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 213 ASN : amide:sc= 0.649 K(o=1.1,f=-0.026) USER MOD Set 1.2: A 217 HIS : no HE2:sc= 0.445 K(o=1.1,f=-1.3!) USER MOD Set 2.1: A 179 THR OG1 : rot 110:sc= 0.405 USER MOD Set 2.2: A 181 SER OG : rot 180:sc= 0.193 USER MOD Set 2.3: A 182 GLN : amide:sc= 0.309 K(o=0.91,f=0.35) USER MOD Set 3.1: A 162 TYR OH : rot 64:sc= 0.0461 USER MOD Set 3.2: A 209 SER OG : rot 75:sc= 1.08 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 82:sc= 0.793 USER MOD Single : A 168 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00205) USER MOD Single : A 172 SER OG : rot 88:sc= 1.22 USER MOD Single : A 173 SER OG : rot -81:sc= 1.29 USER MOD Single : A 176 LYS NZ :NH3+ -176:sc= 1.27 (180deg=1.26) USER MOD Single : A 184 TYR OH : rot -58:sc= -0.0781 USER MOD Single : A 187 MET CE :methyl -162:sc= 0 (180deg=-0.445) USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 SER OG : rot 177:sc= 0.0171 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+ 169:sc= 1.2 (180deg=1.15) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 202 SER OG : rot -119:sc= 0.89 USER MOD Single : A 203 SER OG : rot 55:sc= 1.21 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 208 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 212 HIS : no HD1:sc= -0.101 X(o=-0.1,f=0) USER MOD Single : A 215 SER OG : rot 180:sc= 0 USER MOD Single : A 218 SER OG : rot 180:sc= 0.0353 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 24:sc= 0.169 USER MOD Single : A 235 MET CE :methyl -118:sc= -0.0155 (180deg=-0.221) USER MOD Single : A 237 ASN : amide:sc= -0.959 K(o=-0.96,f=-0.00012) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -13.246 13.840 -2.121 1.00 0.00 N ATOM 117 CA LEU A 160 -13.740 14.903 -2.996 1.00 0.00 C ATOM 118 C LEU A 160 -15.254 14.778 -3.083 1.00 0.00 C ATOM 119 O LEU A 160 -15.792 13.673 -3.178 1.00 0.00 O ATOM 120 CB LEU A 160 -13.136 14.801 -4.401 1.00 0.00 C ATOM 121 CG LEU A 160 -11.647 15.157 -4.537 1.00 0.00 C ATOM 122 CD1 LEU A 160 -11.212 14.970 -5.989 1.00 0.00 C ATOM 123 CD2 LEU A 160 -11.351 16.600 -4.107 1.00 0.00 C ATOM 0 HA LEU A 160 -13.450 15.868 -2.582 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -13.277 13.781 -4.759 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.704 15.453 -5.064 1.00 0.00 H new ATOM 0 HG LEU A 160 -11.090 14.492 -3.877 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.156 15.222 -6.088 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -11.367 13.932 -6.284 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -11.802 15.622 -6.633 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.286 16.803 -4.222 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -11.921 17.289 -4.730 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -11.636 16.734 -3.063 1.00 0.00 H new ATOM 135 N SER A 161 -15.940 15.909 -3.054 1.00 0.00 N ATOM 136 CA SER A 161 -17.395 15.921 -3.116 1.00 0.00 C ATOM 137 C SER A 161 -17.846 15.603 -4.533 1.00 0.00 C ATOM 138 O SER A 161 -17.061 15.694 -5.475 1.00 0.00 O ATOM 139 CB SER A 161 -17.926 17.299 -2.721 1.00 0.00 C ATOM 140 OG SER A 161 -17.470 17.656 -1.433 1.00 0.00 O ATOM 0 H SER A 161 -15.513 16.833 -2.988 1.00 0.00 H new ATOM 0 HA SER A 161 -17.784 15.172 -2.426 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.599 18.043 -3.448 1.00 0.00 H new ATOM 0 HB3 SER A 161 -19.016 17.294 -2.738 1.00 0.00 H new ATOM 0 HG SER A 161 -17.818 18.541 -1.197 1.00 0.00 H new ATOM 146 N TYR A 162 -19.115 15.258 -4.698 1.00 0.00 N ATOM 147 CA TYR A 162 -19.650 14.981 -6.029 1.00 0.00 C ATOM 148 C TYR A 162 -19.405 16.178 -6.936 1.00 0.00 C ATOM 149 O TYR A 162 -18.962 16.016 -8.056 1.00 0.00 O ATOM 150 CB TYR A 162 -21.149 14.700 -5.976 1.00 0.00 C ATOM 151 CG TYR A 162 -21.490 13.265 -5.663 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.565 12.307 -6.695 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.753 12.850 -4.341 1.00 0.00 C ATOM 154 CE1 TYR A 162 -21.898 10.960 -6.415 1.00 0.00 C ATOM 155 CE2 TYR A 162 -22.082 11.499 -4.056 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.151 10.567 -5.095 1.00 0.00 C ATOM 157 OH TYR A 162 -22.475 9.266 -4.814 1.00 0.00 O ATOM 0 H TYR A 162 -19.789 15.163 -3.938 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.143 14.098 -6.419 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.603 15.344 -5.223 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.593 14.968 -6.935 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.366 12.605 -7.714 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.703 13.568 -3.536 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -21.957 10.238 -7.216 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -22.278 11.192 -3.039 1.00 0.00 H new ATOM 0 HH TYR A 162 -21.720 8.684 -5.042 1.00 0.00 H new ATOM 167 N ALA A 163 -19.676 17.379 -6.444 1.00 0.00 N ATOM 168 CA ALA A 163 -19.477 18.590 -7.236 1.00 0.00 C ATOM 169 C ALA A 163 -18.027 18.721 -7.728 1.00 0.00 C ATOM 170 O ALA A 163 -17.791 19.108 -8.872 1.00 0.00 O ATOM 171 CB ALA A 163 -19.869 19.813 -6.413 1.00 0.00 C ATOM 0 H ALA A 163 -20.033 17.543 -5.503 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.114 18.523 -8.118 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.719 20.715 -7.007 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -20.918 19.738 -6.126 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.250 19.862 -5.517 1.00 0.00 H new ATOM 177 N ASP A 164 -17.069 18.390 -6.873 1.00 0.00 N ATOM 178 CA ASP A 164 -15.653 18.488 -7.232 1.00 0.00 C ATOM 179 C ASP A 164 -15.314 17.484 -8.320 1.00 0.00 C ATOM 180 O ASP A 164 -14.565 17.783 -9.238 1.00 0.00 O ATOM 181 CB ASP A 164 -14.756 18.193 -6.026 1.00 0.00 C ATOM 182 CG ASP A 164 -14.958 19.169 -4.893 1.00 0.00 C ATOM 183 OD1 ASP A 164 -14.959 20.394 -5.137 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.128 18.699 -3.746 1.00 0.00 O ATOM 0 H ASP A 164 -17.242 18.051 -5.926 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.478 19.506 -7.581 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -14.956 17.183 -5.669 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.713 18.219 -6.340 1.00 0.00 H new ATOM 189 N LEU A 165 -15.861 16.283 -8.210 1.00 0.00 N ATOM 190 CA LEU A 165 -15.590 15.221 -9.180 1.00 0.00 C ATOM 191 C LEU A 165 -16.239 15.514 -10.528 1.00 0.00 C ATOM 192 O LEU A 165 -15.633 15.297 -11.572 1.00 0.00 O ATOM 193 CB LEU A 165 -16.099 13.882 -8.642 1.00 0.00 C ATOM 194 CG LEU A 165 -15.363 13.339 -7.408 1.00 0.00 C ATOM 195 CD1 LEU A 165 -16.103 12.124 -6.872 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.917 12.963 -7.745 1.00 0.00 C ATOM 0 H LEU A 165 -16.497 16.014 -7.459 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.511 15.172 -9.329 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.155 13.988 -8.395 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -16.031 13.141 -9.439 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.338 14.121 -6.649 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.582 11.738 -5.996 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -17.118 12.409 -6.594 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -16.141 11.353 -7.641 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.422 12.582 -6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.912 12.195 -8.518 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.386 13.844 -8.105 1.00 0.00 H new ATOM 208 N ILE A 166 -17.465 16.018 -10.504 1.00 0.00 N ATOM 209 CA ILE A 166 -18.174 16.375 -11.735 1.00 0.00 C ATOM 210 C ILE A 166 -17.372 17.478 -12.419 1.00 0.00 C ATOM 211 O ILE A 166 -17.111 17.427 -13.618 1.00 0.00 O ATOM 212 CB ILE A 166 -19.618 16.887 -11.435 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.471 15.786 -10.789 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.324 17.332 -12.719 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.697 16.325 -10.019 1.00 0.00 C ATOM 0 H ILE A 166 -17.993 16.191 -9.649 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.266 15.495 -12.372 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.515 17.731 -10.753 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.812 15.100 -11.565 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.848 15.209 -10.105 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.328 17.684 -12.479 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.758 18.139 -13.184 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.389 16.490 -13.409 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.252 15.491 -9.590 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.363 16.988 -9.221 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.342 16.877 -10.703 1.00 0.00 H new ATOM 227 N THR A 167 -16.967 18.472 -11.642 1.00 0.00 N ATOM 228 CA THR A 167 -16.161 19.565 -12.166 1.00 0.00 C ATOM 229 C THR A 167 -14.840 19.049 -12.722 1.00 0.00 C ATOM 230 O THR A 167 -14.458 19.420 -13.823 1.00 0.00 O ATOM 231 CB THR A 167 -15.873 20.605 -11.065 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.095 21.215 -10.641 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.933 21.680 -11.529 1.00 0.00 C ATOM 0 H THR A 167 -17.183 18.544 -10.648 1.00 0.00 H new ATOM 0 HA THR A 167 -16.728 20.035 -12.970 1.00 0.00 H new ATOM 0 HB THR A 167 -15.401 20.073 -10.239 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.541 20.635 -9.989 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.761 22.388 -10.718 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.985 21.231 -11.826 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.369 22.202 -12.381 1.00 0.00 H new ATOM 241 N LYS A 168 -14.145 18.190 -11.983 1.00 0.00 N ATOM 242 CA LYS A 168 -12.854 17.669 -12.440 1.00 0.00 C ATOM 243 C LYS A 168 -12.975 16.961 -13.766 1.00 0.00 C ATOM 244 O LYS A 168 -12.094 17.084 -14.603 1.00 0.00 O ATOM 245 CB LYS A 168 -12.263 16.682 -11.441 1.00 0.00 C ATOM 246 CG LYS A 168 -11.236 17.278 -10.508 1.00 0.00 C ATOM 247 CD LYS A 168 -10.453 16.164 -9.826 1.00 0.00 C ATOM 248 CE LYS A 168 -9.309 16.725 -8.997 1.00 0.00 C ATOM 249 NZ LYS A 168 -8.436 15.620 -8.476 1.00 0.00 N ATOM 0 H LYS A 168 -14.447 17.841 -11.074 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.201 18.536 -12.540 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -13.072 16.257 -10.847 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.804 15.860 -11.990 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -10.557 17.925 -11.064 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -11.728 17.900 -9.760 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -11.120 15.586 -9.186 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -10.060 15.480 -10.578 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -8.715 17.408 -9.604 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -9.707 17.303 -8.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -7.671 16.025 -7.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -9.005 14.974 -7.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -8.026 15.095 -9.275 1.00 0.00 H new ATOM 263 N ALA A 169 -14.060 16.233 -13.967 1.00 0.00 N ATOM 264 CA ALA A 169 -14.274 15.536 -15.222 1.00 0.00 C ATOM 265 C ALA A 169 -14.315 16.544 -16.370 1.00 0.00 C ATOM 266 O ALA A 169 -13.702 16.346 -17.417 1.00 0.00 O ATOM 267 CB ALA A 169 -15.581 14.746 -15.155 1.00 0.00 C ATOM 0 H ALA A 169 -14.804 16.110 -13.280 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.454 14.840 -15.398 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.739 14.224 -16.099 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.526 14.021 -14.343 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.411 15.430 -14.975 1.00 0.00 H new ATOM 273 N ILE A 170 -15.036 17.632 -16.158 1.00 0.00 N ATOM 274 CA ILE A 170 -15.193 18.660 -17.179 1.00 0.00 C ATOM 275 C ILE A 170 -13.855 19.357 -17.432 1.00 0.00 C ATOM 276 O ILE A 170 -13.497 19.624 -18.574 1.00 0.00 O ATOM 277 CB ILE A 170 -16.268 19.696 -16.746 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.648 19.009 -16.622 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.350 20.838 -17.757 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.639 19.755 -15.719 1.00 0.00 C ATOM 0 H ILE A 170 -15.525 17.829 -15.285 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.523 18.187 -18.104 1.00 0.00 H new ATOM 0 HB ILE A 170 -15.981 20.105 -15.777 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.083 18.909 -17.616 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.507 18.001 -16.233 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.108 21.553 -17.437 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.383 21.338 -17.821 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.618 20.439 -18.735 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.582 19.209 -15.685 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.227 19.832 -14.713 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.813 20.755 -16.117 1.00 0.00 H new ATOM 292 N GLU A 171 -13.108 19.640 -16.377 1.00 0.00 N ATOM 293 CA GLU A 171 -11.809 20.308 -16.518 1.00 0.00 C ATOM 294 C GLU A 171 -10.796 19.412 -17.222 1.00 0.00 C ATOM 295 O GLU A 171 -9.878 19.896 -17.886 1.00 0.00 O ATOM 296 CB GLU A 171 -11.263 20.709 -15.145 1.00 0.00 C ATOM 297 CG GLU A 171 -12.169 21.688 -14.417 1.00 0.00 C ATOM 298 CD GLU A 171 -11.417 22.756 -13.633 1.00 0.00 C ATOM 299 OE1 GLU A 171 -11.567 22.792 -12.389 1.00 0.00 O ATOM 300 OE2 GLU A 171 -10.695 23.568 -14.251 1.00 0.00 O ATOM 0 H GLU A 171 -13.370 19.422 -15.416 1.00 0.00 H new ATOM 0 HA GLU A 171 -11.964 21.200 -17.125 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.135 19.815 -14.534 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.276 21.155 -15.267 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -12.820 22.175 -15.143 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -12.812 21.134 -13.733 1.00 0.00 H new ATOM 307 N SER A 172 -10.978 18.108 -17.079 1.00 0.00 N ATOM 308 CA SER A 172 -10.084 17.121 -17.698 1.00 0.00 C ATOM 309 C SER A 172 -10.345 16.998 -19.193 1.00 0.00 C ATOM 310 O SER A 172 -9.456 16.638 -19.957 1.00 0.00 O ATOM 311 CB SER A 172 -10.280 15.739 -17.068 1.00 0.00 C ATOM 312 OG SER A 172 -10.016 15.760 -15.675 1.00 0.00 O ATOM 0 H SER A 172 -11.740 17.699 -16.537 1.00 0.00 H new ATOM 0 HA SER A 172 -9.065 17.470 -17.531 1.00 0.00 H new ATOM 0 HB2 SER A 172 -11.302 15.401 -17.241 1.00 0.00 H new ATOM 0 HB3 SER A 172 -9.620 15.020 -17.553 1.00 0.00 H new ATOM 0 HG SER A 172 -10.834 15.996 -15.190 1.00 0.00 H new ATOM 318 N SER A 173 -11.569 17.284 -19.609 1.00 0.00 N ATOM 319 CA SER A 173 -11.927 17.177 -21.020 1.00 0.00 C ATOM 320 C SER A 173 -11.213 18.254 -21.823 1.00 0.00 C ATOM 321 O SER A 173 -10.937 19.337 -21.314 1.00 0.00 O ATOM 322 CB SER A 173 -13.434 17.321 -21.192 1.00 0.00 C ATOM 323 OG SER A 173 -13.843 18.661 -21.043 1.00 0.00 O ATOM 0 H SER A 173 -12.327 17.589 -18.998 1.00 0.00 H new ATOM 0 HA SER A 173 -11.620 16.197 -21.385 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.726 16.958 -22.177 1.00 0.00 H new ATOM 0 HB3 SER A 173 -13.947 16.699 -20.458 1.00 0.00 H new ATOM 0 HG SER A 173 -13.919 18.876 -20.090 1.00 0.00 H new ATOM 329 N ALA A 174 -10.916 17.976 -23.084 1.00 0.00 N ATOM 330 CA ALA A 174 -10.253 18.962 -23.931 1.00 0.00 C ATOM 331 C ALA A 174 -11.197 20.137 -24.213 1.00 0.00 C ATOM 332 O ALA A 174 -10.795 21.293 -24.196 1.00 0.00 O ATOM 333 CB ALA A 174 -9.809 18.305 -25.247 1.00 0.00 C ATOM 0 H ALA A 174 -11.120 17.087 -23.541 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.373 19.342 -23.413 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -9.315 19.046 -25.875 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -9.116 17.492 -25.032 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.681 17.911 -25.769 1.00 0.00 H new ATOM 339 N GLU A 175 -12.454 19.814 -24.476 1.00 0.00 N ATOM 340 CA GLU A 175 -13.462 20.812 -24.845 1.00 0.00 C ATOM 341 C GLU A 175 -14.039 21.598 -23.663 1.00 0.00 C ATOM 342 O GLU A 175 -14.840 22.511 -23.857 1.00 0.00 O ATOM 343 CB GLU A 175 -14.636 20.110 -25.523 1.00 0.00 C ATOM 344 CG GLU A 175 -14.294 19.263 -26.729 1.00 0.00 C ATOM 345 CD GLU A 175 -15.559 18.829 -27.456 1.00 0.00 C ATOM 346 OE1 GLU A 175 -16.526 18.411 -26.782 1.00 0.00 O ATOM 347 OE2 GLU A 175 -15.607 18.933 -28.695 1.00 0.00 O ATOM 0 H GLU A 175 -12.809 18.858 -24.442 1.00 0.00 H new ATOM 0 HA GLU A 175 -12.947 21.518 -25.496 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -15.129 19.476 -24.786 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.359 20.866 -25.828 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -13.654 19.828 -27.407 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.729 18.385 -26.415 1.00 0.00 H new ATOM 354 N LYS A 176 -13.648 21.223 -22.448 1.00 0.00 N ATOM 355 CA LYS A 176 -14.159 21.822 -21.204 1.00 0.00 C ATOM 356 C LYS A 176 -15.670 21.686 -21.084 1.00 0.00 C ATOM 357 O LYS A 176 -16.347 22.550 -20.533 1.00 0.00 O ATOM 358 CB LYS A 176 -13.700 23.281 -21.043 1.00 0.00 C ATOM 359 CG LYS A 176 -12.194 23.482 -21.275 1.00 0.00 C ATOM 360 CD LYS A 176 -11.342 22.533 -20.408 1.00 0.00 C ATOM 361 CE LYS A 176 -9.864 22.633 -20.729 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.171 21.384 -20.252 1.00 0.00 N ATOM 0 H LYS A 176 -12.960 20.487 -22.291 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.726 21.257 -20.379 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.254 23.907 -21.743 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -13.953 23.624 -20.040 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -11.964 23.315 -22.327 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -11.928 24.515 -21.050 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -11.500 22.767 -19.355 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.676 21.507 -20.560 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -9.720 22.757 -21.802 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -9.433 23.510 -20.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.147 21.474 -20.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -9.357 21.250 -19.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.530 20.564 -20.781 1.00 0.00 H new ATOM 376 N ARG A 177 -16.177 20.571 -21.589 1.00 0.00 N ATOM 377 CA ARG A 177 -17.594 20.210 -21.520 1.00 0.00 C ATOM 378 C ARG A 177 -17.609 18.703 -21.644 1.00 0.00 C ATOM 379 O ARG A 177 -16.743 18.141 -22.303 1.00 0.00 O ATOM 380 CB ARG A 177 -18.409 20.851 -22.662 1.00 0.00 C ATOM 381 CG ARG A 177 -17.872 20.545 -24.052 1.00 0.00 C ATOM 382 CD ARG A 177 -18.739 21.096 -25.159 1.00 0.00 C ATOM 383 NE ARG A 177 -18.099 20.830 -26.460 1.00 0.00 N ATOM 384 CZ ARG A 177 -17.679 21.751 -27.323 1.00 0.00 C ATOM 385 NH1 ARG A 177 -17.798 23.037 -27.094 1.00 0.00 N ATOM 386 NH2 ARG A 177 -17.117 21.374 -28.433 1.00 0.00 N ATOM 0 H ARG A 177 -15.607 19.875 -22.069 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.051 20.565 -20.596 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.440 20.504 -22.598 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.426 21.932 -22.520 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -16.868 20.958 -24.146 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -17.784 19.465 -24.171 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.726 20.636 -25.126 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -18.883 22.168 -25.024 1.00 0.00 H new ATOM 0 HE ARG A 177 -17.966 19.853 -26.722 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -18.226 23.363 -26.227 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -17.463 23.711 -27.782 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -17.002 20.381 -28.635 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.791 22.071 -29.102 1.00 0.00 H new ATOM 400 N LEU A 178 -18.569 18.051 -21.015 1.00 0.00 N ATOM 401 CA LEU A 178 -18.718 16.602 -21.126 1.00 0.00 C ATOM 402 C LEU A 178 -20.192 16.280 -21.100 1.00 0.00 C ATOM 403 O LEU A 178 -20.981 17.045 -20.563 1.00 0.00 O ATOM 404 CB LEU A 178 -18.062 15.878 -19.948 1.00 0.00 C ATOM 405 CG LEU A 178 -16.538 15.697 -19.933 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.183 14.812 -18.769 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.026 15.045 -21.212 1.00 0.00 C ATOM 0 H LEU A 178 -19.263 18.500 -20.418 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.240 16.275 -22.050 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.337 16.414 -19.040 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.510 14.887 -19.882 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.077 16.681 -19.850 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.103 14.668 -18.737 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.514 15.280 -17.842 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.674 13.846 -18.883 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -14.943 14.937 -21.157 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.483 14.062 -21.328 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.285 15.669 -22.067 1.00 0.00 H new ATOM 419 N THR A 179 -20.575 15.147 -21.657 1.00 0.00 N ATOM 420 CA THR A 179 -21.961 14.720 -21.563 1.00 0.00 C ATOM 421 C THR A 179 -22.112 13.957 -20.261 1.00 0.00 C ATOM 422 O THR A 179 -21.125 13.523 -19.675 1.00 0.00 O ATOM 423 CB THR A 179 -22.380 13.830 -22.739 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.427 12.779 -22.911 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.456 14.632 -24.013 1.00 0.00 C ATOM 0 H THR A 179 -19.961 14.515 -22.170 1.00 0.00 H new ATOM 0 HA THR A 179 -22.607 15.598 -21.593 1.00 0.00 H new ATOM 0 HB THR A 179 -23.363 13.413 -22.520 1.00 0.00 H new ATOM 0 HG1 THR A 179 -21.830 11.926 -22.646 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.755 13.982 -24.835 1.00 0.00 H new ATOM 0 HG22 THR A 179 -23.189 15.431 -23.897 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.479 15.065 -24.229 1.00 0.00 H new ATOM 433 N LEU A 180 -23.344 13.785 -19.806 1.00 0.00 N ATOM 434 CA LEU A 180 -23.599 13.087 -18.545 1.00 0.00 C ATOM 435 C LEU A 180 -22.975 11.685 -18.512 1.00 0.00 C ATOM 436 O LEU A 180 -22.436 11.263 -17.494 1.00 0.00 O ATOM 437 CB LEU A 180 -25.111 13.006 -18.305 1.00 0.00 C ATOM 438 CG LEU A 180 -25.563 12.484 -16.934 1.00 0.00 C ATOM 439 CD1 LEU A 180 -25.058 13.369 -15.791 1.00 0.00 C ATOM 440 CD2 LEU A 180 -27.089 12.422 -16.898 1.00 0.00 C ATOM 0 H LEU A 180 -24.182 14.115 -20.285 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.125 13.659 -17.747 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.532 14.001 -18.446 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.544 12.365 -19.073 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.138 11.490 -16.795 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -25.400 12.964 -14.839 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -23.968 13.394 -15.804 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -25.445 14.380 -15.915 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -27.415 12.052 -15.926 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -27.498 13.419 -17.062 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -27.444 11.751 -17.680 1.00 0.00 H new ATOM 452 N SER A 181 -23.033 10.976 -19.630 1.00 0.00 N ATOM 453 CA SER A 181 -22.450 9.639 -19.722 1.00 0.00 C ATOM 454 C SER A 181 -20.927 9.675 -19.580 1.00 0.00 C ATOM 455 O SER A 181 -20.342 8.823 -18.931 1.00 0.00 O ATOM 456 CB SER A 181 -22.814 9.025 -21.071 1.00 0.00 C ATOM 457 OG SER A 181 -22.832 10.027 -22.082 1.00 0.00 O ATOM 0 H SER A 181 -23.477 11.302 -20.488 1.00 0.00 H new ATOM 0 HA SER A 181 -22.851 9.038 -18.906 1.00 0.00 H new ATOM 0 HB2 SER A 181 -22.094 8.249 -21.331 1.00 0.00 H new ATOM 0 HB3 SER A 181 -23.791 8.545 -21.008 1.00 0.00 H new ATOM 0 HG SER A 181 -23.065 9.620 -22.942 1.00 0.00 H new ATOM 463 N GLN A 182 -20.294 10.672 -20.175 1.00 0.00 N ATOM 464 CA GLN A 182 -18.839 10.796 -20.121 1.00 0.00 C ATOM 465 C GLN A 182 -18.362 11.100 -18.706 1.00 0.00 C ATOM 466 O GLN A 182 -17.324 10.620 -18.275 1.00 0.00 O ATOM 467 CB GLN A 182 -18.383 11.907 -21.061 1.00 0.00 C ATOM 468 CG GLN A 182 -18.313 11.462 -22.520 1.00 0.00 C ATOM 469 CD GLN A 182 -17.773 12.543 -23.431 1.00 0.00 C ATOM 470 OE1 GLN A 182 -16.582 12.741 -23.529 1.00 0.00 O ATOM 471 NE2 GLN A 182 -18.654 13.249 -24.093 1.00 0.00 N ATOM 0 H GLN A 182 -20.761 11.410 -20.702 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.406 9.845 -20.431 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.068 12.751 -20.977 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.401 12.261 -20.747 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -17.681 10.578 -22.597 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -19.309 11.172 -22.856 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -19.649 13.053 -23.985 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -18.345 13.995 -24.717 1.00 0.00 H new ATOM 480 N ILE A 183 -19.130 11.892 -17.974 1.00 0.00 N ATOM 481 CA ILE A 183 -18.794 12.216 -16.588 1.00 0.00 C ATOM 482 C ILE A 183 -18.859 10.937 -15.758 1.00 0.00 C ATOM 483 O ILE A 183 -18.038 10.722 -14.864 1.00 0.00 O ATOM 484 CB ILE A 183 -19.763 13.295 -16.042 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.540 14.594 -16.833 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.542 13.554 -14.527 1.00 0.00 C ATOM 487 CD1 ILE A 183 -20.730 15.493 -16.908 1.00 0.00 C ATOM 0 H ILE A 183 -19.990 12.324 -18.312 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.785 12.624 -16.530 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.787 12.941 -16.164 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.715 15.143 -16.378 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.231 14.337 -17.846 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.240 14.317 -14.183 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.710 12.631 -13.972 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.520 13.896 -14.362 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.478 16.383 -17.485 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.553 14.968 -17.393 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.029 15.786 -15.901 1.00 0.00 H new ATOM 499 N TYR A 184 -19.817 10.071 -16.061 1.00 0.00 N ATOM 500 CA TYR A 184 -19.913 8.798 -15.350 1.00 0.00 C ATOM 501 C TYR A 184 -18.661 7.965 -15.636 1.00 0.00 C ATOM 502 O TYR A 184 -18.023 7.458 -14.721 1.00 0.00 O ATOM 503 CB TYR A 184 -21.163 8.002 -15.768 1.00 0.00 C ATOM 504 CG TYR A 184 -22.513 8.628 -15.414 1.00 0.00 C ATOM 505 CD1 TYR A 184 -22.622 9.759 -14.567 1.00 0.00 C ATOM 506 CD2 TYR A 184 -23.704 8.070 -15.927 1.00 0.00 C ATOM 507 CE1 TYR A 184 -23.889 10.299 -14.233 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.974 8.615 -15.590 1.00 0.00 C ATOM 509 CZ TYR A 184 -25.047 9.720 -14.739 1.00 0.00 C ATOM 510 OH TYR A 184 -26.266 10.246 -14.388 1.00 0.00 O ATOM 0 H TYR A 184 -20.526 10.219 -16.779 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.994 9.012 -14.284 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -21.128 7.851 -16.847 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -21.111 7.016 -15.306 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -21.727 10.216 -14.171 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -23.650 7.216 -16.586 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -23.955 11.161 -13.585 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -25.877 8.177 -15.990 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.360 10.231 -13.413 1.00 0.00 H new ATOM 520 N GLU A 185 -18.297 7.831 -16.900 1.00 0.00 N ATOM 521 CA GLU A 185 -17.120 7.043 -17.265 1.00 0.00 C ATOM 522 C GLU A 185 -15.854 7.613 -16.628 1.00 0.00 C ATOM 523 O GLU A 185 -14.979 6.864 -16.193 1.00 0.00 O ATOM 524 CB GLU A 185 -16.973 6.997 -18.783 1.00 0.00 C ATOM 525 CG GLU A 185 -18.034 6.140 -19.451 1.00 0.00 C ATOM 526 CD GLU A 185 -17.891 6.121 -20.959 1.00 0.00 C ATOM 527 OE1 GLU A 185 -18.117 7.176 -21.594 1.00 0.00 O ATOM 528 OE2 GLU A 185 -17.562 5.050 -21.509 1.00 0.00 O ATOM 0 H GLU A 185 -18.790 8.251 -17.688 1.00 0.00 H new ATOM 0 HA GLU A 185 -17.258 6.030 -16.888 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -17.028 8.011 -19.180 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -15.986 6.609 -19.036 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -17.969 5.121 -19.069 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -19.022 6.517 -19.187 1.00 0.00 H new ATOM 535 N TRP A 186 -15.760 8.933 -16.547 1.00 0.00 N ATOM 536 CA TRP A 186 -14.609 9.574 -15.928 1.00 0.00 C ATOM 537 C TRP A 186 -14.497 9.180 -14.456 1.00 0.00 C ATOM 538 O TRP A 186 -13.403 8.929 -13.972 1.00 0.00 O ATOM 539 CB TRP A 186 -14.711 11.099 -16.058 1.00 0.00 C ATOM 540 CG TRP A 186 -13.537 11.815 -15.448 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.403 12.231 -16.066 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.379 12.199 -14.068 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.546 12.837 -15.191 1.00 0.00 N ATOM 544 CE2 TRP A 186 -12.105 12.822 -13.944 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.190 12.079 -12.925 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.619 13.304 -12.712 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.708 12.559 -11.684 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.422 13.163 -11.591 1.00 0.00 C ATOM 0 H TRP A 186 -16.465 9.579 -16.901 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.712 9.235 -16.447 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.785 11.365 -17.112 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.628 11.440 -15.578 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.203 12.099 -17.119 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.638 13.235 -15.430 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.168 11.626 -12.994 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.647 13.771 -12.643 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.321 12.466 -10.800 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -12.067 13.516 -10.634 1.00 0.00 H new ATOM 559 N MET A 187 -15.607 9.109 -13.733 1.00 0.00 N ATOM 560 CA MET A 187 -15.537 8.750 -12.310 1.00 0.00 C ATOM 561 C MET A 187 -15.132 7.296 -12.124 1.00 0.00 C ATOM 562 O MET A 187 -14.406 6.973 -11.191 1.00 0.00 O ATOM 563 CB MET A 187 -16.861 9.008 -11.593 1.00 0.00 C ATOM 564 CG MET A 187 -17.198 10.475 -11.473 1.00 0.00 C ATOM 565 SD MET A 187 -18.555 10.767 -10.341 1.00 0.00 S ATOM 566 CE MET A 187 -18.885 12.478 -10.677 1.00 0.00 C ATOM 0 H MET A 187 -16.546 9.288 -14.089 1.00 0.00 H new ATOM 0 HA MET A 187 -14.774 9.389 -11.866 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.662 8.501 -12.130 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.818 8.569 -10.596 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.319 11.021 -11.132 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.456 10.868 -12.456 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.465 12.904 -9.859 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.943 13.018 -10.774 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.449 12.564 -11.605 1.00 0.00 H new ATOM 576 N VAL A 188 -15.581 6.424 -13.015 1.00 0.00 N ATOM 577 CA VAL A 188 -15.206 5.007 -12.959 1.00 0.00 C ATOM 578 C VAL A 188 -13.701 4.889 -13.241 1.00 0.00 C ATOM 579 O VAL A 188 -12.996 4.078 -12.640 1.00 0.00 O ATOM 580 CB VAL A 188 -16.024 4.174 -14.008 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.580 2.712 -14.043 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.522 4.223 -13.681 1.00 0.00 C ATOM 0 H VAL A 188 -16.204 6.666 -13.786 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.432 4.609 -11.970 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.837 4.622 -14.984 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -16.171 2.170 -14.782 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.525 2.658 -14.312 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.727 2.263 -13.061 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -18.075 3.640 -14.418 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.691 3.806 -12.688 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.866 5.257 -13.704 1.00 0.00 H new ATOM 592 N LYS A 189 -13.205 5.710 -14.153 1.00 0.00 N ATOM 593 CA LYS A 189 -11.786 5.696 -14.510 1.00 0.00 C ATOM 594 C LYS A 189 -10.889 6.318 -13.433 1.00 0.00 C ATOM 595 O LYS A 189 -9.812 5.806 -13.147 1.00 0.00 O ATOM 596 CB LYS A 189 -11.600 6.468 -15.826 1.00 0.00 C ATOM 597 CG LYS A 189 -10.285 6.197 -16.558 1.00 0.00 C ATOM 598 CD LYS A 189 -10.342 4.881 -17.333 1.00 0.00 C ATOM 599 CE LYS A 189 -9.052 4.657 -18.119 1.00 0.00 C ATOM 600 NZ LYS A 189 -9.139 3.432 -18.995 1.00 0.00 N ATOM 0 H LYS A 189 -13.761 6.397 -14.663 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.486 4.653 -14.612 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.426 6.222 -16.493 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -11.667 7.535 -15.615 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -10.073 7.017 -17.244 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -9.466 6.163 -15.839 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -10.500 4.053 -16.642 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -11.192 4.893 -18.016 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -8.845 5.532 -18.736 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -8.217 4.551 -17.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -8.245 3.312 -19.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -9.312 2.594 -18.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -9.920 3.545 -19.673 1.00 0.00 H new ATOM 614 N SER A 190 -11.329 7.432 -12.864 1.00 0.00 N ATOM 615 CA SER A 190 -10.520 8.208 -11.918 1.00 0.00 C ATOM 616 C SER A 190 -10.655 7.870 -10.433 1.00 0.00 C ATOM 617 O SER A 190 -9.715 8.109 -9.676 1.00 0.00 O ATOM 618 CB SER A 190 -10.857 9.694 -12.073 1.00 0.00 C ATOM 619 OG SER A 190 -10.011 10.490 -11.254 1.00 0.00 O ATOM 0 H SER A 190 -12.253 7.827 -13.041 1.00 0.00 H new ATOM 0 HA SER A 190 -9.496 7.946 -12.186 1.00 0.00 H new ATOM 0 HB2 SER A 190 -10.745 9.990 -13.116 1.00 0.00 H new ATOM 0 HB3 SER A 190 -11.899 9.866 -11.803 1.00 0.00 H new ATOM 0 HG SER A 190 -10.211 11.438 -11.401 1.00 0.00 H new ATOM 625 N VAL A 191 -11.795 7.352 -9.992 1.00 0.00 N ATOM 626 CA VAL A 191 -11.997 7.097 -8.558 1.00 0.00 C ATOM 627 C VAL A 191 -12.264 5.618 -8.273 1.00 0.00 C ATOM 628 O VAL A 191 -13.293 5.081 -8.689 1.00 0.00 O ATOM 629 CB VAL A 191 -13.182 7.929 -7.988 1.00 0.00 C ATOM 630 CG1 VAL A 191 -13.195 7.851 -6.451 1.00 0.00 C ATOM 631 CG2 VAL A 191 -13.073 9.390 -8.402 1.00 0.00 C ATOM 0 H VAL A 191 -12.584 7.102 -10.588 1.00 0.00 H new ATOM 0 HA VAL A 191 -11.071 7.397 -8.068 1.00 0.00 H new ATOM 0 HB VAL A 191 -14.104 7.510 -8.391 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -14.029 8.437 -6.064 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.307 6.812 -6.140 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.259 8.248 -6.059 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -13.914 9.949 -7.990 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -12.140 9.807 -8.023 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -13.087 9.462 -9.490 1.00 0.00 H new ATOM 641 N PRO A 192 -11.354 4.935 -7.543 1.00 0.00 N ATOM 642 CA PRO A 192 -11.606 3.516 -7.250 1.00 0.00 C ATOM 643 C PRO A 192 -12.923 3.249 -6.523 1.00 0.00 C ATOM 644 O PRO A 192 -13.536 2.213 -6.722 1.00 0.00 O ATOM 645 CB PRO A 192 -10.419 3.130 -6.360 1.00 0.00 C ATOM 646 CG PRO A 192 -9.352 4.087 -6.727 1.00 0.00 C ATOM 647 CD PRO A 192 -10.072 5.377 -6.960 1.00 0.00 C ATOM 0 HA PRO A 192 -11.696 2.938 -8.170 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -10.674 3.207 -5.303 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -10.107 2.101 -6.539 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -8.613 4.183 -5.931 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -8.818 3.763 -7.620 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.219 5.931 -6.033 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.523 6.030 -7.638 1.00 0.00 H new ATOM 655 N TYR A 193 -13.366 4.189 -5.697 1.00 0.00 N ATOM 656 CA TYR A 193 -14.637 4.043 -4.987 1.00 0.00 C ATOM 657 C TYR A 193 -15.797 3.878 -5.960 1.00 0.00 C ATOM 658 O TYR A 193 -16.598 2.964 -5.846 1.00 0.00 O ATOM 659 CB TYR A 193 -14.915 5.281 -4.127 1.00 0.00 C ATOM 660 CG TYR A 193 -16.203 5.168 -3.337 1.00 0.00 C ATOM 661 CD1 TYR A 193 -17.408 5.713 -3.838 1.00 0.00 C ATOM 662 CD2 TYR A 193 -16.234 4.509 -2.091 1.00 0.00 C ATOM 663 CE1 TYR A 193 -18.621 5.589 -3.113 1.00 0.00 C ATOM 664 CE2 TYR A 193 -17.449 4.394 -1.358 1.00 0.00 C ATOM 665 CZ TYR A 193 -18.630 4.932 -1.882 1.00 0.00 C ATOM 666 OH TYR A 193 -19.804 4.813 -1.184 1.00 0.00 O ATOM 0 H TYR A 193 -12.869 5.058 -5.501 1.00 0.00 H new ATOM 0 HA TYR A 193 -14.554 3.155 -4.361 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -14.084 5.434 -3.439 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -14.963 6.161 -4.769 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -17.405 6.231 -4.786 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -15.325 4.087 -1.688 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -19.535 6.002 -3.513 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -17.459 3.893 -0.401 1.00 0.00 H new ATOM 0 HH TYR A 193 -19.640 4.329 -0.348 1.00 0.00 H new ATOM 676 N PHE A 194 -15.894 4.779 -6.923 1.00 0.00 N ATOM 677 CA PHE A 194 -17.003 4.747 -7.860 1.00 0.00 C ATOM 678 C PHE A 194 -16.834 3.616 -8.861 1.00 0.00 C ATOM 679 O PHE A 194 -17.816 3.105 -9.385 1.00 0.00 O ATOM 680 CB PHE A 194 -17.129 6.098 -8.554 1.00 0.00 C ATOM 681 CG PHE A 194 -17.793 7.139 -7.698 1.00 0.00 C ATOM 682 CD1 PHE A 194 -19.195 7.197 -7.624 1.00 0.00 C ATOM 683 CD2 PHE A 194 -17.035 8.055 -6.950 1.00 0.00 C ATOM 684 CE1 PHE A 194 -19.844 8.138 -6.817 1.00 0.00 C ATOM 685 CE2 PHE A 194 -17.671 9.011 -6.122 1.00 0.00 C ATOM 686 CZ PHE A 194 -19.080 9.051 -6.052 1.00 0.00 C ATOM 0 H PHE A 194 -15.226 5.534 -7.076 1.00 0.00 H new ATOM 0 HA PHE A 194 -17.926 4.555 -7.314 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -16.137 6.448 -8.838 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.699 5.975 -9.475 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -19.784 6.501 -8.202 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -15.957 8.030 -7.007 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -20.923 8.167 -6.778 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -17.080 9.707 -5.546 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.572 9.774 -5.418 1.00 0.00 H new ATOM 696 N LYS A 195 -15.596 3.211 -9.098 1.00 0.00 N ATOM 697 CA LYS A 195 -15.313 2.065 -9.960 1.00 0.00 C ATOM 698 C LYS A 195 -15.863 0.792 -9.320 1.00 0.00 C ATOM 699 O LYS A 195 -16.507 -0.013 -9.976 1.00 0.00 O ATOM 700 CB LYS A 195 -13.801 1.946 -10.157 1.00 0.00 C ATOM 701 CG LYS A 195 -13.377 0.928 -11.191 1.00 0.00 C ATOM 702 CD LYS A 195 -11.863 0.885 -11.278 1.00 0.00 C ATOM 703 CE LYS A 195 -11.409 -0.082 -12.355 1.00 0.00 C ATOM 704 NZ LYS A 195 -9.910 -0.171 -12.391 1.00 0.00 N ATOM 0 H LYS A 195 -14.767 3.658 -8.706 1.00 0.00 H new ATOM 0 HA LYS A 195 -15.792 2.205 -10.929 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.408 2.921 -10.444 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.343 1.687 -9.202 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -13.763 -0.056 -10.926 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -13.799 1.185 -12.162 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -11.479 1.882 -11.494 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -11.448 0.585 -10.316 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -11.832 -1.069 -12.167 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -11.782 0.245 -13.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -9.620 -0.838 -13.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -9.511 0.768 -12.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -9.560 -0.505 -11.470 1.00 0.00 H new ATOM 718 N ASP A 196 -15.608 0.635 -8.030 1.00 0.00 N ATOM 719 CA ASP A 196 -16.086 -0.521 -7.262 1.00 0.00 C ATOM 720 C ASP A 196 -17.610 -0.525 -7.174 1.00 0.00 C ATOM 721 O ASP A 196 -18.254 -1.564 -7.186 1.00 0.00 O ATOM 722 CB ASP A 196 -15.506 -0.450 -5.848 1.00 0.00 C ATOM 723 CG ASP A 196 -15.956 -1.599 -4.977 1.00 0.00 C ATOM 724 OD1 ASP A 196 -15.524 -2.738 -5.210 1.00 0.00 O ATOM 725 OD2 ASP A 196 -16.746 -1.346 -4.039 1.00 0.00 O ATOM 0 H ASP A 196 -15.065 1.301 -7.480 1.00 0.00 H new ATOM 0 HA ASP A 196 -15.764 -1.433 -7.765 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -14.418 -0.447 -5.906 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -15.803 0.491 -5.384 1.00 0.00 H new ATOM 730 N LYS A 197 -18.192 0.662 -7.097 1.00 0.00 N ATOM 731 CA LYS A 197 -19.645 0.805 -6.990 1.00 0.00 C ATOM 732 C LYS A 197 -20.305 0.880 -8.370 1.00 0.00 C ATOM 733 O LYS A 197 -21.438 1.337 -8.494 1.00 0.00 O ATOM 734 CB LYS A 197 -19.991 2.034 -6.128 1.00 0.00 C ATOM 735 CG LYS A 197 -20.082 1.710 -4.632 1.00 0.00 C ATOM 736 CD LYS A 197 -18.721 1.612 -3.934 1.00 0.00 C ATOM 737 CE LYS A 197 -18.833 0.938 -2.575 1.00 0.00 C ATOM 738 NZ LYS A 197 -19.044 -0.548 -2.730 1.00 0.00 N ATOM 0 H LYS A 197 -17.683 1.546 -7.106 1.00 0.00 H new ATOM 0 HA LYS A 197 -20.044 -0.082 -6.499 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.235 2.804 -6.282 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -20.941 2.450 -6.463 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -20.677 2.479 -4.139 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -20.613 0.766 -4.506 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -18.029 1.051 -4.562 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -18.302 2.611 -3.811 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -17.928 1.123 -1.997 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -19.663 1.371 -2.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -18.932 -1.013 -1.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -20.002 -0.727 -3.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -18.344 -0.930 -3.397 1.00 0.00 H new ATOM 752 N GLY A 198 -19.599 0.421 -9.394 1.00 0.00 N ATOM 753 CA GLY A 198 -20.110 0.466 -10.758 1.00 0.00 C ATOM 754 C GLY A 198 -21.100 -0.635 -11.106 1.00 0.00 C ATOM 755 O GLY A 198 -21.511 -0.752 -12.256 1.00 0.00 O ATOM 0 H GLY A 198 -18.669 0.012 -9.306 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -20.590 1.431 -10.919 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -19.268 0.410 -11.448 1.00 0.00 H new ATOM 759 N ASP A 199 -21.491 -1.434 -10.122 1.00 0.00 N ATOM 760 CA ASP A 199 -22.481 -2.499 -10.327 1.00 0.00 C ATOM 761 C ASP A 199 -23.800 -1.910 -10.851 1.00 0.00 C ATOM 762 O ASP A 199 -24.176 -0.790 -10.505 1.00 0.00 O ATOM 763 CB ASP A 199 -22.731 -3.239 -9.009 1.00 0.00 C ATOM 764 CG ASP A 199 -24.140 -3.797 -8.918 1.00 0.00 C ATOM 765 OD1 ASP A 199 -24.488 -4.723 -9.675 1.00 0.00 O ATOM 766 OD2 ASP A 199 -24.916 -3.281 -8.096 1.00 0.00 O ATOM 0 H ASP A 199 -21.139 -1.369 -9.167 1.00 0.00 H new ATOM 0 HA ASP A 199 -22.092 -3.200 -11.065 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -22.013 -4.053 -8.911 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -22.558 -2.559 -8.175 1.00 0.00 H new ATOM 771 N SER A 200 -24.499 -2.667 -11.686 1.00 0.00 N ATOM 772 CA SER A 200 -25.734 -2.210 -12.317 1.00 0.00 C ATOM 773 C SER A 200 -26.822 -1.757 -11.338 1.00 0.00 C ATOM 774 O SER A 200 -27.558 -0.814 -11.634 1.00 0.00 O ATOM 775 CB SER A 200 -26.286 -3.337 -13.187 1.00 0.00 C ATOM 776 OG SER A 200 -25.282 -3.813 -14.067 1.00 0.00 O ATOM 0 H SER A 200 -24.228 -3.615 -11.946 1.00 0.00 H new ATOM 0 HA SER A 200 -25.471 -1.329 -12.902 1.00 0.00 H new ATOM 0 HB2 SER A 200 -26.643 -4.151 -12.557 1.00 0.00 H new ATOM 0 HB3 SER A 200 -27.141 -2.979 -13.760 1.00 0.00 H new ATOM 0 HG SER A 200 -25.647 -4.536 -14.619 1.00 0.00 H new ATOM 782 N ASN A 201 -26.951 -2.409 -10.189 1.00 0.00 N ATOM 783 CA ASN A 201 -27.969 -1.999 -9.215 1.00 0.00 C ATOM 784 C ASN A 201 -27.488 -0.767 -8.445 1.00 0.00 C ATOM 785 O ASN A 201 -28.227 0.204 -8.270 1.00 0.00 O ATOM 786 CB ASN A 201 -28.296 -3.141 -8.251 1.00 0.00 C ATOM 787 CG ASN A 201 -29.558 -2.887 -7.470 1.00 0.00 C ATOM 788 OD1 ASN A 201 -29.580 -2.103 -6.541 1.00 0.00 O ATOM 789 ND2 ASN A 201 -30.620 -3.544 -7.852 1.00 0.00 N ATOM 0 H ASN A 201 -26.381 -3.206 -9.908 1.00 0.00 H new ATOM 0 HA ASN A 201 -28.882 -1.745 -9.754 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -28.400 -4.069 -8.813 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -27.465 -3.279 -7.559 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -31.506 -3.407 -7.366 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -30.563 -4.194 -8.636 1.00 0.00 H new ATOM 796 N SER A 202 -26.234 -0.810 -8.016 1.00 0.00 N ATOM 797 CA SER A 202 -25.590 0.292 -7.292 1.00 0.00 C ATOM 798 C SER A 202 -25.648 1.572 -8.115 1.00 0.00 C ATOM 799 O SER A 202 -25.763 2.686 -7.575 1.00 0.00 O ATOM 800 CB SER A 202 -24.127 -0.079 -7.017 1.00 0.00 C ATOM 801 OG SER A 202 -23.402 1.010 -6.474 1.00 0.00 O ATOM 0 H SER A 202 -25.625 -1.615 -8.159 1.00 0.00 H new ATOM 0 HA SER A 202 -26.115 0.460 -6.351 1.00 0.00 H new ATOM 0 HB2 SER A 202 -24.089 -0.921 -6.326 1.00 0.00 H new ATOM 0 HB3 SER A 202 -23.654 -0.405 -7.943 1.00 0.00 H new ATOM 0 HG SER A 202 -22.666 1.246 -7.077 1.00 0.00 H new ATOM 807 N SER A 203 -25.602 1.407 -9.429 1.00 0.00 N ATOM 808 CA SER A 203 -25.661 2.516 -10.370 1.00 0.00 C ATOM 809 C SER A 203 -26.881 3.409 -10.152 1.00 0.00 C ATOM 810 O SER A 203 -26.833 4.594 -10.467 1.00 0.00 O ATOM 811 CB SER A 203 -25.658 2.007 -11.809 1.00 0.00 C ATOM 812 OG SER A 203 -24.415 1.411 -12.133 1.00 0.00 O ATOM 0 H SER A 203 -25.522 0.493 -9.875 1.00 0.00 H new ATOM 0 HA SER A 203 -24.770 3.118 -10.189 1.00 0.00 H new ATOM 0 HB2 SER A 203 -26.460 1.281 -11.944 1.00 0.00 H new ATOM 0 HB3 SER A 203 -25.858 2.833 -12.491 1.00 0.00 H new ATOM 0 HG SER A 203 -24.211 0.706 -11.484 1.00 0.00 H new ATOM 818 N ALA A 204 -27.966 2.870 -9.610 1.00 0.00 N ATOM 819 CA ALA A 204 -29.167 3.667 -9.362 1.00 0.00 C ATOM 820 C ALA A 204 -28.875 4.891 -8.470 1.00 0.00 C ATOM 821 O ALA A 204 -29.284 6.010 -8.790 1.00 0.00 O ATOM 822 CB ALA A 204 -30.250 2.784 -8.725 1.00 0.00 C ATOM 0 H ALA A 204 -28.042 1.891 -9.334 1.00 0.00 H new ATOM 0 HA ALA A 204 -29.522 4.047 -10.320 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.144 3.380 -8.541 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -30.494 1.963 -9.400 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -29.882 2.381 -7.781 1.00 0.00 H new ATOM 828 N GLY A 205 -28.166 4.691 -7.365 1.00 0.00 N ATOM 829 CA GLY A 205 -27.861 5.802 -6.467 1.00 0.00 C ATOM 830 C GLY A 205 -26.683 6.606 -6.979 1.00 0.00 C ATOM 831 O GLY A 205 -26.612 7.829 -6.826 1.00 0.00 O ATOM 0 H GLY A 205 -27.796 3.787 -7.071 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -28.734 6.448 -6.373 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.639 5.419 -5.471 1.00 0.00 H new ATOM 835 N TRP A 206 -25.768 5.892 -7.613 1.00 0.00 N ATOM 836 CA TRP A 206 -24.553 6.444 -8.203 1.00 0.00 C ATOM 837 C TRP A 206 -24.895 7.564 -9.202 1.00 0.00 C ATOM 838 O TRP A 206 -24.425 8.697 -9.081 1.00 0.00 O ATOM 839 CB TRP A 206 -23.943 5.247 -8.932 1.00 0.00 C ATOM 840 CG TRP A 206 -22.531 5.199 -9.284 1.00 0.00 C ATOM 841 CD1 TRP A 206 -21.623 4.334 -8.792 1.00 0.00 C ATOM 842 CD2 TRP A 206 -21.845 5.937 -10.307 1.00 0.00 C ATOM 843 NE1 TRP A 206 -20.421 4.453 -9.414 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.516 5.426 -10.365 1.00 0.00 C ATOM 845 CE3 TRP A 206 -22.219 6.957 -11.203 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.571 5.903 -11.277 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -21.263 7.443 -12.112 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.947 6.908 -12.137 1.00 0.00 C ATOM 0 H TRP A 206 -25.849 4.883 -7.737 1.00 0.00 H new ATOM 0 HA TRP A 206 -23.883 6.887 -7.466 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -24.145 4.369 -8.319 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.503 5.124 -9.859 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -21.826 3.630 -7.998 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -19.586 3.906 -9.205 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -23.222 7.358 -11.192 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.572 5.493 -11.306 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -21.532 8.232 -12.799 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -19.229 7.297 -12.844 1.00 0.00 H new ATOM 859 N LYS A 207 -25.731 7.243 -10.183 1.00 0.00 N ATOM 860 CA LYS A 207 -26.099 8.195 -11.235 1.00 0.00 C ATOM 861 C LYS A 207 -27.028 9.296 -10.739 1.00 0.00 C ATOM 862 O LYS A 207 -26.969 10.433 -11.214 1.00 0.00 O ATOM 863 CB LYS A 207 -26.709 7.437 -12.434 1.00 0.00 C ATOM 864 CG LYS A 207 -28.138 6.897 -12.250 1.00 0.00 C ATOM 865 CD LYS A 207 -28.402 5.642 -13.107 1.00 0.00 C ATOM 866 CE LYS A 207 -28.283 5.893 -14.612 1.00 0.00 C ATOM 867 NZ LYS A 207 -28.524 4.609 -15.376 1.00 0.00 N ATOM 0 H LYS A 207 -26.171 6.327 -10.275 1.00 0.00 H new ATOM 0 HA LYS A 207 -25.188 8.700 -11.557 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -26.705 8.103 -13.297 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -26.056 6.598 -12.675 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -28.302 6.658 -11.199 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -28.855 7.674 -12.516 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -27.697 4.861 -12.820 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -29.401 5.266 -12.888 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -29.005 6.649 -14.920 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -27.293 6.284 -14.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -28.441 4.791 -16.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -27.819 3.899 -15.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -29.478 4.253 -15.165 1.00 0.00 H new ATOM 881 N ASN A 208 -27.898 8.970 -9.792 1.00 0.00 N ATOM 882 CA ASN A 208 -28.861 9.946 -9.293 1.00 0.00 C ATOM 883 C ASN A 208 -28.192 11.047 -8.485 1.00 0.00 C ATOM 884 O ASN A 208 -28.598 12.201 -8.552 1.00 0.00 O ATOM 885 CB ASN A 208 -29.923 9.266 -8.430 1.00 0.00 C ATOM 886 CG ASN A 208 -31.075 10.186 -8.118 1.00 0.00 C ATOM 887 OD1 ASN A 208 -31.570 10.888 -8.990 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.513 10.185 -6.889 1.00 0.00 N ATOM 0 H ASN A 208 -27.958 8.049 -9.358 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.330 10.398 -10.167 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.296 8.381 -8.945 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.469 8.925 -7.499 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -32.295 10.784 -6.626 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -31.073 9.585 -6.191 1.00 0.00 H new ATOM 895 N SER A 209 -27.161 10.704 -7.730 1.00 0.00 N ATOM 896 CA SER A 209 -26.470 11.697 -6.910 1.00 0.00 C ATOM 897 C SER A 209 -25.805 12.770 -7.771 1.00 0.00 C ATOM 898 O SER A 209 -25.815 13.948 -7.421 1.00 0.00 O ATOM 899 CB SER A 209 -25.430 11.014 -6.030 1.00 0.00 C ATOM 900 OG SER A 209 -26.051 10.044 -5.203 1.00 0.00 O ATOM 0 H SER A 209 -26.784 9.758 -7.665 1.00 0.00 H new ATOM 0 HA SER A 209 -27.212 12.187 -6.280 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.671 10.540 -6.652 1.00 0.00 H new ATOM 0 HB3 SER A 209 -24.920 11.755 -5.414 1.00 0.00 H new ATOM 0 HG SER A 209 -26.281 9.256 -5.739 1.00 0.00 H new ATOM 906 N ILE A 210 -25.244 12.369 -8.905 1.00 0.00 N ATOM 907 CA ILE A 210 -24.604 13.321 -9.821 1.00 0.00 C ATOM 908 C ILE A 210 -25.675 14.222 -10.420 1.00 0.00 C ATOM 909 O ILE A 210 -25.507 15.434 -10.494 1.00 0.00 O ATOM 910 CB ILE A 210 -23.830 12.583 -10.950 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.676 11.784 -10.317 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.334 13.569 -12.029 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.113 10.703 -11.190 1.00 0.00 C ATOM 0 H ILE A 210 -25.216 11.398 -9.216 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.882 13.918 -9.264 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.498 11.890 -11.461 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -21.875 12.475 -10.054 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -23.028 11.336 -9.388 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -22.797 13.021 -12.803 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.187 14.082 -12.473 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.667 14.301 -11.574 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.306 10.193 -10.663 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -22.897 9.986 -11.433 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.726 11.142 -12.109 1.00 0.00 H new ATOM 925 N ARG A 211 -26.789 13.626 -10.826 1.00 0.00 N ATOM 926 CA ARG A 211 -27.899 14.386 -11.406 1.00 0.00 C ATOM 927 C ARG A 211 -28.400 15.444 -10.435 1.00 0.00 C ATOM 928 O ARG A 211 -28.660 16.576 -10.818 1.00 0.00 O ATOM 929 CB ARG A 211 -29.046 13.444 -11.741 1.00 0.00 C ATOM 930 CG ARG A 211 -28.968 12.862 -13.132 1.00 0.00 C ATOM 931 CD ARG A 211 -29.644 11.507 -13.186 1.00 0.00 C ATOM 932 NE ARG A 211 -30.930 11.486 -12.458 1.00 0.00 N ATOM 933 CZ ARG A 211 -31.819 10.500 -12.490 1.00 0.00 C ATOM 934 NH1 ARG A 211 -31.645 9.424 -13.219 1.00 0.00 N ATOM 935 NH2 ARG A 211 -32.902 10.598 -11.774 1.00 0.00 N ATOM 0 H ARG A 211 -26.952 12.621 -10.766 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.538 14.877 -12.310 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -29.059 12.630 -11.016 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -29.988 13.981 -11.634 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -29.443 13.539 -13.842 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -27.925 12.765 -13.433 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -29.815 11.231 -14.227 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -28.978 10.755 -12.762 1.00 0.00 H new ATOM 0 HE ARG A 211 -31.154 12.298 -11.882 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -30.804 9.324 -13.787 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -32.351 8.687 -13.218 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -33.059 11.425 -11.198 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -33.593 9.848 -11.789 1.00 0.00 H new ATOM 949 N HIS A 212 -28.535 15.065 -9.177 1.00 0.00 N ATOM 950 CA HIS A 212 -29.018 15.983 -8.157 1.00 0.00 C ATOM 951 C HIS A 212 -28.009 17.109 -7.922 1.00 0.00 C ATOM 952 O HIS A 212 -28.377 18.271 -7.797 1.00 0.00 O ATOM 953 CB HIS A 212 -29.273 15.218 -6.857 1.00 0.00 C ATOM 954 CG HIS A 212 -30.265 15.882 -5.957 1.00 0.00 C ATOM 955 ND1 HIS A 212 -31.575 15.491 -5.828 1.00 0.00 N ATOM 956 CD2 HIS A 212 -30.132 16.947 -5.120 1.00 0.00 C ATOM 957 CE1 HIS A 212 -32.164 16.295 -4.947 1.00 0.00 C ATOM 958 NE2 HIS A 212 -31.328 17.198 -4.480 1.00 0.00 N ATOM 0 H HIS A 212 -28.318 14.129 -8.836 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.951 16.430 -8.499 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -29.628 14.216 -7.098 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -28.330 15.102 -6.322 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -29.223 17.513 -4.978 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -33.200 16.217 -4.652 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -31.523 17.926 -3.793 1.00 0.00 H new ATOM 966 N ASN A 213 -26.729 16.763 -7.874 1.00 0.00 N ATOM 967 CA ASN A 213 -25.678 17.754 -7.633 1.00 0.00 C ATOM 968 C ASN A 213 -25.598 18.783 -8.752 1.00 0.00 C ATOM 969 O ASN A 213 -25.304 19.946 -8.494 1.00 0.00 O ATOM 970 CB ASN A 213 -24.318 17.070 -7.484 1.00 0.00 C ATOM 971 CG ASN A 213 -23.964 16.802 -6.049 1.00 0.00 C ATOM 972 OD1 ASN A 213 -23.221 17.549 -5.440 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.480 15.737 -5.504 1.00 0.00 N ATOM 0 H ASN A 213 -26.390 15.809 -7.998 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.936 18.270 -6.708 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -24.325 16.130 -8.035 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.548 17.697 -7.934 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -24.265 15.505 -4.534 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -25.099 15.135 -6.047 1.00 0.00 H new ATOM 980 N LEU A 214 -25.870 18.365 -9.982 1.00 0.00 N ATOM 981 CA LEU A 214 -25.852 19.280 -11.126 1.00 0.00 C ATOM 982 C LEU A 214 -26.913 20.363 -10.968 1.00 0.00 C ATOM 983 O LEU A 214 -26.688 21.508 -11.327 1.00 0.00 O ATOM 984 CB LEU A 214 -26.119 18.516 -12.429 1.00 0.00 C ATOM 985 CG LEU A 214 -24.962 17.682 -13.001 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.493 16.750 -14.082 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.879 18.576 -13.584 1.00 0.00 C ATOM 0 H LEU A 214 -26.106 17.401 -10.217 1.00 0.00 H new ATOM 0 HA LEU A 214 -24.865 19.741 -11.165 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.966 17.850 -12.263 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.424 19.237 -13.188 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.524 17.099 -12.191 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.672 16.158 -14.488 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -26.242 16.085 -13.653 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.945 17.339 -14.880 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -23.073 17.959 -13.981 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.300 19.183 -14.385 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.486 19.228 -12.804 1.00 0.00 H new ATOM 999 N SER A 215 -28.065 19.993 -10.426 1.00 0.00 N ATOM 1000 CA SER A 215 -29.162 20.944 -10.243 1.00 0.00 C ATOM 1001 C SER A 215 -28.915 21.891 -9.070 1.00 0.00 C ATOM 1002 O SER A 215 -29.306 23.049 -9.115 1.00 0.00 O ATOM 1003 CB SER A 215 -30.471 20.191 -10.002 1.00 0.00 C ATOM 1004 OG SER A 215 -31.575 21.081 -10.002 1.00 0.00 O ATOM 0 H SER A 215 -28.268 19.046 -10.105 1.00 0.00 H new ATOM 0 HA SER A 215 -29.225 21.539 -11.154 1.00 0.00 H new ATOM 0 HB2 SER A 215 -30.608 19.435 -10.776 1.00 0.00 H new ATOM 0 HB3 SER A 215 -30.423 19.666 -9.048 1.00 0.00 H new ATOM 0 HG SER A 215 -32.401 20.577 -9.848 1.00 0.00 H new ATOM 1010 N LEU A 216 -28.278 21.394 -8.018 1.00 0.00 N ATOM 1011 CA LEU A 216 -28.006 22.217 -6.835 1.00 0.00 C ATOM 1012 C LEU A 216 -26.915 23.247 -7.093 1.00 0.00 C ATOM 1013 O LEU A 216 -26.987 24.384 -6.636 1.00 0.00 O ATOM 1014 CB LEU A 216 -27.542 21.336 -5.667 1.00 0.00 C ATOM 1015 CG LEU A 216 -28.567 20.393 -5.023 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -27.842 19.520 -3.994 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -29.701 21.158 -4.342 1.00 0.00 C ATOM 0 H LEU A 216 -27.940 20.434 -7.954 1.00 0.00 H new ATOM 0 HA LEU A 216 -28.937 22.730 -6.595 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.706 20.731 -6.017 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -27.156 21.992 -4.887 1.00 0.00 H new ATOM 0 HG LEU A 216 -29.015 19.781 -5.806 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -28.555 18.842 -3.525 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -27.064 18.941 -4.492 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -27.390 20.155 -3.232 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -30.403 20.451 -3.900 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -29.290 21.798 -3.561 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -30.220 21.772 -5.079 1.00 0.00 H new ATOM 1029 N HIS A 217 -25.884 22.837 -7.811 1.00 0.00 N ATOM 1030 CA HIS A 217 -24.738 23.699 -8.045 1.00 0.00 C ATOM 1031 C HIS A 217 -24.858 24.459 -9.355 1.00 0.00 C ATOM 1032 O HIS A 217 -24.478 23.963 -10.412 1.00 0.00 O ATOM 1033 CB HIS A 217 -23.453 22.871 -8.033 1.00 0.00 C ATOM 1034 CG HIS A 217 -23.172 22.227 -6.712 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -23.675 21.014 -6.323 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -22.429 22.655 -5.654 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -23.245 20.757 -5.093 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -22.472 21.721 -4.639 1.00 0.00 N ATOM 0 H HIS A 217 -25.816 21.915 -8.241 1.00 0.00 H new ATOM 0 HA HIS A 217 -24.707 24.435 -7.241 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -23.521 22.098 -8.798 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -22.614 23.513 -8.302 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -24.277 20.411 -6.883 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -21.886 23.588 -5.615 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -23.498 19.868 -4.535 1.00 0.00 H new ATOM 1046 N SER A 218 -25.355 25.686 -9.267 1.00 0.00 N ATOM 1047 CA SER A 218 -25.492 26.591 -10.418 1.00 0.00 C ATOM 1048 C SER A 218 -24.148 26.967 -11.066 1.00 0.00 C ATOM 1049 O SER A 218 -24.094 27.722 -12.027 1.00 0.00 O ATOM 1050 CB SER A 218 -26.205 27.854 -9.950 1.00 0.00 C ATOM 1051 OG SER A 218 -25.698 28.255 -8.684 1.00 0.00 O ATOM 0 H SER A 218 -25.680 26.092 -8.389 1.00 0.00 H new ATOM 0 HA SER A 218 -26.063 26.067 -11.184 1.00 0.00 H new ATOM 0 HB2 SER A 218 -26.063 28.653 -10.678 1.00 0.00 H new ATOM 0 HB3 SER A 218 -27.278 27.672 -9.881 1.00 0.00 H new ATOM 0 HG SER A 218 -26.159 29.068 -8.390 1.00 0.00 H new ATOM 1057 N LYS A 219 -23.060 26.414 -10.542 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.733 26.579 -11.133 1.00 0.00 C ATOM 1059 C LYS A 219 -21.687 25.803 -12.451 1.00 0.00 C ATOM 1060 O LYS A 219 -20.848 26.082 -13.311 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.663 26.028 -10.181 1.00 0.00 C ATOM 1062 CG LYS A 219 -19.490 26.991 -9.892 1.00 0.00 C ATOM 1063 CD LYS A 219 -18.633 27.359 -11.129 1.00 0.00 C ATOM 1064 CE LYS A 219 -17.947 26.150 -11.790 1.00 0.00 C ATOM 1065 NZ LYS A 219 -17.026 25.388 -10.874 1.00 0.00 N ATOM 0 H LYS A 219 -23.070 25.840 -9.699 1.00 0.00 H new ATOM 0 HA LYS A 219 -21.538 27.637 -11.309 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -21.139 25.765 -9.236 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -20.262 25.107 -10.603 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -19.889 27.908 -9.458 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -18.843 26.538 -9.141 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -19.267 27.853 -11.865 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -17.871 28.079 -10.831 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -18.713 25.471 -12.164 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -17.379 26.496 -12.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -16.603 24.591 -11.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -16.272 26.020 -10.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -17.565 25.027 -10.062 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.577 24.832 -12.596 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.665 24.036 -13.813 1.00 0.00 C ATOM 1081 C PHE A 220 -23.714 24.656 -14.725 1.00 0.00 C ATOM 1082 O PHE A 220 -24.732 25.149 -14.256 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.090 22.596 -13.496 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.146 21.870 -12.576 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -22.573 21.458 -11.302 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -20.829 21.581 -12.978 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -21.697 20.764 -10.431 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -19.944 20.898 -12.112 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.381 20.493 -10.836 1.00 0.00 C ATOM 0 H PHE A 220 -23.255 24.574 -11.879 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.686 24.019 -14.292 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.082 22.611 -13.044 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.173 22.038 -14.429 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -23.582 21.673 -10.983 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -20.491 21.884 -13.958 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -22.041 20.445 -9.458 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -18.933 20.687 -12.429 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.705 19.975 -10.171 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.468 24.607 -16.024 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.419 25.091 -17.017 1.00 0.00 C ATOM 1101 C ILE A 221 -24.644 23.930 -17.982 1.00 0.00 C ATOM 1102 O ILE A 221 -23.834 22.993 -18.031 1.00 0.00 O ATOM 1103 CB ILE A 221 -23.915 26.385 -17.756 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.737 26.076 -18.695 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.493 27.446 -16.740 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.327 27.248 -19.612 1.00 0.00 C ATOM 0 H ILE A 221 -22.607 24.232 -16.421 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.351 25.396 -16.542 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.742 26.763 -18.357 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -21.876 25.783 -18.094 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -22.998 25.219 -19.316 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.147 28.336 -17.266 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.344 27.705 -16.110 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.687 27.055 -16.119 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.490 26.943 -20.240 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.170 27.529 -20.243 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -22.031 28.101 -19.002 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.734 23.977 -18.734 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.089 22.893 -19.655 1.00 0.00 C ATOM 1120 C ARG A 222 -26.185 23.416 -21.078 1.00 0.00 C ATOM 1121 O ARG A 222 -27.030 24.257 -21.371 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.433 22.286 -19.246 1.00 0.00 C ATOM 1123 CG ARG A 222 -27.828 21.049 -20.062 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.302 20.723 -19.892 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.148 21.766 -20.501 1.00 0.00 N ATOM 1126 CZ ARG A 222 -31.476 21.762 -20.528 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -32.185 20.787 -20.012 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -32.102 22.762 -21.084 1.00 0.00 N ATOM 0 H ARG A 222 -26.394 24.755 -18.728 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.312 22.130 -19.609 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.393 22.016 -18.191 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.210 23.043 -19.352 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -27.611 21.222 -21.116 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.226 20.196 -19.748 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.520 19.759 -20.351 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.538 20.632 -18.832 1.00 0.00 H new ATOM 0 HE ARG A 222 -29.674 22.556 -20.938 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -31.718 19.995 -19.570 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -33.204 20.820 -20.053 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -31.572 23.533 -21.490 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -33.122 22.773 -21.112 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.336 22.914 -21.958 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.352 23.331 -23.360 1.00 0.00 C ATOM 1144 C VAL A 223 -26.269 22.404 -24.137 1.00 0.00 C ATOM 1145 O VAL A 223 -26.330 21.192 -23.879 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.945 23.288 -24.042 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -23.908 24.221 -25.259 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -22.844 23.662 -23.054 1.00 0.00 C ATOM 0 H VAL A 223 -24.626 22.218 -21.732 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.695 24.365 -23.372 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.767 22.267 -24.378 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -22.922 24.178 -25.721 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -24.661 23.906 -25.982 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -24.115 25.243 -24.941 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -21.877 23.624 -23.555 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -23.019 24.670 -22.679 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -22.849 22.959 -22.221 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.976 22.969 -25.099 1.00 0.00 N ATOM 1159 CA GLN A 224 -27.796 22.181 -25.999 1.00 0.00 C ATOM 1160 C GLN A 224 -26.848 21.365 -26.886 1.00 0.00 C ATOM 1161 O GLN A 224 -25.663 21.662 -26.996 1.00 0.00 O ATOM 1162 CB GLN A 224 -28.682 23.099 -26.842 1.00 0.00 C ATOM 1163 CG GLN A 224 -29.796 23.762 -26.032 1.00 0.00 C ATOM 1164 CD GLN A 224 -30.429 24.923 -26.760 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -29.938 26.032 -26.700 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -31.521 24.678 -27.435 1.00 0.00 N ATOM 0 H GLN A 224 -26.998 23.973 -25.277 1.00 0.00 H new ATOM 0 HA GLN A 224 -28.455 21.514 -25.444 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -28.064 23.871 -27.300 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -29.125 22.522 -27.654 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -30.562 23.022 -25.800 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -29.392 24.110 -25.082 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -31.903 23.733 -27.461 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -31.991 25.432 -27.935 1.00 0.00 H new ATOM 1265 N SER A 232 -27.154 15.243 -22.838 1.00 0.00 N ATOM 1266 CA SER A 232 -26.916 16.702 -22.838 1.00 0.00 C ATOM 1267 C SER A 232 -25.480 17.055 -22.436 1.00 0.00 C ATOM 1268 O SER A 232 -24.775 16.238 -21.852 1.00 0.00 O ATOM 1269 CB SER A 232 -27.914 17.427 -21.925 1.00 0.00 C ATOM 1270 OG SER A 232 -29.240 17.015 -22.215 1.00 0.00 O ATOM 0 HA SER A 232 -27.066 17.042 -23.863 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.681 17.216 -20.881 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.824 18.505 -22.060 1.00 0.00 H new ATOM 0 HG SER A 232 -29.223 16.127 -22.629 1.00 0.00 H new ATOM 1276 N TRP A 233 -25.041 18.264 -22.758 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.704 18.710 -22.375 1.00 0.00 C ATOM 1278 C TRP A 233 -23.798 19.373 -21.026 1.00 0.00 C ATOM 1279 O TRP A 233 -24.757 20.084 -20.752 1.00 0.00 O ATOM 1280 CB TRP A 233 -23.179 19.786 -23.306 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.727 19.340 -24.638 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -23.275 19.652 -25.836 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.571 18.538 -24.941 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -22.568 19.111 -26.866 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -21.507 18.414 -26.360 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.569 17.926 -24.160 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -20.484 17.698 -27.008 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.534 17.206 -24.810 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.506 17.101 -26.231 1.00 0.00 C ATOM 0 H TRP A 233 -25.585 18.951 -23.280 1.00 0.00 H new ATOM 0 HA TRP A 233 -23.051 17.837 -22.395 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.963 20.531 -23.443 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -22.346 20.287 -22.813 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -24.162 20.255 -25.959 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -22.794 19.210 -27.856 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.589 18.004 -23.083 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -20.462 17.616 -28.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.760 16.733 -24.223 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.711 16.548 -26.708 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.789 19.169 -20.203 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.700 19.821 -18.914 1.00 0.00 C ATOM 1302 C TRP A 234 -21.299 20.392 -18.848 1.00 0.00 C ATOM 1303 O TRP A 234 -20.330 19.715 -19.207 1.00 0.00 O ATOM 1304 CB TRP A 234 -22.959 18.808 -17.804 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.303 18.158 -17.968 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.596 17.042 -18.685 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.565 18.612 -17.438 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -25.923 16.750 -18.643 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.560 17.687 -17.877 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -25.960 19.704 -16.640 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -27.920 17.819 -17.532 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.328 19.841 -16.286 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.293 18.890 -16.736 1.00 0.00 C ATOM 0 H TRP A 234 -22.008 18.546 -20.410 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.442 20.610 -18.787 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.180 18.046 -17.814 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -22.908 19.305 -16.835 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -23.864 16.458 -19.223 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.371 15.960 -19.107 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.232 20.427 -16.302 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.652 17.105 -17.879 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.641 20.672 -15.671 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.328 19.007 -16.452 1.00 0.00 H new ATOM 1324 N MET A 235 -21.182 21.635 -18.419 1.00 0.00 N ATOM 1325 CA MET A 235 -19.886 22.292 -18.338 1.00 0.00 C ATOM 1326 C MET A 235 -19.914 23.334 -17.242 1.00 0.00 C ATOM 1327 O MET A 235 -20.937 23.527 -16.599 1.00 0.00 O ATOM 1328 CB MET A 235 -19.496 22.923 -19.676 1.00 0.00 C ATOM 1329 CG MET A 235 -20.338 24.085 -20.114 1.00 0.00 C ATOM 1330 SD MET A 235 -19.690 24.842 -21.619 1.00 0.00 S ATOM 1331 CE MET A 235 -18.231 25.730 -20.970 1.00 0.00 C ATOM 0 H MET A 235 -21.968 22.212 -18.120 1.00 0.00 H new ATOM 0 HA MET A 235 -19.131 21.542 -18.101 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.459 23.252 -19.614 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.541 22.154 -20.447 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.361 23.750 -20.285 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.375 24.829 -19.318 1.00 0.00 H new ATOM 0 HE1 MET A 235 -18.353 26.800 -21.136 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.133 25.538 -19.902 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.335 25.383 -21.484 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.794 23.994 -17.015 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.695 24.992 -15.958 1.00 0.00 C ATOM 1343 C LEU A 236 -19.056 26.359 -16.525 1.00 0.00 C ATOM 1344 O LEU A 236 -18.731 26.647 -17.668 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.259 25.021 -15.424 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.654 23.658 -15.041 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.233 23.846 -14.566 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.449 22.903 -13.974 1.00 0.00 C ATOM 0 H LEU A 236 -17.935 23.859 -17.549 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.379 24.742 -15.147 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.621 25.480 -16.179 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.231 25.668 -14.547 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.688 23.048 -15.943 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.809 22.879 -14.296 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.639 24.293 -15.363 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.224 24.502 -13.695 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -16.959 21.953 -13.759 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.496 23.501 -13.064 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.459 22.716 -14.338 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.712 27.198 -15.735 1.00 0.00 N ATOM 1361 CA ASN A 237 -20.044 28.558 -16.174 1.00 0.00 C ATOM 1362 C ASN A 237 -18.719 29.302 -16.423 1.00 0.00 C ATOM 1363 O ASN A 237 -17.924 29.468 -15.491 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.887 29.265 -15.098 1.00 0.00 C ATOM 1365 CG ASN A 237 -21.664 30.453 -15.639 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -22.864 30.504 -15.515 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -20.986 31.400 -16.223 1.00 0.00 N ATOM 0 H ASN A 237 -20.026 26.969 -14.792 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.634 28.541 -17.090 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.584 28.550 -14.662 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -20.232 29.602 -14.294 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -21.469 32.219 -16.593 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -19.973 31.323 -16.310 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.453 29.747 -17.668 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.120 30.317 -17.934 1.00 0.00 C ATOM 1376 C PRO A 238 -16.834 31.648 -17.242 1.00 0.00 C ATOM 1377 O PRO A 238 -15.716 31.902 -16.797 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.110 30.472 -19.456 1.00 0.00 C ATOM 1379 CG PRO A 238 -18.541 30.618 -19.836 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.291 29.727 -18.886 1.00 0.00 C ATOM 0 HA PRO A 238 -16.337 29.671 -17.536 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -16.530 31.343 -19.760 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -16.660 29.604 -19.938 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -18.869 31.654 -19.747 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -18.707 30.319 -20.871 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.295 30.103 -18.690 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.400 28.718 -19.283 1.00 0.00 H new