.897 -5.266 1.00 0.00 N ATOM 0 H LYS A 148 -5.379 12.659 -10.911 1.00 0.00 H new ATOM 0 HA LYS A 148 -5.916 11.056 -8.602 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -6.339 13.440 -8.547 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -7.273 13.382 -10.029 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -9.114 12.285 -8.969 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -8.152 11.818 -7.580 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -8.421 14.769 -8.059 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -9.874 13.930 -7.554 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -8.525 12.853 -5.684 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -7.162 13.851 -6.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -8.354 14.797 -4.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -8.470 15.815 -5.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -9.791 14.847 -5.214 1.00 0.00 H new ATOM 995 N TRP A 149 -7.851 10.671 -11.258 1.00 0.00 N ATOM 996 CA TRP A 149 -8.859 9.801 -11.869 1.00 0.00 C ATOM 997 C TRP A 149 -8.408 8.351 -11.909 1.00 0.00 C ATOM 998 O TRP A 149 -9.213 7.462 -11.662 1.00 0.00 O ATOM 999 CB TRP A 149 -9.209 10.287 -13.283 1.00 0.00 C ATOM 1000 CG TRP A 149 -8.819 11.700 -13.572 1.00 0.00 C ATOM 1001 CD1 TRP A 149 -7.892 12.075 -14.476 1.00 0.00 C ATOM 1002 CD2 TRP A 149 -9.214 12.911 -12.868 1.00 0.00 C ATOM 1003 NE1 TRP A 149 -7.747 13.444 -14.438 1.00 0.00 N ATOM 1004 CE2 TRP A 149 -8.525 14.013 -13.452 1.00 0.00 C ATOM 1005 CE3 TRP A 149 -10.021 13.172 -11.742 1.00 0.00 C ATOM 1006 CZ2 TRP A 149 -8.657 15.318 -12.960 1.00 0.00 C ATOM 1007 CZ3 TRP A 149 -10.145 14.472 -11.229 1.00 0.00 C ATOM 1008 CH2 TRP A 149 -9.476 15.546 -11.843 1.00 0.00 C ATOM 0 H TRP A 149 -7.542 11.426 -11.870 1.00 0.00 H new ATOM 0 HA TRP A 149 -9.751 9.853 -11.245 1.00 0.00 H new ATOM 0 HB2 TRP A 149 -8.722 9.635 -14.008 1.00 0.00 H new ATOM 0 HB3 TRP A 149 -10.284 10.183 -13.433 1.00 0.00 H new ATOM 0 HD1 TRP A 149 -7.348 11.407 -15.128 1.00 0.00 H new ATOM 0 HE1 TRP A 149 -7.138 13.973 -15.063 1.00 0.00 H new ATOM 0 HE3 TRP A 149 -10.551 12.360 -11.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 149 -8.136 16.137 -13.433 1.00 0.00 H new ATOM 0 HZ3 TRP A 149 -10.758 14.649 -10.357 1.00 0.00 H new ATOM 0 HH2 TRP A 149 -9.593 16.547 -11.455 1.00 0.00 H new ATOM 1019 N ASP A 150 -7.123 8.129 -12.193 1.00 0.00 N ATOM 1020 CA ASP A 150 -6.535 6.797 -12.262 1.00 0.00 C ATOM 1021 C ASP A 150 -6.775 6.088 -10.926 1.00 0.00 C ATOM 1022 O ASP A 150 -7.220 4.943 -10.868 1.00 0.00 O ATOM 1023 CB ASP A 150 -5.008 6.884 -12.478 1.00 0.00 C ATOM 1024 CG ASP A 150 -4.502 7.458 -13.801 1.00 0.00 C ATOM 1025 OD1 ASP A 150 -5.298 7.878 -14.673 1.00 0.00 O ATOM 1026 OD2 ASP A 150 -3.267 7.459 -13.997 1.00 0.00 O ATOM 0 H ASP A 150 -6.458 8.879 -12.383 1.00 0.00 H new ATOM 0 HA ASP A 150 -6.991 6.257 -13.092 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -4.590 7.486 -11.671 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -4.598 5.880 -12.371 1.00 0.00 H new ATOM 1031 N ALA A 151 -6.462 6.814 -9.849 1.00 0.00 N ATOM 1032 CA ALA A 151 -6.580 6.396 -8.472 1.00 0.00 C ATOM 1033 C ALA A 151 -8.047 6.228 -8.061 1.00 0.00 C ATOM 1034 O ALA A 151 -8.419 5.157 -7.593 1.00 0.00 O ATOM 1035 CB ALA A 151 -5.825 7.423 -7.613 1.00 0.00 C ATOM 0 H ALA A 151 -6.099 7.764 -9.933 1.00 0.00 H new ATOM 0 HA ALA A 151 -6.134 5.412 -8.325 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -5.893 7.139 -6.563 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -4.778 7.450 -7.915 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -6.268 8.409 -7.751 1.00 0.00 H new ATOM 1041 N GLU A 152 -8.882 7.257 -8.233 1.00 0.00 N ATOM 1042 CA GLU A 152 -10.299 7.235 -7.870 1.00 0.00 C ATOM 1043 C GLU A 152 -11.041 6.083 -8.541 1.00 0.00 C ATOM 1044 O GLU A 152 -11.811 5.389 -7.873 1.00 0.00 O ATOM 1045 CB GLU A 152 -10.987 8.574 -8.198 1.00 0.00 C ATOM 1046 CG GLU A 152 -10.558 9.685 -7.241 1.00 0.00 C ATOM 1047 CD GLU A 152 -11.500 10.894 -7.236 1.00 0.00 C ATOM 1048 OE1 GLU A 152 -11.765 11.478 -8.311 1.00 0.00 O ATOM 1049 OE2 GLU A 152 -11.964 11.280 -6.134 1.00 0.00 O ATOM 0 H GLU A 152 -8.584 8.145 -8.637 1.00 0.00 H new ATOM 0 HA GLU A 152 -10.342 7.081 -6.792 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -10.748 8.864 -9.221 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -12.069 8.448 -8.147 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -10.498 9.279 -6.231 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -9.556 10.018 -7.511 1.00 0.00 H new ATOM 1056 N ASN A 153 -10.794 5.857 -9.834 1.00 0.00 N ATOM 1057 CA ASN A 153 -11.448 4.787 -10.580 1.00 0.00 C ATOM 1058 C ASN A 153 -11.174 3.439 -9.916 1.00 0.00 C ATOM 1059 O ASN A 153 -12.080 2.632 -9.714 1.00 0.00 O ATOM 1060 CB ASN A 153 -10.997 4.772 -12.048 1.00 0.00 C ATOM 1061 CG ASN A 153 -11.954 3.913 -12.869 1.00 0.00 C ATOM 1062 OD1 ASN A 153 -13.162 4.001 -12.702 1.00 0.00 O ATOM 1063 ND2 ASN A 153 -11.456 3.092 -13.775 1.00 0.00 N ATOM 0 H ASN A 153 -10.139 6.409 -10.387 1.00 0.00 H new ATOM 0 HA ASN A 153 -12.522 4.972 -10.568 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -10.975 5.788 -12.442 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -9.983 4.378 -12.123 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -12.081 2.522 -14.345 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -10.446 3.028 -13.905 1.00 0.00 H new ATOM 1070 N ALA A 154 -9.913 3.211 -9.544 1.00 0.00 N ATOM 1071 CA ALA A 154 -9.483 2.000 -8.890 1.00 0.00 C ATOM 1072 C ALA A 154 -10.091 1.896 -7.495 1.00 0.00 C ATOM 1073 O ALA A 154 -10.560 0.820 -7.153 1.00 0.00 O ATOM 1074 CB ALA A 154 -7.962 1.945 -8.823 1.00 0.00 C ATOM 0 H ALA A 154 -9.159 3.881 -9.697 1.00 0.00 H new ATOM 0 HA ALA A 154 -9.832 1.149 -9.474 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -7.653 1.025 -8.327 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -7.552 1.968 -9.833 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -7.591 2.803 -8.262 1.00 0.00 H new ATOM 1080 N ILE A 155 -10.105 2.961 -6.681 1.00 0.00 N ATOM 1081 CA ILE A 155 -10.685 2.916 -5.336 1.00 0.00 C ATOM 1082 C ILE A 155 -12.118 2.375 -5.390 1.00 0.00 C ATOM 1083 O ILE A 155 -12.528 1.654 -4.474 1.00 0.00 O ATOM 1084 CB ILE A 155 -10.623 4.309 -4.659 1.00 0.00 C ATOM 1085 CG1 ILE A 155 -9.157 4.676 -4.365 1.00 0.00 C ATOM 1086 CG2 ILE A 155 -11.416 4.316 -3.340 1.00 0.00 C ATOM 1087 CD1 ILE A 155 -8.950 6.118 -3.878 1.00 0.00 C ATOM 0 H ILE A 155 -9.717 3.870 -6.936 1.00 0.00 H new ATOM 0 HA ILE A 155 -10.094 2.234 -4.725 1.00 0.00 H new ATOM 0 HB ILE A 155 -11.064 5.038 -5.339 1.00 0.00 H new ATOM 0 HG12 ILE A 155 -8.768 3.991 -3.611 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -8.568 4.523 -5.269 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -11.357 5.305 -2.885 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -12.459 4.071 -3.541 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -10.995 3.577 -2.658 1.00 0.00 H new ATOM 0 HD11 ILE A 155 -7.890 6.291 -3.695 1.00 0.00 H new ATOM 0 HD12 ILE A 155 -9.305 6.813 -4.638 1.00 0.00 H new ATOM 0 HD13 ILE A 155 -9.508 6.274 -2.955 1.00 0.00 H new ATOM 1099 N GLN A 156 -12.861 2.745 -6.431 1.00 0.00 N ATOM 1100 CA GLN A 156 -14.234 2.327 -6.649 1.00 0.00 C ATOM 1101 C GLN A 156 -14.289 0.857 -7.082 1.00 0.00 C ATOM 1102 O GLN A 156 -14.807 0.008 -6.356 1.00 0.00 O ATOM 1103 CB GLN A 156 -14.870 3.216 -7.739 1.00 0.00 C ATOM 1104 CG GLN A 156 -14.977 4.698 -7.348 1.00 0.00 C ATOM 1105 CD GLN A 156 -14.960 5.692 -8.507 1.00 0.00 C ATOM 1106 OE1 GLN A 156 -14.825 6.894 -8.262 1.00 0.00 O ATOM 1107 NE2 GLN A 156 -15.070 5.266 -9.754 1.00 0.00 N ATOM 0 H GLN A 156 -12.510 3.361 -7.164 1.00 0.00 H new ATOM 0 HA GLN A 156 -14.788 2.432 -5.716 1.00 0.00 H new ATOM 0 HB2 GLN A 156 -14.280 3.133 -8.652 1.00 0.00 H new ATOM 0 HB3 GLN A 156 -15.866 2.838 -7.967 1.00 0.00 H new ATOM 0 HG2 GLN A 156 -15.899 4.840 -6.785 1.00 0.00 H new ATOM 0 HG3 GLN A 156 -14.153 4.938 -6.676 1.00 0.00 H new ATOM 0 HE21 GLN A 156 -15.181 4.270 -9.945 1.00 0.00 H new ATOM 0 HE22 GLN A 156 -15.044 5.933 -10.525 1.00 0.00 H new ATOM 1116 N GLN A 157 -13.781 0.585 -8.281 1.00 0.00 N ATOM 1117 CA GLN A 157 -13.746 -0.702 -8.955 1.00 0.00 C ATOM 1118 C GLN A 157 -13.011 -1.797 -8.182 1.00 0.00 C ATOM 1119 O GLN A 157 -13.599 -2.840 -7.897 1.00 0.00 O ATOM 1120 CB GLN A 157 -13.113 -0.467 -10.335 1.00 0.00 C ATOM 1121 CG GLN A 157 -14.008 0.373 -11.268 1.00 0.00 C ATOM 1122 CD GLN A 157 -15.078 -0.487 -11.934 1.00 0.00 C ATOM 1123 OE1 GLN A 157 -14.771 -1.321 -12.782 1.00 0.00 O ATOM 1124 NE2 GLN A 157 -16.339 -0.363 -11.560 1.00 0.00 N ATOM 0 H GLN A 157 -13.351 1.317 -8.847 1.00 0.00 H new ATOM 0 HA GLN A 157 -14.765 -1.080 -9.039 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -12.154 0.036 -10.209 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -12.909 -1.429 -10.805 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -14.483 1.171 -10.698 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -13.394 0.849 -12.032 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -16.596 0.329 -10.856 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -17.055 -0.959 -11.975 1.00 0.00 H new ATOM 1133 N MET A 158 -11.735 -1.579 -7.853 1.00 0.00 N ATOM 1134 CA MET A 158 -10.923 -2.565 -7.138 1.00 0.00 C ATOM 1135 C MET A 158 -11.404 -2.850 -5.715 1.00 0.00 C ATOM 1136 O MET A 158 -11.147 -3.942 -5.206 1.00 0.00 O ATOM 1137 CB MET A 158 -9.450 -2.137 -7.108 1.00 0.00 C ATOM 1138 CG MET A 158 -8.832 -2.066 -8.511 1.00 0.00 C ATOM 1139 SD MET A 158 -8.799 -3.630 -9.428 1.00 0.00 S ATOM 1140 CE MET A 158 -8.048 -4.706 -8.192 1.00 0.00 C ATOM 0 H MET A 158 -11.238 -0.716 -8.074 1.00 0.00 H new ATOM 0 HA MET A 158 -11.033 -3.494 -7.698 1.00 0.00 H new ATOM 0 HB2 MET A 158 -9.368 -1.162 -6.628 1.00 0.00 H new ATOM 0 HB3 MET A 158 -8.882 -2.841 -6.499 1.00 0.00 H new ATOM 0 HG2 MET A 158 -9.386 -1.333 -9.097 1.00 0.00 H new ATOM 0 HG3 MET A 158 -7.811 -1.696 -8.421 1.00 0.00 H new ATOM 0 HE1 MET A 158 -7.409 -5.437 -8.686 1.00 0.00 H new ATOM 0 HE2 MET A 158 -7.451 -4.108 -7.504 1.00 0.00 H new ATOM 0 HE3 MET A 158 -8.830 -5.224 -7.637 1.00 0.00 H new ATOM 1150 N GLY A 159 -12.116 -1.916 -5.081 1.00 0.00 N ATOM 1151 CA GLY A 159 -12.625 -2.055 -3.723 1.00 0.00 C ATOM 1152 C GLY A 159 -13.670 -3.159 -3.616 1.00 0.00 C ATOM 1153 O GLY A 159 -14.869 -2.914 -3.780 1.00 0.00 O ATOM 0 H GLY A 159 -12.358 -1.023 -5.511 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -11.798 -2.271 -3.046 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -13.062 -1.110 -3.401 1.00 0.00 H new ATOM 1157 N GLY A 160 -13.229 -4.381 -3.324 1.00 0.00 N ATOM 1158 CA GLY A 160 -14.065 -5.562 -3.183 1.00 0.00 C ATOM 1159 C GLY A 160 -13.673 -6.695 -4.126 1.00 0.00 C ATOM 1160 O GLY A 160 -14.269 -7.774 -4.039 1.00 0.00 O ATOM 0 H GLY A 160 -12.240 -4.579 -3.174 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -14.008 -5.918 -2.155 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -15.104 -5.288 -3.368 1.00 0.00 H new ATOM 1164 N GLN A 161 -12.740 -6.473 -5.055 1.00 0.00 N ATOM 1165 CA GLN A 161 -12.313 -7.520 -5.974 1.00 0.00 C ATOM 1166 C GLN A 161 -11.413 -8.513 -5.234 1.00 0.00 C ATOM 1167 O GLN A 161 -11.092 -8.329 -4.058 1.00 0.00 O ATOM 1168 CB GLN A 161 -11.600 -6.926 -7.203 1.00 0.00 C ATOM 1169 CG GLN A 161 -12.448 -5.903 -7.972 1.00 0.00 C ATOM 1170 CD GLN A 161 -13.829 -6.405 -8.397 1.00 0.00 C ATOM 1171 OE1 GLN A 161 -14.046 -7.590 -8.642 1.00 0.00 O ATOM 1172 NE2 GLN A 161 -14.812 -5.523 -8.443 1.00 0.00 N ATOM 0 H GLN A 161 -12.269 -5.578 -5.187 1.00 0.00 H new ATOM 0 HA GLN A 161 -13.193 -8.049 -6.341 1.00 0.00 H new ATOM 0 HB2 GLN A 161 -10.675 -6.449 -6.880 1.00 0.00 H new ATOM 0 HB3 GLN A 161 -11.322 -7.736 -7.878 1.00 0.00 H new ATOM 0 HG2 GLN A 161 -12.575 -5.016 -7.351 1.00 0.00 H new ATOM 0 HG3 GLN A 161 -11.900 -5.593 -8.862 1.00 0.00 H new ATOM 0 HE21 GLN A 161 -14.626 -4.541 -8.239 1.00 0.00 H new ATOM 0 HE22 GLN A 161 -15.757 -5.824 -8.683 1.00 0.00 H new ATOM 1181 N TRP A 162 -11.044 -9.588 -5.922 1.00 0.00 N ATOM 1182 CA TRP A 162 -10.176 -10.649 -5.435 1.00 0.00 C ATOM 1183 C TRP A 162 -8.865 -10.512 -6.201 1.00 0.00 C ATOM 1184 O TRP A 162 -8.890 -10.377 -7.429 1.00 0.00 O ATOM 1185 CB TRP A 162 -10.821 -12.027 -5.628 1.00 0.00 C ATOM 1186 CG TRP A 162 -11.933 -12.368 -4.684 1.00 0.00 C ATOM 1187 CD1 TRP A 162 -13.087 -11.682 -4.520 1.00 0.00 C ATOM 1188 CD2 TRP A 162 -11.967 -13.424 -3.683 1.00 0.00 C ATOM 1189 NE1 TRP A 162 -13.859 -12.284 -3.553 1.00 0.00 N ATOM 1190 CE2 TRP A 162 -13.170 -13.299 -2.935 1.00 0.00 C ATOM 1191 CE3 TRP A 162 -11.069 -14.429 -3.276 1.00 0.00 C ATOM 1192 CZ2 TRP A 162 -13.424 -14.061 -1.789 1.00 0.00 C ATOM 1193 CZ3 TRP A 162 -11.342 -15.236 -2.157 1.00 0.00 C ATOM 1194 CH2 TRP A 162 -12.502 -15.039 -1.396 1.00 0.00 C ATOM 0 H TRP A 162 -11.358 -9.749 -6.879 1.00 0.00 H new ATOM 0 HA TRP A 162 -10.001 -10.561 -4.363 1.00 0.00 H new ATOM 0 HB2 TRP A 162 -11.204 -12.088 -6.647 1.00 0.00 H new ATOM 0 HB3 TRP A 162 -10.045 -12.786 -5.533 1.00 0.00 H new ATOM 0 HD1 TRP A 162 -13.362 -10.793 -5.067 1.00 0.00 H new ATOM 0 HE1 TRP A 162 -14.816 -12.013 -3.325 1.00 0.00 H new ATOM 0 HE3 TRP A 162 -10.156 -14.583 -3.832 1.00 0.00 H new ATOM 0 HZ2 TRP A 162 -14.323 -13.896 -1.213 1.00 0.00 H new ATOM 0 HZ3 TRP A 162 -10.649 -16.017 -1.881 1.00 0.00 H new ATOM 0 HH2 TRP A 162 -12.683 -15.636 -0.514 1.00 0.00 H new ATOM 1205 N LEU A 163 -7.743 -10.487 -5.484 1.00 0.00 N ATOM 1206 CA LEU A 163 -6.396 -10.344 -6.013 1.00 0.00 C ATOM 1207 C LEU A 163 -5.547 -11.501 -5.518 1.00 0.00 C ATOM 1208 O LEU A 163 -5.414 -11.699 -4.306 1.00 0.00 O ATOM 1209 CB LEU A 163 -5.802 -9.010 -5.528 1.00 0.00 C ATOM 1210 CG LEU A 163 -4.300 -8.820 -5.821 1.00 0.00 C ATOM 1211 CD1 LEU A 163 -3.998 -8.893 -7.316 1.00 0.00 C ATOM 1212 CD2 LEU A 163 -3.830 -7.461 -5.286 1.00 0.00 C ATOM 0 H LEU A 163 -7.754 -10.570 -4.467 1.00 0.00 H new ATOM 0 HA LEU A 163 -6.417 -10.351 -7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -6.354 -8.193 -5.994 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -5.960 -8.929 -4.453 1.00 0.00 H new ATOM 0 HG LEU A 163 -3.768 -9.630 -5.322 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -2.929 -8.754 -7.478 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -4.300 -9.867 -7.701 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -4.549 -8.110 -7.837 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -2.768 -7.334 -5.497 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -4.394 -6.664 -5.771 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -3.994 -7.417 -4.209 1.00 0.00 H new ATOM 1224 N GLY A 164 -4.945 -12.232 -6.453 1.00 0.00 N ATOM 1225 CA GLY A 164 -4.078 -13.365 -6.193 1.00 0.00 C ATOM 1226 C GLY A 164 -4.870 -14.581 -5.729 1.00 0.00 C ATOM 1227 O GLY A 164 -4.798 -15.634 -6.365 1.00 0.00 O ATOM 0 H GLY A 164 -5.056 -12.039 -7.449 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -3.523 -13.615 -7.097 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -3.344 -13.096 -5.433 1.00 0.00 H new ATOM 1231 N GLY A 165 -5.599 -14.456 -4.623 1.00 0.00 N ATOM 1232 CA GLY A 165 -6.410 -15.521 -4.061 1.00 0.00 C ATOM 1233 C GLY A 165 -7.402 -15.077 -2.984 1.00 0.00 C ATOM 1234 O GLY A 165 -8.143 -15.936 -2.501 1.00 0.00 O ATOM 0 H GLY A 165 -5.640 -13.591 -4.084 1.00 0.00 H new ATOM 0 HA2 GLY A 165 -6.963 -16.001 -4.868 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -5.748 -16.276 -3.636 1.00 0.00 H new ATOM 1238 N ARG A 166 -7.436 -13.795 -2.577 1.00 0.00 N ATOM 1239 CA ARG A 166 -8.349 -13.285 -1.541 1.00 0.00 C ATOM 1240 C ARG A 166 -8.868 -11.895 -1.889 1.00 0.00 C ATOM 1241 O ARG A 166 -8.358 -11.264 -2.813 1.00 0.00 O ATOM 1242 CB ARG A 166 -7.650 -13.285 -0.169 1.00 0.00 C ATOM 1243 CG ARG A 166 -7.483 -14.728 0.316 1.00 0.00 C ATOM 1244 CD ARG A 166 -6.944 -14.829 1.736 1.00 0.00 C ATOM 1245 NE ARG A 166 -6.913 -16.238 2.151 1.00 0.00 N ATOM 1246 CZ ARG A 166 -5.861 -17.061 2.186 1.00 0.00 C ATOM 1247 NH1 ARG A 166 -4.660 -16.658 1.787 1.00 0.00 N ATOM 1248 NH2 ARG A 166 -6.046 -18.298 2.628 1.00 0.00 N ATOM 0 H ARG A 166 -6.823 -13.077 -2.963 1.00 0.00 H new ATOM 0 HA ARG A 166 -9.211 -13.950 -1.493 1.00 0.00 H new ATOM 0 HB2 ARG A 166 -6.677 -12.800 -0.244 1.00 0.00 H new ATOM 0 HB3 ARG A 166 -8.236 -12.713 0.550 1.00 0.00 H new ATOM 0 HG2 ARG A 166 -8.447 -15.235 0.264 1.00 0.00 H new ATOM 0 HG3 ARG A 166 -6.809 -15.255 -0.359 1.00 0.00 H new ATOM 0 HD2 ARG A 166 -5.942 -14.402 1.787 1.00 0.00 H new ATOM 0 HD3 ARG A 166 -7.571 -14.253 2.416 1.00 0.00 H new ATOM 0 HE ARG A 166 -7.803 -16.637 2.449 1.00 0.00 H new ATOM 0 HH11 ARG A 166 -4.529 -15.706 1.446 1.00 0.00 H new ATOM 0 HH12 ARG A 166 -3.869 -17.301 1.821 1.00 0.00 H new ATOM 0 HH21 ARG A 166 -6.973 -18.598 2.930 1.00 0.00 H new ATOM 0 HH22 ARG A 166 -5.261 -18.949 2.666 1.00 0.00 H new ATOM 1262 N GLN A 167 -9.913 -11.453 -1.184 1.00 0.00 N ATOM 1263 CA GLN A 167 -10.520 -10.138 -1.385 1.00 0.00 C ATOM 1264 C GLN A 167 -9.558 -9.029 -0.957 1.00 0.00 C ATOM 1265 O GLN A 167 -8.647 -9.265 -0.164 1.00 0.00 O ATOM 1266 CB GLN A 167 -11.808 -9.978 -0.551 1.00 0.00 C ATOM 1267 CG GLN A 167 -13.095 -10.310 -1.290 1.00 0.00 C ATOM 1268 CD GLN A 167 -14.298 -9.597 -0.690 1.00 0.00 C ATOM 1269 OE1 GLN A 167 -14.828 -9.972 0.356 1.00 0.00 O ATOM 1270 NE2 GLN A 167 -14.753 -8.547 -1.344 1.00 0.00 N ATOM 0 H GLN A 167 -10.364 -12.003 -0.453 1.00 0.00 H new ATOM 0 HA GLN A 167 -10.752 -10.060 -2.447 1.00 0.00 H new ATOM 0 HB2 GLN A 167 -11.736 -10.618 0.328 1.00 0.00 H new ATOM 0 HB3 GLN A 167 -11.866 -8.950 -0.193 1.00 0.00 H new ATOM 0 HG2 GLN A 167 -12.993 -10.030 -2.338 1.00 0.00 H new ATOM 0 HG3 GLN A 167 -13.261 -11.387 -1.263 1.00 0.00 H new ATOM 0 HE21 GLN A 167 -14.302 -8.250 -2.209 1.00 0.00 H new ATOM 0 HE22 GLN A 167 -15.556 -8.031 -0.985 1.00 0.00 H new ATOM 1279 N ILE A 168 -9.816 -7.804 -1.426 1.00 0.00 N ATOM 1280 CA ILE A 168 -9.036 -6.616 -1.106 1.00 0.00 C ATOM 1281 C ILE A 168 -9.970 -5.425 -0.868 1.00 0.00 C ATOM 1282 O ILE A 168 -11.100 -5.395 -1.364 1.00 0.00 O ATOM 1283 CB ILE A 168 -8.000 -6.303 -2.210 1.00 0.00 C ATOM 1284 CG1 ILE A 168 -8.647 -5.817 -3.528 1.00 0.00 C ATOM 1285 CG2 ILE A 168 -7.095 -7.520 -2.458 1.00 0.00 C ATOM 1286 CD1 ILE A 168 -7.639 -5.300 -4.555 1.00 0.00 C ATOM 0 H ILE A 168 -10.595 -7.612 -2.055 1.00 0.00 H new ATOM 0 HA ILE A 168 -8.477 -6.809 -0.190 1.00 0.00 H new ATOM 0 HB ILE A 168 -7.392 -5.475 -1.845 1.00 0.00 H new ATOM 0 HG12 ILE A 168 -9.212 -6.638 -3.969 1.00 0.00 H new ATOM 0 HG13 ILE A 168 -9.360 -5.024 -3.301 1.00 0.00 H new ATOM 0 HG21 ILE A 168 -6.372 -7.283 -3.238 1.00 0.00 H new ATOM 0 HG22 ILE A 168 -6.567 -7.774 -1.539 1.00 0.00 H new ATOM 0 HG23 ILE A 168 -7.703 -8.368 -2.773 1.00 0.00 H new ATOM 0 HD11 ILE A 168 -8.167 -4.977 -5.452 1.00 0.00 H new ATOM 0 HD12 ILE A 168 -7.090 -4.458 -4.134 1.00 0.00 H new ATOM 0 HD13 ILE A 168 -6.940 -6.096 -4.812 1.00 0.00 H new ATOM 1298 N ARG A 169 -9.481 -4.420 -0.138 1.00 0.00 N ATOM 1299 CA ARG A 169 -10.199 -3.181 0.174 1.00 0.00 C ATOM 1300 C ARG A 169 -9.344 -2.032 -0.349 1.00 0.00 C ATOM 1301 O ARG A 169 -8.117 -2.153 -0.304 1.00 0.00 O ATOM 1302 CB ARG A 169 -10.514 -3.087 1.685 1.00 0.00 C ATOM 1303 CG ARG A 169 -9.357 -2.640 2.585 1.00 0.00 C ATOM 1304 CD ARG A 169 -9.753 -2.593 4.070 1.00 0.00 C ATOM 1305 NE ARG A 169 -9.881 -3.936 4.672 1.00 0.00 N ATOM 1306 CZ ARG A 169 -9.686 -4.246 5.963 1.00 0.00 C ATOM 1307 NH1 ARG A 169 -9.362 -3.312 6.854 1.00 0.00 N ATOM 1308 NH2 ARG A 169 -9.798 -5.498 6.383 1.00 0.00 N ATOM 0 H ARG A 169 -8.545 -4.447 0.265 1.00 0.00 H new ATOM 0 HA ARG A 169 -11.174 -3.145 -0.311 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -11.343 -2.393 1.821 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -10.857 -4.064 2.026 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -8.517 -3.322 2.457 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -9.017 -1.653 2.271 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -9.007 -2.022 4.622 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -10.700 -2.063 4.172 1.00 0.00 H new ATOM 0 HE ARG A 169 -10.142 -4.699 4.048 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -9.258 -2.341 6.560 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -9.218 -3.567 7.831 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -10.035 -6.238 5.722 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -9.647 -5.721 7.367 1.00 0.00 H new ATOM 1322 N THR A 170 -9.932 -0.923 -0.795 1.00 0.00 N ATOM 1323 CA THR A 170 -9.200 0.228 -1.319 1.00 0.00 C ATOM 1324 C THR A 170 -9.826 1.528 -0.822 1.00 0.00 C ATOM 1325 O THR A 170 -11.050 1.667 -0.851 1.00 0.00 O ATOM 1326 CB THR A 170 -9.169 0.196 -2.859 1.00 0.00 C ATOM 1327 OG1 THR A 170 -10.440 -0.047 -3.417 1.00 0.00 O ATOM 1328 CG2 THR A 170 -8.312 -0.942 -3.403 1.00 0.00 C ATOM 0 H THR A 170 -10.944 -0.797 -0.802 1.00 0.00 H new ATOM 0 HA THR A 170 -8.174 0.178 -0.956 1.00 0.00 H new ATOM 0 HB THR A 170 -8.776 1.176 -3.129 1.00 0.00 H new ATOM 0 HG1 THR A 170 -10.916 0.802 -3.528 1.00 0.00 H new ATOM 0 HG21 THR A 170 -8.325 -0.918 -4.493 1.00 0.00 H new ATOM 0 HG22 THR A 170 -7.287 -0.827 -3.050 1.00 0.00 H new ATOM 0 HG23 THR A 170 -8.710 -1.895 -3.056 1.00 0.00 H new ATOM 1336 N ASN A 171 -9.011 2.480 -0.365 1.00 0.00 N ATOM 1337 CA ASN A 171 -9.454 3.783 0.137 1.00 0.00 C ATOM 1338 C ASN A 171 -8.291 4.781 0.025 1.00 0.00 C ATOM 1339 O ASN A 171 -7.209 4.410 -0.428 1.00 0.00 O ATOM 1340 CB ASN A 171 -9.968 3.628 1.584 1.00 0.00 C ATOM 1341 CG ASN A 171 -10.524 4.915 2.165 1.00 0.00 C ATOM 1342 OD1 ASN A 171 -10.085 5.372 3.215 1.00 0.00 O ATOM 1343 ND2 ASN A 171 -11.458 5.556 1.486 1.00 0.00 N ATOM 0 H ASN A 171 -7.998 2.364 -0.333 1.00 0.00 H new ATOM 0 HA ASN A 171 -10.281 4.171 -0.458 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -10.744 2.863 1.607 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -9.153 3.275 2.216 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -11.823 6.443 1.833 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -11.814 5.164 0.614 1.00 0.00 H new ATOM 1350 N TRP A 172 -8.482 6.055 0.368 1.00 0.00 N ATOM 1351 CA TRP A 172 -7.411 7.044 0.299 1.00 0.00 C ATOM 1352 C TRP A 172 -6.421 6.840 1.444 1.00 0.00 C ATOM 1353 O TRP A 172 -6.835 6.646 2.592 1.00 0.00 O ATOM 1354 CB TRP A 172 -7.987 8.460 0.391 1.00 0.00 C ATOM 1355 CG TRP A 172 -8.634 8.964 -0.857 1.00 0.00 C ATOM 1356 CD1 TRP A 172 -9.918 9.368 -0.976 1.00 0.00 C ATOM 1357 CD2 TRP A 172 -8.026 9.152 -2.173 1.00 0.00 C ATOM 1358 NE1 TRP A 172 -10.131 9.826 -2.259 1.00 0.00 N ATOM 1359 CE2 TRP A 172 -9.000 9.731 -3.035 1.00 0.00 C ATOM 1360 CE3 TRP A 172 -6.754 8.901 -2.731 1.00 0.00 C ATOM 1361 CZ2 TRP A 172 -8.718 10.084 -4.361 1.00 0.00 C ATOM 1362 CZ3 TRP A 172 -6.480 9.184 -4.082 1.00 0.00 C ATOM 1363 CH2 TRP A 172 -7.455 9.786 -4.898 1.00 0.00 C ATOM 0 H TRP A 172 -9.373 6.426 0.698 1.00 0.00 H new ATOM 0 HA TRP A 172 -6.897 6.918 -0.654 1.00 0.00 H new ATOM 0 HB2 TRP A 172 -8.720 8.485 1.197 1.00 0.00 H new ATOM 0 HB3 TRP A 172 -7.185 9.144 0.668 1.00 0.00 H new ATOM 0 HD1 TRP A 172 -10.659 9.337 -0.191 1.00 0.00 H new ATOM 0 HE1 TRP A 172 -11.023 10.192 -2.593 1.00 0.00 H new ATOM 0 HE3 TRP A 172 -5.976 8.484 -2.109 1.00 0.00 H new ATOM 0 HZ2 TRP A 172 -9.464 10.580 -4.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 172 -5.513 8.937 -4.496 1.00 0.00 H new ATOM 0 HH2 TRP A 172 -7.234 10.017 -5.930 1.00 0.00 H new ATOM 1374 N ALA A 173 -5.120 6.863 1.130 1.00 0.00 N ATOM 1375 CA ALA A 173 -4.074 6.720 2.135 1.00 0.00 C ATOM 1376 C ALA A 173 -3.953 8.065 2.857 1.00 0.00 C ATOM 1377 O ALA A 173 -4.008 8.127 4.087 1.00 0.00 O ATOM 1378 CB ALA A 173 -2.744 6.317 1.482 1.00 0.00 C ATOM 0 H ALA A 173 -4.771 6.980 0.179 1.00 0.00 H new ATOM 0 HA ALA A 173 -4.325 5.932 2.845 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -1.977 6.216 2.250 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -2.866 5.366 0.964 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -2.443 7.083 0.767 1.00 0.00 H new