USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=24 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 179 THR OG1 : rot 113:sc= 0.136 USER MOD Set 1.2: A 181 SER OG : rot 180:sc= 0.189 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 78:sc= 0.0671 USER MOD Single : A 167 THR OG1 : rot 81:sc= 0.626 USER MOD Single : A 168 LYS NZ :NH3+ 165:sc= -0.0471 (180deg=-0.272) USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 173 SER OG : rot -76:sc= 1.35 USER MOD Single : A 176 LYS NZ :NH3+ 162:sc= 1.03 (180deg=0.774) USER MOD Single : A 182 GLN : amide:sc= -0.0222 K(o=-0.022,f=-1.3) USER MOD Single : A 184 TYR OH : rot 180:sc=-0.00538 USER MOD Single : A 187 MET CE :methyl -161:sc=-0.00185 (180deg=-0.535) USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 SER OG : rot 178:sc= 0.868 USER MOD Single : A 193 TYR OH : rot 180:sc= 0 USER MOD Single : A 195 LYS NZ :NH3+ -163:sc= -0.0505 (180deg=-0.317) USER MOD Single : A 197 LYS NZ :NH3+ -169:sc= 1.25 (180deg=1.05) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc=-0.00419 K(o=-0.0042,f=-0.78) USER MOD Single : A 202 SER OG : rot 180:sc= -0.012 USER MOD Single : A 203 SER OG : rot -104:sc= 1.36 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= -0.492 (180deg=-0.492) USER MOD Single : A 208 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 209 SER OG : rot 78:sc= 0.988 USER MOD Single : A 212 HIS : no HD1:sc= -0.0565 X(o=-0.056,f=0) USER MOD Single : A 213 ASN : amide:sc= 0.739 K(o=0.74,f=-0.24) USER MOD Single : A 215 SER OG : rot 85:sc= 1.27 USER MOD Single : A 217 HIS : no HE2:sc= -1.29 X(o=-1.3,f=-1.4) USER MOD Single : A 218 SER OG : rot 180:sc= 0.0587 USER MOD Single : A 219 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 232 SER OG : rot 33:sc= 0.208 USER MOD Single : A 235 MET CE :methyl -177:sc= -0.231 (180deg=-0.25) USER MOD Single : A 237 ASN : amide:sc= -0.575 K(o=-0.58,f=-4!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -12.849 14.245 -2.052 1.00 0.00 N ATOM 117 CA LEU A 160 -13.544 15.083 -3.033 1.00 0.00 C ATOM 118 C LEU A 160 -15.029 14.726 -3.090 1.00 0.00 C ATOM 119 O LEU A 160 -15.399 13.554 -3.166 1.00 0.00 O ATOM 120 CB LEU A 160 -12.931 14.899 -4.427 1.00 0.00 C ATOM 121 CG LEU A 160 -11.477 15.361 -4.603 1.00 0.00 C ATOM 122 CD1 LEU A 160 -10.962 14.939 -5.979 1.00 0.00 C ATOM 123 CD2 LEU A 160 -11.331 16.876 -4.443 1.00 0.00 C ATOM 0 HA LEU A 160 -13.434 16.122 -2.722 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -12.987 13.842 -4.687 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.549 15.437 -5.145 1.00 0.00 H new ATOM 0 HG LEU A 160 -10.886 14.886 -3.820 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -9.930 15.269 -6.098 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -11.008 13.854 -6.068 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -11.580 15.393 -6.754 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.286 17.157 -4.576 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -11.941 17.381 -5.192 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -11.662 17.170 -3.447 1.00 0.00 H new ATOM 135 N SER A 161 -15.870 15.748 -3.064 1.00 0.00 N ATOM 136 CA SER A 161 -17.318 15.570 -3.094 1.00 0.00 C ATOM 137 C SER A 161 -17.794 15.353 -4.523 1.00 0.00 C ATOM 138 O SER A 161 -17.035 15.526 -5.474 1.00 0.00 O ATOM 139 CB SER A 161 -17.993 16.812 -2.515 1.00 0.00 C ATOM 140 OG SER A 161 -17.641 16.976 -1.153 1.00 0.00 O ATOM 0 H SER A 161 -15.572 16.723 -3.022 1.00 0.00 H new ATOM 0 HA SER A 161 -17.580 14.695 -2.499 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.695 17.694 -3.083 1.00 0.00 H new ATOM 0 HB3 SER A 161 -19.075 16.723 -2.609 1.00 0.00 H new ATOM 0 HG SER A 161 -18.079 17.776 -0.796 1.00 0.00 H new ATOM 146 N TYR A 162 -19.063 14.997 -4.683 1.00 0.00 N ATOM 147 CA TYR A 162 -19.630 14.780 -6.017 1.00 0.00 C ATOM 148 C TYR A 162 -19.403 15.992 -6.914 1.00 0.00 C ATOM 149 O TYR A 162 -18.983 15.840 -8.049 1.00 0.00 O ATOM 150 CB TYR A 162 -21.136 14.510 -5.934 1.00 0.00 C ATOM 151 CG TYR A 162 -21.499 13.041 -5.869 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.634 12.284 -7.051 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.721 12.401 -4.632 1.00 0.00 C ATOM 154 CE1 TYR A 162 -21.998 10.912 -7.001 1.00 0.00 C ATOM 155 CE2 TYR A 162 -22.084 11.024 -4.578 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.225 10.298 -5.765 1.00 0.00 C ATOM 157 OH TYR A 162 -22.590 8.976 -5.721 1.00 0.00 O ATOM 0 H TYR A 162 -19.718 14.852 -3.915 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.124 13.913 -6.442 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.536 15.011 -5.053 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.622 14.955 -6.802 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.458 12.754 -8.007 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.615 12.961 -3.715 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.099 10.345 -7.914 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -22.249 10.543 -3.625 1.00 0.00 H new ATOM 0 HH TYR A 162 -21.800 8.414 -5.864 1.00 0.00 H new ATOM 167 N ALA A 163 -19.665 17.190 -6.405 1.00 0.00 N ATOM 168 CA ALA A 163 -19.503 18.407 -7.198 1.00 0.00 C ATOM 169 C ALA A 163 -18.063 18.559 -7.703 1.00 0.00 C ATOM 170 O ALA A 163 -17.834 18.930 -8.856 1.00 0.00 O ATOM 171 CB ALA A 163 -19.902 19.628 -6.364 1.00 0.00 C ATOM 0 H ALA A 163 -19.989 17.347 -5.451 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.155 18.334 -8.068 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.779 20.532 -6.960 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -20.944 19.534 -6.057 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.267 19.688 -5.480 1.00 0.00 H new ATOM 177 N ASP A 164 -17.101 18.263 -6.844 1.00 0.00 N ATOM 178 CA ASP A 164 -15.695 18.394 -7.206 1.00 0.00 C ATOM 179 C ASP A 164 -15.355 17.428 -8.321 1.00 0.00 C ATOM 180 O ASP A 164 -14.687 17.784 -9.279 1.00 0.00 O ATOM 181 CB ASP A 164 -14.795 18.082 -6.012 1.00 0.00 C ATOM 182 CG ASP A 164 -15.067 18.975 -4.834 1.00 0.00 C ATOM 183 OD1 ASP A 164 -15.185 18.440 -3.710 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.178 20.200 -5.020 1.00 0.00 O ATOM 0 H ASP A 164 -17.265 17.931 -5.894 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.529 19.422 -7.530 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -14.938 17.043 -5.716 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.752 18.188 -6.310 1.00 0.00 H new ATOM 189 N LEU A 165 -15.819 16.195 -8.195 1.00 0.00 N ATOM 190 CA LEU A 165 -15.529 15.157 -9.182 1.00 0.00 C ATOM 191 C LEU A 165 -16.179 15.456 -10.531 1.00 0.00 C ATOM 192 O LEU A 165 -15.569 15.247 -11.575 1.00 0.00 O ATOM 193 CB LEU A 165 -16.003 13.802 -8.658 1.00 0.00 C ATOM 194 CG LEU A 165 -15.265 13.287 -7.411 1.00 0.00 C ATOM 195 CD1 LEU A 165 -15.981 12.063 -6.876 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.806 12.945 -7.726 1.00 0.00 C ATOM 0 H LEU A 165 -16.401 15.884 -7.417 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.450 15.135 -9.338 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.066 13.871 -8.428 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -15.896 13.065 -9.454 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.266 14.076 -6.659 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.461 11.695 -5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -17.005 12.327 -6.611 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -15.993 11.286 -7.640 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.314 12.584 -6.823 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.771 12.171 -8.492 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.293 13.836 -8.087 1.00 0.00 H new ATOM 208 N ILE A 166 -17.407 15.958 -10.512 1.00 0.00 N ATOM 209 CA ILE A 166 -18.099 16.326 -11.752 1.00 0.00 C ATOM 210 C ILE A 166 -17.292 17.435 -12.421 1.00 0.00 C ATOM 211 O ILE A 166 -17.041 17.408 -13.626 1.00 0.00 O ATOM 212 CB ILE A 166 -19.550 16.840 -11.472 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.413 15.731 -10.855 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.230 17.313 -12.765 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.639 16.257 -10.094 1.00 0.00 C ATOM 0 H ILE A 166 -17.946 16.121 -9.661 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.179 15.447 -12.392 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.463 17.675 -10.777 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.747 15.060 -11.646 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.799 15.141 -10.175 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.237 17.664 -12.539 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.652 18.126 -13.204 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.285 16.485 -13.471 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.201 15.417 -9.685 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.312 16.905 -9.281 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.275 16.823 -10.775 1.00 0.00 H new ATOM 227 N THR A 167 -16.868 18.407 -11.630 1.00 0.00 N ATOM 228 CA THR A 167 -16.075 19.513 -12.145 1.00 0.00 C ATOM 229 C THR A 167 -14.741 19.020 -12.694 1.00 0.00 C ATOM 230 O THR A 167 -14.336 19.425 -13.776 1.00 0.00 O ATOM 231 CB THR A 167 -15.813 20.546 -11.039 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.050 21.113 -10.607 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.900 21.651 -11.495 1.00 0.00 C ATOM 0 H THR A 167 -17.059 18.453 -10.629 1.00 0.00 H new ATOM 0 HA THR A 167 -16.641 19.978 -12.952 1.00 0.00 H new ATOM 0 HB THR A 167 -15.323 20.023 -10.218 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.483 20.507 -9.970 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.745 22.356 -10.678 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.941 21.229 -11.797 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.351 22.170 -12.341 1.00 0.00 H new ATOM 241 N LYS A 168 -14.061 18.142 -11.967 1.00 0.00 N ATOM 242 CA LYS A 168 -12.765 17.618 -12.411 1.00 0.00 C ATOM 243 C LYS A 168 -12.894 16.913 -13.747 1.00 0.00 C ATOM 244 O LYS A 168 -12.000 17.007 -14.576 1.00 0.00 O ATOM 245 CB LYS A 168 -12.195 16.629 -11.394 1.00 0.00 C ATOM 246 CG LYS A 168 -11.676 17.256 -10.108 1.00 0.00 C ATOM 247 CD LYS A 168 -10.232 16.842 -9.817 1.00 0.00 C ATOM 248 CE LYS A 168 -9.220 17.564 -10.727 1.00 0.00 C ATOM 249 NZ LYS A 168 -9.227 19.063 -10.524 1.00 0.00 N ATOM 0 H LYS A 168 -14.380 17.776 -11.070 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.092 18.470 -12.509 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -12.969 15.905 -11.141 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.382 16.075 -11.864 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -11.735 18.342 -10.183 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -12.314 16.959 -9.276 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -9.998 17.058 -8.775 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -10.132 15.765 -9.950 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -8.220 17.178 -10.530 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -9.449 17.340 -11.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -8.376 19.476 -10.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -10.074 19.470 -10.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -9.236 19.275 -9.506 1.00 0.00 H new ATOM 263 N ALA A 169 -14.002 16.221 -13.959 1.00 0.00 N ATOM 264 CA ALA A 169 -14.242 15.547 -15.223 1.00 0.00 C ATOM 265 C ALA A 169 -14.308 16.568 -16.362 1.00 0.00 C ATOM 266 O ALA A 169 -13.687 16.398 -17.411 1.00 0.00 O ATOM 267 CB ALA A 169 -15.547 14.752 -15.141 1.00 0.00 C ATOM 0 H ALA A 169 -14.748 16.112 -13.272 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.421 14.860 -15.425 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.726 14.247 -16.090 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.473 14.012 -14.344 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.374 15.430 -14.930 1.00 0.00 H new ATOM 273 N ILE A 170 -15.058 17.636 -16.142 1.00 0.00 N ATOM 274 CA ILE A 170 -15.238 18.669 -17.158 1.00 0.00 C ATOM 275 C ILE A 170 -13.901 19.372 -17.407 1.00 0.00 C ATOM 276 O ILE A 170 -13.544 19.662 -18.545 1.00 0.00 O ATOM 277 CB ILE A 170 -16.315 19.697 -16.707 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.686 19.000 -16.569 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.422 20.846 -17.714 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.687 19.758 -15.691 1.00 0.00 C ATOM 0 H ILE A 170 -15.554 17.813 -15.269 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.580 18.205 -18.083 1.00 0.00 H new ATOM 0 HB ILE A 170 -16.016 20.104 -15.741 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.116 18.869 -17.562 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.535 18.004 -16.153 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.181 21.553 -17.380 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.461 21.354 -17.790 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.701 20.449 -18.690 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.624 19.203 -15.645 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.280 19.867 -14.686 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.870 20.745 -16.117 1.00 0.00 H new ATOM 292 N GLU A 171 -13.151 19.624 -16.347 1.00 0.00 N ATOM 293 CA GLU A 171 -11.844 20.271 -16.463 1.00 0.00 C ATOM 294 C GLU A 171 -10.856 19.388 -17.216 1.00 0.00 C ATOM 295 O GLU A 171 -9.933 19.883 -17.867 1.00 0.00 O ATOM 296 CB GLU A 171 -11.262 20.546 -15.080 1.00 0.00 C ATOM 297 CG GLU A 171 -11.985 21.598 -14.292 1.00 0.00 C ATOM 298 CD GLU A 171 -11.047 22.715 -13.890 1.00 0.00 C ATOM 299 OE1 GLU A 171 -10.788 23.612 -14.724 1.00 0.00 O ATOM 300 OE2 GLU A 171 -10.552 22.690 -12.740 1.00 0.00 O ATOM 0 H GLU A 171 -13.421 19.392 -15.391 1.00 0.00 H new ATOM 0 HA GLU A 171 -11.995 21.203 -17.008 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.265 19.618 -14.509 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.221 20.848 -15.193 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -12.805 22.003 -14.885 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -12.427 21.151 -13.401 1.00 0.00 H new ATOM 307 N SER A 172 -11.042 18.081 -17.114 1.00 0.00 N ATOM 308 CA SER A 172 -10.137 17.126 -17.748 1.00 0.00 C ATOM 309 C SER A 172 -10.395 17.074 -19.242 1.00 0.00 C ATOM 310 O SER A 172 -9.499 16.763 -20.029 1.00 0.00 O ATOM 311 CB SER A 172 -10.334 15.731 -17.150 1.00 0.00 C ATOM 312 OG SER A 172 -9.361 14.825 -17.642 1.00 0.00 O ATOM 0 H SER A 172 -11.811 17.654 -16.598 1.00 0.00 H new ATOM 0 HA SER A 172 -9.112 17.452 -17.569 1.00 0.00 H new ATOM 0 HB2 SER A 172 -10.269 15.785 -16.063 1.00 0.00 H new ATOM 0 HB3 SER A 172 -11.332 15.365 -17.392 1.00 0.00 H new ATOM 0 HG SER A 172 -9.506 13.941 -17.245 1.00 0.00 H new ATOM 318 N SER A 173 -11.624 17.367 -19.637 1.00 0.00 N ATOM 319 CA SER A 173 -11.979 17.359 -21.048 1.00 0.00 C ATOM 320 C SER A 173 -11.300 18.537 -21.750 1.00 0.00 C ATOM 321 O SER A 173 -11.164 19.626 -21.186 1.00 0.00 O ATOM 322 CB SER A 173 -13.497 17.432 -21.209 1.00 0.00 C ATOM 323 OG SER A 173 -13.973 18.745 -21.026 1.00 0.00 O ATOM 0 H SER A 173 -12.387 17.612 -19.006 1.00 0.00 H new ATOM 0 HA SER A 173 -11.635 16.431 -21.505 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.776 17.078 -22.201 1.00 0.00 H new ATOM 0 HB3 SER A 173 -13.973 16.768 -20.488 1.00 0.00 H new ATOM 0 HG SER A 173 -13.971 18.964 -20.071 1.00 0.00 H new ATOM 329 N ALA A 174 -10.861 18.323 -22.982 1.00 0.00 N ATOM 330 CA ALA A 174 -10.181 19.376 -23.731 1.00 0.00 C ATOM 331 C ALA A 174 -11.149 20.515 -24.062 1.00 0.00 C ATOM 332 O ALA A 174 -10.769 21.679 -24.094 1.00 0.00 O ATOM 333 CB ALA A 174 -9.587 18.793 -25.020 1.00 0.00 C ATOM 0 H ALA A 174 -10.961 17.440 -23.482 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.377 19.780 -23.116 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -9.080 19.582 -25.576 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -8.872 18.009 -24.769 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.386 18.373 -25.631 1.00 0.00 H new ATOM 339 N GLU A 175 -12.397 20.152 -24.315 1.00 0.00 N ATOM 340 CA GLU A 175 -13.432 21.109 -24.712 1.00 0.00 C ATOM 341 C GLU A 175 -14.122 21.789 -23.529 1.00 0.00 C ATOM 342 O GLU A 175 -14.990 22.632 -23.728 1.00 0.00 O ATOM 343 CB GLU A 175 -14.514 20.378 -25.508 1.00 0.00 C ATOM 344 CG GLU A 175 -14.034 19.662 -26.757 1.00 0.00 C ATOM 345 CD GLU A 175 -15.208 19.124 -27.562 1.00 0.00 C ATOM 346 OE1 GLU A 175 -16.155 18.591 -26.946 1.00 0.00 O ATOM 347 OE2 GLU A 175 -15.202 19.242 -28.800 1.00 0.00 O ATOM 0 H GLU A 175 -12.726 19.189 -24.253 1.00 0.00 H new ATOM 0 HA GLU A 175 -12.927 21.877 -25.298 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -14.992 19.649 -24.854 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.279 21.099 -25.795 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -13.450 20.347 -27.372 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.373 18.841 -26.479 1.00 0.00 H new ATOM 354 N LYS A 176 -13.753 21.406 -22.308 1.00 0.00 N ATOM 355 CA LYS A 176 -14.387 21.908 -21.081 1.00 0.00 C ATOM 356 C LYS A 176 -15.894 21.717 -21.064 1.00 0.00 C ATOM 357 O LYS A 176 -16.624 22.557 -20.564 1.00 0.00 O ATOM 358 CB LYS A 176 -14.010 23.373 -20.813 1.00 0.00 C ATOM 359 CG LYS A 176 -12.512 23.599 -20.668 1.00 0.00 C ATOM 360 CD LYS A 176 -11.931 22.679 -19.592 1.00 0.00 C ATOM 361 CE LYS A 176 -10.512 23.035 -19.230 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.608 21.978 -19.785 1.00 0.00 N ATOM 0 H LYS A 176 -13.003 20.736 -22.137 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.992 21.299 -20.268 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.385 23.991 -21.629 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.509 23.708 -19.904 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -12.016 23.412 -21.621 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.319 24.640 -20.407 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -12.554 22.732 -18.699 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.965 21.648 -19.944 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -10.250 24.012 -19.637 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -10.401 23.100 -18.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.633 22.339 -19.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -9.643 21.136 -19.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.919 21.724 -20.744 1.00 0.00 H new ATOM 376 N ARG A 177 -16.342 20.588 -21.593 1.00 0.00 N ATOM 377 CA ARG A 177 -17.754 20.206 -21.587 1.00 0.00 C ATOM 378 C ARG A 177 -17.760 18.693 -21.683 1.00 0.00 C ATOM 379 O ARG A 177 -16.895 18.124 -22.342 1.00 0.00 O ATOM 380 CB ARG A 177 -18.519 20.833 -22.774 1.00 0.00 C ATOM 381 CG ARG A 177 -17.973 20.433 -24.142 1.00 0.00 C ATOM 382 CD ARG A 177 -18.749 21.027 -25.297 1.00 0.00 C ATOM 383 NE ARG A 177 -18.261 20.445 -26.558 1.00 0.00 N ATOM 384 CZ ARG A 177 -18.732 20.702 -27.769 1.00 0.00 C ATOM 385 NH1 ARG A 177 -19.734 21.522 -27.976 1.00 0.00 N ATOM 386 NH2 ARG A 177 -18.178 20.116 -28.791 1.00 0.00 N ATOM 0 H ARG A 177 -15.734 19.903 -22.043 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.256 20.562 -20.687 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.567 20.541 -22.713 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.484 21.919 -22.683 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -16.931 20.746 -24.215 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -17.986 19.346 -24.226 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.814 20.825 -25.177 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -18.629 22.110 -25.312 1.00 0.00 H new ATOM 0 HE ARG A 177 -17.488 19.782 -26.493 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -20.181 21.990 -27.188 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -20.066 21.692 -28.925 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -17.398 19.474 -28.650 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -18.524 20.299 -29.733 1.00 0.00 H new ATOM 400 N LEU A 178 -18.709 18.041 -21.032 1.00 0.00 N ATOM 401 CA LEU A 178 -18.852 16.587 -21.123 1.00 0.00 C ATOM 402 C LEU A 178 -20.331 16.236 -21.123 1.00 0.00 C ATOM 403 O LEU A 178 -21.153 17.007 -20.648 1.00 0.00 O ATOM 404 CB LEU A 178 -18.176 15.881 -19.938 1.00 0.00 C ATOM 405 CG LEU A 178 -16.643 15.735 -19.946 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.239 14.891 -18.769 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.115 15.068 -21.237 1.00 0.00 C ATOM 0 H LEU A 178 -19.398 18.493 -20.431 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.372 16.253 -22.043 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.453 16.418 -19.031 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.604 14.881 -19.860 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.214 16.736 -19.894 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.155 14.777 -18.758 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.562 15.374 -17.847 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.707 13.910 -18.847 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.029 14.991 -21.188 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.546 14.072 -21.334 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.398 15.671 -22.100 1.00 0.00 H new ATOM 419 N THR A 179 -20.667 15.068 -21.642 1.00 0.00 N ATOM 420 CA THR A 179 -22.040 14.581 -21.602 1.00 0.00 C ATOM 421 C THR A 179 -22.176 13.804 -20.296 1.00 0.00 C ATOM 422 O THR A 179 -21.171 13.469 -19.671 1.00 0.00 O ATOM 423 CB THR A 179 -22.335 13.647 -22.787 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.353 12.609 -22.818 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.274 14.406 -24.104 1.00 0.00 C ATOM 0 H THR A 179 -20.008 14.436 -22.098 1.00 0.00 H new ATOM 0 HA THR A 179 -22.742 15.412 -21.663 1.00 0.00 H new ATOM 0 HB THR A 179 -23.335 13.233 -22.660 1.00 0.00 H new ATOM 0 HG1 THR A 179 -21.777 11.751 -22.607 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.486 13.724 -24.927 1.00 0.00 H new ATOM 0 HG22 THR A 179 -23.013 15.207 -24.097 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.279 14.832 -24.233 1.00 0.00 H new ATOM 433 N LEU A 180 -23.398 13.507 -19.875 1.00 0.00 N ATOM 434 CA LEU A 180 -23.598 12.795 -18.608 1.00 0.00 C ATOM 435 C LEU A 180 -22.894 11.438 -18.564 1.00 0.00 C ATOM 436 O LEU A 180 -22.340 11.063 -17.539 1.00 0.00 O ATOM 437 CB LEU A 180 -25.091 12.603 -18.325 1.00 0.00 C ATOM 438 CG LEU A 180 -25.676 13.559 -17.269 1.00 0.00 C ATOM 439 CD1 LEU A 180 -27.189 13.374 -17.188 1.00 0.00 C ATOM 440 CD2 LEU A 180 -25.064 13.316 -15.887 1.00 0.00 C ATOM 0 H LEU A 180 -24.255 13.740 -20.377 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.149 13.421 -17.837 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.642 12.732 -19.256 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.255 11.577 -17.996 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.437 14.578 -17.574 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -27.599 14.052 -16.440 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -27.635 13.592 -18.158 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -27.415 12.345 -16.908 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -25.501 14.009 -15.168 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -25.268 12.292 -15.574 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -23.986 13.474 -15.933 1.00 0.00 H new ATOM 452 N SER A 181 -22.903 10.714 -19.674 1.00 0.00 N ATOM 453 CA SER A 181 -22.255 9.405 -19.733 1.00 0.00 C ATOM 454 C SER A 181 -20.749 9.531 -19.543 1.00 0.00 C ATOM 455 O SER A 181 -20.132 8.718 -18.873 1.00 0.00 O ATOM 456 CB SER A 181 -22.540 8.754 -21.083 1.00 0.00 C ATOM 457 OG SER A 181 -22.480 9.724 -22.118 1.00 0.00 O ATOM 0 H SER A 181 -23.349 11.006 -20.544 1.00 0.00 H new ATOM 0 HA SER A 181 -22.656 8.789 -18.928 1.00 0.00 H new ATOM 0 HB2 SER A 181 -21.815 7.963 -21.274 1.00 0.00 H new ATOM 0 HB3 SER A 181 -23.525 8.287 -21.069 1.00 0.00 H new ATOM 0 HG SER A 181 -22.663 9.295 -22.980 1.00 0.00 H new ATOM 463 N GLN A 182 -20.165 10.566 -20.126 1.00 0.00 N ATOM 464 CA GLN A 182 -18.727 10.781 -20.034 1.00 0.00 C ATOM 465 C GLN A 182 -18.314 11.092 -18.603 1.00 0.00 C ATOM 466 O GLN A 182 -17.267 10.661 -18.143 1.00 0.00 O ATOM 467 CB GLN A 182 -18.332 11.940 -20.937 1.00 0.00 C ATOM 468 CG GLN A 182 -17.906 11.514 -22.339 1.00 0.00 C ATOM 469 CD GLN A 182 -16.451 11.073 -22.411 1.00 0.00 C ATOM 470 OE1 GLN A 182 -15.734 11.068 -21.426 1.00 0.00 O ATOM 471 NE2 GLN A 182 -16.014 10.718 -23.587 1.00 0.00 N ATOM 0 H GLN A 182 -20.664 11.271 -20.668 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.219 9.870 -20.350 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.173 12.629 -21.017 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.514 12.489 -20.470 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -18.545 10.697 -22.674 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -18.063 12.344 -23.028 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -16.642 10.734 -24.391 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -15.044 10.424 -23.703 1.00 0.00 H new ATOM 480 N ILE A 183 -19.149 11.832 -17.891 1.00 0.00 N ATOM 481 CA ILE A 183 -18.871 12.156 -16.493 1.00 0.00 C ATOM 482 C ILE A 183 -18.889 10.861 -15.684 1.00 0.00 C ATOM 483 O ILE A 183 -18.051 10.667 -14.797 1.00 0.00 O ATOM 484 CB ILE A 183 -19.911 13.172 -15.943 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.780 14.499 -16.714 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.705 13.427 -14.423 1.00 0.00 C ATOM 487 CD1 ILE A 183 -21.029 15.345 -16.704 1.00 0.00 C ATOM 0 H ILE A 183 -20.021 12.220 -18.252 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.890 12.625 -16.411 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.908 12.754 -16.081 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.960 15.076 -16.286 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.510 14.281 -17.747 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.448 14.142 -14.070 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.816 12.489 -13.878 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.706 13.829 -14.254 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.853 16.261 -17.268 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.848 14.790 -17.160 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.290 15.597 -15.676 1.00 0.00 H new ATOM 499 N TYR A 184 -19.818 9.965 -15.992 1.00 0.00 N ATOM 500 CA TYR A 184 -19.864 8.680 -15.294 1.00 0.00 C ATOM 501 C TYR A 184 -18.577 7.905 -15.552 1.00 0.00 C ATOM 502 O TYR A 184 -17.937 7.422 -14.625 1.00 0.00 O ATOM 503 CB TYR A 184 -21.046 7.803 -15.744 1.00 0.00 C ATOM 504 CG TYR A 184 -22.436 8.412 -15.631 1.00 0.00 C ATOM 505 CD1 TYR A 184 -23.455 7.998 -16.512 1.00 0.00 C ATOM 506 CD2 TYR A 184 -22.752 9.384 -14.655 1.00 0.00 C ATOM 507 CE1 TYR A 184 -24.762 8.536 -16.427 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.071 9.918 -14.561 1.00 0.00 C ATOM 509 CZ TYR A 184 -25.058 9.485 -15.449 1.00 0.00 C ATOM 510 OH TYR A 184 -26.336 9.984 -15.378 1.00 0.00 O ATOM 0 H TYR A 184 -20.537 10.096 -16.704 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.986 8.906 -14.235 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -20.883 7.521 -16.784 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -21.029 6.884 -15.158 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -23.235 7.257 -17.266 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -21.987 9.726 -13.974 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -25.527 8.212 -17.117 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -24.306 10.654 -13.806 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.393 10.635 -14.648 1.00 0.00 H new ATOM 520 N GLU A 185 -18.187 7.795 -16.811 1.00 0.00 N ATOM 521 CA GLU A 185 -16.982 7.053 -17.163 1.00 0.00 C ATOM 522 C GLU A 185 -15.753 7.658 -16.508 1.00 0.00 C ATOM 523 O GLU A 185 -14.871 6.936 -16.052 1.00 0.00 O ATOM 524 CB GLU A 185 -16.774 7.046 -18.674 1.00 0.00 C ATOM 525 CG GLU A 185 -17.780 6.205 -19.429 1.00 0.00 C ATOM 526 CD GLU A 185 -17.474 6.186 -20.911 1.00 0.00 C ATOM 527 OE1 GLU A 185 -18.307 6.672 -21.708 1.00 0.00 O ATOM 528 OE2 GLU A 185 -16.381 5.687 -21.277 1.00 0.00 O ATOM 0 H GLU A 185 -18.681 8.206 -17.603 1.00 0.00 H new ATOM 0 HA GLU A 185 -17.117 6.033 -16.804 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -16.823 8.071 -19.042 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -15.772 6.677 -18.891 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -17.772 5.187 -19.040 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -18.783 6.600 -19.267 1.00 0.00 H new ATOM 535 N TRP A 186 -15.689 8.978 -16.446 1.00 0.00 N ATOM 536 CA TRP A 186 -14.547 9.638 -15.850 1.00 0.00 C ATOM 537 C TRP A 186 -14.431 9.243 -14.387 1.00 0.00 C ATOM 538 O TRP A 186 -13.344 8.953 -13.924 1.00 0.00 O ATOM 539 CB TRP A 186 -14.670 11.155 -15.991 1.00 0.00 C ATOM 540 CG TRP A 186 -13.485 11.876 -15.430 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.373 12.282 -16.091 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.283 12.274 -14.062 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.489 12.901 -15.255 1.00 0.00 N ATOM 544 CE2 TRP A 186 -12.008 12.907 -13.990 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.053 12.162 -12.892 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.486 13.414 -12.784 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.533 12.665 -11.673 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.251 13.288 -11.634 1.00 0.00 C ATOM 0 H TRP A 186 -16.410 9.607 -16.799 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.644 9.323 -16.372 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.783 11.412 -17.044 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.573 11.493 -15.482 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.207 12.134 -17.148 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.589 13.295 -15.529 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.028 11.699 -12.921 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.516 13.888 -12.756 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.113 12.576 -10.766 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -11.871 13.667 -10.697 1.00 0.00 H new ATOM 559 N MET A 187 -15.536 9.208 -13.653 1.00 0.00 N ATOM 560 CA MET A 187 -15.465 8.849 -12.235 1.00 0.00 C ATOM 561 C MET A 187 -15.048 7.395 -12.049 1.00 0.00 C ATOM 562 O MET A 187 -14.321 7.084 -11.118 1.00 0.00 O ATOM 563 CB MET A 187 -16.796 9.091 -11.530 1.00 0.00 C ATOM 564 CG MET A 187 -17.148 10.547 -11.370 1.00 0.00 C ATOM 565 SD MET A 187 -18.595 10.732 -10.326 1.00 0.00 S ATOM 566 CE MET A 187 -18.939 12.437 -10.545 1.00 0.00 C ATOM 0 H MET A 187 -16.472 9.417 -14.001 1.00 0.00 H new ATOM 0 HA MET A 187 -14.708 9.492 -11.786 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.588 8.596 -12.091 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.764 8.625 -10.545 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.306 11.085 -10.934 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.338 10.991 -12.347 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.575 12.787 -9.732 1.00 0.00 H new ATOM 0 HE2 MET A 187 -18.005 13.000 -10.544 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.451 12.586 -11.496 1.00 0.00 H new ATOM 576 N VAL A 188 -15.488 6.511 -12.935 1.00 0.00 N ATOM 577 CA VAL A 188 -15.099 5.096 -12.863 1.00 0.00 C ATOM 578 C VAL A 188 -13.586 4.960 -13.080 1.00 0.00 C ATOM 579 O VAL A 188 -12.919 4.169 -12.417 1.00 0.00 O ATOM 580 CB VAL A 188 -15.867 4.251 -13.943 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.345 2.810 -14.022 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.364 4.213 -13.623 1.00 0.00 C ATOM 0 H VAL A 188 -16.111 6.740 -13.710 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.361 4.717 -11.875 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.698 4.736 -14.904 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -15.904 2.262 -14.781 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.288 2.820 -14.286 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.473 2.323 -13.055 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -17.883 3.624 -14.379 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.515 3.759 -12.643 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.761 5.228 -13.618 1.00 0.00 H new ATOM 592 N LYS A 189 -13.042 5.723 -14.016 1.00 0.00 N ATOM 593 CA LYS A 189 -11.615 5.645 -14.338 1.00 0.00 C ATOM 594 C LYS A 189 -10.741 6.409 -13.335 1.00 0.00 C ATOM 595 O LYS A 189 -9.598 6.041 -13.104 1.00 0.00 O ATOM 596 CB LYS A 189 -11.382 6.213 -15.747 1.00 0.00 C ATOM 597 CG LYS A 189 -11.443 5.179 -16.907 1.00 0.00 C ATOM 598 CD LYS A 189 -12.823 4.514 -17.068 1.00 0.00 C ATOM 599 CE LYS A 189 -12.925 3.666 -18.338 1.00 0.00 C ATOM 600 NZ LYS A 189 -13.159 4.514 -19.572 1.00 0.00 N ATOM 0 H LYS A 189 -13.562 6.405 -14.569 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.327 4.595 -14.289 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.126 6.987 -15.935 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -10.406 6.698 -15.767 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -11.177 5.676 -17.840 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -10.694 4.406 -16.733 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -13.023 3.886 -16.200 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -13.593 5.285 -17.088 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -12.008 3.090 -18.463 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -13.740 2.950 -18.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -13.222 3.900 -20.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -14.047 5.045 -19.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -12.369 5.180 -19.690 1.00 0.00 H new ATOM 614 N SER A 190 -11.278 7.477 -12.766 1.00 0.00 N ATOM 615 CA SER A 190 -10.526 8.347 -11.852 1.00 0.00 C ATOM 616 C SER A 190 -10.590 7.930 -10.384 1.00 0.00 C ATOM 617 O SER A 190 -9.624 8.105 -9.645 1.00 0.00 O ATOM 618 CB SER A 190 -11.071 9.773 -11.977 1.00 0.00 C ATOM 619 OG SER A 190 -10.318 10.704 -11.222 1.00 0.00 O ATOM 0 H SER A 190 -12.243 7.771 -12.919 1.00 0.00 H new ATOM 0 HA SER A 190 -9.480 8.271 -12.148 1.00 0.00 H new ATOM 0 HB2 SER A 190 -11.067 10.071 -13.026 1.00 0.00 H new ATOM 0 HB3 SER A 190 -12.109 9.793 -11.644 1.00 0.00 H new ATOM 0 HG SER A 190 -10.685 11.603 -11.352 1.00 0.00 H new ATOM 625 N VAL A 191 -11.724 7.394 -9.946 1.00 0.00 N ATOM 626 CA VAL A 191 -11.901 7.048 -8.536 1.00 0.00 C ATOM 627 C VAL A 191 -12.209 5.557 -8.364 1.00 0.00 C ATOM 628 O VAL A 191 -13.257 5.079 -8.817 1.00 0.00 O ATOM 629 CB VAL A 191 -13.057 7.868 -7.889 1.00 0.00 C ATOM 630 CG1 VAL A 191 -12.966 7.801 -6.356 1.00 0.00 C ATOM 631 CG2 VAL A 191 -13.006 9.332 -8.325 1.00 0.00 C ATOM 0 H VAL A 191 -12.529 7.190 -10.539 1.00 0.00 H new ATOM 0 HA VAL A 191 -10.962 7.288 -8.037 1.00 0.00 H new ATOM 0 HB VAL A 191 -13.998 7.431 -8.224 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -13.780 8.378 -5.918 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.042 6.763 -6.032 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.011 8.214 -6.030 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -13.825 9.879 -7.858 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -12.056 9.770 -8.019 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -13.101 9.392 -9.409 1.00 0.00 H new ATOM 641 N PRO A 192 -11.317 4.798 -7.694 1.00 0.00 N ATOM 642 CA PRO A 192 -11.618 3.371 -7.505 1.00 0.00 C ATOM 643 C PRO A 192 -12.937 3.117 -6.779 1.00 0.00 C ATOM 644 O PRO A 192 -13.598 2.121 -7.024 1.00 0.00 O ATOM 645 CB PRO A 192 -10.440 2.874 -6.660 1.00 0.00 C ATOM 646 CG PRO A 192 -9.342 3.821 -6.961 1.00 0.00 C ATOM 647 CD PRO A 192 -10.018 5.149 -7.087 1.00 0.00 C ATOM 0 HA PRO A 192 -11.735 2.861 -8.461 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -10.685 2.875 -5.598 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -10.166 1.852 -6.923 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -8.596 3.829 -6.167 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -8.825 3.550 -7.881 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.142 5.633 -6.118 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.450 5.834 -7.716 1.00 0.00 H new ATOM 655 N TYR A 193 -13.323 4.034 -5.899 1.00 0.00 N ATOM 656 CA TYR A 193 -14.587 3.923 -5.173 1.00 0.00 C ATOM 657 C TYR A 193 -15.769 3.829 -6.128 1.00 0.00 C ATOM 658 O TYR A 193 -16.641 2.997 -5.962 1.00 0.00 O ATOM 659 CB TYR A 193 -14.791 5.152 -4.278 1.00 0.00 C ATOM 660 CG TYR A 193 -16.103 5.130 -3.515 1.00 0.00 C ATOM 661 CD1 TYR A 193 -16.195 4.520 -2.247 1.00 0.00 C ATOM 662 CD2 TYR A 193 -17.262 5.729 -4.057 1.00 0.00 C ATOM 663 CE1 TYR A 193 -17.427 4.507 -1.533 1.00 0.00 C ATOM 664 CE2 TYR A 193 -18.491 5.709 -3.352 1.00 0.00 C ATOM 665 CZ TYR A 193 -18.561 5.102 -2.097 1.00 0.00 C ATOM 666 OH TYR A 193 -19.752 5.098 -1.416 1.00 0.00 O ATOM 0 H TYR A 193 -12.779 4.865 -5.669 1.00 0.00 H new ATOM 0 HA TYR A 193 -14.537 3.015 -4.571 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -13.967 5.216 -3.567 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -14.752 6.051 -4.893 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -15.321 4.057 -1.812 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -17.211 6.209 -5.023 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -17.486 4.040 -0.561 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -19.371 6.162 -3.784 1.00 0.00 H new ATOM 0 HH TYR A 193 -20.436 5.554 -1.950 1.00 0.00 H new ATOM 676 N PHE A 194 -15.804 4.692 -7.128 1.00 0.00 N ATOM 677 CA PHE A 194 -16.934 4.721 -8.045 1.00 0.00 C ATOM 678 C PHE A 194 -16.903 3.547 -9.009 1.00 0.00 C ATOM 679 O PHE A 194 -17.953 3.085 -9.449 1.00 0.00 O ATOM 680 CB PHE A 194 -16.959 6.051 -8.787 1.00 0.00 C ATOM 681 CG PHE A 194 -17.663 7.135 -8.023 1.00 0.00 C ATOM 682 CD1 PHE A 194 -19.056 7.274 -8.132 1.00 0.00 C ATOM 683 CD2 PHE A 194 -16.954 8.009 -7.181 1.00 0.00 C ATOM 684 CE1 PHE A 194 -19.746 8.264 -7.418 1.00 0.00 C ATOM 685 CE2 PHE A 194 -17.634 9.009 -6.445 1.00 0.00 C ATOM 686 CZ PHE A 194 -19.033 9.140 -6.568 1.00 0.00 C ATOM 0 H PHE A 194 -15.073 5.375 -7.326 1.00 0.00 H new ATOM 0 HA PHE A 194 -17.853 4.626 -7.466 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -15.936 6.365 -8.993 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.451 5.914 -9.750 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -19.606 6.606 -8.778 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -15.881 7.917 -7.095 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -20.817 8.357 -7.517 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -17.083 9.669 -5.791 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.557 9.906 -6.015 1.00 0.00 H new ATOM 696 N LYS A 195 -15.715 3.039 -9.312 1.00 0.00 N ATOM 697 CA LYS A 195 -15.599 1.826 -10.126 1.00 0.00 C ATOM 698 C LYS A 195 -16.204 0.662 -9.356 1.00 0.00 C ATOM 699 O LYS A 195 -16.968 -0.127 -9.896 1.00 0.00 O ATOM 700 CB LYS A 195 -14.127 1.517 -10.425 1.00 0.00 C ATOM 701 CG LYS A 195 -13.926 0.233 -11.224 1.00 0.00 C ATOM 702 CD LYS A 195 -12.452 -0.124 -11.336 1.00 0.00 C ATOM 703 CE LYS A 195 -12.262 -1.476 -12.033 1.00 0.00 C ATOM 704 NZ LYS A 195 -12.899 -2.607 -11.254 1.00 0.00 N ATOM 0 H LYS A 195 -14.826 3.439 -9.013 1.00 0.00 H new ATOM 0 HA LYS A 195 -16.124 1.977 -11.069 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.694 2.351 -10.977 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.582 1.440 -9.484 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -14.465 -0.584 -10.744 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -14.350 0.353 -12.221 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -11.928 0.653 -11.893 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -12.007 -0.158 -10.342 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -12.696 -1.434 -13.032 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -11.197 -1.675 -12.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -12.516 -3.515 -11.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -12.690 -2.492 -10.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -13.929 -2.592 -11.399 1.00 0.00 H new ATOM 718 N ASP A 196 -15.845 0.575 -8.087 1.00 0.00 N ATOM 719 CA ASP A 196 -16.312 -0.488 -7.199 1.00 0.00 C ATOM 720 C ASP A 196 -17.824 -0.416 -6.996 1.00 0.00 C ATOM 721 O ASP A 196 -18.495 -1.417 -6.802 1.00 0.00 O ATOM 722 CB ASP A 196 -15.611 -0.329 -5.849 1.00 0.00 C ATOM 723 CG ASP A 196 -15.835 -1.503 -4.934 1.00 0.00 C ATOM 724 OD1 ASP A 196 -16.443 -1.303 -3.858 1.00 0.00 O ATOM 725 OD2 ASP A 196 -15.396 -2.616 -5.273 1.00 0.00 O ATOM 0 H ASP A 196 -15.218 1.241 -7.636 1.00 0.00 H new ATOM 0 HA ASP A 196 -16.079 -1.454 -7.648 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -14.541 -0.201 -6.013 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -15.970 0.578 -5.363 1.00 0.00 H new ATOM 730 N LYS A 197 -18.357 0.795 -7.057 1.00 0.00 N ATOM 731 CA LYS A 197 -19.786 1.029 -6.831 1.00 0.00 C ATOM 732 C LYS A 197 -20.578 1.073 -8.132 1.00 0.00 C ATOM 733 O LYS A 197 -21.709 1.537 -8.162 1.00 0.00 O ATOM 734 CB LYS A 197 -19.964 2.320 -6.014 1.00 0.00 C ATOM 735 CG LYS A 197 -20.029 2.066 -4.504 1.00 0.00 C ATOM 736 CD LYS A 197 -18.739 1.471 -3.907 1.00 0.00 C ATOM 737 CE LYS A 197 -18.955 0.988 -2.485 1.00 0.00 C ATOM 738 NZ LYS A 197 -17.728 0.277 -1.988 1.00 0.00 N ATOM 0 H LYS A 197 -17.822 1.639 -7.262 1.00 0.00 H new ATOM 0 HA LYS A 197 -20.189 0.189 -6.265 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.137 2.997 -6.228 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -20.877 2.823 -6.332 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -20.250 3.006 -3.998 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -20.858 1.389 -4.296 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -18.399 0.641 -4.527 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -17.950 2.223 -3.921 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -19.182 1.834 -1.836 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -19.814 0.317 -2.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -17.946 -0.208 -1.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -17.421 -0.421 -2.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -16.967 0.968 -1.830 1.00 0.00 H new ATOM 752 N GLY A 198 -19.982 0.573 -9.203 1.00 0.00 N ATOM 753 CA GLY A 198 -20.631 0.568 -10.510 1.00 0.00 C ATOM 754 C GLY A 198 -21.646 -0.549 -10.708 1.00 0.00 C ATOM 755 O GLY A 198 -22.026 -0.846 -11.837 1.00 0.00 O ATOM 0 H GLY A 198 -19.048 0.164 -9.195 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -21.131 1.526 -10.657 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -19.865 0.486 -11.281 1.00 0.00 H new ATOM 759 N ASP A 199 -22.076 -1.172 -9.621 1.00 0.00 N ATOM 760 CA ASP A 199 -23.054 -2.262 -9.675 1.00 0.00 C ATOM 761 C ASP A 199 -24.417 -1.784 -10.206 1.00 0.00 C ATOM 762 O ASP A 199 -24.775 -0.606 -10.090 1.00 0.00 O ATOM 763 CB ASP A 199 -23.230 -2.871 -8.282 1.00 0.00 C ATOM 764 CG ASP A 199 -24.148 -4.079 -8.292 1.00 0.00 C ATOM 765 OD1 ASP A 199 -24.135 -4.835 -9.288 1.00 0.00 O ATOM 766 OD2 ASP A 199 -24.903 -4.255 -7.319 1.00 0.00 O ATOM 0 H ASP A 199 -21.762 -0.942 -8.678 1.00 0.00 H new ATOM 0 HA ASP A 199 -22.672 -3.014 -10.365 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -22.256 -3.162 -7.889 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -23.634 -2.117 -7.607 1.00 0.00 H new ATOM 771 N SER A 200 -25.174 -2.711 -10.778 1.00 0.00 N ATOM 772 CA SER A 200 -26.453 -2.409 -11.418 1.00 0.00 C ATOM 773 C SER A 200 -27.438 -1.682 -10.504 1.00 0.00 C ATOM 774 O SER A 200 -28.016 -0.668 -10.899 1.00 0.00 O ATOM 775 CB SER A 200 -27.091 -3.709 -11.918 1.00 0.00 C ATOM 776 OG SER A 200 -28.277 -3.447 -12.649 1.00 0.00 O ATOM 0 H SER A 200 -24.920 -3.698 -10.813 1.00 0.00 H new ATOM 0 HA SER A 200 -26.236 -1.734 -12.245 1.00 0.00 H new ATOM 0 HB2 SER A 200 -26.383 -4.246 -12.549 1.00 0.00 H new ATOM 0 HB3 SER A 200 -27.318 -4.356 -11.071 1.00 0.00 H new ATOM 0 HG SER A 200 -28.664 -4.292 -12.958 1.00 0.00 H new ATOM 782 N ASN A 201 -27.638 -2.165 -9.286 1.00 0.00 N ATOM 783 CA ASN A 201 -28.583 -1.505 -8.379 1.00 0.00 C ATOM 784 C ASN A 201 -27.992 -0.205 -7.836 1.00 0.00 C ATOM 785 O ASN A 201 -28.693 0.791 -7.650 1.00 0.00 O ATOM 786 CB ASN A 201 -28.956 -2.426 -7.219 1.00 0.00 C ATOM 787 CG ASN A 201 -30.101 -1.877 -6.398 1.00 0.00 C ATOM 788 OD1 ASN A 201 -31.015 -1.260 -6.921 1.00 0.00 O ATOM 789 ND2 ASN A 201 -30.059 -2.103 -5.115 1.00 0.00 N ATOM 0 H ASN A 201 -27.175 -2.990 -8.904 1.00 0.00 H new ATOM 0 HA ASN A 201 -29.484 -1.274 -8.947 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -29.229 -3.407 -7.609 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -28.087 -2.569 -6.577 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -30.807 -1.760 -4.512 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -29.278 -2.623 -4.714 1.00 0.00 H new ATOM 796 N SER A 202 -26.688 -0.210 -7.598 1.00 0.00 N ATOM 797 CA SER A 202 -25.992 0.963 -7.065 1.00 0.00 C ATOM 798 C SER A 202 -26.067 2.145 -8.025 1.00 0.00 C ATOM 799 O SER A 202 -25.956 3.307 -7.609 1.00 0.00 O ATOM 800 CB SER A 202 -24.536 0.611 -6.787 1.00 0.00 C ATOM 801 OG SER A 202 -24.474 -0.469 -5.872 1.00 0.00 O ATOM 0 H SER A 202 -26.084 -1.015 -7.765 1.00 0.00 H new ATOM 0 HA SER A 202 -26.485 1.256 -6.138 1.00 0.00 H new ATOM 0 HB2 SER A 202 -24.032 0.343 -7.716 1.00 0.00 H new ATOM 0 HB3 SER A 202 -24.014 1.476 -6.379 1.00 0.00 H new ATOM 0 HG SER A 202 -23.537 -0.695 -5.696 1.00 0.00 H new ATOM 807 N SER A 203 -26.288 1.852 -9.303 1.00 0.00 N ATOM 808 CA SER A 203 -26.431 2.881 -10.331 1.00 0.00 C ATOM 809 C SER A 203 -27.522 3.886 -9.964 1.00 0.00 C ATOM 810 O SER A 203 -27.475 5.045 -10.389 1.00 0.00 O ATOM 811 CB SER A 203 -26.751 2.265 -11.694 1.00 0.00 C ATOM 812 OG SER A 203 -28.105 1.845 -11.755 1.00 0.00 O ATOM 0 H SER A 203 -26.373 0.899 -9.656 1.00 0.00 H new ATOM 0 HA SER A 203 -25.475 3.401 -10.392 1.00 0.00 H new ATOM 0 HB2 SER A 203 -26.556 2.993 -12.481 1.00 0.00 H new ATOM 0 HB3 SER A 203 -26.094 1.415 -11.877 1.00 0.00 H new ATOM 0 HG SER A 203 -28.149 0.869 -11.674 1.00 0.00 H new ATOM 818 N ALA A 204 -28.506 3.453 -9.178 1.00 0.00 N ATOM 819 CA ALA A 204 -29.607 4.315 -8.772 1.00 0.00 C ATOM 820 C ALA A 204 -29.123 5.599 -8.084 1.00 0.00 C ATOM 821 O ALA A 204 -29.547 6.697 -8.456 1.00 0.00 O ATOM 822 CB ALA A 204 -30.563 3.541 -7.852 1.00 0.00 C ATOM 0 H ALA A 204 -28.560 2.504 -8.809 1.00 0.00 H new ATOM 0 HA ALA A 204 -30.135 4.620 -9.675 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.385 4.191 -7.551 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -30.960 2.677 -8.384 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -30.023 3.205 -6.966 1.00 0.00 H new ATOM 828 N GLY A 205 -28.238 5.464 -7.103 1.00 0.00 N ATOM 829 CA GLY A 205 -27.742 6.628 -6.376 1.00 0.00 C ATOM 830 C GLY A 205 -26.625 7.314 -7.133 1.00 0.00 C ATOM 831 O GLY A 205 -26.438 8.528 -7.041 1.00 0.00 O ATOM 0 H GLY A 205 -27.852 4.571 -6.795 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -28.558 7.331 -6.211 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.383 6.320 -5.394 1.00 0.00 H new ATOM 835 N TRP A 206 -25.904 6.514 -7.902 1.00 0.00 N ATOM 836 CA TRP A 206 -24.775 6.964 -8.717 1.00 0.00 C ATOM 837 C TRP A 206 -25.211 8.101 -9.651 1.00 0.00 C ATOM 838 O TRP A 206 -24.667 9.205 -9.619 1.00 0.00 O ATOM 839 CB TRP A 206 -24.376 5.749 -9.563 1.00 0.00 C ATOM 840 CG TRP A 206 -22.961 5.402 -9.723 1.00 0.00 C ATOM 841 CD1 TRP A 206 -22.334 4.306 -9.229 1.00 0.00 C ATOM 842 CD2 TRP A 206 -21.977 6.077 -10.517 1.00 0.00 C ATOM 843 NE1 TRP A 206 -21.046 4.227 -9.655 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.793 5.284 -10.477 1.00 0.00 C ATOM 845 CE3 TRP A 206 -21.976 7.262 -11.275 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.640 5.624 -11.190 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -20.807 7.621 -11.969 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.652 6.787 -11.927 1.00 0.00 C ATOM 0 H TRP A 206 -26.086 5.514 -7.982 1.00 0.00 H new ATOM 0 HA TRP A 206 -23.958 7.333 -8.097 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -24.877 4.879 -9.138 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.788 5.899 -10.561 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -22.801 3.584 -8.576 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -20.379 3.498 -9.402 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -22.857 7.885 -11.323 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.764 4.992 -11.164 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -20.784 8.538 -12.539 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -18.771 7.072 -12.483 1.00 0.00 H new ATOM 859 N LYS A 207 -26.213 7.832 -10.480 1.00 0.00 N ATOM 860 CA LYS A 207 -26.696 8.827 -11.440 1.00 0.00 C ATOM 861 C LYS A 207 -27.467 9.951 -10.770 1.00 0.00 C ATOM 862 O LYS A 207 -27.409 11.093 -11.214 1.00 0.00 O ATOM 863 CB LYS A 207 -27.549 8.152 -12.532 1.00 0.00 C ATOM 864 CG LYS A 207 -28.874 7.532 -12.052 1.00 0.00 C ATOM 865 CD LYS A 207 -29.472 6.603 -13.115 1.00 0.00 C ATOM 866 CE LYS A 207 -30.153 5.377 -12.488 1.00 0.00 C ATOM 867 NZ LYS A 207 -31.295 5.734 -11.574 1.00 0.00 N ATOM 0 H LYS A 207 -26.707 6.940 -10.510 1.00 0.00 H new ATOM 0 HA LYS A 207 -25.820 9.279 -11.905 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -27.772 8.890 -13.302 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -26.952 7.371 -13.003 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -28.704 6.973 -11.132 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -29.585 8.324 -11.817 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -30.197 7.155 -13.713 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -28.685 6.274 -13.793 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -30.522 4.728 -13.283 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -29.413 4.806 -11.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -31.712 4.865 -11.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -30.944 6.329 -10.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -32.019 6.255 -12.110 1.00 0.00 H new ATOM 881 N ASN A 208 -28.207 9.639 -9.715 1.00 0.00 N ATOM 882 CA ASN A 208 -29.060 10.644 -9.091 1.00 0.00 C ATOM 883 C ASN A 208 -28.268 11.737 -8.396 1.00 0.00 C ATOM 884 O ASN A 208 -28.630 12.900 -8.474 1.00 0.00 O ATOM 885 CB ASN A 208 -30.015 10.002 -8.088 1.00 0.00 C ATOM 886 CG ASN A 208 -31.153 10.917 -7.723 1.00 0.00 C ATOM 887 OD1 ASN A 208 -31.843 11.426 -8.593 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.362 11.125 -6.453 1.00 0.00 N ATOM 0 H ASN A 208 -28.236 8.717 -9.279 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.627 11.103 -9.901 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.414 9.078 -8.508 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.465 9.731 -7.187 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -32.125 11.732 -6.155 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -30.762 10.680 -5.758 1.00 0.00 H new ATOM 895 N SER A 209 -27.188 11.374 -7.723 1.00 0.00 N ATOM 896 CA SER A 209 -26.391 12.363 -6.998 1.00 0.00 C ATOM 897 C SER A 209 -25.712 13.343 -7.952 1.00 0.00 C ATOM 898 O SER A 209 -25.630 14.541 -7.677 1.00 0.00 O ATOM 899 CB SER A 209 -25.344 11.657 -6.150 1.00 0.00 C ATOM 900 OG SER A 209 -25.959 10.698 -5.306 1.00 0.00 O ATOM 0 H SER A 209 -26.843 10.416 -7.661 1.00 0.00 H new ATOM 0 HA SER A 209 -27.062 12.932 -6.355 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.613 11.169 -6.795 1.00 0.00 H new ATOM 0 HB3 SER A 209 -24.801 12.386 -5.548 1.00 0.00 H new ATOM 0 HG SER A 209 -26.184 9.900 -5.828 1.00 0.00 H new ATOM 906 N ILE A 210 -25.240 12.844 -9.085 1.00 0.00 N ATOM 907 CA ILE A 210 -24.608 13.707 -10.083 1.00 0.00 C ATOM 908 C ILE A 210 -25.668 14.636 -10.655 1.00 0.00 C ATOM 909 O ILE A 210 -25.461 15.840 -10.771 1.00 0.00 O ATOM 910 CB ILE A 210 -23.937 12.874 -11.216 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.775 12.067 -10.612 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.459 13.778 -12.380 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.236 10.977 -11.498 1.00 0.00 C ATOM 0 H ILE A 210 -25.280 11.857 -9.339 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.818 14.288 -9.607 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.669 12.188 -11.642 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -21.963 12.752 -10.368 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -23.109 11.622 -9.675 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -22.996 13.163 -13.152 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.312 14.309 -12.802 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.732 14.499 -12.006 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.421 10.464 -10.988 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -23.030 10.264 -11.722 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.866 11.412 -12.426 1.00 0.00 H new ATOM 925 N ARG A 211 -26.817 14.077 -11.002 1.00 0.00 N ATOM 926 CA ARG A 211 -27.896 14.871 -11.586 1.00 0.00 C ATOM 927 C ARG A 211 -28.431 15.914 -10.616 1.00 0.00 C ATOM 928 O ARG A 211 -28.807 16.993 -11.041 1.00 0.00 O ATOM 929 CB ARG A 211 -29.005 13.957 -12.082 1.00 0.00 C ATOM 930 CG ARG A 211 -28.675 13.404 -13.461 1.00 0.00 C ATOM 931 CD ARG A 211 -29.397 12.112 -13.753 1.00 0.00 C ATOM 932 NE ARG A 211 -30.859 12.251 -13.655 1.00 0.00 N ATOM 933 CZ ARG A 211 -31.743 11.403 -14.169 1.00 0.00 C ATOM 934 NH1 ARG A 211 -31.384 10.344 -14.854 1.00 0.00 N ATOM 935 NH2 ARG A 211 -33.016 11.627 -13.990 1.00 0.00 N ATOM 0 H ARG A 211 -27.029 13.085 -10.892 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.487 15.419 -12.435 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -29.146 13.135 -11.380 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -29.945 14.507 -12.122 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -28.939 14.143 -14.218 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -27.600 13.241 -13.536 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -29.134 11.770 -14.754 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -29.060 11.345 -13.055 1.00 0.00 H new ATOM 0 HE ARG A 211 -31.222 13.062 -13.153 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -30.395 10.148 -15.008 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -32.094 9.717 -15.233 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -33.321 12.444 -13.461 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -33.706 10.985 -14.379 1.00 0.00 H new ATOM 949 N HIS A 212 -28.449 15.610 -9.328 1.00 0.00 N ATOM 950 CA HIS A 212 -28.882 16.580 -8.323 1.00 0.00 C ATOM 951 C HIS A 212 -27.964 17.800 -8.349 1.00 0.00 C ATOM 952 O HIS A 212 -28.430 18.930 -8.385 1.00 0.00 O ATOM 953 CB HIS A 212 -28.855 15.945 -6.927 1.00 0.00 C ATOM 954 CG HIS A 212 -29.270 16.881 -5.833 1.00 0.00 C ATOM 955 ND1 HIS A 212 -30.545 16.974 -5.334 1.00 0.00 N ATOM 956 CD2 HIS A 212 -28.543 17.784 -5.117 1.00 0.00 C ATOM 957 CE1 HIS A 212 -30.547 17.894 -4.371 1.00 0.00 C ATOM 958 NE2 HIS A 212 -29.352 18.419 -4.199 1.00 0.00 N ATOM 0 H HIS A 212 -28.171 14.704 -8.950 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.901 16.890 -8.552 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -29.513 15.076 -6.920 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -27.848 15.583 -6.721 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -27.488 17.974 -5.249 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -31.421 18.175 -3.802 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -29.083 19.141 -3.530 1.00 0.00 H new ATOM 966 N ASN A 213 -26.658 17.565 -8.347 1.00 0.00 N ATOM 967 CA ASN A 213 -25.683 18.659 -8.351 1.00 0.00 C ATOM 968 C ASN A 213 -25.780 19.489 -9.632 1.00 0.00 C ATOM 969 O ASN A 213 -25.642 20.707 -9.605 1.00 0.00 O ATOM 970 CB ASN A 213 -24.265 18.096 -8.212 1.00 0.00 C ATOM 971 CG ASN A 213 -23.883 17.841 -6.778 1.00 0.00 C ATOM 972 OD1 ASN A 213 -23.368 18.710 -6.109 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.122 16.648 -6.304 1.00 0.00 N ATOM 0 H ASN A 213 -26.246 16.632 -8.343 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.907 19.309 -7.505 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -24.190 17.166 -8.775 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.555 18.795 -8.655 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -23.873 16.423 -5.341 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -24.557 15.941 -6.897 1.00 0.00 H new ATOM 980 N LEU A 214 -26.028 18.830 -10.753 1.00 0.00 N ATOM 981 CA LEU A 214 -26.165 19.531 -12.032 1.00 0.00 C ATOM 982 C LEU A 214 -27.453 20.356 -12.086 1.00 0.00 C ATOM 983 O LEU A 214 -27.511 21.377 -12.761 1.00 0.00 O ATOM 984 CB LEU A 214 -26.169 18.528 -13.190 1.00 0.00 C ATOM 985 CG LEU A 214 -24.855 17.778 -13.473 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.117 16.701 -14.513 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.757 18.709 -13.965 1.00 0.00 C ATOM 0 H LEU A 214 -26.139 17.818 -10.810 1.00 0.00 H new ATOM 0 HA LEU A 214 -25.313 20.205 -12.125 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.945 17.788 -12.994 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.457 19.060 -14.097 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.510 17.335 -12.539 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.192 16.163 -14.721 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -25.865 16.004 -14.135 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.483 17.162 -15.430 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -22.849 18.135 -14.151 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.076 19.192 -14.888 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.557 19.468 -13.208 1.00 0.00 H new ATOM 999 N SER A 215 -28.479 19.917 -11.369 1.00 0.00 N ATOM 1000 CA SER A 215 -29.775 20.604 -11.366 1.00 0.00 C ATOM 1001 C SER A 215 -29.728 21.942 -10.636 1.00 0.00 C ATOM 1002 O SER A 215 -30.621 22.764 -10.801 1.00 0.00 O ATOM 1003 CB SER A 215 -30.844 19.729 -10.710 1.00 0.00 C ATOM 1004 OG SER A 215 -30.998 18.506 -11.414 1.00 0.00 O ATOM 0 H SER A 215 -28.444 19.086 -10.778 1.00 0.00 H new ATOM 0 HA SER A 215 -30.023 20.792 -12.411 1.00 0.00 H new ATOM 0 HB2 SER A 215 -30.569 19.526 -9.675 1.00 0.00 H new ATOM 0 HB3 SER A 215 -31.794 20.263 -10.688 1.00 0.00 H new ATOM 0 HG SER A 215 -30.330 17.861 -11.100 1.00 0.00 H new ATOM 1010 N LEU A 216 -28.688 22.161 -9.842 1.00 0.00 N ATOM 1011 CA LEU A 216 -28.534 23.422 -9.112 1.00 0.00 C ATOM 1012 C LEU A 216 -28.246 24.564 -10.085 1.00 0.00 C ATOM 1013 O LEU A 216 -28.528 25.719 -9.793 1.00 0.00 O ATOM 1014 CB LEU A 216 -27.390 23.315 -8.095 1.00 0.00 C ATOM 1015 CG LEU A 216 -27.526 22.211 -7.030 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -26.244 22.141 -6.203 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -28.724 22.449 -6.107 1.00 0.00 C ATOM 0 H LEU A 216 -27.939 21.487 -9.684 1.00 0.00 H new ATOM 0 HA LEU A 216 -29.464 23.627 -8.582 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.461 23.151 -8.641 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -27.295 24.273 -7.584 1.00 0.00 H new ATOM 0 HG LEU A 216 -27.692 21.266 -7.548 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -26.340 21.360 -5.449 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -25.402 21.914 -6.856 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -26.075 23.100 -5.713 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -28.782 21.647 -5.372 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -28.604 23.403 -5.594 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -29.640 22.467 -6.697 1.00 0.00 H new ATOM 1029 N HIS A 217 -27.685 24.209 -11.239 1.00 0.00 N ATOM 1030 CA HIS A 217 -27.376 25.136 -12.341 1.00 0.00 C ATOM 1031 C HIS A 217 -26.448 26.329 -12.012 1.00 0.00 C ATOM 1032 O HIS A 217 -26.250 27.210 -12.843 1.00 0.00 O ATOM 1033 CB HIS A 217 -28.681 25.656 -12.960 1.00 0.00 C ATOM 1034 CG HIS A 217 -28.687 25.630 -14.458 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -29.792 25.351 -15.220 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -27.687 25.854 -15.355 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -29.438 25.401 -16.502 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -28.163 25.696 -16.646 1.00 0.00 N ATOM 0 H HIS A 217 -27.423 23.245 -11.445 1.00 0.00 H new ATOM 0 HA HIS A 217 -26.798 24.533 -13.041 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -29.513 25.056 -12.591 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -28.851 26.678 -12.622 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -30.725 25.141 -14.865 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -26.672 26.116 -15.097 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -30.115 25.221 -17.324 1.00 0.00 H new ATOM 1046 N SER A 218 -25.891 26.365 -10.810 1.00 0.00 N ATOM 1047 CA SER A 218 -25.034 27.474 -10.395 1.00 0.00 C ATOM 1048 C SER A 218 -23.600 27.360 -10.918 1.00 0.00 C ATOM 1049 O SER A 218 -23.132 28.204 -11.676 1.00 0.00 O ATOM 1050 CB SER A 218 -25.021 27.528 -8.869 1.00 0.00 C ATOM 1051 OG SER A 218 -24.838 26.222 -8.330 1.00 0.00 O ATOM 0 H SER A 218 -26.015 25.641 -10.103 1.00 0.00 H new ATOM 0 HA SER A 218 -25.445 28.388 -10.823 1.00 0.00 H new ATOM 0 HB2 SER A 218 -24.221 28.185 -8.528 1.00 0.00 H new ATOM 0 HB3 SER A 218 -25.957 27.951 -8.505 1.00 0.00 H new ATOM 0 HG SER A 218 -24.830 26.270 -7.351 1.00 0.00 H new ATOM 1057 N LYS A 219 -22.890 26.312 -10.515 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.512 26.119 -10.978 1.00 0.00 C ATOM 1059 C LYS A 219 -21.485 25.388 -12.301 1.00 0.00 C ATOM 1060 O LYS A 219 -20.561 25.559 -13.099 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.694 25.307 -9.963 1.00 0.00 C ATOM 1062 CG LYS A 219 -19.614 26.112 -9.204 1.00 0.00 C ATOM 1063 CD LYS A 219 -18.597 26.864 -10.114 1.00 0.00 C ATOM 1064 CE LYS A 219 -17.877 25.951 -11.120 1.00 0.00 C ATOM 1065 NZ LYS A 219 -16.843 26.722 -11.901 1.00 0.00 N ATOM 0 H LYS A 219 -23.234 25.592 -9.880 1.00 0.00 H new ATOM 0 HA LYS A 219 -21.074 27.110 -11.092 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -21.377 24.868 -9.236 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -20.211 24.481 -10.485 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -20.109 26.838 -8.559 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -19.064 25.432 -8.554 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -19.122 27.649 -10.659 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -17.854 27.355 -9.485 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -17.399 25.126 -10.591 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -18.603 25.513 -11.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -16.370 26.085 -12.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -17.306 27.494 -12.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.139 27.119 -11.247 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.497 24.570 -12.518 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.605 23.764 -13.721 1.00 0.00 C ATOM 1081 C PHE A 220 -23.692 24.369 -14.556 1.00 0.00 C ATOM 1082 O PHE A 220 -24.712 24.764 -14.021 1.00 0.00 O ATOM 1083 CB PHE A 220 -22.997 22.333 -13.372 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.087 21.691 -12.380 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -22.515 21.474 -11.055 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -20.793 21.295 -12.756 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -21.654 20.878 -10.109 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -19.926 20.700 -11.820 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.357 20.497 -10.492 1.00 0.00 C ATOM 0 H PHE A 220 -23.270 24.445 -11.864 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.650 23.743 -14.247 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.013 22.329 -12.977 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.007 21.735 -14.283 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -23.512 21.767 -10.761 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -20.460 21.448 -13.772 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -21.990 20.716 -9.096 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -18.932 20.399 -12.118 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.690 20.049 -9.770 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.487 24.431 -15.855 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.485 24.976 -16.751 1.00 0.00 C ATOM 1101 C ILE A 221 -24.763 23.920 -17.809 1.00 0.00 C ATOM 1102 O ILE A 221 -23.950 23.006 -18.023 1.00 0.00 O ATOM 1103 CB ILE A 221 -24.035 26.342 -17.360 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.937 26.142 -18.417 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.526 27.281 -16.232 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.671 27.366 -19.290 1.00 0.00 C ATOM 0 H ILE A 221 -22.635 24.110 -16.315 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.404 25.203 -16.211 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.895 26.799 -17.849 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -22.012 25.862 -17.913 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -23.216 25.307 -19.059 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.214 28.232 -16.664 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.327 27.454 -15.514 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.679 26.817 -15.726 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.883 27.137 -20.007 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.581 27.636 -19.825 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -22.359 28.200 -18.662 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.908 24.034 -18.458 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.328 23.057 -19.459 1.00 0.00 C ATOM 1120 C ARG A 222 -26.372 23.690 -20.835 1.00 0.00 C ATOM 1121 O ARG A 222 -27.188 24.567 -21.103 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.704 22.506 -19.097 1.00 0.00 C ATOM 1123 CG ARG A 222 -28.173 21.378 -20.012 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.586 20.957 -19.654 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.548 22.044 -19.911 1.00 0.00 N ATOM 1126 CZ ARG A 222 -31.810 22.067 -19.502 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -32.337 21.089 -18.805 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -32.552 23.099 -19.789 1.00 0.00 N ATOM 0 H ARG A 222 -26.570 24.796 -18.312 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.605 22.241 -19.475 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.681 22.143 -18.070 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.431 23.317 -19.133 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -28.137 21.706 -21.051 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.500 20.526 -19.923 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.864 20.077 -20.234 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.628 20.672 -18.603 1.00 0.00 H new ATOM 0 HE ARG A 222 -30.216 22.845 -20.448 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -31.773 20.276 -18.560 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -33.311 21.142 -18.508 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -32.161 23.876 -20.322 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -33.524 23.130 -19.481 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.494 23.226 -21.703 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.424 23.703 -23.079 1.00 0.00 C ATOM 1144 C VAL A 223 -26.227 22.702 -23.892 1.00 0.00 C ATOM 1145 O VAL A 223 -26.176 21.491 -23.662 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.931 23.864 -23.588 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -22.967 23.209 -22.662 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -23.739 23.427 -25.057 1.00 0.00 C ATOM 0 H VAL A 223 -24.806 22.507 -21.478 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.838 24.706 -23.178 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.711 24.932 -23.578 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -21.953 23.338 -23.041 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -23.046 23.663 -21.674 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -23.195 22.145 -22.592 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -22.696 23.562 -25.343 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -24.011 22.377 -25.163 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -24.374 24.033 -25.703 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.993 23.213 -24.833 1.00 0.00 N ATOM 1159 CA GLN A 224 -27.826 22.368 -25.675 1.00 0.00 C ATOM 1160 C GLN A 224 -27.009 21.934 -26.880 1.00 0.00 C ATOM 1161 O GLN A 224 -26.109 22.646 -27.315 1.00 0.00 O ATOM 1162 CB GLN A 224 -29.078 23.122 -26.123 1.00 0.00 C ATOM 1163 CG GLN A 224 -29.927 23.609 -24.951 1.00 0.00 C ATOM 1164 CD GLN A 224 -31.296 24.091 -25.381 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -32.307 23.578 -24.930 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -31.336 25.076 -26.240 1.00 0.00 N ATOM 0 H GLN A 224 -27.059 24.210 -25.037 1.00 0.00 H new ATOM 0 HA GLN A 224 -28.149 21.493 -25.112 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -28.783 23.977 -26.732 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -29.681 22.472 -26.757 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -30.041 22.800 -24.230 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -29.405 24.419 -24.441 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -30.469 25.479 -26.595 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -32.235 25.441 -26.555 1.00 0.00 H new ATOM 1265 N SER A 232 -27.605 16.333 -23.849 1.00 0.00 N ATOM 1266 CA SER A 232 -27.072 17.665 -23.542 1.00 0.00 C ATOM 1267 C SER A 232 -25.594 17.674 -23.141 1.00 0.00 C ATOM 1268 O SER A 232 -24.988 16.643 -22.824 1.00 0.00 O ATOM 1269 CB SER A 232 -27.911 18.352 -22.458 1.00 0.00 C ATOM 1270 OG SER A 232 -29.295 18.276 -22.771 1.00 0.00 O ATOM 0 HA SER A 232 -27.139 18.223 -24.476 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.725 17.880 -21.493 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.611 19.396 -22.366 1.00 0.00 H new ATOM 0 HG SER A 232 -29.477 17.439 -23.247 1.00 0.00 H new ATOM 1276 N TRP A 233 -25.024 18.866 -23.152 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.650 19.079 -22.757 1.00 0.00 C ATOM 1278 C TRP A 233 -23.713 19.696 -21.375 1.00 0.00 C ATOM 1279 O TRP A 233 -24.603 20.497 -21.086 1.00 0.00 O ATOM 1280 CB TRP A 233 -23.012 20.074 -23.711 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.499 19.512 -24.972 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.934 19.801 -26.216 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.416 18.578 -25.149 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -22.224 19.140 -27.164 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -21.273 18.371 -26.552 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.544 17.906 -24.269 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -20.290 17.520 -27.093 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.548 17.049 -24.811 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.434 16.868 -26.221 1.00 0.00 C ATOM 0 H TRP A 233 -25.508 19.717 -23.438 1.00 0.00 H new ATOM 0 HA TRP A 233 -23.072 18.155 -22.768 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.747 20.843 -23.950 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -22.190 20.569 -23.194 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.749 20.477 -26.431 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -22.375 19.206 -28.171 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.631 18.040 -23.201 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -20.206 17.379 -28.160 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.871 16.530 -24.149 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.670 16.214 -26.614 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.771 19.339 -20.528 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.702 19.881 -19.186 1.00 0.00 C ATOM 1302 C TRP A 234 -21.305 20.438 -19.027 1.00 0.00 C ATOM 1303 O TRP A 234 -20.318 19.754 -19.309 1.00 0.00 O ATOM 1304 CB TRP A 234 -23.000 18.779 -18.173 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.341 18.140 -18.436 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.609 17.098 -19.270 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.617 18.523 -17.886 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -25.936 16.794 -19.287 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.594 17.637 -18.435 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -26.037 19.523 -16.985 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -27.959 17.715 -18.093 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.411 19.601 -16.634 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.356 18.689 -17.191 1.00 0.00 C ATOM 0 H TRP A 234 -22.035 18.668 -20.748 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.438 20.667 -19.016 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.218 18.020 -18.217 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -22.984 19.194 -17.165 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -23.860 16.576 -19.848 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.369 16.057 -19.844 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.324 20.219 -16.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.677 17.033 -18.523 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.743 20.358 -15.939 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.395 18.759 -16.906 1.00 0.00 H new ATOM 1324 N MET A 235 -21.219 21.685 -18.606 1.00 0.00 N ATOM 1325 CA MET A 235 -19.933 22.358 -18.463 1.00 0.00 C ATOM 1326 C MET A 235 -19.971 23.291 -17.274 1.00 0.00 C ATOM 1327 O MET A 235 -21.000 23.426 -16.627 1.00 0.00 O ATOM 1328 CB MET A 235 -19.592 23.140 -19.733 1.00 0.00 C ATOM 1329 CG MET A 235 -20.519 24.274 -20.047 1.00 0.00 C ATOM 1330 SD MET A 235 -20.005 25.151 -21.539 1.00 0.00 S ATOM 1331 CE MET A 235 -18.562 26.067 -20.925 1.00 0.00 C ATOM 0 H MET A 235 -22.025 22.258 -18.355 1.00 0.00 H new ATOM 0 HA MET A 235 -19.161 21.605 -18.303 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.580 23.534 -19.638 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.588 22.450 -20.577 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.532 23.893 -20.178 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.546 24.967 -19.206 1.00 0.00 H new ATOM 0 HE1 MET A 235 -18.166 26.699 -21.720 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.858 26.690 -20.081 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.794 25.363 -20.605 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.855 23.937 -16.987 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.782 24.879 -15.880 1.00 0.00 C ATOM 1343 C LEU A 236 -19.194 26.238 -16.430 1.00 0.00 C ATOM 1344 O LEU A 236 -19.040 26.479 -17.620 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.347 24.945 -15.335 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.718 23.591 -14.949 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.258 23.768 -14.548 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.473 22.884 -13.826 1.00 0.00 C ATOM 0 H LEU A 236 -17.984 23.827 -17.506 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.435 24.572 -15.063 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.714 25.419 -16.085 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.340 25.592 -14.458 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.784 22.961 -15.836 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.834 22.800 -14.280 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.700 24.189 -15.384 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.195 24.441 -13.693 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -16.983 21.937 -13.598 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.476 23.514 -12.937 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.500 22.695 -14.140 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.700 27.123 -15.585 1.00 0.00 N ATOM 1361 CA ASN A 237 -20.043 28.477 -16.035 1.00 0.00 C ATOM 1362 C ASN A 237 -18.734 29.140 -16.526 1.00 0.00 C ATOM 1363 O ASN A 237 -17.752 29.149 -15.788 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.674 29.275 -14.883 1.00 0.00 C ATOM 1365 CG ASN A 237 -21.124 30.659 -15.303 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -20.406 31.372 -15.975 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -22.303 31.039 -14.902 1.00 0.00 N ATOM 0 H ASN A 237 -19.883 26.940 -14.598 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.774 28.450 -16.843 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.529 28.724 -14.491 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -19.952 29.364 -14.071 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -22.653 31.964 -15.151 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -22.877 30.411 -14.339 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.704 29.682 -17.769 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.481 30.268 -18.345 1.00 0.00 C ATOM 1376 C PRO A 238 -16.870 31.433 -17.582 1.00 0.00 C ATOM 1377 O PRO A 238 -15.663 31.657 -17.644 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.956 30.791 -19.705 1.00 0.00 C ATOM 1379 CG PRO A 238 -19.149 30.029 -20.016 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.823 29.764 -18.723 1.00 0.00 C ATOM 0 HA PRO A 238 -16.695 29.513 -18.351 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -18.172 31.858 -19.662 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -17.191 30.651 -20.469 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -19.802 30.586 -20.688 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -18.894 29.097 -20.520 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.518 30.562 -18.461 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -20.397 28.838 -18.751 1.00 0.00 H new