USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=25 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 208 ASN : amide:sc= -0.0033 K(o=0.89,f=-0.098) USER MOD Set 1.2: A 212 HIS : no HE2:sc= 0.897 K(o=0.89,f=-2.7!) USER MOD Set 2.1: A 179 THR OG1 : rot -71:sc= 0.902 USER MOD Set 2.2: A 182 GLN : amide:sc= 1.63 K(o=2.5,f=-3!) USER MOD Set 3.1: A 162 TYR OH : rot 110:sc= 0 USER MOD Set 3.2: A 209 SER OG : rot 180:sc= 0 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 17:sc= 0.722 USER MOD Single : A 168 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0579) USER MOD Single : A 172 SER OG : rot -24:sc= 0.3 USER MOD Single : A 173 SER OG : rot -67:sc= 1.26 USER MOD Single : A 176 LYS NZ :NH3+ -134:sc= 0.379 (180deg=0.23) USER MOD Single : A 181 SER OG : rot 180:sc= 0 USER MOD Single : A 184 TYR OH : rot 165:sc= -0.0941 USER MOD Single : A 187 MET CE :methyl -155:sc=-0.000959 (180deg=-0.526) USER MOD Single : A 189 LYS NZ :NH3+ 170:sc=-0.00147 (180deg=-0.0835) USER MOD Single : A 190 SER OG : rot -95:sc= 1.16 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+ -156:sc= 1.28 (180deg=1.21) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc= -0.189 K(o=-0.19,f=-1.9!) USER MOD Single : A 202 SER OG : rot 77:sc= 1.09 USER MOD Single : A 203 SER OG : rot 76:sc= 1.17 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 213 ASN : amide:sc= 0.351 K(o=0.35,f=-0.48) USER MOD Single : A 215 SER OG : rot 79:sc= 0.0141 USER MOD Single : A 217 HIS :FLIP no HE2:sc= 0.021 F(o=-0.59,f=0.021) USER MOD Single : A 218 SER OG : rot 180:sc=0.000507 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 25:sc= 0.238 USER MOD Single : A 235 MET CE :methyl -168:sc= -0.378 (180deg=-0.63) USER MOD Single : A 237 ASN : amide:sc= -0.555 K(o=-0.56,f=-7.6!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -13.415 13.872 -1.846 1.00 0.00 N ATOM 117 CA LEU A 160 -13.890 14.866 -2.808 1.00 0.00 C ATOM 118 C LEU A 160 -15.405 14.755 -2.954 1.00 0.00 C ATOM 119 O LEU A 160 -15.956 13.659 -3.039 1.00 0.00 O ATOM 120 CB LEU A 160 -13.229 14.641 -4.171 1.00 0.00 C ATOM 121 CG LEU A 160 -11.726 14.946 -4.242 1.00 0.00 C ATOM 122 CD1 LEU A 160 -11.134 14.346 -5.516 1.00 0.00 C ATOM 123 CD2 LEU A 160 -11.460 16.453 -4.208 1.00 0.00 C ATOM 0 HA LEU A 160 -13.629 15.860 -2.445 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -13.384 13.602 -4.462 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.741 15.259 -4.909 1.00 0.00 H new ATOM 0 HG LEU A 160 -11.250 14.498 -3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.067 14.566 -5.560 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -11.282 13.266 -5.512 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -11.630 14.777 -6.386 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.386 16.634 -4.260 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -11.950 16.928 -5.058 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -11.854 16.871 -3.282 1.00 0.00 H new ATOM 135 N SER A 161 -16.066 15.898 -2.991 1.00 0.00 N ATOM 136 CA SER A 161 -17.516 15.950 -3.123 1.00 0.00 C ATOM 137 C SER A 161 -17.913 15.589 -4.546 1.00 0.00 C ATOM 138 O SER A 161 -17.091 15.648 -5.458 1.00 0.00 O ATOM 139 CB SER A 161 -18.009 17.364 -2.814 1.00 0.00 C ATOM 140 OG SER A 161 -17.551 17.785 -1.544 1.00 0.00 O ATOM 0 H SER A 161 -15.619 16.813 -2.931 1.00 0.00 H new ATOM 0 HA SER A 161 -17.963 15.242 -2.425 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.656 18.054 -3.581 1.00 0.00 H new ATOM 0 HB3 SER A 161 -19.098 17.389 -2.840 1.00 0.00 H new ATOM 0 HG SER A 161 -17.875 18.692 -1.364 1.00 0.00 H new ATOM 146 N TYR A 162 -19.176 15.241 -4.755 1.00 0.00 N ATOM 147 CA TYR A 162 -19.650 14.936 -6.104 1.00 0.00 C ATOM 148 C TYR A 162 -19.390 16.132 -7.010 1.00 0.00 C ATOM 149 O TYR A 162 -18.893 15.965 -8.108 1.00 0.00 O ATOM 150 CB TYR A 162 -21.143 14.615 -6.111 1.00 0.00 C ATOM 151 CG TYR A 162 -21.461 13.162 -5.861 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.785 12.703 -4.567 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.455 12.232 -6.922 1.00 0.00 C ATOM 154 CE1 TYR A 162 -22.096 11.337 -4.338 1.00 0.00 C ATOM 155 CE2 TYR A 162 -21.766 10.868 -6.695 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.090 10.436 -5.405 1.00 0.00 C ATOM 157 OH TYR A 162 -22.402 9.121 -5.180 1.00 0.00 O ATOM 0 H TYR A 162 -19.882 15.163 -4.023 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.111 14.060 -6.465 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.637 15.220 -5.351 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.562 14.907 -7.074 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.797 13.399 -3.741 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.210 12.564 -7.920 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.336 10.996 -3.342 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -21.753 10.165 -7.515 1.00 0.00 H new ATOM 0 HH TYR A 162 -23.272 8.918 -5.583 1.00 0.00 H new ATOM 167 N ALA A 163 -19.709 17.334 -6.547 1.00 0.00 N ATOM 168 CA ALA A 163 -19.480 18.545 -7.336 1.00 0.00 C ATOM 169 C ALA A 163 -18.005 18.685 -7.748 1.00 0.00 C ATOM 170 O ALA A 163 -17.707 19.055 -8.883 1.00 0.00 O ATOM 171 CB ALA A 163 -19.932 19.775 -6.541 1.00 0.00 C ATOM 0 H ALA A 163 -20.126 17.500 -5.631 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.068 18.469 -8.251 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.759 20.674 -7.133 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -20.994 19.690 -6.312 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.364 19.837 -5.613 1.00 0.00 H new ATOM 177 N ASP A 164 -17.092 18.378 -6.837 1.00 0.00 N ATOM 178 CA ASP A 164 -15.659 18.489 -7.123 1.00 0.00 C ATOM 179 C ASP A 164 -15.299 17.537 -8.249 1.00 0.00 C ATOM 180 O ASP A 164 -14.583 17.883 -9.179 1.00 0.00 O ATOM 181 CB ASP A 164 -14.803 18.100 -5.906 1.00 0.00 C ATOM 182 CG ASP A 164 -15.106 18.925 -4.675 1.00 0.00 C ATOM 183 OD1 ASP A 164 -14.867 18.409 -3.560 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.586 20.063 -4.805 1.00 0.00 O ATOM 0 H ASP A 164 -17.311 18.051 -5.896 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.459 19.527 -7.389 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -14.965 17.046 -5.678 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.749 18.213 -6.160 1.00 0.00 H new ATOM 189 N LEU A 165 -15.800 16.316 -8.148 1.00 0.00 N ATOM 190 CA LEU A 165 -15.502 15.267 -9.115 1.00 0.00 C ATOM 191 C LEU A 165 -16.132 15.539 -10.479 1.00 0.00 C ATOM 192 O LEU A 165 -15.506 15.310 -11.511 1.00 0.00 O ATOM 193 CB LEU A 165 -15.999 13.932 -8.558 1.00 0.00 C ATOM 194 CG LEU A 165 -15.248 13.435 -7.312 1.00 0.00 C ATOM 195 CD1 LEU A 165 -16.012 12.291 -6.693 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.828 12.981 -7.655 1.00 0.00 C ATOM 0 H LEU A 165 -16.423 16.023 -7.396 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.423 15.238 -9.269 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.057 14.027 -8.314 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -15.919 13.176 -9.339 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.173 14.262 -6.606 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.482 11.936 -5.809 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -17.008 12.631 -6.407 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -16.099 11.479 -7.415 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.328 12.636 -6.750 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.871 12.167 -8.378 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.272 13.816 -8.081 1.00 0.00 H new ATOM 208 N ILE A 166 -17.359 16.037 -10.489 1.00 0.00 N ATOM 209 CA ILE A 166 -18.044 16.376 -11.739 1.00 0.00 C ATOM 210 C ILE A 166 -17.239 17.476 -12.425 1.00 0.00 C ATOM 211 O ILE A 166 -16.953 17.406 -13.621 1.00 0.00 O ATOM 212 CB ILE A 166 -19.498 16.875 -11.477 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.362 15.755 -10.880 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.160 17.358 -12.775 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.581 16.269 -10.109 1.00 0.00 C ATOM 0 H ILE A 166 -17.906 16.218 -9.647 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.113 15.487 -12.367 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.429 17.704 -10.772 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.700 15.100 -11.683 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.748 15.150 -10.212 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.173 17.700 -12.562 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.580 18.180 -13.195 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.198 16.537 -13.491 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.145 15.424 -9.715 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.250 16.900 -9.284 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.216 16.849 -10.778 1.00 0.00 H new ATOM 227 N THR A 167 -16.853 18.485 -11.661 1.00 0.00 N ATOM 228 CA THR A 167 -16.046 19.573 -12.195 1.00 0.00 C ATOM 229 C THR A 167 -14.714 19.056 -12.720 1.00 0.00 C ATOM 230 O THR A 167 -14.298 19.427 -13.810 1.00 0.00 O ATOM 231 CB THR A 167 -15.776 20.633 -11.118 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.009 21.226 -10.709 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.846 21.714 -11.605 1.00 0.00 C ATOM 0 H THR A 167 -17.084 18.574 -10.672 1.00 0.00 H new ATOM 0 HA THR A 167 -16.608 20.022 -13.014 1.00 0.00 H new ATOM 0 HB THR A 167 -15.296 20.130 -10.278 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.755 20.657 -10.992 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.685 22.441 -10.809 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.892 21.271 -11.891 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.288 22.213 -12.468 1.00 0.00 H new ATOM 241 N LYS A 168 -14.046 18.190 -11.966 1.00 0.00 N ATOM 242 CA LYS A 168 -12.759 17.641 -12.404 1.00 0.00 C ATOM 243 C LYS A 168 -12.887 16.884 -13.710 1.00 0.00 C ATOM 244 O LYS A 168 -11.949 16.859 -14.502 1.00 0.00 O ATOM 245 CB LYS A 168 -12.172 16.696 -11.361 1.00 0.00 C ATOM 246 CG LYS A 168 -11.499 17.377 -10.215 1.00 0.00 C ATOM 247 CD LYS A 168 -10.781 16.355 -9.375 1.00 0.00 C ATOM 248 CE LYS A 168 -10.480 16.881 -7.998 1.00 0.00 C ATOM 249 NZ LYS A 168 -9.796 18.227 -7.980 1.00 0.00 N ATOM 0 H LYS A 168 -14.366 17.853 -11.058 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.097 18.496 -12.542 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -12.970 16.063 -10.973 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.453 16.038 -11.849 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -10.793 18.121 -10.584 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -12.235 17.908 -9.611 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -11.391 15.455 -9.296 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -9.851 16.068 -9.866 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -11.412 16.953 -7.438 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -9.850 16.160 -7.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -9.518 18.462 -7.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -8.949 18.194 -8.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -10.449 18.953 -8.339 1.00 0.00 H new ATOM 263 N ALA A 169 -14.035 16.277 -13.954 1.00 0.00 N ATOM 264 CA ALA A 169 -14.248 15.572 -15.204 1.00 0.00 C ATOM 265 C ALA A 169 -14.323 16.562 -16.362 1.00 0.00 C ATOM 266 O ALA A 169 -13.690 16.367 -17.400 1.00 0.00 O ATOM 267 CB ALA A 169 -15.518 14.759 -15.129 1.00 0.00 C ATOM 0 H ALA A 169 -14.826 16.258 -13.310 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.408 14.898 -15.376 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.670 14.233 -16.072 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.439 14.035 -14.318 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.363 15.421 -14.943 1.00 0.00 H new ATOM 273 N ILE A 170 -15.090 17.626 -16.170 1.00 0.00 N ATOM 274 CA ILE A 170 -15.285 18.642 -17.206 1.00 0.00 C ATOM 275 C ILE A 170 -13.947 19.323 -17.477 1.00 0.00 C ATOM 276 O ILE A 170 -13.580 19.581 -18.618 1.00 0.00 O ATOM 277 CB ILE A 170 -16.344 19.684 -16.753 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.722 19.006 -16.587 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.445 20.825 -17.768 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.689 19.776 -15.677 1.00 0.00 C ATOM 0 H ILE A 170 -15.592 17.813 -15.302 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.650 18.172 -18.119 1.00 0.00 H new ATOM 0 HB ILE A 170 -16.031 20.096 -15.794 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.179 18.889 -17.570 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.577 18.005 -16.182 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.192 21.545 -17.433 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.478 21.320 -17.856 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.737 20.424 -18.738 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.634 19.236 -15.611 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.255 19.871 -14.682 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.866 20.768 -16.091 1.00 0.00 H new ATOM 292 N GLU A 171 -13.207 19.583 -16.416 1.00 0.00 N ATOM 293 CA GLU A 171 -11.880 20.178 -16.512 1.00 0.00 C ATOM 294 C GLU A 171 -10.927 19.280 -17.275 1.00 0.00 C ATOM 295 O GLU A 171 -10.051 19.740 -17.999 1.00 0.00 O ATOM 296 CB GLU A 171 -11.309 20.319 -15.114 1.00 0.00 C ATOM 297 CG GLU A 171 -11.719 21.537 -14.391 1.00 0.00 C ATOM 298 CD GLU A 171 -10.532 22.475 -14.216 1.00 0.00 C ATOM 299 OE1 GLU A 171 -10.308 22.944 -13.084 1.00 0.00 O ATOM 300 OE2 GLU A 171 -9.802 22.719 -15.215 1.00 0.00 O ATOM 0 H GLU A 171 -13.506 19.389 -15.460 1.00 0.00 H new ATOM 0 HA GLU A 171 -11.980 21.136 -17.023 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.606 19.450 -14.528 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.221 20.303 -15.179 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -12.513 22.043 -14.940 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -12.126 21.269 -13.416 1.00 0.00 H new ATOM 307 N SER A 172 -11.095 17.982 -17.089 1.00 0.00 N ATOM 308 CA SER A 172 -10.208 16.998 -17.706 1.00 0.00 C ATOM 309 C SER A 172 -10.506 16.799 -19.182 1.00 0.00 C ATOM 310 O SER A 172 -9.688 16.214 -19.907 1.00 0.00 O ATOM 311 CB SER A 172 -10.305 15.655 -16.991 1.00 0.00 C ATOM 312 OG SER A 172 -9.315 14.769 -17.490 1.00 0.00 O ATOM 0 H SER A 172 -11.837 17.580 -16.516 1.00 0.00 H new ATOM 0 HA SER A 172 -9.197 17.393 -17.612 1.00 0.00 H new ATOM 0 HB2 SER A 172 -10.173 15.794 -15.918 1.00 0.00 H new ATOM 0 HB3 SER A 172 -11.296 15.226 -17.137 1.00 0.00 H new ATOM 0 HG SER A 172 -9.058 15.042 -18.395 1.00 0.00 H new ATOM 318 N SER A 173 -11.660 17.263 -19.630 1.00 0.00 N ATOM 319 CA SER A 173 -11.994 17.212 -21.048 1.00 0.00 C ATOM 320 C SER A 173 -11.236 18.332 -21.767 1.00 0.00 C ATOM 321 O SER A 173 -10.828 19.319 -21.148 1.00 0.00 O ATOM 322 CB SER A 173 -13.497 17.385 -21.246 1.00 0.00 C ATOM 323 OG SER A 173 -13.884 18.730 -21.097 1.00 0.00 O ATOM 0 H SER A 173 -12.380 17.678 -19.038 1.00 0.00 H new ATOM 0 HA SER A 173 -11.707 16.244 -21.459 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.778 17.032 -22.238 1.00 0.00 H new ATOM 0 HB3 SER A 173 -14.034 16.769 -20.525 1.00 0.00 H new ATOM 0 HG SER A 173 -13.757 19.006 -20.165 1.00 0.00 H new ATOM 329 N ALA A 174 -11.055 18.194 -23.070 1.00 0.00 N ATOM 330 CA ALA A 174 -10.390 19.224 -23.863 1.00 0.00 C ATOM 331 C ALA A 174 -11.453 20.249 -24.258 1.00 0.00 C ATOM 332 O ALA A 174 -11.185 21.434 -24.405 1.00 0.00 O ATOM 333 CB ALA A 174 -9.766 18.596 -25.115 1.00 0.00 C ATOM 0 H ALA A 174 -11.358 17.380 -23.605 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.592 19.700 -23.293 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -9.271 19.370 -25.702 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -9.036 17.843 -24.819 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.547 18.128 -25.715 1.00 0.00 H new ATOM 339 N GLU A 175 -12.661 19.740 -24.434 1.00 0.00 N ATOM 340 CA GLU A 175 -13.810 20.513 -24.896 1.00 0.00 C ATOM 341 C GLU A 175 -14.392 21.413 -23.804 1.00 0.00 C ATOM 342 O GLU A 175 -15.218 22.285 -24.082 1.00 0.00 O ATOM 343 CB GLU A 175 -14.914 19.539 -25.361 1.00 0.00 C ATOM 344 CG GLU A 175 -14.429 18.294 -26.134 1.00 0.00 C ATOM 345 CD GLU A 175 -14.159 17.084 -25.221 1.00 0.00 C ATOM 346 OE1 GLU A 175 -15.067 16.252 -25.040 1.00 0.00 O ATOM 347 OE2 GLU A 175 -13.028 16.978 -24.677 1.00 0.00 O ATOM 0 H GLU A 175 -12.878 18.759 -24.257 1.00 0.00 H new ATOM 0 HA GLU A 175 -13.466 21.152 -25.710 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -15.471 19.206 -24.485 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.613 20.087 -25.993 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -15.178 18.021 -26.877 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.517 18.543 -26.677 1.00 0.00 H new ATOM 354 N LYS A 176 -13.962 21.165 -22.570 1.00 0.00 N ATOM 355 CA LYS A 176 -14.448 21.848 -21.357 1.00 0.00 C ATOM 356 C LYS A 176 -15.941 21.679 -21.182 1.00 0.00 C ATOM 357 O LYS A 176 -16.616 22.540 -20.634 1.00 0.00 O ATOM 358 CB LYS A 176 -14.043 23.328 -21.315 1.00 0.00 C ATOM 359 CG LYS A 176 -12.542 23.570 -21.475 1.00 0.00 C ATOM 360 CD LYS A 176 -11.717 22.698 -20.510 1.00 0.00 C ATOM 361 CE LYS A 176 -10.234 22.962 -20.611 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.511 21.874 -19.876 1.00 0.00 N ATOM 0 H LYS A 176 -13.246 20.466 -22.372 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.959 21.364 -20.512 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.572 23.861 -22.105 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.370 23.756 -20.367 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -12.246 23.355 -22.502 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.322 24.622 -21.293 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -12.046 22.883 -19.488 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.910 21.646 -20.722 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -9.923 22.986 -21.655 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -9.992 23.935 -20.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.775 22.293 -19.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -10.185 21.347 -19.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.070 21.227 -20.560 1.00 0.00 H new ATOM 376 N ARG A 177 -16.437 20.542 -21.643 1.00 0.00 N ATOM 377 CA ARG A 177 -17.842 20.177 -21.527 1.00 0.00 C ATOM 378 C ARG A 177 -17.871 18.674 -21.650 1.00 0.00 C ATOM 379 O ARG A 177 -17.079 18.119 -22.397 1.00 0.00 O ATOM 380 CB ARG A 177 -18.682 20.843 -22.635 1.00 0.00 C ATOM 381 CG ARG A 177 -18.237 20.530 -24.057 1.00 0.00 C ATOM 382 CD ARG A 177 -19.034 21.319 -25.068 1.00 0.00 C ATOM 383 NE ARG A 177 -18.714 20.910 -26.448 1.00 0.00 N ATOM 384 CZ ARG A 177 -17.766 21.439 -27.215 1.00 0.00 C ATOM 385 NH1 ARG A 177 -16.968 22.393 -26.795 1.00 0.00 N ATOM 386 NH2 ARG A 177 -17.617 20.998 -28.435 1.00 0.00 N ATOM 0 H ARG A 177 -15.869 19.837 -22.114 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.272 20.514 -20.583 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.720 20.533 -22.519 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.654 21.923 -22.491 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -17.177 20.759 -24.167 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -18.354 19.464 -24.251 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -20.099 21.178 -24.883 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -18.828 22.382 -24.946 1.00 0.00 H new ATOM 0 HE ARG A 177 -19.269 20.154 -26.850 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -17.063 22.756 -25.847 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -16.253 22.771 -27.417 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -18.224 20.258 -28.787 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.894 21.394 -29.036 1.00 0.00 H new ATOM 400 N LEU A 178 -18.759 18.019 -20.922 1.00 0.00 N ATOM 401 CA LEU A 178 -18.906 16.565 -21.002 1.00 0.00 C ATOM 402 C LEU A 178 -20.381 16.217 -20.902 1.00 0.00 C ATOM 403 O LEU A 178 -21.141 16.908 -20.234 1.00 0.00 O ATOM 404 CB LEU A 178 -18.156 15.862 -19.865 1.00 0.00 C ATOM 405 CG LEU A 178 -16.622 15.736 -19.938 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.170 14.842 -18.808 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.136 15.135 -21.266 1.00 0.00 C ATOM 0 H LEU A 178 -19.395 18.469 -20.264 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.487 16.229 -21.950 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.398 16.386 -18.940 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.564 14.855 -19.777 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.200 16.738 -19.862 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.085 14.737 -18.839 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.465 15.282 -17.856 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.632 13.861 -18.913 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.048 15.071 -21.260 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.558 14.138 -21.390 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.457 15.770 -22.092 1.00 0.00 H new ATOM 419 N THR A 179 -20.790 15.144 -21.552 1.00 0.00 N ATOM 420 CA THR A 179 -22.166 14.666 -21.440 1.00 0.00 C ATOM 421 C THR A 179 -22.243 13.859 -20.149 1.00 0.00 C ATOM 422 O THR A 179 -21.213 13.514 -19.574 1.00 0.00 O ATOM 423 CB THR A 179 -22.555 13.759 -22.624 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.660 12.646 -22.683 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.481 14.513 -23.945 1.00 0.00 C ATOM 0 H THR A 179 -20.195 14.584 -22.163 1.00 0.00 H new ATOM 0 HA THR A 179 -22.851 15.514 -21.442 1.00 0.00 H new ATOM 0 HB THR A 179 -23.580 13.422 -22.469 1.00 0.00 H new ATOM 0 HG1 THR A 179 -20.778 12.951 -22.981 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.761 13.846 -24.761 1.00 0.00 H new ATOM 0 HG22 THR A 179 -23.165 15.361 -23.919 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.464 14.872 -24.103 1.00 0.00 H new ATOM 433 N LEU A 180 -23.447 13.540 -19.686 1.00 0.00 N ATOM 434 CA LEU A 180 -23.594 12.780 -18.437 1.00 0.00 C ATOM 435 C LEU A 180 -22.835 11.453 -18.488 1.00 0.00 C ATOM 436 O LEU A 180 -22.214 11.064 -17.508 1.00 0.00 O ATOM 437 CB LEU A 180 -25.071 12.506 -18.122 1.00 0.00 C ATOM 438 CG LEU A 180 -25.775 13.451 -17.123 1.00 0.00 C ATOM 439 CD1 LEU A 180 -27.241 13.036 -16.971 1.00 0.00 C ATOM 440 CD2 LEU A 180 -25.136 13.436 -15.736 1.00 0.00 C ATOM 0 H LEU A 180 -24.325 13.788 -20.143 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.167 13.397 -17.646 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.626 12.535 -19.060 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.150 11.490 -17.736 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.681 14.458 -17.530 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -27.737 13.703 -16.266 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -27.738 13.096 -17.939 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -27.293 12.013 -16.600 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -25.675 14.119 -15.080 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -25.181 12.427 -15.325 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -24.095 13.751 -15.812 1.00 0.00 H new ATOM 452 N SER A 181 -22.874 10.772 -19.626 1.00 0.00 N ATOM 453 CA SER A 181 -22.197 9.482 -19.768 1.00 0.00 C ATOM 454 C SER A 181 -20.697 9.615 -19.547 1.00 0.00 C ATOM 455 O SER A 181 -20.087 8.823 -18.843 1.00 0.00 O ATOM 456 CB SER A 181 -22.452 8.912 -21.160 1.00 0.00 C ATOM 457 OG SER A 181 -23.844 8.910 -21.443 1.00 0.00 O ATOM 0 H SER A 181 -23.364 11.087 -20.463 1.00 0.00 H new ATOM 0 HA SER A 181 -22.599 8.809 -19.010 1.00 0.00 H new ATOM 0 HB2 SER A 181 -21.923 9.505 -21.906 1.00 0.00 H new ATOM 0 HB3 SER A 181 -22.060 7.897 -21.223 1.00 0.00 H new ATOM 0 HG SER A 181 -23.995 8.544 -22.339 1.00 0.00 H new ATOM 463 N GLN A 182 -20.118 10.643 -20.140 1.00 0.00 N ATOM 464 CA GLN A 182 -18.686 10.886 -20.046 1.00 0.00 C ATOM 465 C GLN A 182 -18.247 11.197 -18.620 1.00 0.00 C ATOM 466 O GLN A 182 -17.159 10.817 -18.195 1.00 0.00 O ATOM 467 CB GLN A 182 -18.344 12.057 -20.944 1.00 0.00 C ATOM 468 CG GLN A 182 -18.172 11.669 -22.411 1.00 0.00 C ATOM 469 CD GLN A 182 -18.150 12.878 -23.315 1.00 0.00 C ATOM 470 OE1 GLN A 182 -19.089 13.666 -23.319 1.00 0.00 O ATOM 471 NE2 GLN A 182 -17.096 13.042 -24.067 1.00 0.00 N ATOM 0 H GLN A 182 -20.622 11.331 -20.698 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.162 9.982 -20.356 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.130 12.808 -20.865 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.424 12.521 -20.589 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -17.245 11.109 -22.532 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -18.985 11.008 -22.709 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -16.336 12.363 -24.034 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -17.033 13.849 -24.687 1.00 0.00 H new ATOM 480 N ILE A 183 -19.095 11.879 -17.870 1.00 0.00 N ATOM 481 CA ILE A 183 -18.794 12.188 -16.477 1.00 0.00 C ATOM 482 C ILE A 183 -18.793 10.882 -15.685 1.00 0.00 C ATOM 483 O ILE A 183 -17.945 10.685 -14.811 1.00 0.00 O ATOM 484 CB ILE A 183 -19.816 13.202 -15.912 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.684 14.519 -16.697 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.580 13.467 -14.401 1.00 0.00 C ATOM 487 CD1 ILE A 183 -20.922 15.351 -16.719 1.00 0.00 C ATOM 0 H ILE A 183 -19.995 12.230 -18.198 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.812 12.654 -16.396 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.818 12.788 -16.021 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.874 15.106 -16.264 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.397 14.289 -17.723 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.316 14.184 -14.038 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.680 12.533 -13.848 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.578 13.870 -14.254 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.740 16.259 -17.293 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.732 14.786 -17.181 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.200 15.616 -15.699 1.00 0.00 H new ATOM 499 N TYR A 184 -19.714 9.976 -15.998 1.00 0.00 N ATOM 500 CA TYR A 184 -19.727 8.675 -15.323 1.00 0.00 C ATOM 501 C TYR A 184 -18.420 7.953 -15.626 1.00 0.00 C ATOM 502 O TYR A 184 -17.757 7.459 -14.728 1.00 0.00 O ATOM 503 CB TYR A 184 -20.874 7.762 -15.784 1.00 0.00 C ATOM 504 CG TYR A 184 -22.263 8.363 -15.793 1.00 0.00 C ATOM 505 CD1 TYR A 184 -23.213 7.913 -16.731 1.00 0.00 C ATOM 506 CD2 TYR A 184 -22.650 9.363 -14.875 1.00 0.00 C ATOM 507 CE1 TYR A 184 -24.517 8.453 -16.767 1.00 0.00 C ATOM 508 CE2 TYR A 184 -23.959 9.909 -14.909 1.00 0.00 C ATOM 509 CZ TYR A 184 -24.879 9.440 -15.855 1.00 0.00 C ATOM 510 OH TYR A 184 -26.157 9.933 -15.901 1.00 0.00 O ATOM 0 H TYR A 184 -20.446 10.109 -16.696 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.860 8.875 -14.260 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -20.648 7.415 -16.792 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -20.888 6.883 -15.140 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -22.939 7.141 -17.435 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -21.942 9.716 -14.139 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -25.230 8.102 -17.498 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -24.244 10.681 -14.210 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.347 10.427 -15.076 1.00 0.00 H new ATOM 520 N GLU A 185 -18.050 7.908 -16.897 1.00 0.00 N ATOM 521 CA GLU A 185 -16.834 7.217 -17.330 1.00 0.00 C ATOM 522 C GLU A 185 -15.607 7.780 -16.624 1.00 0.00 C ATOM 523 O GLU A 185 -14.711 7.034 -16.227 1.00 0.00 O ATOM 524 CB GLU A 185 -16.654 7.379 -18.845 1.00 0.00 C ATOM 525 CG GLU A 185 -17.718 6.682 -19.695 1.00 0.00 C ATOM 526 CD GLU A 185 -17.966 7.412 -21.016 1.00 0.00 C ATOM 527 OE1 GLU A 185 -17.004 7.997 -21.565 1.00 0.00 O ATOM 528 OE2 GLU A 185 -19.122 7.412 -21.498 1.00 0.00 O ATOM 0 H GLU A 185 -18.575 8.344 -17.655 1.00 0.00 H new ATOM 0 HA GLU A 185 -16.937 6.162 -17.076 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -16.656 8.442 -19.085 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -15.674 6.991 -19.124 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -17.405 5.658 -19.900 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -18.650 6.624 -19.133 1.00 0.00 H new ATOM 535 N TRP A 186 -15.562 9.093 -16.454 1.00 0.00 N ATOM 536 CA TRP A 186 -14.446 9.722 -15.771 1.00 0.00 C ATOM 537 C TRP A 186 -14.393 9.255 -14.321 1.00 0.00 C ATOM 538 O TRP A 186 -13.318 8.954 -13.818 1.00 0.00 O ATOM 539 CB TRP A 186 -14.565 11.247 -15.835 1.00 0.00 C ATOM 540 CG TRP A 186 -13.422 11.962 -15.154 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.281 12.421 -15.716 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.327 12.311 -13.760 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.470 13.028 -14.795 1.00 0.00 N ATOM 544 CE2 TRP A 186 -12.079 12.975 -13.572 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.172 12.136 -12.654 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.663 13.455 -12.308 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.756 12.602 -11.388 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.502 13.258 -11.232 1.00 0.00 C ATOM 0 H TRP A 186 -16.282 9.739 -16.778 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.522 9.430 -16.271 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.609 11.558 -16.879 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.503 11.552 -15.371 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.039 12.321 -16.764 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.562 13.450 -14.989 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.130 11.650 -12.770 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.716 13.961 -12.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.395 12.459 -10.529 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -12.203 13.607 -10.255 1.00 0.00 H new ATOM 559 N MET A 187 -15.533 9.180 -13.645 1.00 0.00 N ATOM 560 CA MET A 187 -15.549 8.759 -12.240 1.00 0.00 C ATOM 561 C MET A 187 -15.176 7.292 -12.085 1.00 0.00 C ATOM 562 O MET A 187 -14.430 6.943 -11.179 1.00 0.00 O ATOM 563 CB MET A 187 -16.915 9.002 -11.600 1.00 0.00 C ATOM 564 CG MET A 187 -17.226 10.467 -11.393 1.00 0.00 C ATOM 565 SD MET A 187 -18.600 10.704 -10.269 1.00 0.00 S ATOM 566 CE MET A 187 -18.849 12.445 -10.424 1.00 0.00 C ATOM 0 H MET A 187 -16.449 9.401 -14.035 1.00 0.00 H new ATOM 0 HA MET A 187 -14.802 9.366 -11.728 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.687 8.559 -12.229 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.954 8.490 -10.639 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.344 10.974 -11.001 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.458 10.928 -12.353 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.324 12.827 -9.520 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.888 12.939 -10.565 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.489 12.646 -11.283 1.00 0.00 H new ATOM 576 N VAL A 188 -15.675 6.441 -12.970 1.00 0.00 N ATOM 577 CA VAL A 188 -15.361 5.007 -12.927 1.00 0.00 C ATOM 578 C VAL A 188 -13.851 4.826 -13.122 1.00 0.00 C ATOM 579 O VAL A 188 -13.227 3.955 -12.519 1.00 0.00 O ATOM 580 CB VAL A 188 -16.161 4.228 -14.038 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.786 2.746 -14.089 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.666 4.314 -13.775 1.00 0.00 C ATOM 0 H VAL A 188 -16.300 6.712 -13.729 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.656 4.599 -11.960 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.902 4.698 -14.987 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -16.363 2.251 -14.870 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.722 2.647 -14.306 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -16.005 2.282 -13.127 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -18.203 3.770 -14.552 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.891 3.875 -12.803 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.977 5.359 -13.782 1.00 0.00 H new ATOM 592 N LYS A 189 -13.253 5.660 -13.961 1.00 0.00 N ATOM 593 CA LYS A 189 -11.820 5.561 -14.237 1.00 0.00 C ATOM 594 C LYS A 189 -10.907 6.225 -13.199 1.00 0.00 C ATOM 595 O LYS A 189 -9.768 5.804 -13.030 1.00 0.00 O ATOM 596 CB LYS A 189 -11.543 6.144 -15.616 1.00 0.00 C ATOM 597 CG LYS A 189 -10.346 5.511 -16.299 1.00 0.00 C ATOM 598 CD LYS A 189 -10.460 5.683 -17.799 1.00 0.00 C ATOM 599 CE LYS A 189 -9.364 4.922 -18.547 1.00 0.00 C ATOM 600 NZ LYS A 189 -9.560 3.429 -18.453 1.00 0.00 N ATOM 0 H LYS A 189 -13.731 6.409 -14.461 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.577 4.500 -14.189 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.424 6.012 -16.244 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -11.376 7.217 -15.524 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -9.426 5.971 -15.940 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -10.291 4.452 -16.048 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -11.437 5.332 -18.131 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -10.401 6.742 -18.048 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -9.361 5.224 -19.594 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -8.390 5.188 -18.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -8.905 2.951 -19.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -9.371 3.115 -17.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -10.539 3.191 -18.709 1.00 0.00 H new ATOM 614 N SER A 190 -11.389 7.265 -12.530 1.00 0.00 N ATOM 615 CA SER A 190 -10.576 8.017 -11.568 1.00 0.00 C ATOM 616 C SER A 190 -10.779 7.666 -10.093 1.00 0.00 C ATOM 617 O SER A 190 -9.855 7.824 -9.298 1.00 0.00 O ATOM 618 CB SER A 190 -10.862 9.509 -11.726 1.00 0.00 C ATOM 619 OG SER A 190 -12.231 9.784 -11.512 1.00 0.00 O ATOM 0 H SER A 190 -12.343 7.612 -12.633 1.00 0.00 H new ATOM 0 HA SER A 190 -9.549 7.741 -11.809 1.00 0.00 H new ATOM 0 HB2 SER A 190 -10.258 10.076 -11.018 1.00 0.00 H new ATOM 0 HB3 SER A 190 -10.573 9.835 -12.725 1.00 0.00 H new ATOM 0 HG SER A 190 -12.701 9.796 -12.372 1.00 0.00 H new ATOM 625 N VAL A 191 -11.969 7.218 -9.712 1.00 0.00 N ATOM 626 CA VAL A 191 -12.273 6.963 -8.300 1.00 0.00 C ATOM 627 C VAL A 191 -12.553 5.476 -8.071 1.00 0.00 C ATOM 628 O VAL A 191 -13.473 4.919 -8.672 1.00 0.00 O ATOM 629 CB VAL A 191 -13.524 7.776 -7.845 1.00 0.00 C ATOM 630 CG1 VAL A 191 -13.735 7.658 -6.329 1.00 0.00 C ATOM 631 CG2 VAL A 191 -13.382 9.254 -8.209 1.00 0.00 C ATOM 0 H VAL A 191 -12.738 7.023 -10.353 1.00 0.00 H new ATOM 0 HA VAL A 191 -11.405 7.272 -7.718 1.00 0.00 H new ATOM 0 HB VAL A 191 -14.385 7.357 -8.365 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -14.613 8.234 -6.038 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.883 6.611 -6.063 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.859 8.045 -5.809 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -14.268 9.797 -7.880 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -12.501 9.667 -7.718 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -13.276 9.354 -9.289 1.00 0.00 H new ATOM 641 N PRO A 192 -11.777 4.809 -7.189 1.00 0.00 N ATOM 642 CA PRO A 192 -12.055 3.382 -6.960 1.00 0.00 C ATOM 643 C PRO A 192 -13.478 3.089 -6.486 1.00 0.00 C ATOM 644 O PRO A 192 -14.034 2.050 -6.802 1.00 0.00 O ATOM 645 CB PRO A 192 -11.045 3.003 -5.869 1.00 0.00 C ATOM 646 CG PRO A 192 -9.945 3.983 -6.026 1.00 0.00 C ATOM 647 CD PRO A 192 -10.633 5.265 -6.376 1.00 0.00 C ATOM 0 HA PRO A 192 -11.965 2.814 -7.886 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -11.492 3.063 -4.876 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -10.688 1.981 -5.996 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -9.366 4.081 -5.107 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -9.251 3.678 -6.809 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.958 5.806 -5.487 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.980 5.935 -6.936 1.00 0.00 H new ATOM 655 N TYR A 193 -14.074 4.013 -5.743 1.00 0.00 N ATOM 656 CA TYR A 193 -15.444 3.839 -5.268 1.00 0.00 C ATOM 657 C TYR A 193 -16.435 3.696 -6.422 1.00 0.00 C ATOM 658 O TYR A 193 -17.292 2.827 -6.405 1.00 0.00 O ATOM 659 CB TYR A 193 -15.864 5.036 -4.410 1.00 0.00 C ATOM 660 CG TYR A 193 -17.215 4.837 -3.759 1.00 0.00 C ATOM 661 CD1 TYR A 193 -17.333 4.167 -2.523 1.00 0.00 C ATOM 662 CD2 TYR A 193 -18.387 5.309 -4.381 1.00 0.00 C ATOM 663 CE1 TYR A 193 -18.610 3.972 -1.921 1.00 0.00 C ATOM 664 CE2 TYR A 193 -19.660 5.105 -3.791 1.00 0.00 C ATOM 665 CZ TYR A 193 -19.759 4.440 -2.568 1.00 0.00 C ATOM 666 OH TYR A 193 -20.992 4.247 -2.001 1.00 0.00 O ATOM 0 H TYR A 193 -13.634 4.887 -5.456 1.00 0.00 H new ATOM 0 HA TYR A 193 -15.461 2.923 -4.677 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -15.114 5.206 -3.638 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -15.892 5.932 -5.031 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -16.447 3.798 -2.028 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -18.315 5.834 -5.322 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -18.690 3.466 -0.970 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -20.550 5.463 -4.286 1.00 0.00 H new ATOM 0 HH TYR A 193 -21.682 4.634 -2.579 1.00 0.00 H new ATOM 676 N PHE A 194 -16.317 4.540 -7.436 1.00 0.00 N ATOM 677 CA PHE A 194 -17.257 4.495 -8.552 1.00 0.00 C ATOM 678 C PHE A 194 -16.853 3.433 -9.558 1.00 0.00 C ATOM 679 O PHE A 194 -17.656 3.024 -10.382 1.00 0.00 O ATOM 680 CB PHE A 194 -17.397 5.874 -9.187 1.00 0.00 C ATOM 681 CG PHE A 194 -17.965 6.896 -8.239 1.00 0.00 C ATOM 682 CD1 PHE A 194 -17.241 8.051 -7.903 1.00 0.00 C ATOM 683 CD2 PHE A 194 -19.229 6.695 -7.655 1.00 0.00 C ATOM 684 CE1 PHE A 194 -17.762 8.985 -6.979 1.00 0.00 C ATOM 685 CE2 PHE A 194 -19.758 7.630 -6.734 1.00 0.00 C ATOM 686 CZ PHE A 194 -19.019 8.772 -6.394 1.00 0.00 C ATOM 0 H PHE A 194 -15.593 5.254 -7.512 1.00 0.00 H new ATOM 0 HA PHE A 194 -18.239 4.212 -8.174 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -16.420 6.210 -9.534 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -18.040 5.802 -10.064 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -16.276 8.228 -8.355 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -19.802 5.817 -7.913 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -17.191 9.865 -6.723 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -20.730 7.464 -6.293 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.416 9.484 -5.685 1.00 0.00 H new ATOM 696 N LYS A 195 -15.618 2.957 -9.464 1.00 0.00 N ATOM 697 CA LYS A 195 -15.189 1.808 -10.258 1.00 0.00 C ATOM 698 C LYS A 195 -15.909 0.579 -9.716 1.00 0.00 C ATOM 699 O LYS A 195 -16.444 -0.224 -10.468 1.00 0.00 O ATOM 700 CB LYS A 195 -13.677 1.598 -10.149 1.00 0.00 C ATOM 701 CG LYS A 195 -13.162 0.470 -11.027 1.00 0.00 C ATOM 702 CD LYS A 195 -11.738 0.106 -10.662 1.00 0.00 C ATOM 703 CE LYS A 195 -11.284 -1.111 -11.457 1.00 0.00 C ATOM 704 NZ LYS A 195 -9.955 -1.620 -10.973 1.00 0.00 N ATOM 0 H LYS A 195 -14.899 3.343 -8.852 1.00 0.00 H new ATOM 0 HA LYS A 195 -15.429 1.978 -11.308 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.168 2.523 -10.422 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.420 1.387 -9.111 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -13.804 -0.404 -10.917 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -13.208 0.769 -12.074 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -11.077 0.949 -10.864 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -11.671 -0.103 -9.594 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -12.030 -1.901 -11.373 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -11.213 -0.851 -12.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -9.675 -2.449 -11.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -9.239 -0.873 -11.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -10.031 -1.891 -9.972 1.00 0.00 H new ATOM 718 N ASP A 196 -15.921 0.459 -8.397 1.00 0.00 N ATOM 719 CA ASP A 196 -16.569 -0.659 -7.708 1.00 0.00 C ATOM 720 C ASP A 196 -18.079 -0.619 -7.916 1.00 0.00 C ATOM 721 O ASP A 196 -18.739 -1.638 -8.038 1.00 0.00 O ATOM 722 CB ASP A 196 -16.267 -0.555 -6.213 1.00 0.00 C ATOM 723 CG ASP A 196 -16.764 -1.747 -5.434 1.00 0.00 C ATOM 724 OD1 ASP A 196 -16.383 -2.881 -5.763 1.00 0.00 O ATOM 725 OD2 ASP A 196 -17.537 -1.536 -4.470 1.00 0.00 O ATOM 0 H ASP A 196 -15.483 1.132 -7.769 1.00 0.00 H new ATOM 0 HA ASP A 196 -16.186 -1.596 -8.113 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -15.191 -0.456 -6.070 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -16.726 0.350 -5.816 1.00 0.00 H new ATOM 730 N LYS A 197 -18.620 0.588 -7.977 1.00 0.00 N ATOM 731 CA LYS A 197 -20.058 0.788 -8.174 1.00 0.00 C ATOM 732 C LYS A 197 -20.339 1.007 -9.660 1.00 0.00 C ATOM 733 O LYS A 197 -21.336 1.613 -10.039 1.00 0.00 O ATOM 734 CB LYS A 197 -20.551 1.964 -7.310 1.00 0.00 C ATOM 735 CG LYS A 197 -20.965 1.559 -5.881 1.00 0.00 C ATOM 736 CD LYS A 197 -19.805 1.104 -4.993 1.00 0.00 C ATOM 737 CE LYS A 197 -20.315 0.573 -3.665 1.00 0.00 C ATOM 738 NZ LYS A 197 -19.185 0.005 -2.860 1.00 0.00 N ATOM 0 H LYS A 197 -18.086 1.453 -7.893 1.00 0.00 H new ATOM 0 HA LYS A 197 -20.607 -0.098 -7.855 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.762 2.714 -7.250 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -21.401 2.434 -7.805 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -21.460 2.405 -5.405 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -21.697 0.754 -5.942 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -19.233 0.329 -5.504 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -19.126 1.939 -4.819 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -20.800 1.375 -3.108 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -21.068 -0.195 -3.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -19.557 -0.692 -2.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -18.505 -0.459 -3.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -18.709 0.771 -2.342 1.00 0.00 H new ATOM 752 N GLY A 198 -19.446 0.495 -10.494 1.00 0.00 N ATOM 753 CA GLY A 198 -19.570 0.639 -11.937 1.00 0.00 C ATOM 754 C GLY A 198 -20.603 -0.289 -12.545 1.00 0.00 C ATOM 755 O GLY A 198 -20.970 -0.136 -13.708 1.00 0.00 O ATOM 0 H GLY A 198 -18.623 -0.027 -10.194 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -19.835 1.670 -12.171 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -18.602 0.446 -12.399 1.00 0.00 H new ATOM 759 N ASP A 199 -21.082 -1.247 -11.763 1.00 0.00 N ATOM 760 CA ASP A 199 -22.134 -2.159 -12.217 1.00 0.00 C ATOM 761 C ASP A 199 -23.373 -1.320 -12.536 1.00 0.00 C ATOM 762 O ASP A 199 -23.640 -0.326 -11.866 1.00 0.00 O ATOM 763 CB ASP A 199 -22.445 -3.196 -11.129 1.00 0.00 C ATOM 764 CG ASP A 199 -23.936 -3.359 -10.883 1.00 0.00 C ATOM 765 OD1 ASP A 199 -24.391 -2.945 -9.804 1.00 0.00 O ATOM 766 OD2 ASP A 199 -24.661 -3.876 -11.763 1.00 0.00 O ATOM 0 H ASP A 199 -20.761 -1.416 -10.810 1.00 0.00 H new ATOM 0 HA ASP A 199 -21.812 -2.702 -13.105 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -22.021 -4.158 -11.418 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -21.958 -2.899 -10.200 1.00 0.00 H new ATOM 771 N SER A 200 -24.119 -1.710 -13.559 1.00 0.00 N ATOM 772 CA SER A 200 -25.280 -0.949 -14.016 1.00 0.00 C ATOM 773 C SER A 200 -26.308 -0.638 -12.926 1.00 0.00 C ATOM 774 O SER A 200 -26.914 0.442 -12.943 1.00 0.00 O ATOM 775 CB SER A 200 -25.968 -1.724 -15.137 1.00 0.00 C ATOM 776 OG SER A 200 -25.044 -2.028 -16.167 1.00 0.00 O ATOM 0 H SER A 200 -23.941 -2.559 -14.096 1.00 0.00 H new ATOM 0 HA SER A 200 -24.897 0.014 -14.355 1.00 0.00 H new ATOM 0 HB2 SER A 200 -26.397 -2.645 -14.741 1.00 0.00 H new ATOM 0 HB3 SER A 200 -26.792 -1.136 -15.541 1.00 0.00 H new ATOM 0 HG SER A 200 -25.499 -2.526 -16.878 1.00 0.00 H new ATOM 782 N ASN A 201 -26.512 -1.556 -11.989 1.00 0.00 N ATOM 783 CA ASN A 201 -27.485 -1.337 -10.916 1.00 0.00 C ATOM 784 C ASN A 201 -26.946 -0.303 -9.926 1.00 0.00 C ATOM 785 O ASN A 201 -27.593 0.704 -9.655 1.00 0.00 O ATOM 786 CB ASN A 201 -27.799 -2.657 -10.200 1.00 0.00 C ATOM 787 CG ASN A 201 -29.008 -2.555 -9.301 1.00 0.00 C ATOM 788 OD1 ASN A 201 -29.115 -1.670 -8.477 1.00 0.00 O ATOM 789 ND2 ASN A 201 -29.932 -3.459 -9.468 1.00 0.00 N ATOM 0 H ASN A 201 -26.025 -2.451 -11.946 1.00 0.00 H new ATOM 0 HA ASN A 201 -28.410 -0.957 -11.350 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -27.967 -3.438 -10.942 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -26.935 -2.960 -9.608 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -30.777 -3.436 -8.897 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -29.810 -4.189 -10.170 1.00 0.00 H new ATOM 796 N SER A 202 -25.752 -0.541 -9.408 1.00 0.00 N ATOM 797 CA SER A 202 -25.116 0.366 -8.450 1.00 0.00 C ATOM 798 C SER A 202 -24.929 1.756 -9.049 1.00 0.00 C ATOM 799 O SER A 202 -25.009 2.778 -8.353 1.00 0.00 O ATOM 800 CB SER A 202 -23.755 -0.189 -8.047 1.00 0.00 C ATOM 801 OG SER A 202 -23.883 -1.488 -7.496 1.00 0.00 O ATOM 0 H SER A 202 -25.193 -1.364 -9.635 1.00 0.00 H new ATOM 0 HA SER A 202 -25.764 0.446 -7.577 1.00 0.00 H new ATOM 0 HB2 SER A 202 -23.099 -0.221 -8.917 1.00 0.00 H new ATOM 0 HB3 SER A 202 -23.288 0.475 -7.320 1.00 0.00 H new ATOM 0 HG SER A 202 -24.023 -2.137 -8.217 1.00 0.00 H new ATOM 807 N SER A 203 -24.699 1.792 -10.353 1.00 0.00 N ATOM 808 CA SER A 203 -24.541 3.042 -11.074 1.00 0.00 C ATOM 809 C SER A 203 -25.777 3.909 -10.978 1.00 0.00 C ATOM 810 O SER A 203 -25.666 5.131 -10.990 1.00 0.00 O ATOM 811 CB SER A 203 -24.209 2.792 -12.543 1.00 0.00 C ATOM 812 OG SER A 203 -22.937 2.197 -12.685 1.00 0.00 O ATOM 0 H SER A 203 -24.617 0.960 -10.937 1.00 0.00 H new ATOM 0 HA SER A 203 -23.712 3.571 -10.603 1.00 0.00 H new ATOM 0 HB2 SER A 203 -24.967 2.145 -12.985 1.00 0.00 H new ATOM 0 HB3 SER A 203 -24.236 3.734 -13.090 1.00 0.00 H new ATOM 0 HG SER A 203 -22.990 1.249 -12.442 1.00 0.00 H new ATOM 818 N ALA A 204 -26.954 3.296 -10.894 1.00 0.00 N ATOM 819 CA ALA A 204 -28.210 4.045 -10.844 1.00 0.00 C ATOM 820 C ALA A 204 -28.205 5.028 -9.673 1.00 0.00 C ATOM 821 O ALA A 204 -28.662 6.166 -9.808 1.00 0.00 O ATOM 822 CB ALA A 204 -29.401 3.080 -10.733 1.00 0.00 C ATOM 0 H ALA A 204 -27.067 2.283 -10.859 1.00 0.00 H new ATOM 0 HA ALA A 204 -28.310 4.616 -11.767 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -30.329 3.650 -10.697 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -29.415 2.418 -11.599 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -29.304 2.486 -9.824 1.00 0.00 H new ATOM 828 N GLY A 205 -27.677 4.594 -8.537 1.00 0.00 N ATOM 829 CA GLY A 205 -27.641 5.450 -7.366 1.00 0.00 C ATOM 830 C GLY A 205 -26.758 6.672 -7.545 1.00 0.00 C ATOM 831 O GLY A 205 -27.213 7.801 -7.373 1.00 0.00 O ATOM 0 H GLY A 205 -27.273 3.667 -8.404 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -28.655 5.774 -7.129 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.283 4.873 -6.513 1.00 0.00 H new ATOM 835 N TRP A 206 -25.496 6.478 -7.901 1.00 0.00 N ATOM 836 CA TRP A 206 -24.588 7.618 -8.011 1.00 0.00 C ATOM 837 C TRP A 206 -24.806 8.491 -9.250 1.00 0.00 C ATOM 838 O TRP A 206 -24.570 9.698 -9.196 1.00 0.00 O ATOM 839 CB TRP A 206 -23.126 7.220 -7.793 1.00 0.00 C ATOM 840 CG TRP A 206 -22.494 6.302 -8.784 1.00 0.00 C ATOM 841 CD1 TRP A 206 -22.450 4.949 -8.740 1.00 0.00 C ATOM 842 CD2 TRP A 206 -21.726 6.670 -9.946 1.00 0.00 C ATOM 843 NE1 TRP A 206 -21.724 4.437 -9.774 1.00 0.00 N ATOM 844 CE2 TRP A 206 -21.252 5.461 -10.537 1.00 0.00 C ATOM 845 CE3 TRP A 206 -21.367 7.897 -10.534 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -20.445 5.449 -11.688 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -20.555 7.890 -11.693 1.00 0.00 C ATOM 848 CH2 TRP A 206 -20.106 6.663 -12.258 1.00 0.00 C ATOM 0 H TRP A 206 -25.083 5.570 -8.114 1.00 0.00 H new ATOM 0 HA TRP A 206 -24.856 8.275 -7.184 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -22.533 8.134 -7.759 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -23.050 6.754 -6.811 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -22.930 4.350 -7.980 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -21.561 3.445 -9.948 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -21.706 8.830 -10.107 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -20.100 4.519 -12.115 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -20.273 8.825 -12.154 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -19.491 6.680 -13.146 1.00 0.00 H new ATOM 859 N LYS A 207 -25.277 7.935 -10.364 1.00 0.00 N ATOM 860 CA LYS A 207 -25.600 8.786 -11.525 1.00 0.00 C ATOM 861 C LYS A 207 -26.746 9.728 -11.157 1.00 0.00 C ATOM 862 O LYS A 207 -26.831 10.844 -11.671 1.00 0.00 O ATOM 863 CB LYS A 207 -25.915 7.967 -12.788 1.00 0.00 C ATOM 864 CG LYS A 207 -27.270 7.257 -12.834 1.00 0.00 C ATOM 865 CD LYS A 207 -27.439 6.411 -14.121 1.00 0.00 C ATOM 866 CE LYS A 207 -26.507 5.187 -14.138 1.00 0.00 C ATOM 867 NZ LYS A 207 -26.719 4.267 -15.310 1.00 0.00 N ATOM 0 H LYS A 207 -25.442 6.937 -10.495 1.00 0.00 H new ATOM 0 HA LYS A 207 -24.718 9.377 -11.773 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -25.852 8.633 -13.648 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -25.134 7.216 -12.908 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -27.371 6.613 -11.961 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -28.069 7.997 -12.779 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -28.474 6.079 -14.202 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -27.235 7.033 -14.992 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -25.473 5.532 -14.143 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -26.650 4.622 -13.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -26.055 3.469 -15.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -27.695 3.907 -15.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -26.554 4.788 -16.195 1.00 0.00 H new ATOM 881 N ASN A 208 -27.615 9.300 -10.249 1.00 0.00 N ATOM 882 CA ASN A 208 -28.695 10.161 -9.779 1.00 0.00 C ATOM 883 C ASN A 208 -28.113 11.274 -8.904 1.00 0.00 C ATOM 884 O ASN A 208 -28.560 12.416 -8.962 1.00 0.00 O ATOM 885 CB ASN A 208 -29.726 9.355 -8.988 1.00 0.00 C ATOM 886 CG ASN A 208 -30.952 10.160 -8.662 1.00 0.00 C ATOM 887 OD1 ASN A 208 -31.379 10.993 -9.446 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.517 9.929 -7.510 1.00 0.00 N ATOM 0 H ASN A 208 -27.595 8.372 -9.827 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.197 10.600 -10.641 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.014 8.475 -9.563 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.273 8.997 -8.064 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -32.348 10.453 -7.235 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -31.128 9.224 -6.884 1.00 0.00 H new ATOM 895 N SER A 209 -27.105 10.952 -8.105 1.00 0.00 N ATOM 896 CA SER A 209 -26.457 11.952 -7.254 1.00 0.00 C ATOM 897 C SER A 209 -25.777 13.035 -8.090 1.00 0.00 C ATOM 898 O SER A 209 -25.765 14.203 -7.706 1.00 0.00 O ATOM 899 CB SER A 209 -25.420 11.285 -6.353 1.00 0.00 C ATOM 900 OG SER A 209 -25.989 10.179 -5.675 1.00 0.00 O ATOM 0 H SER A 209 -26.717 10.012 -8.025 1.00 0.00 H new ATOM 0 HA SER A 209 -27.230 12.418 -6.643 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.570 10.955 -6.950 1.00 0.00 H new ATOM 0 HB3 SER A 209 -25.041 12.007 -5.629 1.00 0.00 H new ATOM 0 HG SER A 209 -25.311 9.762 -5.103 1.00 0.00 H new ATOM 906 N ILE A 210 -25.226 12.658 -9.239 1.00 0.00 N ATOM 907 CA ILE A 210 -24.595 13.631 -10.141 1.00 0.00 C ATOM 908 C ILE A 210 -25.664 14.570 -10.663 1.00 0.00 C ATOM 909 O ILE A 210 -25.468 15.774 -10.698 1.00 0.00 O ATOM 910 CB ILE A 210 -23.871 12.945 -11.342 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.644 12.186 -10.820 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.467 13.980 -12.433 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.056 11.216 -11.809 1.00 0.00 C ATOM 0 H ILE A 210 -25.200 11.694 -9.571 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.838 14.175 -9.577 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.558 12.242 -11.814 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -21.878 12.907 -10.535 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -22.923 11.643 -9.917 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -22.966 13.467 -13.253 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.360 14.480 -12.809 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.792 14.719 -12.001 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.193 10.721 -11.364 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -22.805 10.470 -12.076 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.744 11.754 -12.704 1.00 0.00 H new ATOM 925 N ARG A 211 -26.807 14.025 -11.053 1.00 0.00 N ATOM 926 CA ARG A 211 -27.899 14.851 -11.572 1.00 0.00 C ATOM 927 C ARG A 211 -28.367 15.853 -10.530 1.00 0.00 C ATOM 928 O ARG A 211 -28.643 16.995 -10.855 1.00 0.00 O ATOM 929 CB ARG A 211 -29.059 13.974 -12.013 1.00 0.00 C ATOM 930 CG ARG A 211 -28.811 13.276 -13.333 1.00 0.00 C ATOM 931 CD ARG A 211 -29.951 12.340 -13.615 1.00 0.00 C ATOM 932 NE ARG A 211 -29.907 11.783 -14.976 1.00 0.00 N ATOM 933 CZ ARG A 211 -30.810 10.953 -15.487 1.00 0.00 C ATOM 934 NH1 ARG A 211 -31.842 10.530 -14.796 1.00 0.00 N ATOM 935 NH2 ARG A 211 -30.674 10.544 -16.719 1.00 0.00 N ATOM 0 H ARG A 211 -27.006 13.025 -11.023 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.525 15.404 -12.433 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -29.253 13.226 -11.245 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -29.957 14.586 -12.096 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -28.719 14.009 -14.135 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -27.872 12.724 -13.296 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -29.933 11.524 -12.892 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -30.893 12.869 -13.474 1.00 0.00 H new ATOM 0 HE ARG A 211 -29.125 12.054 -15.572 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -31.972 10.838 -13.832 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -32.515 9.893 -15.222 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -29.882 10.862 -17.277 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -31.360 9.907 -17.123 1.00 0.00 H new ATOM 949 N HIS A 212 -28.438 15.432 -9.279 1.00 0.00 N ATOM 950 CA HIS A 212 -28.819 16.344 -8.206 1.00 0.00 C ATOM 951 C HIS A 212 -27.746 17.412 -8.012 1.00 0.00 C ATOM 952 O HIS A 212 -28.055 18.581 -7.865 1.00 0.00 O ATOM 953 CB HIS A 212 -29.035 15.577 -6.901 1.00 0.00 C ATOM 954 CG HIS A 212 -30.358 14.882 -6.830 1.00 0.00 C ATOM 955 ND1 HIS A 212 -30.665 13.720 -7.492 1.00 0.00 N ATOM 956 CD2 HIS A 212 -31.496 15.217 -6.161 1.00 0.00 C ATOM 957 CE1 HIS A 212 -31.926 13.406 -7.220 1.00 0.00 C ATOM 958 NE2 HIS A 212 -32.480 14.281 -6.407 1.00 0.00 N ATOM 0 H HIS A 212 -28.240 14.477 -8.980 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.754 16.829 -8.485 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -28.240 14.840 -6.786 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -28.952 16.270 -6.064 1.00 0.00 H new ATOM 0 HD1 HIS A 212 -30.033 13.189 -8.091 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -31.611 16.087 -5.531 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -32.435 12.540 -7.617 1.00 0.00 H new ATOM 966 N ASN A 213 -26.481 17.014 -8.020 1.00 0.00 N ATOM 967 CA ASN A 213 -25.389 17.970 -7.816 1.00 0.00 C ATOM 968 C ASN A 213 -25.302 18.982 -8.952 1.00 0.00 C ATOM 969 O ASN A 213 -24.929 20.119 -8.724 1.00 0.00 O ATOM 970 CB ASN A 213 -24.050 17.245 -7.679 1.00 0.00 C ATOM 971 CG ASN A 213 -23.716 16.919 -6.249 1.00 0.00 C ATOM 972 OD1 ASN A 213 -22.834 17.521 -5.659 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.403 15.962 -5.687 1.00 0.00 N ATOM 0 H ASN A 213 -26.183 16.049 -8.163 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.607 18.507 -6.893 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -24.078 16.324 -8.261 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.259 17.865 -8.101 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -24.210 15.695 -4.722 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -25.133 15.482 -6.213 1.00 0.00 H new ATOM 980 N LEU A 214 -25.657 18.576 -10.164 1.00 0.00 N ATOM 981 CA LEU A 214 -25.647 19.485 -11.311 1.00 0.00 C ATOM 982 C LEU A 214 -26.656 20.612 -11.106 1.00 0.00 C ATOM 983 O LEU A 214 -26.412 21.740 -11.500 1.00 0.00 O ATOM 984 CB LEU A 214 -25.987 18.733 -12.606 1.00 0.00 C ATOM 985 CG LEU A 214 -24.868 17.878 -13.229 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.462 16.984 -14.315 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.762 18.741 -13.829 1.00 0.00 C ATOM 0 H LEU A 214 -25.956 17.625 -10.382 1.00 0.00 H new ATOM 0 HA LEU A 214 -24.645 19.905 -11.395 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.840 18.084 -12.407 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.309 19.464 -13.348 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.426 17.273 -12.438 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.673 16.377 -14.759 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -26.218 16.332 -13.877 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.920 17.604 -15.086 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -22.992 18.100 -14.258 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.180 19.378 -14.609 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.323 19.363 -13.049 1.00 0.00 H new ATOM 999 N SER A 215 -27.785 20.297 -10.485 1.00 0.00 N ATOM 1000 CA SER A 215 -28.819 21.298 -10.222 1.00 0.00 C ATOM 1001 C SER A 215 -28.530 22.148 -8.983 1.00 0.00 C ATOM 1002 O SER A 215 -28.866 23.323 -8.940 1.00 0.00 O ATOM 1003 CB SER A 215 -30.160 20.597 -10.023 1.00 0.00 C ATOM 1004 OG SER A 215 -30.459 19.757 -11.127 1.00 0.00 O ATOM 0 H SER A 215 -28.011 19.359 -10.153 1.00 0.00 H new ATOM 0 HA SER A 215 -28.838 21.965 -11.084 1.00 0.00 H new ATOM 0 HB2 SER A 215 -30.134 20.006 -9.107 1.00 0.00 H new ATOM 0 HB3 SER A 215 -30.949 21.339 -9.901 1.00 0.00 H new ATOM 0 HG SER A 215 -29.954 18.921 -11.048 1.00 0.00 H new ATOM 1010 N LEU A 216 -27.925 21.541 -7.970 1.00 0.00 N ATOM 1011 CA LEU A 216 -27.646 22.240 -6.709 1.00 0.00 C ATOM 1012 C LEU A 216 -26.418 23.145 -6.788 1.00 0.00 C ATOM 1013 O LEU A 216 -26.386 24.219 -6.192 1.00 0.00 O ATOM 1014 CB LEU A 216 -27.426 21.217 -5.586 1.00 0.00 C ATOM 1015 CG LEU A 216 -28.648 20.377 -5.169 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -28.191 19.221 -4.277 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -29.691 21.215 -4.432 1.00 0.00 C ATOM 0 H LEU A 216 -27.616 20.569 -7.990 1.00 0.00 H new ATOM 0 HA LEU A 216 -28.512 22.869 -6.504 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.634 20.535 -5.896 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -27.062 21.749 -4.707 1.00 0.00 H new ATOM 0 HG LEU A 216 -29.115 19.991 -6.075 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -29.055 18.626 -3.981 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -27.489 18.593 -4.826 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -27.703 19.619 -3.387 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -30.536 20.584 -4.156 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -29.246 21.640 -3.532 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -30.036 22.020 -5.081 1.00 0.00 H new ATOM 1029 N HIS A 217 -25.399 22.710 -7.510 1.00 0.00 N ATOM 1030 CA HIS A 217 -24.163 23.474 -7.622 1.00 0.00 C ATOM 1031 C HIS A 217 -24.226 24.343 -8.879 1.00 0.00 C ATOM 1032 O HIS A 217 -23.942 23.892 -9.985 1.00 0.00 O ATOM 1033 CB HIS A 217 -22.970 22.522 -7.652 1.00 0.00 C ATOM 1034 CG HIS A 217 -21.645 23.210 -7.558 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -20.639 23.318 -8.466 1.00 0.00 N flip ATOM 1036 CD2 HIS A 217 -21.194 23.873 -6.444 1.00 0.00 C flip ATOM 1037 CE1 HIS A 217 -19.593 24.042 -7.928 1.00 0.00 C flip ATOM 1038 NE2 HIS A 217 -19.980 24.346 -6.706 1.00 0.00 N flip ATOM 0 H HIS A 217 -25.401 21.832 -8.028 1.00 0.00 H new ATOM 0 HA HIS A 217 -24.041 24.128 -6.759 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -23.061 21.815 -6.828 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -23.003 21.942 -8.574 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -20.654 22.923 -9.406 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -21.733 23.990 -5.515 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -18.660 24.302 -8.406 1.00 0.00 H new ATOM 1046 N SER A 218 -24.615 25.597 -8.684 1.00 0.00 N ATOM 1047 CA SER A 218 -24.847 26.561 -9.770 1.00 0.00 C ATOM 1048 C SER A 218 -23.671 26.874 -10.704 1.00 0.00 C ATOM 1049 O SER A 218 -23.838 27.596 -11.684 1.00 0.00 O ATOM 1050 CB SER A 218 -25.320 27.870 -9.143 1.00 0.00 C ATOM 1051 OG SER A 218 -24.391 28.306 -8.163 1.00 0.00 O ATOM 0 H SER A 218 -24.783 25.986 -7.756 1.00 0.00 H new ATOM 0 HA SER A 218 -25.580 26.077 -10.415 1.00 0.00 H new ATOM 0 HB2 SER A 218 -25.431 28.632 -9.914 1.00 0.00 H new ATOM 0 HB3 SER A 218 -26.301 27.731 -8.689 1.00 0.00 H new ATOM 0 HG SER A 218 -24.703 29.147 -7.768 1.00 0.00 H new ATOM 1057 N LYS A 219 -22.489 26.336 -10.436 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.357 26.536 -11.338 1.00 0.00 C ATOM 1059 C LYS A 219 -21.596 25.761 -12.625 1.00 0.00 C ATOM 1060 O LYS A 219 -21.050 26.103 -13.673 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.052 26.063 -10.686 1.00 0.00 C ATOM 1062 CG LYS A 219 -18.769 26.360 -11.493 1.00 0.00 C ATOM 1063 CD LYS A 219 -18.579 27.859 -11.785 1.00 0.00 C ATOM 1064 CE LYS A 219 -17.358 28.110 -12.662 1.00 0.00 C ATOM 1065 NZ LYS A 219 -16.064 27.900 -11.928 1.00 0.00 N ATOM 0 H LYS A 219 -22.288 25.766 -9.615 1.00 0.00 H new ATOM 0 HA LYS A 219 -21.267 27.600 -11.557 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -19.963 26.533 -9.706 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -20.117 24.988 -10.519 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -17.905 25.990 -10.941 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -18.804 25.813 -12.435 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -19.469 28.250 -12.279 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -18.471 28.402 -10.846 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -17.393 27.446 -13.525 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -17.393 29.131 -13.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -15.267 28.084 -12.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -16.014 28.552 -11.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.014 26.919 -11.586 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.398 24.715 -12.547 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.673 23.889 -13.709 1.00 0.00 C ATOM 1081 C PHE A 220 -23.770 24.493 -14.572 1.00 0.00 C ATOM 1082 O PHE A 220 -24.786 24.958 -14.068 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.103 22.497 -13.264 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.077 21.790 -12.424 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -22.413 21.309 -11.149 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -20.768 21.593 -12.902 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -21.464 20.621 -10.361 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -19.812 20.918 -12.117 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.164 20.432 -10.845 1.00 0.00 C ATOM 0 H PHE A 220 -22.870 24.417 -11.693 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.758 23.830 -14.299 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.031 22.576 -12.698 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.317 21.893 -14.146 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -23.410 21.467 -10.765 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -20.494 21.962 -13.879 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -21.740 20.242 -9.388 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -18.809 20.774 -12.492 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.433 19.914 -10.243 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.561 24.465 -15.878 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.553 24.934 -16.837 1.00 0.00 C ATOM 1101 C ILE A 221 -24.784 23.809 -17.837 1.00 0.00 C ATOM 1102 O ILE A 221 -23.989 22.863 -17.920 1.00 0.00 O ATOM 1103 CB ILE A 221 -24.110 26.252 -17.572 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.953 25.999 -18.557 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.674 27.310 -16.550 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.661 27.178 -19.504 1.00 0.00 C ATOM 0 H ILE A 221 -22.702 24.118 -16.304 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.472 25.186 -16.309 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.971 26.609 -18.137 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -22.051 25.771 -17.989 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -23.185 25.117 -19.154 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.370 28.217 -17.072 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.506 27.537 -15.884 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.836 26.929 -15.967 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.833 26.918 -20.164 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.547 27.393 -20.101 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -22.395 28.058 -18.918 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.860 23.915 -18.600 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.201 22.920 -19.615 1.00 0.00 C ATOM 1120 C ARG A 222 -26.125 23.616 -20.960 1.00 0.00 C ATOM 1121 O ARG A 222 -26.717 24.676 -21.134 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.610 22.389 -19.366 1.00 0.00 C ATOM 1123 CG ARG A 222 -28.013 21.242 -20.286 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.478 20.883 -20.080 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.360 21.987 -20.499 1.00 0.00 N ATOM 1126 CZ ARG A 222 -31.681 22.016 -20.356 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -32.347 21.029 -19.808 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -32.340 23.065 -20.762 1.00 0.00 N ATOM 0 H ARG A 222 -26.522 24.688 -18.537 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.516 22.073 -19.583 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.683 22.054 -18.331 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.322 23.206 -19.488 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -27.844 21.525 -21.325 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.388 20.372 -20.087 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.719 19.985 -20.649 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.654 20.651 -19.030 1.00 0.00 H new ATOM 0 HE ARG A 222 -29.920 22.797 -20.935 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -31.851 20.203 -19.474 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -33.361 21.087 -19.715 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -31.841 23.849 -21.183 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -33.354 23.102 -20.659 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.397 23.032 -21.898 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.185 23.636 -23.204 1.00 0.00 C ATOM 1144 C VAL A 223 -25.689 22.708 -24.310 1.00 0.00 C ATOM 1145 O VAL A 223 -25.630 21.479 -24.193 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.696 24.119 -23.353 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -22.718 23.055 -23.482 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -23.548 25.071 -24.511 1.00 0.00 C ATOM 0 H VAL A 223 -24.938 22.129 -21.777 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.783 24.542 -23.305 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.480 24.623 -22.411 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -21.722 23.486 -23.579 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -22.753 22.419 -22.597 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -22.943 22.459 -24.366 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -22.508 25.389 -24.590 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -23.846 24.572 -25.433 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -24.182 25.942 -24.349 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.242 23.299 -25.360 1.00 0.00 N ATOM 1159 CA GLN A 224 -26.771 22.530 -26.483 1.00 0.00 C ATOM 1160 C GLN A 224 -25.622 21.831 -27.203 1.00 0.00 C ATOM 1161 O GLN A 224 -24.458 22.191 -27.030 1.00 0.00 O ATOM 1162 CB GLN A 224 -27.513 23.438 -27.469 1.00 0.00 C ATOM 1163 CG GLN A 224 -28.689 24.184 -26.855 1.00 0.00 C ATOM 1164 CD GLN A 224 -29.614 24.746 -27.911 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -30.451 24.041 -28.440 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -29.474 26.011 -28.211 1.00 0.00 N ATOM 0 H GLN A 224 -26.337 24.310 -25.460 1.00 0.00 H new ATOM 0 HA GLN A 224 -27.475 21.793 -26.097 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -26.810 24.163 -27.880 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -27.873 22.835 -28.303 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -29.247 23.510 -26.205 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -28.317 24.995 -26.229 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -28.759 26.570 -27.745 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -30.080 26.439 -28.911 1.00 0.00 H new ATOM 1265 N SER A 232 -27.288 16.168 -23.892 1.00 0.00 N ATOM 1266 CA SER A 232 -26.904 17.547 -23.590 1.00 0.00 C ATOM 1267 C SER A 232 -25.506 17.593 -22.980 1.00 0.00 C ATOM 1268 O SER A 232 -25.065 16.624 -22.346 1.00 0.00 O ATOM 1269 CB SER A 232 -27.894 18.162 -22.606 1.00 0.00 C ATOM 1270 OG SER A 232 -29.226 17.962 -23.048 1.00 0.00 O ATOM 0 HA SER A 232 -26.909 18.113 -24.522 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.761 17.715 -21.621 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.696 19.229 -22.501 1.00 0.00 H new ATOM 0 HG SER A 232 -29.261 17.179 -23.637 1.00 0.00 H new ATOM 1276 N TRP A 233 -24.819 18.711 -23.157 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.487 18.889 -22.620 1.00 0.00 C ATOM 1278 C TRP A 233 -23.657 19.547 -21.268 1.00 0.00 C ATOM 1279 O TRP A 233 -24.565 20.360 -21.087 1.00 0.00 O ATOM 1280 CB TRP A 233 -22.752 19.878 -23.494 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.171 19.392 -24.775 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.491 19.830 -26.012 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.124 18.423 -24.973 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -21.748 19.224 -26.972 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -20.891 18.344 -26.379 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.344 17.633 -24.113 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -19.915 17.496 -26.937 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.353 16.777 -24.671 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.156 16.719 -26.080 1.00 0.00 C ATOM 0 H TRP A 233 -25.171 19.516 -23.676 1.00 0.00 H new ATOM 0 HA TRP A 233 -22.951 17.941 -22.565 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.440 20.690 -23.728 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -21.942 20.306 -22.903 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.248 20.574 -26.213 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -21.819 19.398 -27.975 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.494 17.674 -23.044 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -19.763 17.453 -28.005 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.745 16.166 -24.020 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.403 16.059 -26.486 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.780 19.230 -20.337 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.767 19.876 -19.036 1.00 0.00 C ATOM 1302 C TRP A 234 -21.373 20.449 -18.900 1.00 0.00 C ATOM 1303 O TRP A 234 -20.390 19.777 -19.229 1.00 0.00 O ATOM 1304 CB TRP A 234 -23.078 18.862 -17.941 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.433 18.250 -18.132 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.738 17.140 -18.852 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.690 18.727 -17.616 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -26.075 16.877 -18.832 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.701 17.827 -18.074 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -26.070 19.823 -16.815 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -28.062 17.988 -17.742 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.438 19.985 -16.472 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.419 19.060 -16.940 1.00 0.00 C ATOM 0 H TRP A 234 -22.058 18.520 -20.458 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.523 20.656 -18.943 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.320 18.079 -17.942 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -23.031 19.350 -16.967 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -24.010 16.539 -19.376 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.534 16.099 -19.305 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.331 20.529 -16.467 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.806 17.294 -18.103 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.739 20.816 -15.851 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.454 19.198 -16.665 1.00 0.00 H new ATOM 1324 N MET A 235 -21.273 21.688 -18.450 1.00 0.00 N ATOM 1325 CA MET A 235 -19.979 22.351 -18.350 1.00 0.00 C ATOM 1326 C MET A 235 -19.951 23.388 -17.246 1.00 0.00 C ATOM 1327 O MET A 235 -20.969 23.681 -16.640 1.00 0.00 O ATOM 1328 CB MET A 235 -19.610 22.995 -19.687 1.00 0.00 C ATOM 1329 CG MET A 235 -20.583 24.011 -20.216 1.00 0.00 C ATOM 1330 SD MET A 235 -19.941 24.821 -21.696 1.00 0.00 S ATOM 1331 CE MET A 235 -18.607 25.842 -20.990 1.00 0.00 C ATOM 0 H MET A 235 -22.066 22.255 -18.149 1.00 0.00 H new ATOM 0 HA MET A 235 -19.242 21.588 -18.099 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.636 23.473 -19.582 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.499 22.206 -20.430 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.531 23.525 -20.447 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.786 24.758 -19.449 1.00 0.00 H new ATOM 0 HE1 MET A 235 -18.260 26.555 -21.738 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.983 26.382 -20.121 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.779 25.201 -20.688 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.772 23.931 -16.984 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.590 24.939 -15.944 1.00 0.00 C ATOM 1343 C LEU A 236 -18.937 26.280 -16.580 1.00 0.00 C ATOM 1344 O LEU A 236 -18.565 26.515 -17.722 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.123 24.943 -15.461 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.515 23.563 -15.131 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.032 23.646 -14.754 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.254 22.852 -14.023 1.00 0.00 C ATOM 0 H LEU A 236 -17.916 23.688 -17.483 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.222 24.736 -15.080 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.510 25.414 -16.229 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.056 25.569 -14.572 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.616 22.989 -16.052 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.657 22.647 -14.532 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.468 24.069 -15.586 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -14.915 24.281 -13.876 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -16.784 21.887 -13.833 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.221 23.457 -13.117 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.292 22.698 -14.318 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.645 27.145 -15.868 1.00 0.00 N ATOM 1361 CA ASN A 237 -20.012 28.457 -16.409 1.00 0.00 C ATOM 1362 C ASN A 237 -18.747 29.258 -16.777 1.00 0.00 C ATOM 1363 O ASN A 237 -17.925 29.536 -15.895 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.822 29.266 -15.382 1.00 0.00 C ATOM 1365 CG ASN A 237 -21.441 30.514 -15.982 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -21.022 30.970 -17.024 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -22.417 31.066 -15.328 1.00 0.00 N ATOM 0 H ASN A 237 -19.978 26.969 -14.920 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.619 28.289 -17.299 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.610 28.636 -14.969 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -20.173 29.549 -14.554 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -22.858 31.912 -15.688 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -22.743 30.653 -14.454 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.589 29.655 -18.060 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.449 30.476 -18.489 1.00 0.00 C ATOM 1376 C PRO A 238 -17.315 31.794 -17.737 1.00 0.00 C ATOM 1377 O PRO A 238 -16.218 32.313 -17.558 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.773 30.780 -19.954 1.00 0.00 C ATOM 1379 CG PRO A 238 -18.657 29.707 -20.380 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.486 29.366 -19.192 1.00 0.00 C ATOM 0 HA PRO A 238 -16.511 29.950 -18.311 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -18.256 31.752 -20.057 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -16.867 30.808 -20.560 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -19.282 30.024 -21.215 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -18.087 28.842 -20.720 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.394 29.967 -19.149 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.795 28.321 -19.204 1.00 0.00 H new