USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=23 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 203 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 179 THR OG1 : rot 180:sc= 0.0266 USER MOD Set 2.2: A 181 SER OG : rot 59:sc= 0.161 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 14:sc= 0.88 USER MOD Single : A 168 LYS NZ :NH3+ -169:sc= -0.0308 (180deg=-0.173) USER MOD Single : A 172 SER OG : rot 84:sc= 1.24 USER MOD Single : A 173 SER OG : rot -79:sc= 1.38 USER MOD Single : A 176 LYS NZ :NH3+ 165:sc= 1.87 (180deg=1.58) USER MOD Single : A 182 GLN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 184 TYR OH : rot 50:sc= 0 USER MOD Single : A 187 MET CE :methyl -161:sc= -0.0353 (180deg=-0.342) USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 SER OG : rot 79:sc= 0.602 USER MOD Single : A 193 TYR OH : rot 180:sc= 0 USER MOD Single : A 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 202 SER OG : rot 53:sc= 1.25 USER MOD Single : A 208 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 209 SER OG : rot 79:sc= 1.12 USER MOD Single : A 212 HIS : no HD1:sc= -0.0801 X(o=-0.08,f=-0.12) USER MOD Single : A 213 ASN : amide:sc= 0.401 K(o=0.4,f=-1.1) USER MOD Single : A 215 SER OG : rot 74:sc= 0.969 USER MOD Single : A 217 HIS : no HE2:sc= -0.0282 K(o=-0.028,f=-0.74) USER MOD Single : A 218 SER OG : rot 180:sc= 0.115 USER MOD Single : A 219 LYS NZ :NH3+ 135:sc= 0.0437 (180deg=0) USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 232 SER OG : rot 41:sc= 0.286 USER MOD Single : A 235 MET CE :methyl -114:sc= -0.239 (180deg=-0.362) USER MOD Single : A 237 ASN : amide:sc= -0.445 K(o=-0.44,f=-3.4!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -13.168 13.862 -2.047 1.00 0.00 N ATOM 117 CA LEU A 160 -13.845 14.853 -2.883 1.00 0.00 C ATOM 118 C LEU A 160 -15.334 14.571 -3.007 1.00 0.00 C ATOM 119 O LEU A 160 -15.758 13.421 -3.104 1.00 0.00 O ATOM 120 CB LEU A 160 -13.220 14.880 -4.277 1.00 0.00 C ATOM 121 CG LEU A 160 -11.793 15.432 -4.364 1.00 0.00 C ATOM 122 CD1 LEU A 160 -11.353 15.392 -5.817 1.00 0.00 C ATOM 123 CD2 LEU A 160 -11.668 16.865 -3.832 1.00 0.00 C ATOM 0 HA LEU A 160 -13.722 15.822 -2.399 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -13.220 13.864 -4.673 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.859 15.476 -4.928 1.00 0.00 H new ATOM 0 HG LEU A 160 -11.157 14.809 -3.735 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.338 15.781 -5.901 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -11.378 14.363 -6.176 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -12.027 16.003 -6.418 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.634 17.197 -3.921 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -12.313 17.526 -4.411 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -11.968 16.892 -2.785 1.00 0.00 H new ATOM 135 N SER A 161 -16.119 15.636 -3.015 1.00 0.00 N ATOM 136 CA SER A 161 -17.569 15.535 -3.125 1.00 0.00 C ATOM 137 C SER A 161 -17.959 15.311 -4.578 1.00 0.00 C ATOM 138 O SER A 161 -17.142 15.481 -5.482 1.00 0.00 O ATOM 139 CB SER A 161 -18.214 16.831 -2.630 1.00 0.00 C ATOM 140 OG SER A 161 -17.833 17.096 -1.293 1.00 0.00 O ATOM 0 H SER A 161 -15.773 16.593 -2.946 1.00 0.00 H new ATOM 0 HA SER A 161 -17.914 14.697 -2.519 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.915 17.661 -3.271 1.00 0.00 H new ATOM 0 HB3 SER A 161 -19.299 16.752 -2.696 1.00 0.00 H new ATOM 0 HG SER A 161 -18.253 17.929 -0.992 1.00 0.00 H new ATOM 146 N TYR A 162 -19.218 14.957 -4.810 1.00 0.00 N ATOM 147 CA TYR A 162 -19.709 14.747 -6.172 1.00 0.00 C ATOM 148 C TYR A 162 -19.422 15.972 -7.034 1.00 0.00 C ATOM 149 O TYR A 162 -18.906 15.842 -8.129 1.00 0.00 O ATOM 150 CB TYR A 162 -21.217 14.507 -6.171 1.00 0.00 C ATOM 151 CG TYR A 162 -21.632 13.058 -6.148 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.700 12.315 -7.342 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.972 12.421 -4.938 1.00 0.00 C ATOM 154 CE1 TYR A 162 -22.123 10.961 -7.333 1.00 0.00 C ATOM 155 CE2 TYR A 162 -22.392 11.064 -4.926 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.472 10.351 -6.123 1.00 0.00 C ATOM 157 OH TYR A 162 -22.895 9.048 -6.111 1.00 0.00 O ATOM 0 H TYR A 162 -19.915 14.810 -4.080 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.196 13.874 -6.577 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.649 15.007 -5.304 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.645 14.978 -7.056 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.427 12.782 -8.277 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.913 12.970 -4.010 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.175 10.403 -8.256 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -22.649 10.585 -3.993 1.00 0.00 H new ATOM 0 HH TYR A 162 -23.097 8.778 -5.191 1.00 0.00 H new ATOM 167 N ALA A 163 -19.745 17.157 -6.534 1.00 0.00 N ATOM 168 CA ALA A 163 -19.533 18.395 -7.285 1.00 0.00 C ATOM 169 C ALA A 163 -18.072 18.576 -7.728 1.00 0.00 C ATOM 170 O ALA A 163 -17.808 18.991 -8.858 1.00 0.00 O ATOM 171 CB ALA A 163 -19.983 19.589 -6.439 1.00 0.00 C ATOM 0 H ALA A 163 -20.156 17.291 -5.610 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.131 18.335 -8.194 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.825 20.511 -6.998 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -21.041 19.487 -6.199 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.403 19.620 -5.516 1.00 0.00 H new ATOM 177 N ASP A 164 -17.132 18.259 -6.851 1.00 0.00 N ATOM 178 CA ASP A 164 -15.711 18.412 -7.165 1.00 0.00 C ATOM 179 C ASP A 164 -15.319 17.467 -8.288 1.00 0.00 C ATOM 180 O ASP A 164 -14.579 17.822 -9.202 1.00 0.00 O ATOM 181 CB ASP A 164 -14.853 18.064 -5.950 1.00 0.00 C ATOM 182 CG ASP A 164 -15.160 18.923 -4.753 1.00 0.00 C ATOM 183 OD1 ASP A 164 -15.188 20.157 -4.893 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.385 18.349 -3.664 1.00 0.00 O ATOM 0 H ASP A 164 -17.322 17.895 -5.917 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.547 19.449 -7.459 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -15.008 17.017 -5.689 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.800 18.175 -6.211 1.00 0.00 H new ATOM 189 N LEU A 165 -15.818 16.245 -8.203 1.00 0.00 N ATOM 190 CA LEU A 165 -15.497 15.207 -9.176 1.00 0.00 C ATOM 191 C LEU A 165 -16.142 15.482 -10.531 1.00 0.00 C ATOM 192 O LEU A 165 -15.518 15.283 -11.567 1.00 0.00 O ATOM 193 CB LEU A 165 -15.960 13.855 -8.634 1.00 0.00 C ATOM 194 CG LEU A 165 -15.222 13.376 -7.371 1.00 0.00 C ATOM 195 CD1 LEU A 165 -15.940 12.170 -6.804 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.759 13.029 -7.668 1.00 0.00 C ATOM 0 H LEU A 165 -16.453 15.943 -7.464 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.418 15.199 -9.328 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.026 13.914 -8.414 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -15.837 13.105 -9.415 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.223 14.187 -6.642 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.422 11.826 -5.909 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -16.964 12.443 -6.548 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -15.952 11.372 -7.546 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.271 12.695 -6.752 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.718 12.234 -8.412 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.246 13.911 -8.051 1.00 0.00 H new ATOM 208 N ILE A 166 -17.380 15.955 -10.524 1.00 0.00 N ATOM 209 CA ILE A 166 -18.077 16.297 -11.768 1.00 0.00 C ATOM 210 C ILE A 166 -17.300 17.424 -12.440 1.00 0.00 C ATOM 211 O ILE A 166 -17.038 17.391 -13.640 1.00 0.00 O ATOM 212 CB ILE A 166 -19.539 16.776 -11.498 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.391 15.647 -10.901 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.209 17.252 -12.793 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.628 16.153 -10.145 1.00 0.00 C ATOM 0 H ILE A 166 -17.926 16.112 -9.677 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.130 15.411 -12.401 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.476 17.602 -10.789 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.711 14.981 -11.702 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.775 15.057 -10.222 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.226 17.580 -12.577 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.641 18.082 -13.213 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.237 16.432 -13.511 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.185 15.304 -9.749 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.314 16.796 -9.323 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.264 16.719 -10.826 1.00 0.00 H new ATOM 227 N THR A 167 -16.912 18.419 -11.659 1.00 0.00 N ATOM 228 CA THR A 167 -16.140 19.535 -12.186 1.00 0.00 C ATOM 229 C THR A 167 -14.806 19.062 -12.739 1.00 0.00 C ATOM 230 O THR A 167 -14.414 19.457 -13.834 1.00 0.00 O ATOM 231 CB THR A 167 -15.874 20.575 -11.094 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.107 21.156 -10.669 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.948 21.665 -11.568 1.00 0.00 C ATOM 0 H THR A 167 -17.117 18.478 -10.662 1.00 0.00 H new ATOM 0 HA THR A 167 -16.727 19.984 -12.987 1.00 0.00 H new ATOM 0 HB THR A 167 -15.392 20.061 -10.262 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.855 20.617 -11.002 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.786 22.381 -10.762 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.994 21.229 -11.863 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.393 22.175 -12.422 1.00 0.00 H new ATOM 241 N LYS A 168 -14.103 18.209 -12.004 1.00 0.00 N ATOM 242 CA LYS A 168 -12.811 17.709 -12.471 1.00 0.00 C ATOM 243 C LYS A 168 -12.952 16.972 -13.781 1.00 0.00 C ATOM 244 O LYS A 168 -12.074 17.058 -14.624 1.00 0.00 O ATOM 245 CB LYS A 168 -12.183 16.761 -11.463 1.00 0.00 C ATOM 246 CG LYS A 168 -11.372 17.439 -10.399 1.00 0.00 C ATOM 247 CD LYS A 168 -10.571 16.397 -9.640 1.00 0.00 C ATOM 248 CE LYS A 168 -9.711 17.019 -8.558 1.00 0.00 C ATOM 249 NZ LYS A 168 -8.740 18.037 -9.095 1.00 0.00 N ATOM 0 H LYS A 168 -14.398 17.852 -11.095 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.172 18.582 -12.601 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -12.973 16.181 -10.986 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.545 16.055 -11.995 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -10.703 18.173 -10.848 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -12.027 17.980 -9.716 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -11.251 15.673 -9.191 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -9.937 15.849 -10.337 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -10.355 17.493 -7.817 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -9.158 16.233 -8.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -8.058 18.291 -8.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -8.232 17.637 -9.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -9.259 18.887 -9.394 1.00 0.00 H new ATOM 263 N ALA A 169 -14.049 16.260 -13.960 1.00 0.00 N ATOM 264 CA ALA A 169 -14.282 15.542 -15.201 1.00 0.00 C ATOM 265 C ALA A 169 -14.384 16.524 -16.365 1.00 0.00 C ATOM 266 O ALA A 169 -13.795 16.320 -17.422 1.00 0.00 O ATOM 267 CB ALA A 169 -15.558 14.733 -15.084 1.00 0.00 C ATOM 0 H ALA A 169 -14.790 16.163 -13.266 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.446 14.868 -15.390 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.734 14.194 -16.015 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.463 14.021 -14.264 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.396 15.402 -14.888 1.00 0.00 H new ATOM 273 N ILE A 170 -15.129 17.596 -16.154 1.00 0.00 N ATOM 274 CA ILE A 170 -15.342 18.598 -17.191 1.00 0.00 C ATOM 275 C ILE A 170 -14.018 19.291 -17.509 1.00 0.00 C ATOM 276 O ILE A 170 -13.704 19.549 -18.664 1.00 0.00 O ATOM 277 CB ILE A 170 -16.407 19.628 -16.729 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.779 18.936 -16.578 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.515 20.773 -17.725 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.759 19.693 -15.682 1.00 0.00 C ATOM 0 H ILE A 170 -15.599 17.797 -15.271 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.710 18.113 -18.095 1.00 0.00 H new ATOM 0 HB ILE A 170 -16.099 20.033 -15.765 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.224 18.814 -17.565 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.628 17.936 -16.171 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.267 21.484 -17.382 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.551 21.276 -17.807 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.804 20.381 -18.700 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.699 19.144 -15.626 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.336 19.792 -14.682 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.942 20.684 -16.098 1.00 0.00 H new ATOM 292 N GLU A 171 -13.233 19.574 -16.484 1.00 0.00 N ATOM 293 CA GLU A 171 -11.924 20.208 -16.667 1.00 0.00 C ATOM 294 C GLU A 171 -10.960 19.303 -17.400 1.00 0.00 C ATOM 295 O GLU A 171 -10.093 19.759 -18.140 1.00 0.00 O ATOM 296 CB GLU A 171 -11.299 20.506 -15.314 1.00 0.00 C ATOM 297 CG GLU A 171 -11.986 21.568 -14.550 1.00 0.00 C ATOM 298 CD GLU A 171 -11.469 22.975 -14.885 1.00 0.00 C ATOM 299 OE1 GLU A 171 -11.566 23.869 -14.016 1.00 0.00 O ATOM 300 OE2 GLU A 171 -10.975 23.190 -16.023 1.00 0.00 O ATOM 0 H GLU A 171 -13.473 19.377 -15.512 1.00 0.00 H new ATOM 0 HA GLU A 171 -12.094 21.117 -17.244 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.293 19.592 -14.720 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.259 20.796 -15.463 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -13.056 21.521 -14.754 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -11.857 21.383 -13.484 1.00 0.00 H new ATOM 307 N SER A 172 -11.114 18.012 -17.167 1.00 0.00 N ATOM 308 CA SER A 172 -10.248 17.008 -17.794 1.00 0.00 C ATOM 309 C SER A 172 -10.517 16.930 -19.289 1.00 0.00 C ATOM 310 O SER A 172 -9.638 16.573 -20.068 1.00 0.00 O ATOM 311 CB SER A 172 -10.459 15.626 -17.173 1.00 0.00 C ATOM 312 OG SER A 172 -10.131 15.631 -15.793 1.00 0.00 O ATOM 0 H SER A 172 -11.828 17.626 -16.550 1.00 0.00 H new ATOM 0 HA SER A 172 -9.216 17.316 -17.624 1.00 0.00 H new ATOM 0 HB2 SER A 172 -11.497 15.321 -17.302 1.00 0.00 H new ATOM 0 HB3 SER A 172 -9.844 14.892 -17.694 1.00 0.00 H new ATOM 0 HG SER A 172 -10.897 15.956 -15.276 1.00 0.00 H new ATOM 318 N SER A 173 -11.731 17.272 -19.693 1.00 0.00 N ATOM 319 CA SER A 173 -12.066 17.284 -21.109 1.00 0.00 C ATOM 320 C SER A 173 -11.402 18.495 -21.761 1.00 0.00 C ATOM 321 O SER A 173 -11.383 19.586 -21.192 1.00 0.00 O ATOM 322 CB SER A 173 -13.580 17.342 -21.295 1.00 0.00 C ATOM 323 OG SER A 173 -14.080 18.653 -21.157 1.00 0.00 O ATOM 0 H SER A 173 -12.492 17.542 -19.070 1.00 0.00 H new ATOM 0 HA SER A 173 -11.703 16.371 -21.580 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.839 16.957 -22.281 1.00 0.00 H new ATOM 0 HB3 SER A 173 -14.060 16.692 -20.563 1.00 0.00 H new ATOM 0 HG SER A 173 -14.142 18.881 -20.206 1.00 0.00 H new ATOM 329 N ALA A 174 -10.863 18.316 -22.959 1.00 0.00 N ATOM 330 CA ALA A 174 -10.214 19.417 -23.668 1.00 0.00 C ATOM 331 C ALA A 174 -11.244 20.489 -24.037 1.00 0.00 C ATOM 332 O ALA A 174 -10.944 21.675 -24.079 1.00 0.00 O ATOM 333 CB ALA A 174 -9.523 18.885 -24.931 1.00 0.00 C ATOM 0 H ALA A 174 -10.860 17.427 -23.460 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.464 19.867 -23.017 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -9.041 19.709 -25.456 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -8.773 18.145 -24.651 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.264 18.423 -25.584 1.00 0.00 H new ATOM 339 N GLU A 175 -12.463 20.043 -24.298 1.00 0.00 N ATOM 340 CA GLU A 175 -13.554 20.926 -24.707 1.00 0.00 C ATOM 341 C GLU A 175 -14.193 21.681 -23.538 1.00 0.00 C ATOM 342 O GLU A 175 -15.064 22.522 -23.747 1.00 0.00 O ATOM 343 CB GLU A 175 -14.658 20.088 -25.352 1.00 0.00 C ATOM 344 CG GLU A 175 -14.235 19.233 -26.526 1.00 0.00 C ATOM 345 CD GLU A 175 -15.404 18.407 -27.040 1.00 0.00 C ATOM 346 OE1 GLU A 175 -16.410 19.007 -27.488 1.00 0.00 O ATOM 347 OE2 GLU A 175 -15.330 17.165 -26.981 1.00 0.00 O ATOM 0 H GLU A 175 -12.728 19.060 -24.233 1.00 0.00 H new ATOM 0 HA GLU A 175 -13.120 21.654 -25.393 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -15.087 19.438 -24.589 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.451 20.759 -25.682 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -13.853 19.868 -27.325 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.421 18.573 -26.227 1.00 0.00 H new ATOM 354 N LYS A 176 -13.780 21.353 -22.314 1.00 0.00 N ATOM 355 CA LYS A 176 -14.363 21.910 -21.084 1.00 0.00 C ATOM 356 C LYS A 176 -15.870 21.697 -21.005 1.00 0.00 C ATOM 357 O LYS A 176 -16.587 22.519 -20.445 1.00 0.00 O ATOM 358 CB LYS A 176 -14.016 23.396 -20.915 1.00 0.00 C ATOM 359 CG LYS A 176 -12.521 23.692 -20.925 1.00 0.00 C ATOM 360 CD LYS A 176 -11.788 22.862 -19.867 1.00 0.00 C ATOM 361 CE LYS A 176 -10.374 23.353 -19.638 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.724 22.562 -18.544 1.00 0.00 N ATOM 0 H LYS A 176 -13.026 20.688 -22.142 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.914 21.359 -20.257 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.493 23.962 -21.715 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.440 23.752 -19.976 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -12.111 23.474 -21.911 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.356 24.753 -20.738 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -12.341 22.901 -18.929 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.763 21.818 -20.179 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -9.795 23.260 -20.557 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -10.386 24.411 -19.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.697 22.723 -18.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -10.105 22.863 -17.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.919 21.550 -18.684 1.00 0.00 H new ATOM 376 N ARG A 177 -16.337 20.582 -21.552 1.00 0.00 N ATOM 377 CA ARG A 177 -17.752 20.205 -21.518 1.00 0.00 C ATOM 378 C ARG A 177 -17.797 18.696 -21.662 1.00 0.00 C ATOM 379 O ARG A 177 -16.988 18.130 -22.384 1.00 0.00 O ATOM 380 CB ARG A 177 -18.539 20.887 -22.658 1.00 0.00 C ATOM 381 CG ARG A 177 -18.053 20.535 -24.054 1.00 0.00 C ATOM 382 CD ARG A 177 -18.783 21.300 -25.132 1.00 0.00 C ATOM 383 NE ARG A 177 -18.369 20.816 -26.458 1.00 0.00 N ATOM 384 CZ ARG A 177 -18.826 21.251 -27.623 1.00 0.00 C ATOM 385 NH1 ARG A 177 -19.721 22.205 -27.720 1.00 0.00 N ATOM 386 NH2 ARG A 177 -18.363 20.707 -28.709 1.00 0.00 N ATOM 0 H ARG A 177 -15.745 19.907 -22.036 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.216 20.527 -20.586 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.590 20.612 -22.572 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.480 21.968 -22.528 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -16.985 20.742 -24.126 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -18.182 19.466 -24.221 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.859 21.178 -25.011 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -18.570 22.365 -25.041 1.00 0.00 H new ATOM 0 HE ARG A 177 -17.666 20.078 -26.483 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -20.093 22.643 -26.877 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -20.045 22.509 -28.638 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -17.666 19.965 -28.650 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -18.697 21.022 -29.620 1.00 0.00 H new ATOM 400 N LEU A 178 -18.722 18.047 -20.975 1.00 0.00 N ATOM 401 CA LEU A 178 -18.881 16.594 -21.074 1.00 0.00 C ATOM 402 C LEU A 178 -20.357 16.231 -21.042 1.00 0.00 C ATOM 403 O LEU A 178 -21.172 16.966 -20.499 1.00 0.00 O ATOM 404 CB LEU A 178 -18.178 15.883 -19.909 1.00 0.00 C ATOM 405 CG LEU A 178 -16.647 15.707 -19.958 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.236 14.807 -18.825 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.176 15.085 -21.289 1.00 0.00 C ATOM 0 H LEU A 178 -19.379 18.499 -20.339 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.432 16.272 -22.014 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.418 16.429 -18.997 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.621 14.892 -19.813 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.187 16.691 -19.872 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.155 14.670 -18.843 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.529 15.258 -17.877 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.726 13.839 -18.933 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.091 14.980 -21.278 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.634 14.104 -21.414 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.470 15.731 -22.116 1.00 0.00 H new ATOM 419 N THR A 179 -20.703 15.089 -21.612 1.00 0.00 N ATOM 420 CA THR A 179 -22.074 14.588 -21.550 1.00 0.00 C ATOM 421 C THR A 179 -22.185 13.791 -20.257 1.00 0.00 C ATOM 422 O THR A 179 -21.170 13.449 -19.653 1.00 0.00 O ATOM 423 CB THR A 179 -22.389 13.662 -22.738 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.404 12.629 -22.802 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.365 14.426 -24.051 1.00 0.00 C ATOM 0 H THR A 179 -20.057 14.488 -22.124 1.00 0.00 H new ATOM 0 HA THR A 179 -22.777 15.420 -21.587 1.00 0.00 H new ATOM 0 HB THR A 179 -23.385 13.244 -22.588 1.00 0.00 H new ATOM 0 HG1 THR A 179 -21.601 12.035 -23.556 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.591 13.746 -24.872 1.00 0.00 H new ATOM 0 HG22 THR A 179 -23.110 15.221 -24.023 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.377 14.860 -24.201 1.00 0.00 H new ATOM 433 N LEU A 180 -23.401 13.476 -19.826 1.00 0.00 N ATOM 434 CA LEU A 180 -23.588 12.722 -18.579 1.00 0.00 C ATOM 435 C LEU A 180 -22.840 11.387 -18.597 1.00 0.00 C ATOM 436 O LEU A 180 -22.249 10.997 -17.602 1.00 0.00 O ATOM 437 CB LEU A 180 -25.079 12.473 -18.318 1.00 0.00 C ATOM 438 CG LEU A 180 -25.796 13.519 -17.441 1.00 0.00 C ATOM 439 CD1 LEU A 180 -27.308 13.266 -17.458 1.00 0.00 C ATOM 440 CD2 LEU A 180 -25.305 13.487 -15.989 1.00 0.00 C ATOM 0 H LEU A 180 -24.265 13.724 -20.309 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.173 13.330 -17.775 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.592 12.421 -19.278 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.187 11.497 -17.845 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.568 14.500 -17.858 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -27.808 14.009 -16.836 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -27.678 13.340 -18.481 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -27.514 12.269 -17.069 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -25.837 14.240 -15.408 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -25.492 12.501 -15.563 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -24.236 13.697 -15.962 1.00 0.00 H new ATOM 452 N SER A 181 -22.856 10.699 -19.731 1.00 0.00 N ATOM 453 CA SER A 181 -22.185 9.405 -19.858 1.00 0.00 C ATOM 454 C SER A 181 -20.677 9.518 -19.661 1.00 0.00 C ATOM 455 O SER A 181 -20.054 8.656 -19.051 1.00 0.00 O ATOM 456 CB SER A 181 -22.469 8.840 -21.244 1.00 0.00 C ATOM 457 OG SER A 181 -22.943 9.874 -22.098 1.00 0.00 O ATOM 0 H SER A 181 -23.326 11.013 -20.580 1.00 0.00 H new ATOM 0 HA SER A 181 -22.571 8.746 -19.080 1.00 0.00 H new ATOM 0 HB2 SER A 181 -21.563 8.399 -21.660 1.00 0.00 H new ATOM 0 HB3 SER A 181 -23.210 8.043 -21.177 1.00 0.00 H new ATOM 0 HG SER A 181 -22.275 10.589 -22.148 1.00 0.00 H new ATOM 463 N GLN A 182 -20.099 10.592 -20.171 1.00 0.00 N ATOM 464 CA GLN A 182 -18.662 10.812 -20.063 1.00 0.00 C ATOM 465 C GLN A 182 -18.247 11.077 -18.621 1.00 0.00 C ATOM 466 O GLN A 182 -17.200 10.628 -18.170 1.00 0.00 O ATOM 467 CB GLN A 182 -18.275 12.013 -20.918 1.00 0.00 C ATOM 468 CG GLN A 182 -18.108 11.710 -22.409 1.00 0.00 C ATOM 469 CD GLN A 182 -16.736 11.148 -22.747 1.00 0.00 C ATOM 470 OE1 GLN A 182 -16.240 10.253 -22.087 1.00 0.00 O ATOM 471 NE2 GLN A 182 -16.121 11.681 -23.768 1.00 0.00 N ATOM 0 H GLN A 182 -20.602 11.329 -20.666 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.152 9.913 -20.408 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.036 12.785 -20.801 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.340 12.426 -20.538 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -18.873 10.998 -22.718 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -18.272 12.623 -22.981 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -16.567 12.429 -24.298 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -15.194 11.349 -24.035 1.00 0.00 H new ATOM 480 N ILE A 183 -19.082 11.801 -17.894 1.00 0.00 N ATOM 481 CA ILE A 183 -18.804 12.109 -16.494 1.00 0.00 C ATOM 482 C ILE A 183 -18.823 10.810 -15.692 1.00 0.00 C ATOM 483 O ILE A 183 -18.006 10.622 -14.784 1.00 0.00 O ATOM 484 CB ILE A 183 -19.840 13.128 -15.951 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.695 14.450 -16.728 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.643 13.390 -14.435 1.00 0.00 C ATOM 487 CD1 ILE A 183 -20.954 15.264 -16.802 1.00 0.00 C ATOM 0 H ILE A 183 -19.958 12.188 -18.246 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.819 12.567 -16.400 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.838 12.712 -16.089 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.915 15.050 -16.259 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.360 14.228 -17.741 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.387 14.109 -14.090 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.760 12.456 -13.886 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.644 13.790 -14.262 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.764 16.177 -17.366 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.732 14.686 -17.300 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.281 15.521 -15.794 1.00 0.00 H new ATOM 499 N TYR A 184 -19.731 9.901 -16.033 1.00 0.00 N ATOM 500 CA TYR A 184 -19.776 8.608 -15.347 1.00 0.00 C ATOM 501 C TYR A 184 -18.456 7.868 -15.556 1.00 0.00 C ATOM 502 O TYR A 184 -17.835 7.413 -14.601 1.00 0.00 O ATOM 503 CB TYR A 184 -20.924 7.709 -15.845 1.00 0.00 C ATOM 504 CG TYR A 184 -22.319 8.319 -15.847 1.00 0.00 C ATOM 505 CD1 TYR A 184 -23.275 7.888 -16.789 1.00 0.00 C ATOM 506 CD2 TYR A 184 -22.703 9.310 -14.915 1.00 0.00 C ATOM 507 CE1 TYR A 184 -24.579 8.444 -16.819 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.017 9.868 -14.941 1.00 0.00 C ATOM 509 CZ TYR A 184 -24.934 9.429 -15.898 1.00 0.00 C ATOM 510 OH TYR A 184 -26.198 9.960 -15.955 1.00 0.00 O ATOM 0 H TYR A 184 -20.432 10.027 -16.763 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.946 8.818 -14.291 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -20.690 7.391 -16.861 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -20.946 6.812 -15.227 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -23.009 7.120 -17.501 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -21.994 9.649 -14.174 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -25.295 8.106 -17.553 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -24.300 10.625 -14.225 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.856 9.235 -15.985 1.00 0.00 H new ATOM 520 N GLU A 185 -18.023 7.759 -16.805 1.00 0.00 N ATOM 521 CA GLU A 185 -16.787 7.042 -17.128 1.00 0.00 C ATOM 522 C GLU A 185 -15.568 7.665 -16.466 1.00 0.00 C ATOM 523 O GLU A 185 -14.671 6.954 -16.013 1.00 0.00 O ATOM 524 CB GLU A 185 -16.569 7.010 -18.641 1.00 0.00 C ATOM 525 CG GLU A 185 -17.237 5.829 -19.322 1.00 0.00 C ATOM 526 CD GLU A 185 -16.696 4.494 -18.812 1.00 0.00 C ATOM 527 OE1 GLU A 185 -15.462 4.248 -18.919 1.00 0.00 O ATOM 528 OE2 GLU A 185 -17.501 3.693 -18.294 1.00 0.00 O ATOM 0 H GLU A 185 -18.505 8.155 -17.612 1.00 0.00 H new ATOM 0 HA GLU A 185 -16.903 6.029 -16.743 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -16.951 7.934 -19.075 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -15.499 6.980 -18.846 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -18.313 5.873 -19.152 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -17.082 5.896 -20.399 1.00 0.00 H new ATOM 535 N TRP A 186 -15.523 8.987 -16.390 1.00 0.00 N ATOM 536 CA TRP A 186 -14.392 9.660 -15.771 1.00 0.00 C ATOM 537 C TRP A 186 -14.299 9.271 -14.300 1.00 0.00 C ATOM 538 O TRP A 186 -13.205 9.025 -13.791 1.00 0.00 O ATOM 539 CB TRP A 186 -14.527 11.179 -15.904 1.00 0.00 C ATOM 540 CG TRP A 186 -13.379 11.920 -15.271 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.249 12.369 -15.872 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.248 12.300 -13.887 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.421 12.994 -14.984 1.00 0.00 N ATOM 544 CE2 TRP A 186 -11.997 12.965 -13.746 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.064 12.145 -12.752 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.547 13.467 -12.507 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.613 12.633 -11.507 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.356 13.290 -11.397 1.00 0.00 C ATOM 0 H TRP A 186 -16.249 9.609 -16.745 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.481 9.349 -16.283 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.587 11.444 -16.960 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.461 11.499 -15.441 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.031 12.247 -16.923 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.519 13.414 -15.209 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.025 11.658 -12.832 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.598 13.975 -12.426 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.229 12.506 -10.629 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -12.028 13.656 -10.435 1.00 0.00 H new ATOM 559 N MET A 187 -15.431 9.197 -13.613 1.00 0.00 N ATOM 560 CA MET A 187 -15.419 8.836 -12.195 1.00 0.00 C ATOM 561 C MET A 187 -15.035 7.374 -12.013 1.00 0.00 C ATOM 562 O MET A 187 -14.302 7.046 -11.088 1.00 0.00 O ATOM 563 CB MET A 187 -16.777 9.092 -11.550 1.00 0.00 C ATOM 564 CG MET A 187 -17.076 10.544 -11.286 1.00 0.00 C ATOM 565 SD MET A 187 -18.582 10.698 -10.320 1.00 0.00 S ATOM 566 CE MET A 187 -18.920 12.397 -10.513 1.00 0.00 C ATOM 0 H MET A 187 -16.356 9.378 -14.003 1.00 0.00 H new ATOM 0 HA MET A 187 -14.675 9.464 -11.704 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.555 8.685 -12.196 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.827 8.546 -10.608 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.244 11.004 -10.753 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.184 11.079 -12.230 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.602 12.724 -9.728 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.991 12.963 -10.445 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.379 12.568 -11.487 1.00 0.00 H new ATOM 576 N VAL A 188 -15.504 6.498 -12.894 1.00 0.00 N ATOM 577 CA VAL A 188 -15.140 5.081 -12.819 1.00 0.00 C ATOM 578 C VAL A 188 -13.627 4.952 -13.009 1.00 0.00 C ATOM 579 O VAL A 188 -12.966 4.201 -12.301 1.00 0.00 O ATOM 580 CB VAL A 188 -15.889 4.237 -13.909 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.365 2.796 -13.964 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.392 4.201 -13.620 1.00 0.00 C ATOM 0 H VAL A 188 -16.131 6.737 -13.662 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.435 4.694 -11.843 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.705 4.718 -14.869 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -15.907 2.241 -14.730 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.302 2.804 -14.205 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.514 2.318 -12.996 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -17.896 3.611 -14.386 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.564 3.749 -12.643 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.788 5.217 -13.625 1.00 0.00 H new ATOM 592 N LYS A 189 -13.066 5.691 -13.957 1.00 0.00 N ATOM 593 CA LYS A 189 -11.622 5.631 -14.207 1.00 0.00 C ATOM 594 C LYS A 189 -10.792 6.216 -13.069 1.00 0.00 C ATOM 595 O LYS A 189 -9.806 5.609 -12.641 1.00 0.00 O ATOM 596 CB LYS A 189 -11.274 6.408 -15.488 1.00 0.00 C ATOM 597 CG LYS A 189 -10.635 5.564 -16.589 1.00 0.00 C ATOM 598 CD LYS A 189 -11.663 4.678 -17.292 1.00 0.00 C ATOM 599 CE LYS A 189 -11.034 3.903 -18.447 1.00 0.00 C ATOM 600 NZ LYS A 189 -12.095 3.122 -19.186 1.00 0.00 N ATOM 0 H LYS A 189 -13.577 6.334 -14.562 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.378 4.573 -14.302 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.184 6.864 -15.879 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -10.595 7.221 -15.231 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -10.159 6.219 -17.319 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -9.850 4.941 -16.160 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -12.094 3.979 -16.575 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -12.480 5.294 -17.668 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -10.537 4.592 -19.130 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -10.270 3.224 -18.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -11.657 2.598 -19.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -12.551 2.452 -18.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -12.809 3.777 -19.564 1.00 0.00 H new ATOM 614 N SER A 190 -11.169 7.402 -12.616 1.00 0.00 N ATOM 615 CA SER A 190 -10.356 8.176 -11.676 1.00 0.00 C ATOM 616 C SER A 190 -10.599 7.964 -10.187 1.00 0.00 C ATOM 617 O SER A 190 -9.775 8.381 -9.374 1.00 0.00 O ATOM 618 CB SER A 190 -10.560 9.662 -11.969 1.00 0.00 C ATOM 619 OG SER A 190 -10.484 9.909 -13.364 1.00 0.00 O ATOM 0 H SER A 190 -12.041 7.857 -12.885 1.00 0.00 H new ATOM 0 HA SER A 190 -9.343 7.812 -11.848 1.00 0.00 H new ATOM 0 HB2 SER A 190 -11.530 9.984 -11.589 1.00 0.00 H new ATOM 0 HB3 SER A 190 -9.803 10.249 -11.448 1.00 0.00 H new ATOM 0 HG SER A 190 -11.332 9.660 -13.787 1.00 0.00 H new ATOM 625 N VAL A 191 -11.707 7.344 -9.808 1.00 0.00 N ATOM 626 CA VAL A 191 -12.017 7.154 -8.387 1.00 0.00 C ATOM 627 C VAL A 191 -12.251 5.676 -8.089 1.00 0.00 C ATOM 628 O VAL A 191 -13.117 5.047 -8.696 1.00 0.00 O ATOM 629 CB VAL A 191 -13.276 7.965 -7.968 1.00 0.00 C ATOM 630 CG1 VAL A 191 -13.498 7.876 -6.460 1.00 0.00 C ATOM 631 CG2 VAL A 191 -13.122 9.423 -8.346 1.00 0.00 C ATOM 0 H VAL A 191 -12.403 6.966 -10.451 1.00 0.00 H new ATOM 0 HA VAL A 191 -11.163 7.515 -7.814 1.00 0.00 H new ATOM 0 HB VAL A 191 -14.131 7.537 -8.491 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -14.384 8.450 -6.188 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.639 6.834 -6.174 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.630 8.280 -5.940 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -14.013 9.973 -8.044 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -12.250 9.840 -7.841 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -12.991 9.507 -9.425 1.00 0.00 H new ATOM 641 N PRO A 192 -11.490 5.096 -7.139 1.00 0.00 N ATOM 642 CA PRO A 192 -11.728 3.668 -6.892 1.00 0.00 C ATOM 643 C PRO A 192 -13.096 3.399 -6.271 1.00 0.00 C ATOM 644 O PRO A 192 -13.683 2.362 -6.508 1.00 0.00 O ATOM 645 CB PRO A 192 -10.582 3.284 -5.952 1.00 0.00 C ATOM 646 CG PRO A 192 -10.248 4.545 -5.235 1.00 0.00 C ATOM 647 CD PRO A 192 -10.422 5.630 -6.269 1.00 0.00 C ATOM 0 HA PRO A 192 -11.743 3.081 -7.810 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -10.885 2.501 -5.257 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -9.724 2.904 -6.507 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -10.907 4.702 -4.381 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -9.228 4.524 -4.851 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.709 6.578 -5.814 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.501 5.809 -6.824 1.00 0.00 H new ATOM 655 N TYR A 193 -13.611 4.352 -5.504 1.00 0.00 N ATOM 656 CA TYR A 193 -14.934 4.215 -4.901 1.00 0.00 C ATOM 657 C TYR A 193 -15.981 3.964 -5.974 1.00 0.00 C ATOM 658 O TYR A 193 -16.726 3.003 -5.911 1.00 0.00 O ATOM 659 CB TYR A 193 -15.313 5.496 -4.147 1.00 0.00 C ATOM 660 CG TYR A 193 -16.699 5.432 -3.541 1.00 0.00 C ATOM 661 CD1 TYR A 193 -16.928 4.753 -2.328 1.00 0.00 C ATOM 662 CD2 TYR A 193 -17.796 6.045 -4.187 1.00 0.00 C ATOM 663 CE1 TYR A 193 -18.234 4.683 -1.770 1.00 0.00 C ATOM 664 CE2 TYR A 193 -19.101 5.968 -3.636 1.00 0.00 C ATOM 665 CZ TYR A 193 -19.306 5.287 -2.435 1.00 0.00 C ATOM 666 OH TYR A 193 -20.570 5.212 -1.907 1.00 0.00 O ATOM 0 H TYR A 193 -13.135 5.227 -5.284 1.00 0.00 H new ATOM 0 HA TYR A 193 -14.901 3.373 -4.210 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -14.584 5.676 -3.357 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -15.259 6.344 -4.830 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -16.103 4.280 -1.816 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -17.639 6.579 -5.112 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -18.398 4.165 -0.836 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -19.932 6.434 -4.144 1.00 0.00 H new ATOM 0 HH TYR A 193 -21.198 5.685 -2.493 1.00 0.00 H new ATOM 676 N PHE A 194 -16.033 4.843 -6.961 1.00 0.00 N ATOM 677 CA PHE A 194 -17.035 4.744 -8.012 1.00 0.00 C ATOM 678 C PHE A 194 -16.801 3.563 -8.932 1.00 0.00 C ATOM 679 O PHE A 194 -17.744 3.025 -9.505 1.00 0.00 O ATOM 680 CB PHE A 194 -17.068 6.043 -8.798 1.00 0.00 C ATOM 681 CG PHE A 194 -17.855 7.113 -8.112 1.00 0.00 C ATOM 682 CD1 PHE A 194 -17.215 8.186 -7.472 1.00 0.00 C ATOM 683 CD2 PHE A 194 -19.257 7.037 -8.084 1.00 0.00 C ATOM 684 CE1 PHE A 194 -17.968 9.169 -6.796 1.00 0.00 C ATOM 685 CE2 PHE A 194 -20.019 8.009 -7.428 1.00 0.00 C ATOM 686 CZ PHE A 194 -19.370 9.082 -6.770 1.00 0.00 C ATOM 0 H PHE A 194 -15.395 5.633 -7.058 1.00 0.00 H new ATOM 0 HA PHE A 194 -18.002 4.575 -7.538 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -16.048 6.393 -8.956 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.497 5.856 -9.782 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -16.138 8.260 -7.497 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -19.755 6.215 -8.577 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -17.468 9.987 -6.299 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -21.097 7.942 -7.423 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.950 9.830 -6.250 1.00 0.00 H new ATOM 696 N LYS A 195 -15.553 3.141 -9.046 1.00 0.00 N ATOM 697 CA LYS A 195 -15.215 1.952 -9.820 1.00 0.00 C ATOM 698 C LYS A 195 -15.871 0.743 -9.159 1.00 0.00 C ATOM 699 O LYS A 195 -16.413 -0.131 -9.826 1.00 0.00 O ATOM 700 CB LYS A 195 -13.695 1.811 -9.853 1.00 0.00 C ATOM 701 CG LYS A 195 -13.151 0.815 -10.869 1.00 0.00 C ATOM 702 CD LYS A 195 -11.610 0.775 -10.828 1.00 0.00 C ATOM 703 CE LYS A 195 -10.997 2.109 -11.293 1.00 0.00 C ATOM 704 NZ LYS A 195 -9.506 2.122 -11.297 1.00 0.00 N ATOM 0 H LYS A 195 -14.754 3.603 -8.613 1.00 0.00 H new ATOM 0 HA LYS A 195 -15.578 2.027 -10.845 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.261 2.789 -10.061 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.353 1.515 -8.861 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -13.550 -0.178 -10.661 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -13.485 1.090 -11.869 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -11.278 0.555 -9.813 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -11.249 -0.033 -11.464 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -11.355 2.331 -12.298 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -11.355 2.908 -10.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -9.168 3.051 -11.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -9.155 1.942 -10.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -9.154 1.383 -11.938 1.00 0.00 H new ATOM 718 N ASP A 196 -15.838 0.725 -7.835 1.00 0.00 N ATOM 719 CA ASP A 196 -16.441 -0.352 -7.046 1.00 0.00 C ATOM 720 C ASP A 196 -17.966 -0.188 -6.934 1.00 0.00 C ATOM 721 O ASP A 196 -18.660 -1.032 -6.357 1.00 0.00 O ATOM 722 CB ASP A 196 -15.810 -0.387 -5.647 1.00 0.00 C ATOM 723 CG ASP A 196 -14.328 -0.762 -5.678 1.00 0.00 C ATOM 724 OD1 ASP A 196 -13.603 -0.388 -4.731 1.00 0.00 O ATOM 725 OD2 ASP A 196 -13.890 -1.438 -6.641 1.00 0.00 O ATOM 0 H ASP A 196 -15.395 1.452 -7.273 1.00 0.00 H new ATOM 0 HA ASP A 196 -16.247 -1.294 -7.559 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -15.924 0.590 -5.177 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -16.349 -1.104 -5.027 1.00 0.00 H new ATOM 730 N LYS A 197 -18.504 0.890 -7.500 1.00 0.00 N ATOM 731 CA LYS A 197 -19.960 1.111 -7.524 1.00 0.00 C ATOM 732 C LYS A 197 -20.485 0.894 -8.932 1.00 0.00 C ATOM 733 O LYS A 197 -21.559 1.365 -9.268 1.00 0.00 O ATOM 734 CB LYS A 197 -20.362 2.530 -7.055 1.00 0.00 C ATOM 735 CG LYS A 197 -19.999 2.944 -5.610 1.00 0.00 C ATOM 736 CD LYS A 197 -20.002 1.814 -4.567 1.00 0.00 C ATOM 737 CE LYS A 197 -21.381 1.159 -4.383 1.00 0.00 C ATOM 738 NZ LYS A 197 -21.219 -0.246 -3.873 1.00 0.00 N ATOM 0 H LYS A 197 -17.960 1.627 -7.949 1.00 0.00 H new ATOM 0 HA LYS A 197 -20.399 0.396 -6.828 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.904 3.249 -7.734 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -21.442 2.627 -7.169 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -19.009 3.399 -5.621 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -20.700 3.713 -5.286 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -19.282 1.052 -4.866 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -19.666 2.212 -3.610 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -21.979 1.742 -3.683 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -21.918 1.151 -5.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -22.156 -0.681 -3.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -20.665 -0.801 -4.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -20.724 -0.228 -2.958 1.00 0.00 H new ATOM 752 N GLY A 198 -19.731 0.171 -9.744 1.00 0.00 N ATOM 753 CA GLY A 198 -20.142 -0.103 -11.118 1.00 0.00 C ATOM 754 C GLY A 198 -21.307 -1.077 -11.254 1.00 0.00 C ATOM 755 O GLY A 198 -21.716 -1.412 -12.360 1.00 0.00 O ATOM 0 H GLY A 198 -18.834 -0.237 -9.480 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -20.416 0.838 -11.595 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -19.288 -0.501 -11.665 1.00 0.00 H new ATOM 759 N ASP A 199 -21.848 -1.522 -10.129 1.00 0.00 N ATOM 760 CA ASP A 199 -23.006 -2.417 -10.106 1.00 0.00 C ATOM 761 C ASP A 199 -24.218 -1.724 -10.753 1.00 0.00 C ATOM 762 O ASP A 199 -24.466 -0.534 -10.537 1.00 0.00 O ATOM 763 CB ASP A 199 -23.300 -2.805 -8.650 1.00 0.00 C ATOM 764 CG ASP A 199 -24.778 -3.021 -8.383 1.00 0.00 C ATOM 765 OD1 ASP A 199 -25.298 -2.344 -7.476 1.00 0.00 O ATOM 766 OD2 ASP A 199 -25.425 -3.838 -9.061 1.00 0.00 O ATOM 0 H ASP A 199 -21.499 -1.275 -9.203 1.00 0.00 H new ATOM 0 HA ASP A 199 -22.796 -3.321 -10.678 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -22.755 -3.717 -8.405 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -22.927 -2.023 -7.989 1.00 0.00 H new ATOM 771 N SER A 200 -24.964 -2.472 -11.555 1.00 0.00 N ATOM 772 CA SER A 200 -26.104 -1.935 -12.291 1.00 0.00 C ATOM 773 C SER A 200 -27.196 -1.356 -11.391 1.00 0.00 C ATOM 774 O SER A 200 -27.852 -0.389 -11.770 1.00 0.00 O ATOM 775 CB SER A 200 -26.703 -3.037 -13.165 1.00 0.00 C ATOM 776 OG SER A 200 -26.990 -4.184 -12.386 1.00 0.00 O ATOM 0 H SER A 200 -24.798 -3.466 -11.714 1.00 0.00 H new ATOM 0 HA SER A 200 -25.727 -1.111 -12.896 1.00 0.00 H new ATOM 0 HB2 SER A 200 -27.614 -2.676 -13.642 1.00 0.00 H new ATOM 0 HB3 SER A 200 -26.007 -3.296 -13.963 1.00 0.00 H new ATOM 0 HG SER A 200 -27.374 -4.880 -12.958 1.00 0.00 H new ATOM 782 N ASN A 201 -27.398 -1.913 -10.205 1.00 0.00 N ATOM 783 CA ASN A 201 -28.412 -1.367 -9.298 1.00 0.00 C ATOM 784 C ASN A 201 -27.907 -0.060 -8.683 1.00 0.00 C ATOM 785 O ASN A 201 -28.657 0.903 -8.519 1.00 0.00 O ATOM 786 CB ASN A 201 -28.747 -2.367 -8.195 1.00 0.00 C ATOM 787 CG ASN A 201 -29.909 -1.921 -7.351 1.00 0.00 C ATOM 788 OD1 ASN A 201 -30.893 -1.410 -7.853 1.00 0.00 O ATOM 789 ND2 ASN A 201 -29.805 -2.121 -6.066 1.00 0.00 N ATOM 0 H ASN A 201 -26.890 -2.723 -9.849 1.00 0.00 H new ATOM 0 HA ASN A 201 -29.319 -1.171 -9.870 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -28.976 -3.334 -8.642 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -27.873 -2.509 -7.559 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -30.565 -1.846 -5.444 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -28.964 -2.552 -5.683 1.00 0.00 H new ATOM 796 N SER A 202 -26.621 -0.020 -8.363 1.00 0.00 N ATOM 797 CA SER A 202 -25.992 1.180 -7.809 1.00 0.00 C ATOM 798 C SER A 202 -26.058 2.315 -8.817 1.00 0.00 C ATOM 799 O SER A 202 -26.033 3.489 -8.435 1.00 0.00 O ATOM 800 CB SER A 202 -24.527 0.914 -7.444 1.00 0.00 C ATOM 801 OG SER A 202 -24.421 -0.041 -6.397 1.00 0.00 O ATOM 0 H SER A 202 -25.985 -0.809 -8.477 1.00 0.00 H new ATOM 0 HA SER A 202 -26.535 1.457 -6.905 1.00 0.00 H new ATOM 0 HB2 SER A 202 -23.991 0.555 -8.322 1.00 0.00 H new ATOM 0 HB3 SER A 202 -24.051 1.846 -7.139 1.00 0.00 H new ATOM 0 HG SER A 202 -24.926 -0.846 -6.636 1.00 0.00 H new ATOM 807 N SER A 203 -26.162 1.973 -10.099 1.00 0.00 N ATOM 808 CA SER A 203 -26.266 2.970 -11.164 1.00 0.00 C ATOM 809 C SER A 203 -27.429 3.928 -10.900 1.00 0.00 C ATOM 810 O SER A 203 -27.344 5.112 -11.221 1.00 0.00 O ATOM 811 CB SER A 203 -26.453 2.306 -12.530 1.00 0.00 C ATOM 812 OG SER A 203 -26.326 3.259 -13.580 1.00 0.00 O ATOM 0 H SER A 203 -26.177 1.008 -10.428 1.00 0.00 H new ATOM 0 HA SER A 203 -25.333 3.533 -11.173 1.00 0.00 H new ATOM 0 HB2 SER A 203 -25.713 1.516 -12.659 1.00 0.00 H new ATOM 0 HB3 SER A 203 -27.435 1.834 -12.578 1.00 0.00 H new ATOM 0 HG SER A 203 -26.448 2.812 -14.444 1.00 0.00 H new ATOM 818 N ALA A 204 -28.507 3.435 -10.304 1.00 0.00 N ATOM 819 CA ALA A 204 -29.673 4.268 -10.021 1.00 0.00 C ATOM 820 C ALA A 204 -29.299 5.500 -9.172 1.00 0.00 C ATOM 821 O ALA A 204 -29.675 6.630 -9.499 1.00 0.00 O ATOM 822 CB ALA A 204 -30.748 3.427 -9.312 1.00 0.00 C ATOM 0 H ALA A 204 -28.600 2.464 -10.007 1.00 0.00 H new ATOM 0 HA ALA A 204 -30.069 4.636 -10.967 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.617 4.050 -9.102 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -31.043 2.597 -9.954 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -30.346 3.037 -8.377 1.00 0.00 H new ATOM 828 N GLY A 205 -28.552 5.285 -8.098 1.00 0.00 N ATOM 829 CA GLY A 205 -28.150 6.391 -7.236 1.00 0.00 C ATOM 830 C GLY A 205 -27.011 7.184 -7.844 1.00 0.00 C ATOM 831 O GLY A 205 -26.888 8.388 -7.636 1.00 0.00 O ATOM 0 H GLY A 205 -28.215 4.368 -7.804 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -29.002 7.049 -7.065 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.846 6.004 -6.263 1.00 0.00 H new ATOM 835 N TRP A 206 -26.190 6.495 -8.619 1.00 0.00 N ATOM 836 CA TRP A 206 -25.030 7.077 -9.302 1.00 0.00 C ATOM 837 C TRP A 206 -25.431 8.257 -10.189 1.00 0.00 C ATOM 838 O TRP A 206 -24.927 9.373 -10.043 1.00 0.00 O ATOM 839 CB TRP A 206 -24.529 5.977 -10.231 1.00 0.00 C ATOM 840 CG TRP A 206 -23.154 5.535 -10.194 1.00 0.00 C ATOM 841 CD1 TRP A 206 -22.701 4.354 -9.721 1.00 0.00 C ATOM 842 CD2 TRP A 206 -22.016 6.179 -10.775 1.00 0.00 C ATOM 843 NE1 TRP A 206 -21.380 4.191 -9.969 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.922 5.280 -10.645 1.00 0.00 C ATOM 845 CE3 TRP A 206 -21.811 7.414 -11.417 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.660 5.557 -11.170 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -20.530 7.711 -11.918 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.470 6.769 -11.800 1.00 0.00 C ATOM 0 H TRP A 206 -26.307 5.498 -8.799 1.00 0.00 H new ATOM 0 HA TRP A 206 -24.300 7.427 -8.573 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -25.150 5.100 -10.050 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.731 6.305 -11.251 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -23.316 3.629 -9.208 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -20.820 3.384 -9.694 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -22.621 8.120 -11.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.854 4.843 -11.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -20.350 8.662 -12.396 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -18.500 7.007 -12.211 1.00 0.00 H new ATOM 859 N LYS A 207 -26.359 8.008 -11.109 1.00 0.00 N ATOM 860 CA LYS A 207 -26.780 9.036 -12.062 1.00 0.00 C ATOM 861 C LYS A 207 -27.622 10.106 -11.395 1.00 0.00 C ATOM 862 O LYS A 207 -27.545 11.277 -11.761 1.00 0.00 O ATOM 863 CB LYS A 207 -27.492 8.409 -13.282 1.00 0.00 C ATOM 864 CG LYS A 207 -28.797 7.644 -12.996 1.00 0.00 C ATOM 865 CD LYS A 207 -28.812 6.251 -13.659 1.00 0.00 C ATOM 866 CE LYS A 207 -28.921 6.266 -15.172 1.00 0.00 C ATOM 867 NZ LYS A 207 -28.851 4.836 -15.666 1.00 0.00 N ATOM 0 H LYS A 207 -26.832 7.111 -11.216 1.00 0.00 H new ATOM 0 HA LYS A 207 -25.883 9.531 -12.433 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -27.711 9.204 -13.995 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -26.796 7.726 -13.770 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -28.923 7.533 -11.919 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -29.644 8.226 -13.358 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -27.901 5.722 -13.380 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -29.648 5.681 -13.254 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -29.858 6.729 -15.481 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -28.115 6.858 -15.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -28.924 4.823 -16.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -27.946 4.413 -15.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -29.635 4.289 -15.257 1.00 0.00 H new ATOM 881 N ASN A 208 -28.420 9.718 -10.412 1.00 0.00 N ATOM 882 CA ASN A 208 -29.281 10.678 -9.734 1.00 0.00 C ATOM 883 C ASN A 208 -28.473 11.669 -8.909 1.00 0.00 C ATOM 884 O ASN A 208 -28.771 12.852 -8.900 1.00 0.00 O ATOM 885 CB ASN A 208 -30.282 9.964 -8.829 1.00 0.00 C ATOM 886 CG ASN A 208 -31.354 10.895 -8.328 1.00 0.00 C ATOM 887 OD1 ASN A 208 -31.927 11.649 -9.093 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.620 10.857 -7.052 1.00 0.00 N ATOM 0 H ASN A 208 -28.490 8.760 -10.069 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.819 11.227 -10.507 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.743 9.142 -9.376 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.756 9.527 -7.980 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -32.332 11.474 -6.661 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -31.117 10.210 -6.445 1.00 0.00 H new ATOM 895 N SER A 209 -27.443 11.196 -8.224 1.00 0.00 N ATOM 896 CA SER A 209 -26.636 12.080 -7.385 1.00 0.00 C ATOM 897 C SER A 209 -25.860 13.091 -8.218 1.00 0.00 C ATOM 898 O SER A 209 -25.714 14.246 -7.816 1.00 0.00 O ATOM 899 CB SER A 209 -25.672 11.267 -6.536 1.00 0.00 C ATOM 900 OG SER A 209 -26.381 10.338 -5.737 1.00 0.00 O ATOM 0 H SER A 209 -27.146 10.220 -8.229 1.00 0.00 H new ATOM 0 HA SER A 209 -27.319 12.629 -6.736 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.967 10.740 -7.179 1.00 0.00 H new ATOM 0 HB3 SER A 209 -25.088 11.932 -5.900 1.00 0.00 H new ATOM 0 HG SER A 209 -26.640 9.567 -6.284 1.00 0.00 H new ATOM 906 N ILE A 210 -25.375 12.677 -9.382 1.00 0.00 N ATOM 907 CA ILE A 210 -24.666 13.601 -10.268 1.00 0.00 C ATOM 908 C ILE A 210 -25.658 14.646 -10.759 1.00 0.00 C ATOM 909 O ILE A 210 -25.357 15.830 -10.754 1.00 0.00 O ATOM 910 CB ILE A 210 -23.972 12.861 -11.458 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.796 12.039 -10.899 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.498 13.855 -12.549 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.199 11.030 -11.855 1.00 0.00 C ATOM 0 H ILE A 210 -25.456 11.723 -9.734 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.863 14.086 -9.713 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.689 12.196 -11.939 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -22.010 12.727 -10.586 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -23.134 11.513 -10.006 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -23.021 13.305 -13.360 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.355 14.404 -12.938 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.784 14.556 -12.117 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.379 10.505 -11.365 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -22.964 10.312 -12.151 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.823 11.545 -12.739 1.00 0.00 H new ATOM 925 N ARG A 211 -26.852 14.225 -11.158 1.00 0.00 N ATOM 926 CA ARG A 211 -27.869 15.176 -11.621 1.00 0.00 C ATOM 927 C ARG A 211 -28.279 16.141 -10.517 1.00 0.00 C ATOM 928 O ARG A 211 -28.479 17.322 -10.770 1.00 0.00 O ATOM 929 CB ARG A 211 -29.101 14.436 -12.135 1.00 0.00 C ATOM 930 CG ARG A 211 -28.941 13.909 -13.552 1.00 0.00 C ATOM 931 CD ARG A 211 -30.237 13.273 -14.010 1.00 0.00 C ATOM 932 NE ARG A 211 -30.219 12.927 -15.440 1.00 0.00 N ATOM 933 CZ ARG A 211 -31.262 12.466 -16.124 1.00 0.00 C ATOM 934 NH1 ARG A 211 -32.431 12.263 -15.567 1.00 0.00 N ATOM 935 NH2 ARG A 211 -31.125 12.216 -17.397 1.00 0.00 N ATOM 0 H ARG A 211 -27.142 13.247 -11.173 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.426 15.752 -12.434 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -29.320 13.602 -11.468 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -29.960 15.106 -12.099 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -28.667 14.722 -14.224 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -28.133 13.178 -13.589 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -30.424 12.373 -13.424 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -31.063 13.957 -13.815 1.00 0.00 H new ATOM 0 HE ARG A 211 -29.341 13.050 -15.944 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -32.564 12.460 -14.575 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -33.207 11.908 -16.125 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -30.227 12.375 -17.854 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -31.916 11.862 -17.935 1.00 0.00 H new ATOM 949 N HIS A 212 -28.392 15.646 -9.296 1.00 0.00 N ATOM 950 CA HIS A 212 -28.750 16.497 -8.168 1.00 0.00 C ATOM 951 C HIS A 212 -27.658 17.543 -7.942 1.00 0.00 C ATOM 952 O HIS A 212 -27.944 18.716 -7.769 1.00 0.00 O ATOM 953 CB HIS A 212 -28.946 15.647 -6.907 1.00 0.00 C ATOM 954 CG HIS A 212 -29.690 16.349 -5.814 1.00 0.00 C ATOM 955 ND1 HIS A 212 -29.723 15.932 -4.507 1.00 0.00 N ATOM 956 CD2 HIS A 212 -30.467 17.471 -5.844 1.00 0.00 C ATOM 957 CE1 HIS A 212 -30.490 16.773 -3.819 1.00 0.00 C ATOM 958 NE2 HIS A 212 -30.973 17.728 -4.587 1.00 0.00 N ATOM 0 H HIS A 212 -28.243 14.665 -9.059 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.687 17.008 -8.389 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -29.484 14.737 -7.174 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -27.970 15.341 -6.531 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -30.657 18.069 -6.723 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -30.692 16.684 -2.762 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -31.589 18.493 -4.311 1.00 0.00 H new ATOM 966 N ASN A 213 -26.401 17.120 -7.967 1.00 0.00 N ATOM 967 CA ASN A 213 -25.284 18.047 -7.759 1.00 0.00 C ATOM 968 C ASN A 213 -25.178 19.052 -8.904 1.00 0.00 C ATOM 969 O ASN A 213 -24.832 20.203 -8.679 1.00 0.00 O ATOM 970 CB ASN A 213 -23.966 17.285 -7.624 1.00 0.00 C ATOM 971 CG ASN A 213 -23.676 16.880 -6.202 1.00 0.00 C ATOM 972 OD1 ASN A 213 -22.807 17.442 -5.557 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.386 15.902 -5.710 1.00 0.00 N ATOM 0 H ASN A 213 -26.125 16.151 -8.127 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.480 18.591 -6.835 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -23.999 16.395 -8.252 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.151 17.907 -7.995 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -24.222 15.583 -4.755 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -25.105 15.456 -6.280 1.00 0.00 H new ATOM 980 N LEU A 214 -25.487 18.618 -10.119 1.00 0.00 N ATOM 981 CA LEU A 214 -25.475 19.507 -11.286 1.00 0.00 C ATOM 982 C LEU A 214 -26.523 20.605 -11.124 1.00 0.00 C ATOM 983 O LEU A 214 -26.337 21.714 -11.594 1.00 0.00 O ATOM 984 CB LEU A 214 -25.774 18.722 -12.575 1.00 0.00 C ATOM 985 CG LEU A 214 -24.625 17.919 -13.210 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.187 16.972 -14.272 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.587 18.832 -13.847 1.00 0.00 C ATOM 0 H LEU A 214 -25.750 17.655 -10.328 1.00 0.00 H new ATOM 0 HA LEU A 214 -24.482 19.950 -11.357 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.589 18.030 -12.364 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.140 19.428 -13.320 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.137 17.351 -12.418 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.372 16.404 -14.721 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -25.896 16.286 -13.809 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.694 17.551 -15.044 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -22.792 18.229 -14.285 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.059 19.431 -14.626 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.167 19.491 -13.087 1.00 0.00 H new ATOM 999 N SER A 215 -27.626 20.277 -10.466 1.00 0.00 N ATOM 1000 CA SER A 215 -28.716 21.232 -10.267 1.00 0.00 C ATOM 1001 C SER A 215 -28.483 22.168 -9.077 1.00 0.00 C ATOM 1002 O SER A 215 -28.835 23.339 -9.127 1.00 0.00 O ATOM 1003 CB SER A 215 -30.023 20.471 -10.046 1.00 0.00 C ATOM 1004 OG SER A 215 -30.238 19.529 -11.089 1.00 0.00 O ATOM 0 H SER A 215 -27.793 19.357 -10.059 1.00 0.00 H new ATOM 0 HA SER A 215 -28.764 21.849 -11.164 1.00 0.00 H new ATOM 0 HB2 SER A 215 -29.992 19.957 -9.085 1.00 0.00 H new ATOM 0 HB3 SER A 215 -30.856 21.173 -10.006 1.00 0.00 H new ATOM 0 HG SER A 215 -29.628 18.770 -10.976 1.00 0.00 H new ATOM 1010 N LEU A 216 -27.906 21.643 -8.003 1.00 0.00 N ATOM 1011 CA LEU A 216 -27.668 22.437 -6.792 1.00 0.00 C ATOM 1012 C LEU A 216 -26.486 23.385 -6.933 1.00 0.00 C ATOM 1013 O LEU A 216 -26.518 24.517 -6.460 1.00 0.00 O ATOM 1014 CB LEU A 216 -27.372 21.513 -5.604 1.00 0.00 C ATOM 1015 CG LEU A 216 -28.524 20.659 -5.055 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -27.954 19.682 -4.027 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -29.613 21.518 -4.411 1.00 0.00 C ATOM 0 H LEU A 216 -27.593 20.674 -7.940 1.00 0.00 H new ATOM 0 HA LEU A 216 -28.574 23.021 -6.631 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.566 20.840 -5.896 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -26.993 22.128 -4.788 1.00 0.00 H new ATOM 0 HG LEU A 216 -28.986 20.121 -5.883 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -28.759 19.066 -3.625 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -27.212 19.043 -4.505 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -27.485 20.239 -3.216 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -30.409 20.875 -4.036 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -29.186 22.087 -3.585 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -30.021 22.205 -5.153 1.00 0.00 H new ATOM 1029 N HIS A 217 -25.427 22.913 -7.566 1.00 0.00 N ATOM 1030 CA HIS A 217 -24.212 23.697 -7.691 1.00 0.00 C ATOM 1031 C HIS A 217 -24.281 24.525 -8.971 1.00 0.00 C ATOM 1032 O HIS A 217 -23.957 24.045 -10.053 1.00 0.00 O ATOM 1033 CB HIS A 217 -23.002 22.760 -7.685 1.00 0.00 C ATOM 1034 CG HIS A 217 -21.689 23.456 -7.510 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -20.495 22.983 -7.992 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -21.373 24.614 -6.862 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -19.534 23.824 -7.627 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -20.014 24.844 -6.946 1.00 0.00 N ATOM 0 H HIS A 217 -25.384 21.991 -8.001 1.00 0.00 H new ATOM 0 HA HIS A 217 -24.109 24.382 -6.850 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -23.124 22.032 -6.883 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -22.983 22.203 -8.622 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -20.367 22.131 -8.538 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -22.081 25.256 -6.358 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -18.488 23.688 -7.860 1.00 0.00 H new ATOM 1046 N SER A 218 -24.696 25.778 -8.828 1.00 0.00 N ATOM 1047 CA SER A 218 -24.866 26.721 -9.946 1.00 0.00 C ATOM 1048 C SER A 218 -23.604 27.003 -10.771 1.00 0.00 C ATOM 1049 O SER A 218 -23.643 27.716 -11.771 1.00 0.00 O ATOM 1050 CB SER A 218 -25.387 28.035 -9.380 1.00 0.00 C ATOM 1051 OG SER A 218 -25.995 27.798 -8.119 1.00 0.00 O ATOM 0 H SER A 218 -24.930 26.182 -7.921 1.00 0.00 H new ATOM 0 HA SER A 218 -25.562 26.247 -10.638 1.00 0.00 H new ATOM 0 HB2 SER A 218 -24.569 28.747 -9.273 1.00 0.00 H new ATOM 0 HB3 SER A 218 -26.108 28.479 -10.066 1.00 0.00 H new ATOM 0 HG SER A 218 -26.329 28.643 -7.753 1.00 0.00 H new ATOM 1057 N LYS A 219 -22.485 26.426 -10.357 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.245 26.505 -11.114 1.00 0.00 C ATOM 1059 C LYS A 219 -21.433 25.755 -12.429 1.00 0.00 C ATOM 1060 O LYS A 219 -20.791 26.074 -13.428 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.117 25.854 -10.307 1.00 0.00 C ATOM 1062 CG LYS A 219 -18.763 25.788 -11.010 1.00 0.00 C ATOM 1063 CD LYS A 219 -18.154 27.161 -11.259 1.00 0.00 C ATOM 1064 CE LYS A 219 -17.080 27.032 -12.305 1.00 0.00 C ATOM 1065 NZ LYS A 219 -16.379 28.310 -12.562 1.00 0.00 N ATOM 0 H LYS A 219 -22.411 25.892 -9.491 1.00 0.00 H new ATOM 0 HA LYS A 219 -20.989 27.546 -11.312 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -19.996 26.404 -9.374 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -20.420 24.841 -10.043 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -18.075 25.196 -10.407 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -18.879 25.270 -11.962 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -18.922 27.860 -11.591 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -17.736 27.561 -10.336 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -16.356 26.282 -11.986 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -17.524 26.672 -13.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -15.353 28.142 -12.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -16.700 28.706 -13.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.591 28.982 -11.797 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.299 24.757 -12.423 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.559 23.967 -13.613 1.00 0.00 C ATOM 1081 C PHE A 220 -23.621 24.631 -14.468 1.00 0.00 C ATOM 1082 O PHE A 220 -24.609 25.143 -13.957 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.047 22.577 -13.224 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.067 21.807 -12.393 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -20.805 21.467 -12.906 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -22.402 21.403 -11.091 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -19.887 20.735 -12.126 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -21.496 20.656 -10.308 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.238 20.330 -10.826 1.00 0.00 C ATOM 0 H PHE A 220 -22.836 24.474 -11.603 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.630 23.890 -14.177 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -23.983 22.671 -12.673 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.266 22.011 -14.130 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -20.535 21.769 -13.907 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -23.366 21.667 -10.683 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -18.915 20.486 -12.526 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -21.773 20.338 -9.314 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.537 19.767 -10.228 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.417 24.604 -15.774 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.388 25.129 -16.722 1.00 0.00 C ATOM 1101 C ILE A 221 -24.633 24.019 -17.742 1.00 0.00 C ATOM 1102 O ILE A 221 -23.821 23.089 -17.870 1.00 0.00 O ATOM 1103 CB ILE A 221 -23.898 26.460 -17.408 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.760 26.198 -18.409 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.412 27.462 -16.345 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.394 27.412 -19.287 1.00 0.00 C ATOM 0 H ILE A 221 -22.577 24.219 -16.207 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.311 25.403 -16.212 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.747 26.876 -17.950 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -21.874 25.882 -17.859 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -23.045 25.369 -19.057 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.076 28.377 -16.834 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.230 27.694 -15.663 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.585 27.026 -15.785 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.584 27.141 -19.964 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.265 27.717 -19.868 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -22.075 28.238 -18.651 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.732 24.110 -18.473 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.067 23.117 -19.492 1.00 0.00 C ATOM 1120 C ARG A 222 -26.027 23.832 -20.828 1.00 0.00 C ATOM 1121 O ARG A 222 -26.678 24.857 -20.995 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.455 22.533 -19.227 1.00 0.00 C ATOM 1123 CG ARG A 222 -27.815 21.368 -20.143 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.262 20.928 -19.926 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.214 21.975 -20.340 1.00 0.00 N ATOM 1126 CZ ARG A 222 -30.727 22.117 -21.559 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -30.447 21.300 -22.547 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -31.543 23.108 -21.787 1.00 0.00 N ATOM 0 H ARG A 222 -26.413 24.864 -18.382 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.362 22.286 -19.480 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.507 22.198 -18.191 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.199 23.320 -19.345 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -27.672 21.661 -21.183 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.144 20.530 -19.953 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.454 20.016 -20.491 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.417 20.690 -18.874 1.00 0.00 H new ATOM 0 HE ARG A 222 -30.504 22.648 -19.631 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -29.812 20.516 -22.396 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -30.865 21.449 -23.466 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -31.778 23.758 -21.037 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -31.946 23.233 -22.715 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.260 23.300 -21.764 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.070 23.926 -23.064 1.00 0.00 C ATOM 1144 C VAL A 223 -25.661 23.047 -24.162 1.00 0.00 C ATOM 1145 O VAL A 223 -25.656 21.811 -24.073 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.572 24.352 -23.275 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -22.651 23.250 -23.463 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -23.436 25.315 -24.439 1.00 0.00 C ATOM 0 H VAL A 223 -24.752 22.424 -21.646 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.625 24.863 -23.114 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.293 24.838 -22.340 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -21.642 23.639 -23.601 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -22.674 22.603 -22.586 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -22.943 22.678 -24.344 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -22.389 25.592 -24.561 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -23.793 24.836 -25.351 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -24.028 26.209 -24.243 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.224 23.697 -25.170 1.00 0.00 N ATOM 1159 CA GLN A 224 -26.852 23.009 -26.289 1.00 0.00 C ATOM 1160 C GLN A 224 -25.857 22.079 -26.978 1.00 0.00 C ATOM 1161 O GLN A 224 -24.658 22.340 -27.026 1.00 0.00 O ATOM 1162 CB GLN A 224 -27.373 24.029 -27.305 1.00 0.00 C ATOM 1163 CG GLN A 224 -28.542 24.862 -26.794 1.00 0.00 C ATOM 1164 CD GLN A 224 -28.917 25.969 -27.754 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -28.568 27.111 -27.545 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -29.624 25.635 -28.801 1.00 0.00 N ATOM 0 H GLN A 224 -26.259 24.714 -25.236 1.00 0.00 H new ATOM 0 HA GLN A 224 -27.682 22.418 -25.902 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -26.559 24.697 -27.586 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -27.681 23.503 -28.209 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -29.404 24.215 -26.633 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -28.283 25.294 -25.827 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -29.898 24.663 -28.942 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -29.901 26.346 -29.477 1.00 0.00 H new ATOM 1265 N SER A 232 -27.436 16.427 -23.819 1.00 0.00 N ATOM 1266 CA SER A 232 -26.897 17.769 -23.551 1.00 0.00 C ATOM 1267 C SER A 232 -25.434 17.763 -23.116 1.00 0.00 C ATOM 1268 O SER A 232 -24.863 16.721 -22.787 1.00 0.00 O ATOM 1269 CB SER A 232 -27.747 18.505 -22.511 1.00 0.00 C ATOM 1270 OG SER A 232 -29.114 18.526 -22.897 1.00 0.00 O ATOM 0 HA SER A 232 -26.942 18.299 -24.502 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.646 18.017 -21.542 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.382 19.525 -22.394 1.00 0.00 H new ATOM 0 HG SER A 232 -29.360 17.657 -23.279 1.00 0.00 H new ATOM 1276 N TRP A 233 -24.826 18.939 -23.121 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.460 19.092 -22.679 1.00 0.00 C ATOM 1278 C TRP A 233 -23.588 19.723 -21.314 1.00 0.00 C ATOM 1279 O TRP A 233 -24.448 20.582 -21.108 1.00 0.00 O ATOM 1280 CB TRP A 233 -22.759 20.085 -23.569 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.214 19.605 -24.855 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.534 20.073 -26.081 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.197 18.610 -25.076 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -21.818 19.464 -27.058 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -20.977 18.549 -26.485 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.436 17.778 -24.233 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -20.027 17.686 -27.064 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.475 16.907 -24.811 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.284 16.874 -26.225 1.00 0.00 C ATOM 0 H TRP A 233 -25.267 19.805 -23.430 1.00 0.00 H new ATOM 0 HA TRP A 233 -22.912 18.150 -22.686 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.460 20.892 -23.784 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -21.937 20.520 -23.000 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.272 20.841 -26.261 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -21.894 19.656 -28.057 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.581 17.802 -23.163 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -19.882 17.658 -28.134 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.884 16.264 -24.175 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.548 16.205 -26.647 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.740 19.320 -20.395 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.727 19.882 -19.062 1.00 0.00 C ATOM 1302 C TRP A 234 -21.338 20.452 -18.922 1.00 0.00 C ATOM 1303 O TRP A 234 -20.352 19.778 -19.232 1.00 0.00 O ATOM 1304 CB TRP A 234 -23.033 18.788 -18.043 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.354 18.138 -18.356 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.584 17.111 -19.219 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.652 18.497 -17.843 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -25.906 16.799 -19.293 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.602 17.618 -18.448 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -26.113 19.472 -16.934 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -27.980 17.682 -18.162 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.500 19.537 -16.638 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.418 18.633 -17.255 1.00 0.00 C ATOM 0 H TRP A 234 -22.040 18.594 -20.550 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.480 20.652 -18.892 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.240 18.040 -18.053 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -23.058 19.213 -17.039 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -23.810 16.605 -19.778 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.312 16.072 -19.883 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.421 20.159 -16.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.677 17.007 -18.637 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.864 20.276 -15.940 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.468 18.692 -17.011 1.00 0.00 H new ATOM 1324 N MET A 235 -21.250 21.701 -18.501 1.00 0.00 N ATOM 1325 CA MET A 235 -19.968 22.379 -18.428 1.00 0.00 C ATOM 1326 C MET A 235 -19.951 23.375 -17.291 1.00 0.00 C ATOM 1327 O MET A 235 -20.941 23.549 -16.596 1.00 0.00 O ATOM 1328 CB MET A 235 -19.644 23.065 -19.759 1.00 0.00 C ATOM 1329 CG MET A 235 -20.611 24.127 -20.205 1.00 0.00 C ATOM 1330 SD MET A 235 -19.991 25.017 -21.652 1.00 0.00 S ATOM 1331 CE MET A 235 -18.630 26.004 -20.927 1.00 0.00 C ATOM 0 H MET A 235 -22.047 22.265 -18.206 1.00 0.00 H new ATOM 0 HA MET A 235 -19.198 21.633 -18.233 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.653 23.513 -19.683 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.590 22.301 -20.535 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.572 23.670 -20.441 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.784 24.830 -19.390 1.00 0.00 H new ATOM 0 HE1 MET A 235 -18.878 27.064 -20.985 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.491 25.721 -19.884 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.710 25.816 -21.480 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.814 24.016 -17.097 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.638 24.963 -16.006 1.00 0.00 C ATOM 1343 C LEU A 236 -18.929 26.373 -16.495 1.00 0.00 C ATOM 1344 O LEU A 236 -18.573 26.717 -17.617 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.191 24.882 -15.513 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.711 23.489 -15.075 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.240 23.555 -14.736 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.496 22.907 -13.894 1.00 0.00 C ATOM 0 H LEU A 236 -17.989 23.898 -17.686 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.324 24.721 -15.194 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.536 25.238 -16.308 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.074 25.567 -14.673 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.887 22.815 -15.914 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.894 22.569 -14.425 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.679 23.876 -15.613 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.085 24.267 -13.925 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -17.099 21.923 -13.643 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.400 23.568 -13.032 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.548 22.816 -14.166 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.559 27.185 -15.658 1.00 0.00 N ATOM 1361 CA ASN A 237 -19.851 28.575 -16.008 1.00 0.00 C ATOM 1362 C ASN A 237 -18.531 29.292 -16.318 1.00 0.00 C ATOM 1363 O ASN A 237 -17.619 29.323 -15.470 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.582 29.284 -14.861 1.00 0.00 C ATOM 1365 CG ASN A 237 -21.098 30.641 -15.261 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -20.381 31.430 -15.852 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -22.333 30.915 -14.955 1.00 0.00 N ATOM 0 H ASN A 237 -19.880 26.908 -14.730 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.501 28.598 -16.883 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.415 28.665 -14.527 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -19.905 29.391 -14.013 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -22.734 31.818 -15.211 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -22.900 30.227 -14.460 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.396 29.856 -17.534 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.106 30.455 -17.883 1.00 0.00 C ATOM 1376 C PRO A 238 -16.782 31.800 -17.255 1.00 0.00 C ATOM 1377 O PRO A 238 -15.642 32.038 -16.849 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.212 30.598 -19.397 1.00 0.00 C ATOM 1379 CG PRO A 238 -18.655 30.805 -19.663 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.359 29.943 -18.654 1.00 0.00 C ATOM 0 HA PRO A 238 -16.296 29.829 -17.508 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -16.620 31.440 -19.756 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -16.841 29.708 -19.904 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -18.932 31.853 -19.549 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -18.915 30.515 -20.681 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.303 30.387 -18.337 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.590 28.958 -19.060 1.00 0.00 H new