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 193 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 197 LYS NZ :NH3+ -168:sc= 0.117 (180deg=0.057) USER MOD Set 2.1: A 179 THR OG1 : rot 113:sc= 0.0653 USER MOD Set 2.2: A 181 SER OG : rot 180:sc= 0.189 USER MOD Set 3.1: A 162 TYR OH : rot 82:sc= 0.166 USER MOD Set 3.2: A 209 SER OG : rot 77:sc= 1.1 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot 80:sc= 0.759 USER MOD Single : A 168 LYS NZ :NH3+ -169:sc= -0.0179 (180deg=-0.146) USER MOD Single : A 172 SER OG : rot 78:sc= 1.28 USER MOD Single : A 173 SER OG : rot -63:sc= 1.36 USER MOD Single : A 176 LYS NZ :NH3+ 167:sc= 1.79 (180deg=1.57) USER MOD Single : A 182 GLN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Single : A 184 TYR OH : rot 180:sc= -0.0187 USER MOD Single : A 187 MET CE :methyl -161:sc= 0 (180deg=-0.254) USER MOD Single : A 189 LYS NZ :NH3+ 171:sc= 1.25 (180deg=1.19) USER MOD Single : A 190 SER OG : rot -32:sc= 0.252 USER MOD Single : A 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 202 SER OG : rot 71:sc= 1.13 USER MOD Single : A 203 SER OG : rot 57:sc= 1.07 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=-0.3) USER MOD Single : A 212 HIS : no HD1:sc= -0.107 X(o=-0.11,f=0) USER MOD Single : A 213 ASN : amide:sc= 0.805 K(o=0.81,f=-0.21) USER MOD Single : A 215 SER OG : rot 79:sc= 1.26 USER MOD Single : A 217 HIS : no HE2:sc= 0.645 K(o=0.64,f=-2.6!) USER MOD Single : A 218 SER OG : rot 180:sc= 0.0019 USER MOD Single : A 219 LYS NZ :NH3+ 162:sc= 0.442 (180deg=0.316) USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 232 SER OG : rot -27:sc= 0.0829 USER MOD Single : A 235 MET CE :methyl -113:sc= -0.0123 (180deg=-0.163) USER MOD Single : A 237 ASN : amide:sc= -0.702 K(o=-0.7,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -12.491 14.633 -2.317 1.00 0.00 N ATOM 117 CA LEU A 160 -13.322 15.397 -3.241 1.00 0.00 C ATOM 118 C LEU A 160 -14.806 15.036 -3.138 1.00 0.00 C ATOM 119 O LEU A 160 -15.169 13.865 -3.070 1.00 0.00 O ATOM 120 CB LEU A 160 -12.860 15.136 -4.674 1.00 0.00 C ATOM 121 CG LEU A 160 -12.029 16.267 -5.268 1.00 0.00 C ATOM 122 CD1 LEU A 160 -10.637 16.261 -4.748 1.00 0.00 C ATOM 123 CD2 LEU A 160 -12.013 16.158 -6.784 1.00 0.00 C ATOM 0 HA LEU A 160 -13.212 16.448 -2.973 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -12.274 14.217 -4.695 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.734 14.971 -5.303 1.00 0.00 H new ATOM 0 HG LEU A 160 -12.492 17.208 -4.971 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.078 17.082 -5.196 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -10.653 16.381 -3.665 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -10.158 15.315 -5.001 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -11.417 16.970 -7.201 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -11.578 15.202 -7.075 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -13.032 16.224 -7.164 1.00 0.00 H new ATOM 135 N SER A 161 -15.655 16.052 -3.145 1.00 0.00 N ATOM 136 CA SER A 161 -17.105 15.857 -3.092 1.00 0.00 C ATOM 137 C SER A 161 -17.641 15.569 -4.492 1.00 0.00 C ATOM 138 O SER A 161 -16.918 15.694 -5.479 1.00 0.00 O ATOM 139 CB SER A 161 -17.775 17.118 -2.547 1.00 0.00 C ATOM 140 OG SER A 161 -17.288 17.420 -1.254 1.00 0.00 O ATOM 0 H SER A 161 -15.367 17.029 -3.187 1.00 0.00 H new ATOM 0 HA SER A 161 -17.325 15.013 -2.438 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.586 17.956 -3.218 1.00 0.00 H new ATOM 0 HB3 SER A 161 -18.855 16.976 -2.511 1.00 0.00 H new ATOM 0 HG SER A 161 -17.726 18.231 -0.921 1.00 0.00 H new ATOM 146 N TYR A 162 -18.917 15.207 -4.586 1.00 0.00 N ATOM 147 CA TYR A 162 -19.543 14.919 -5.883 1.00 0.00 C ATOM 148 C TYR A 162 -19.347 16.069 -6.867 1.00 0.00 C ATOM 149 O TYR A 162 -18.949 15.852 -8.004 1.00 0.00 O ATOM 150 CB TYR A 162 -21.050 14.693 -5.718 1.00 0.00 C ATOM 151 CG TYR A 162 -21.476 13.244 -5.779 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.615 12.584 -7.020 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.758 12.521 -4.600 1.00 0.00 C ATOM 154 CE1 TYR A 162 -22.040 11.230 -7.080 1.00 0.00 C ATOM 155 CE2 TYR A 162 -22.182 11.165 -4.660 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.322 10.537 -5.900 1.00 0.00 C ATOM 157 OH TYR A 162 -22.743 9.234 -5.965 1.00 0.00 O ATOM 0 H TYR A 162 -19.540 15.105 -3.785 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.063 14.020 -6.271 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.365 15.111 -4.762 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.575 15.246 -6.497 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.395 13.115 -7.934 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.650 13.004 -3.640 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.145 10.737 -8.035 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -22.395 10.623 -3.751 1.00 0.00 H new ATOM 0 HH TYR A 162 -21.967 8.644 -6.071 1.00 0.00 H new ATOM 167 N ALA A 163 -19.616 17.289 -6.424 1.00 0.00 N ATOM 168 CA ALA A 163 -19.490 18.458 -7.288 1.00 0.00 C ATOM 169 C ALA A 163 -18.057 18.625 -7.804 1.00 0.00 C ATOM 170 O ALA A 163 -17.845 18.961 -8.969 1.00 0.00 O ATOM 171 CB ALA A 163 -19.928 19.715 -6.528 1.00 0.00 C ATOM 0 H ALA A 163 -19.922 17.497 -5.474 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.138 18.311 -8.152 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.832 20.585 -7.178 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -20.967 19.608 -6.216 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.297 19.847 -5.649 1.00 0.00 H new ATOM 177 N ASP A 164 -17.083 18.385 -6.943 1.00 0.00 N ATOM 178 CA ASP A 164 -15.680 18.548 -7.314 1.00 0.00 C ATOM 179 C ASP A 164 -15.275 17.520 -8.359 1.00 0.00 C ATOM 180 O ASP A 164 -14.551 17.827 -9.298 1.00 0.00 O ATOM 181 CB ASP A 164 -14.780 18.376 -6.100 1.00 0.00 C ATOM 182 CG ASP A 164 -15.130 19.309 -4.976 1.00 0.00 C ATOM 183 OD1 ASP A 164 -15.308 20.514 -5.224 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.237 18.821 -3.831 1.00 0.00 O ATOM 0 H ASP A 164 -17.233 18.077 -5.982 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.565 19.553 -7.721 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -14.848 17.347 -5.746 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.744 18.543 -6.395 1.00 0.00 H new ATOM 189 N LEU A 165 -15.751 16.294 -8.200 1.00 0.00 N ATOM 190 CA LEU A 165 -15.467 15.228 -9.164 1.00 0.00 C ATOM 191 C LEU A 165 -16.113 15.511 -10.519 1.00 0.00 C ATOM 192 O LEU A 165 -15.487 15.317 -11.558 1.00 0.00 O ATOM 193 CB LEU A 165 -15.974 13.887 -8.629 1.00 0.00 C ATOM 194 CG LEU A 165 -15.242 13.342 -7.395 1.00 0.00 C ATOM 195 CD1 LEU A 165 -15.995 12.142 -6.853 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.802 12.946 -7.729 1.00 0.00 C ATOM 0 H LEU A 165 -16.336 16.007 -7.415 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.387 15.186 -9.301 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.031 13.991 -8.385 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -15.902 13.148 -9.427 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.205 14.129 -6.642 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.477 11.753 -5.976 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -17.005 12.442 -6.574 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -16.045 11.368 -7.618 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.312 12.564 -6.833 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.806 12.173 -8.498 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.260 13.818 -8.095 1.00 0.00 H new ATOM 208 N ILE A 166 -17.353 15.984 -10.512 1.00 0.00 N ATOM 209 CA ILE A 166 -18.049 16.331 -11.757 1.00 0.00 C ATOM 210 C ILE A 166 -17.252 17.447 -12.431 1.00 0.00 C ATOM 211 O ILE A 166 -16.996 17.419 -13.635 1.00 0.00 O ATOM 212 CB ILE A 166 -19.512 16.819 -11.483 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.360 15.692 -10.872 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.192 17.288 -12.779 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.615 16.189 -10.143 1.00 0.00 C ATOM 0 H ILE A 166 -17.900 16.138 -9.665 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.117 15.449 -12.394 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.444 17.652 -10.784 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.659 15.005 -11.663 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.745 15.125 -10.173 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.206 17.621 -12.558 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.625 18.113 -13.209 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.228 16.463 -13.490 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.162 15.337 -9.739 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.324 16.853 -9.329 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.252 16.730 -10.843 1.00 0.00 H new ATOM 227 N THR A 167 -16.842 18.426 -11.642 1.00 0.00 N ATOM 228 CA THR A 167 -16.046 19.536 -12.143 1.00 0.00 C ATOM 229 C THR A 167 -14.712 19.071 -12.713 1.00 0.00 C ATOM 230 O THR A 167 -14.311 19.510 -13.795 1.00 0.00 O ATOM 231 CB THR A 167 -15.772 20.541 -11.013 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.003 21.143 -10.605 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.814 21.623 -11.444 1.00 0.00 C ATOM 0 H THR A 167 -17.049 18.475 -10.644 1.00 0.00 H new ATOM 0 HA THR A 167 -16.620 20.005 -12.942 1.00 0.00 H new ATOM 0 HB THR A 167 -15.318 19.996 -10.186 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.483 20.533 -10.006 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.647 22.312 -10.616 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.866 21.173 -11.738 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.236 22.167 -12.289 1.00 0.00 H new ATOM 241 N LYS A 168 -14.022 18.181 -12.011 1.00 0.00 N ATOM 242 CA LYS A 168 -12.738 17.680 -12.493 1.00 0.00 C ATOM 243 C LYS A 168 -12.909 16.985 -13.818 1.00 0.00 C ATOM 244 O LYS A 168 -12.067 17.137 -14.686 1.00 0.00 O ATOM 245 CB LYS A 168 -12.102 16.703 -11.510 1.00 0.00 C ATOM 246 CG LYS A 168 -11.132 17.352 -10.553 1.00 0.00 C ATOM 247 CD LYS A 168 -10.179 16.311 -9.968 1.00 0.00 C ATOM 248 CE LYS A 168 -9.154 16.943 -9.023 1.00 0.00 C ATOM 249 NZ LYS A 168 -8.273 17.948 -9.723 1.00 0.00 N ATOM 0 H LYS A 168 -14.324 17.794 -11.117 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.082 18.544 -12.601 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -12.889 16.212 -10.938 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.582 15.925 -12.069 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -10.563 18.124 -11.071 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -11.680 17.844 -9.749 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -10.752 15.556 -9.430 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -9.659 15.799 -10.778 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -9.675 17.431 -8.200 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -8.533 16.160 -8.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -7.482 18.210 -9.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -7.900 17.531 -10.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -8.829 18.797 -9.952 1.00 0.00 H new ATOM 263 N ALA A 169 -13.987 16.240 -13.986 1.00 0.00 N ATOM 264 CA ALA A 169 -14.240 15.555 -15.243 1.00 0.00 C ATOM 265 C ALA A 169 -14.353 16.570 -16.384 1.00 0.00 C ATOM 266 O ALA A 169 -13.779 16.392 -17.455 1.00 0.00 O ATOM 267 CB ALA A 169 -15.524 14.727 -15.131 1.00 0.00 C ATOM 0 H ALA A 169 -14.700 16.094 -13.271 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.408 14.886 -15.460 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.710 14.215 -16.075 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.414 13.991 -14.335 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.363 15.385 -14.903 1.00 0.00 H new ATOM 273 N ILE A 170 -15.089 17.644 -16.142 1.00 0.00 N ATOM 274 CA ILE A 170 -15.307 18.664 -17.164 1.00 0.00 C ATOM 275 C ILE A 170 -13.994 19.365 -17.508 1.00 0.00 C ATOM 276 O ILE A 170 -13.703 19.619 -18.672 1.00 0.00 O ATOM 277 CB ILE A 170 -16.356 19.704 -16.681 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.732 19.025 -16.523 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.460 20.864 -17.675 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.700 19.784 -15.610 1.00 0.00 C ATOM 0 H ILE A 170 -15.546 17.834 -15.250 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.688 18.174 -18.060 1.00 0.00 H new ATOM 0 HB ILE A 170 -16.036 20.099 -15.717 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.187 18.916 -17.507 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.587 18.020 -16.126 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.199 21.582 -17.320 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.491 21.355 -17.764 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.764 20.482 -18.650 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.644 19.243 -15.551 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.268 19.870 -14.613 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.878 20.780 -16.016 1.00 0.00 H new ATOM 292 N GLU A 171 -13.191 19.669 -16.504 1.00 0.00 N ATOM 293 CA GLU A 171 -11.904 20.332 -16.732 1.00 0.00 C ATOM 294 C GLU A 171 -10.916 19.418 -17.418 1.00 0.00 C ATOM 295 O GLU A 171 -10.042 19.869 -18.154 1.00 0.00 O ATOM 296 CB GLU A 171 -11.302 20.752 -15.408 1.00 0.00 C ATOM 297 CG GLU A 171 -11.990 21.906 -14.808 1.00 0.00 C ATOM 298 CD GLU A 171 -11.288 23.235 -15.132 1.00 0.00 C ATOM 299 OE1 GLU A 171 -11.102 23.545 -16.337 1.00 0.00 O ATOM 300 OE2 GLU A 171 -10.910 23.971 -14.194 1.00 0.00 O ATOM 0 H GLU A 171 -13.399 19.472 -15.525 1.00 0.00 H new ATOM 0 HA GLU A 171 -12.096 21.195 -17.369 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.340 19.912 -14.714 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.250 20.998 -15.554 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -13.018 21.942 -15.170 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -12.037 21.776 -13.727 1.00 0.00 H new ATOM 307 N SER A 172 -11.059 18.133 -17.158 1.00 0.00 N ATOM 308 CA SER A 172 -10.179 17.124 -17.766 1.00 0.00 C ATOM 309 C SER A 172 -10.436 17.046 -19.264 1.00 0.00 C ATOM 310 O SER A 172 -9.545 16.722 -20.042 1.00 0.00 O ATOM 311 CB SER A 172 -10.402 15.737 -17.155 1.00 0.00 C ATOM 312 OG SER A 172 -10.092 15.729 -15.772 1.00 0.00 O ATOM 0 H SER A 172 -11.770 17.753 -16.534 1.00 0.00 H new ATOM 0 HA SER A 172 -9.151 17.429 -17.572 1.00 0.00 H new ATOM 0 HB2 SER A 172 -11.440 15.436 -17.299 1.00 0.00 H new ATOM 0 HB3 SER A 172 -9.783 15.005 -17.673 1.00 0.00 H new ATOM 0 HG SER A 172 -10.829 16.135 -15.269 1.00 0.00 H new ATOM 318 N SER A 173 -11.662 17.338 -19.671 1.00 0.00 N ATOM 319 CA SER A 173 -12.003 17.316 -21.084 1.00 0.00 C ATOM 320 C SER A 173 -11.367 18.515 -21.785 1.00 0.00 C ATOM 321 O SER A 173 -11.371 19.628 -21.261 1.00 0.00 O ATOM 322 CB SER A 173 -13.520 17.343 -21.263 1.00 0.00 C ATOM 323 OG SER A 173 -14.046 18.645 -21.128 1.00 0.00 O ATOM 0 H SER A 173 -12.430 17.591 -19.049 1.00 0.00 H new ATOM 0 HA SER A 173 -11.619 16.398 -21.529 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.776 16.949 -22.247 1.00 0.00 H new ATOM 0 HB3 SER A 173 -13.984 16.687 -20.526 1.00 0.00 H new ATOM 0 HG SER A 173 -13.886 18.970 -20.217 1.00 0.00 H new ATOM 329 N ALA A 174 -10.827 18.298 -22.975 1.00 0.00 N ATOM 330 CA ALA A 174 -10.213 19.385 -23.739 1.00 0.00 C ATOM 331 C ALA A 174 -11.285 20.400 -24.152 1.00 0.00 C ATOM 332 O ALA A 174 -11.024 21.589 -24.284 1.00 0.00 O ATOM 333 CB ALA A 174 -9.512 18.815 -24.979 1.00 0.00 C ATOM 0 H ALA A 174 -10.799 17.388 -23.434 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.473 19.890 -23.118 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -9.056 19.627 -25.545 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -8.740 18.111 -24.669 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.241 18.301 -25.605 1.00 0.00 H new ATOM 339 N GLU A 175 -12.497 19.903 -24.343 1.00 0.00 N ATOM 340 CA GLU A 175 -13.626 20.729 -24.763 1.00 0.00 C ATOM 341 C GLU A 175 -14.217 21.567 -23.624 1.00 0.00 C ATOM 342 O GLU A 175 -15.064 22.430 -23.869 1.00 0.00 O ATOM 343 CB GLU A 175 -14.735 19.824 -25.308 1.00 0.00 C ATOM 344 CG GLU A 175 -14.362 19.016 -26.541 1.00 0.00 C ATOM 345 CD GLU A 175 -15.517 18.131 -27.012 1.00 0.00 C ATOM 346 OE1 GLU A 175 -15.330 16.904 -27.088 1.00 0.00 O ATOM 347 OE2 GLU A 175 -16.616 18.668 -27.296 1.00 0.00 O ATOM 0 H GLU A 175 -12.729 18.918 -24.212 1.00 0.00 H new ATOM 0 HA GLU A 175 -13.248 21.414 -25.522 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -15.040 19.135 -24.520 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.602 20.441 -25.546 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -14.072 19.693 -27.345 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -13.495 18.394 -26.319 1.00 0.00 H new ATOM 354 N LYS A 176 -13.788 21.296 -22.390 1.00 0.00 N ATOM 355 CA LYS A 176 -14.321 21.936 -21.177 1.00 0.00 C ATOM 356 C LYS A 176 -15.827 21.756 -21.043 1.00 0.00 C ATOM 357 O LYS A 176 -16.524 22.625 -20.526 1.00 0.00 O ATOM 358 CB LYS A 176 -13.929 23.419 -21.098 1.00 0.00 C ATOM 359 CG LYS A 176 -12.421 23.663 -21.145 1.00 0.00 C ATOM 360 CD LYS A 176 -11.705 22.883 -20.042 1.00 0.00 C ATOM 361 CE LYS A 176 -10.274 23.338 -19.858 1.00 0.00 C ATOM 362 NZ LYS A 176 -9.650 22.609 -18.709 1.00 0.00 N ATOM 0 H LYS A 176 -13.051 20.617 -22.198 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.862 21.426 -20.330 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.400 23.954 -21.923 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.327 23.842 -20.176 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -12.031 23.365 -22.118 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.218 24.728 -21.033 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -12.246 23.004 -19.104 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.718 21.820 -20.283 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -9.705 23.153 -20.769 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -10.246 24.412 -19.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -8.621 22.756 -18.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -10.040 22.971 -17.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -9.856 21.593 -18.790 1.00 0.00 H new ATOM 376 N ARG A 177 -16.316 20.611 -21.503 1.00 0.00 N ATOM 377 CA ARG A 177 -17.730 20.242 -21.418 1.00 0.00 C ATOM 378 C ARG A 177 -17.759 18.738 -21.574 1.00 0.00 C ATOM 379 O ARG A 177 -16.923 18.185 -22.276 1.00 0.00 O ATOM 380 CB ARG A 177 -18.554 20.907 -22.535 1.00 0.00 C ATOM 381 CG ARG A 177 -18.053 20.597 -23.931 1.00 0.00 C ATOM 382 CD ARG A 177 -18.855 21.272 -25.007 1.00 0.00 C ATOM 383 NE ARG A 177 -18.262 20.961 -26.318 1.00 0.00 N ATOM 384 CZ ARG A 177 -17.468 21.763 -27.018 1.00 0.00 C ATOM 385 NH1 ARG A 177 -17.125 22.957 -26.601 1.00 0.00 N ATOM 386 NH2 ARG A 177 -17.004 21.350 -28.160 1.00 0.00 N ATOM 0 H ARG A 177 -15.737 19.901 -21.952 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.167 20.572 -20.476 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.591 20.583 -22.451 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.545 21.987 -22.387 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -17.011 20.907 -24.014 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -18.079 19.519 -24.089 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.890 20.933 -24.973 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -18.867 22.350 -24.846 1.00 0.00 H new ATOM 0 HE ARG A 177 -18.480 20.051 -26.724 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -17.471 23.303 -25.706 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -16.512 23.540 -27.171 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -17.251 20.423 -28.506 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.393 21.953 -28.710 1.00 0.00 H new ATOM 400 N LEU A 178 -18.702 18.077 -20.925 1.00 0.00 N ATOM 401 CA LEU A 178 -18.849 16.628 -21.045 1.00 0.00 C ATOM 402 C LEU A 178 -20.322 16.262 -21.042 1.00 0.00 C ATOM 403 O LEU A 178 -21.160 17.035 -20.590 1.00 0.00 O ATOM 404 CB LEU A 178 -18.163 15.908 -19.876 1.00 0.00 C ATOM 405 CG LEU A 178 -16.632 15.740 -19.905 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.242 14.830 -18.772 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.144 15.121 -21.232 1.00 0.00 C ATOM 0 H LEU A 178 -19.382 18.518 -20.306 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.382 16.317 -21.979 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.419 16.444 -18.962 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.603 14.914 -19.797 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.173 16.724 -19.809 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.160 14.694 -18.770 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.554 15.273 -17.826 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.729 13.863 -18.898 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.059 15.021 -21.209 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.597 14.138 -21.363 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.431 15.767 -22.062 1.00 0.00 H new ATOM 419 N THR A 179 -20.636 15.077 -21.536 1.00 0.00 N ATOM 420 CA THR A 179 -21.999 14.561 -21.505 1.00 0.00 C ATOM 421 C THR A 179 -22.121 13.746 -20.223 1.00 0.00 C ATOM 422 O THR A 179 -21.113 13.434 -19.599 1.00 0.00 O ATOM 423 CB THR A 179 -22.270 13.656 -22.713 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.283 12.622 -22.752 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.189 14.447 -24.011 1.00 0.00 C ATOM 0 H THR A 179 -19.960 14.447 -21.968 1.00 0.00 H new ATOM 0 HA THR A 179 -22.719 15.379 -21.539 1.00 0.00 H new ATOM 0 HB THR A 179 -23.271 13.235 -22.613 1.00 0.00 H new ATOM 0 HG1 THR A 179 -21.709 11.756 -22.579 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.385 13.784 -24.854 1.00 0.00 H new ATOM 0 HG22 THR A 179 -22.931 15.245 -23.997 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.193 14.879 -24.112 1.00 0.00 H new ATOM 433 N LEU A 180 -23.335 13.387 -19.823 1.00 0.00 N ATOM 434 CA LEU A 180 -23.518 12.626 -18.582 1.00 0.00 C ATOM 435 C LEU A 180 -22.757 11.306 -18.593 1.00 0.00 C ATOM 436 O LEU A 180 -22.143 10.943 -17.604 1.00 0.00 O ATOM 437 CB LEU A 180 -25.003 12.339 -18.331 1.00 0.00 C ATOM 438 CG LEU A 180 -25.744 13.370 -17.465 1.00 0.00 C ATOM 439 CD1 LEU A 180 -27.236 13.044 -17.437 1.00 0.00 C ATOM 440 CD2 LEU A 180 -25.200 13.401 -16.035 1.00 0.00 C ATOM 0 H LEU A 180 -24.196 13.603 -20.325 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.118 13.248 -17.781 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.509 12.270 -19.294 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.090 11.362 -17.855 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.586 14.353 -17.908 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -27.757 13.778 -16.822 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -27.634 13.073 -18.451 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -27.383 12.049 -17.018 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -25.748 14.142 -15.453 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -25.321 12.419 -15.578 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -24.143 13.665 -16.054 1.00 0.00 H new ATOM 452 N SER A 181 -22.790 10.599 -19.713 1.00 0.00 N ATOM 453 CA SER A 181 -22.113 9.311 -19.825 1.00 0.00 C ATOM 454 C SER A 181 -20.605 9.461 -19.665 1.00 0.00 C ATOM 455 O SER A 181 -19.950 8.613 -19.080 1.00 0.00 O ATOM 456 CB SER A 181 -22.424 8.704 -21.186 1.00 0.00 C ATOM 457 OG SER A 181 -22.640 9.738 -22.139 1.00 0.00 O ATOM 0 H SER A 181 -23.278 10.894 -20.559 1.00 0.00 H new ATOM 0 HA SER A 181 -22.472 8.660 -19.028 1.00 0.00 H new ATOM 0 HB2 SER A 181 -21.599 8.068 -21.507 1.00 0.00 H new ATOM 0 HB3 SER A 181 -23.308 8.070 -21.118 1.00 0.00 H new ATOM 0 HG SER A 181 -22.838 9.341 -23.013 1.00 0.00 H new ATOM 463 N GLN A 182 -20.059 10.553 -20.175 1.00 0.00 N ATOM 464 CA GLN A 182 -18.628 10.807 -20.066 1.00 0.00 C ATOM 465 C GLN A 182 -18.232 11.095 -18.623 1.00 0.00 C ATOM 466 O GLN A 182 -17.187 10.663 -18.160 1.00 0.00 O ATOM 467 CB GLN A 182 -18.251 12.004 -20.934 1.00 0.00 C ATOM 468 CG GLN A 182 -17.973 11.660 -22.399 1.00 0.00 C ATOM 469 CD GLN A 182 -16.555 11.162 -22.628 1.00 0.00 C ATOM 470 OE1 GLN A 182 -16.047 10.345 -21.888 1.00 0.00 O ATOM 471 NE2 GLN A 182 -15.916 11.666 -23.649 1.00 0.00 N ATOM 0 H GLN A 182 -20.582 11.277 -20.668 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.099 9.916 -20.404 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.057 12.736 -20.892 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.366 12.480 -20.511 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -18.679 10.898 -22.729 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -18.147 12.543 -23.014 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -16.374 12.351 -24.250 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -14.958 11.375 -23.846 1.00 0.00 H new ATOM 480 N ILE A 183 -19.077 11.820 -17.906 1.00 0.00 N ATOM 481 CA ILE A 183 -18.811 12.133 -16.503 1.00 0.00 C ATOM 482 C ILE A 183 -18.842 10.828 -15.710 1.00 0.00 C ATOM 483 O ILE A 183 -18.023 10.619 -14.815 1.00 0.00 O ATOM 484 CB ILE A 183 -19.854 13.151 -15.955 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.705 14.481 -16.718 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.664 13.396 -14.432 1.00 0.00 C ATOM 487 CD1 ILE A 183 -20.947 15.340 -16.728 1.00 0.00 C ATOM 0 H ILE A 183 -19.951 12.203 -18.267 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.831 12.599 -16.403 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.852 12.739 -16.104 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.888 15.050 -16.274 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.420 14.265 -17.748 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.408 14.112 -14.083 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.785 12.456 -13.894 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.665 13.793 -14.249 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.752 16.255 -17.287 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.763 14.794 -17.200 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.224 15.592 -15.704 1.00 0.00 H new ATOM 499 N TYR A 184 -19.769 9.942 -16.051 1.00 0.00 N ATOM 500 CA TYR A 184 -19.843 8.646 -15.379 1.00 0.00 C ATOM 501 C TYR A 184 -18.554 7.859 -15.622 1.00 0.00 C ATOM 502 O TYR A 184 -17.927 7.374 -14.687 1.00 0.00 O ATOM 503 CB TYR A 184 -21.040 7.808 -15.869 1.00 0.00 C ATOM 504 CG TYR A 184 -22.423 8.442 -15.715 1.00 0.00 C ATOM 505 CD1 TYR A 184 -22.681 9.455 -14.763 1.00 0.00 C ATOM 506 CD2 TYR A 184 -23.492 8.008 -16.530 1.00 0.00 C ATOM 507 CE1 TYR A 184 -23.983 10.013 -14.626 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.792 8.570 -16.393 1.00 0.00 C ATOM 509 CZ TYR A 184 -25.021 9.560 -15.440 1.00 0.00 C ATOM 510 OH TYR A 184 -26.277 10.095 -15.295 1.00 0.00 O ATOM 0 H TYR A 184 -20.471 10.090 -16.776 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.975 8.841 -14.315 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -20.886 7.576 -16.923 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -21.037 6.860 -15.330 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -21.880 9.810 -14.132 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -23.320 7.238 -17.268 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -24.167 10.785 -13.894 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -25.599 8.230 -17.026 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.888 9.675 -15.936 1.00 0.00 H new ATOM 520 N GLU A 185 -18.150 7.741 -16.877 1.00 0.00 N ATOM 521 CA GLU A 185 -16.945 6.989 -17.221 1.00 0.00 C ATOM 522 C GLU A 185 -15.707 7.557 -16.541 1.00 0.00 C ATOM 523 O GLU A 185 -14.842 6.808 -16.079 1.00 0.00 O ATOM 524 CB GLU A 185 -16.748 6.997 -18.737 1.00 0.00 C ATOM 525 CG GLU A 185 -17.561 5.927 -19.440 1.00 0.00 C ATOM 526 CD GLU A 185 -17.086 4.536 -19.058 1.00 0.00 C ATOM 527 OE1 GLU A 185 -15.916 4.210 -19.358 1.00 0.00 O ATOM 528 OE2 GLU A 185 -17.856 3.772 -18.450 1.00 0.00 O ATOM 0 H GLU A 185 -18.634 8.153 -17.675 1.00 0.00 H new ATOM 0 HA GLU A 185 -17.080 5.967 -16.867 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -17.026 7.975 -19.130 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -15.692 6.851 -18.962 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -18.614 6.038 -19.181 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -17.482 6.057 -20.519 1.00 0.00 H new ATOM 535 N TRP A 186 -15.622 8.877 -16.460 1.00 0.00 N ATOM 536 CA TRP A 186 -14.484 9.517 -15.832 1.00 0.00 C ATOM 537 C TRP A 186 -14.396 9.108 -14.364 1.00 0.00 C ATOM 538 O TRP A 186 -13.314 8.827 -13.869 1.00 0.00 O ATOM 539 CB TRP A 186 -14.601 11.038 -15.968 1.00 0.00 C ATOM 540 CG TRP A 186 -13.433 11.772 -15.386 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.307 12.181 -16.023 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.267 12.186 -14.019 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.447 12.812 -15.172 1.00 0.00 N ATOM 544 CE2 TRP A 186 -11.998 12.826 -13.920 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.065 12.079 -12.866 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.507 13.344 -12.706 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.579 12.600 -11.641 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.299 13.226 -11.576 1.00 0.00 C ATOM 0 H TRP A 186 -16.326 9.520 -16.821 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.570 9.195 -16.331 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.696 11.296 -17.023 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.514 11.372 -15.475 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.115 12.026 -17.074 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.542 13.208 -15.427 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.035 11.606 -12.913 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.539 13.820 -12.657 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.183 12.522 -10.749 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -11.943 13.613 -10.633 1.00 0.00 H new ATOM 559 N MET A 187 -15.521 9.053 -13.662 1.00 0.00 N ATOM 560 CA MET A 187 -15.492 8.682 -12.245 1.00 0.00 C ATOM 561 C MET A 187 -15.144 7.211 -12.043 1.00 0.00 C ATOM 562 O MET A 187 -14.444 6.878 -11.098 1.00 0.00 O ATOM 563 CB MET A 187 -16.823 8.980 -11.562 1.00 0.00 C ATOM 564 CG MET A 187 -17.122 10.451 -11.424 1.00 0.00 C ATOM 565 SD MET A 187 -18.555 10.716 -10.377 1.00 0.00 S ATOM 566 CE MET A 187 -18.828 12.428 -10.621 1.00 0.00 C ATOM 0 H MET A 187 -16.448 9.255 -14.036 1.00 0.00 H new ATOM 0 HA MET A 187 -14.710 9.289 -11.789 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.625 8.508 -12.129 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.822 8.525 -10.572 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.258 10.964 -11.002 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.300 10.884 -12.408 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.444 12.817 -9.811 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.872 12.951 -10.633 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.338 12.583 -11.572 1.00 0.00 H new ATOM 576 N VAL A 188 -15.609 6.332 -12.922 1.00 0.00 N ATOM 577 CA VAL A 188 -15.291 4.901 -12.807 1.00 0.00 C ATOM 578 C VAL A 188 -13.782 4.704 -12.956 1.00 0.00 C ATOM 579 O VAL A 188 -13.166 3.894 -12.257 1.00 0.00 O ATOM 580 CB VAL A 188 -16.033 4.066 -13.911 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.581 2.594 -13.906 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.545 4.118 -13.697 1.00 0.00 C ATOM 0 H VAL A 188 -16.202 6.574 -13.716 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.623 4.553 -11.829 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.779 4.510 -14.874 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -16.115 2.047 -14.683 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.509 2.542 -14.097 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.798 2.150 -12.935 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -18.042 3.534 -14.471 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.788 3.705 -12.718 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.884 5.153 -13.749 1.00 0.00 H new ATOM 592 N LYS A 189 -13.179 5.442 -13.878 1.00 0.00 N ATOM 593 CA LYS A 189 -11.751 5.305 -14.142 1.00 0.00 C ATOM 594 C LYS A 189 -10.880 6.049 -13.128 1.00 0.00 C ATOM 595 O LYS A 189 -9.834 5.548 -12.733 1.00 0.00 O ATOM 596 CB LYS A 189 -11.446 5.808 -15.559 1.00 0.00 C ATOM 597 CG LYS A 189 -11.491 4.710 -16.649 1.00 0.00 C ATOM 598 CD LYS A 189 -12.902 4.143 -16.892 1.00 0.00 C ATOM 599 CE LYS A 189 -12.877 3.013 -17.914 1.00 0.00 C ATOM 600 NZ LYS A 189 -14.248 2.422 -18.108 1.00 0.00 N ATOM 0 H LYS A 189 -13.652 6.138 -14.454 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.505 4.247 -14.049 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.162 6.589 -15.817 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -10.458 6.268 -15.564 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -11.107 5.120 -17.583 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -10.826 3.896 -16.361 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -13.316 3.777 -15.952 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -13.560 4.938 -17.242 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -12.502 3.389 -18.866 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -12.187 2.236 -17.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -14.232 1.764 -18.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -14.530 1.910 -17.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -14.931 3.183 -18.297 1.00 0.00 H new ATOM 614 N SER A 190 -11.299 7.237 -12.719 1.00 0.00 N ATOM 615 CA SER A 190 -10.498 8.069 -11.815 1.00 0.00 C ATOM 616 C SER A 190 -10.709 7.824 -10.322 1.00 0.00 C ATOM 617 O SER A 190 -9.854 8.203 -9.521 1.00 0.00 O ATOM 618 CB SER A 190 -10.782 9.553 -12.089 1.00 0.00 C ATOM 619 OG SER A 190 -9.914 10.384 -11.333 1.00 0.00 O ATOM 0 H SER A 190 -12.189 7.652 -12.995 1.00 0.00 H new ATOM 0 HA SER A 190 -9.468 7.786 -12.031 1.00 0.00 H new ATOM 0 HB2 SER A 190 -10.657 9.761 -13.152 1.00 0.00 H new ATOM 0 HB3 SER A 190 -11.818 9.781 -11.840 1.00 0.00 H new ATOM 0 HG SER A 190 -9.704 9.948 -10.481 1.00 0.00 H new ATOM 625 N VAL A 191 -11.829 7.230 -9.925 1.00 0.00 N ATOM 626 CA VAL A 191 -12.124 7.051 -8.497 1.00 0.00 C ATOM 627 C VAL A 191 -12.467 5.595 -8.165 1.00 0.00 C ATOM 628 O VAL A 191 -13.394 5.020 -8.738 1.00 0.00 O ATOM 629 CB VAL A 191 -13.307 7.959 -8.050 1.00 0.00 C ATOM 630 CG1 VAL A 191 -13.415 7.996 -6.517 1.00 0.00 C ATOM 631 CG2 VAL A 191 -13.113 9.379 -8.561 1.00 0.00 C ATOM 0 H VAL A 191 -12.542 6.867 -10.557 1.00 0.00 H new ATOM 0 HA VAL A 191 -11.221 7.334 -7.957 1.00 0.00 H new ATOM 0 HB VAL A 191 -14.222 7.540 -8.469 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -14.248 8.636 -6.226 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.584 6.987 -6.140 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.490 8.391 -6.097 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -13.950 9.999 -8.239 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -12.184 9.786 -8.161 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -13.066 9.371 -9.650 1.00 0.00 H new ATOM 641 N PRO A 192 -11.732 4.974 -7.222 1.00 0.00 N ATOM 642 CA PRO A 192 -12.052 3.567 -6.946 1.00 0.00 C ATOM 643 C PRO A 192 -13.413 3.373 -6.275 1.00 0.00 C ATOM 644 O PRO A 192 -14.032 2.329 -6.418 1.00 0.00 O ATOM 645 CB PRO A 192 -10.900 3.124 -6.040 1.00 0.00 C ATOM 646 CG PRO A 192 -10.472 4.367 -5.346 1.00 0.00 C ATOM 647 CD PRO A 192 -10.612 5.452 -6.386 1.00 0.00 C ATOM 0 HA PRO A 192 -12.139 2.979 -7.860 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -11.224 2.364 -5.329 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -10.084 2.692 -6.619 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -11.096 4.570 -4.475 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -9.445 4.289 -4.991 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.832 6.419 -5.933 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.698 5.573 -6.968 1.00 0.00 H new ATOM 655 N TYR A 193 -13.887 4.392 -5.568 1.00 0.00 N ATOM 656 CA TYR A 193 -15.201 4.347 -4.923 1.00 0.00 C ATOM 657 C TYR A 193 -16.296 4.123 -5.958 1.00 0.00 C ATOM 658 O TYR A 193 -17.194 3.321 -5.773 1.00 0.00 O ATOM 659 CB TYR A 193 -15.469 5.678 -4.208 1.00 0.00 C ATOM 660 CG TYR A 193 -16.797 5.729 -3.476 1.00 0.00 C ATOM 661 CD1 TYR A 193 -17.981 6.115 -4.148 1.00 0.00 C ATOM 662 CD2 TYR A 193 -16.879 5.405 -2.108 1.00 0.00 C ATOM 663 CE1 TYR A 193 -19.222 6.170 -3.462 1.00 0.00 C ATOM 664 CE2 TYR A 193 -18.120 5.472 -1.416 1.00 0.00 C ATOM 665 CZ TYR A 193 -19.276 5.853 -2.104 1.00 0.00 C ATOM 666 OH TYR A 193 -20.474 5.907 -1.439 1.00 0.00 O ATOM 0 H TYR A 193 -13.380 5.266 -5.424 1.00 0.00 H new ATOM 0 HA TYR A 193 -15.205 3.525 -4.207 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -14.666 5.864 -3.495 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -15.438 6.485 -4.940 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -17.940 6.371 -5.196 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -15.988 5.102 -1.578 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -20.121 6.456 -3.988 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -18.169 5.230 -0.365 1.00 0.00 H new ATOM 0 HH TYR A 193 -20.339 5.656 -0.501 1.00 0.00 H new ATOM 676 N PHE A 194 -16.224 4.854 -7.055 1.00 0.00 N ATOM 677 CA PHE A 194 -17.260 4.780 -8.071 1.00 0.00 C ATOM 678 C PHE A 194 -17.097 3.560 -8.954 1.00 0.00 C ATOM 679 O PHE A 194 -18.068 3.077 -9.530 1.00 0.00 O ATOM 680 CB PHE A 194 -17.251 6.064 -8.883 1.00 0.00 C ATOM 681 CG PHE A 194 -17.935 7.197 -8.183 1.00 0.00 C ATOM 682 CD1 PHE A 194 -19.324 7.360 -8.304 1.00 0.00 C ATOM 683 CD2 PHE A 194 -17.210 8.095 -7.383 1.00 0.00 C ATOM 684 CE1 PHE A 194 -19.993 8.396 -7.645 1.00 0.00 C ATOM 685 CE2 PHE A 194 -17.867 9.140 -6.700 1.00 0.00 C ATOM 686 CZ PHE A 194 -19.260 9.294 -6.829 1.00 0.00 C ATOM 0 H PHE A 194 -15.465 5.502 -7.266 1.00 0.00 H new ATOM 0 HA PHE A 194 -18.228 4.674 -7.581 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -16.220 6.345 -9.098 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.740 5.886 -9.841 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -19.887 6.672 -8.918 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -16.140 7.985 -7.290 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -21.061 8.511 -7.757 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -17.302 9.820 -6.080 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.768 10.093 -6.309 1.00 0.00 H new ATOM 696 N LYS A 195 -15.877 3.046 -9.033 1.00 0.00 N ATOM 697 CA LYS A 195 -15.614 1.807 -9.761 1.00 0.00 C ATOM 698 C LYS A 195 -16.324 0.657 -9.049 1.00 0.00 C ATOM 699 O LYS A 195 -16.970 -0.169 -9.675 1.00 0.00 O ATOM 700 CB LYS A 195 -14.107 1.545 -9.802 1.00 0.00 C ATOM 701 CG LYS A 195 -13.696 0.385 -10.703 1.00 0.00 C ATOM 702 CD LYS A 195 -12.258 -0.062 -10.426 1.00 0.00 C ATOM 703 CE LYS A 195 -11.237 1.033 -10.752 1.00 0.00 C ATOM 704 NZ LYS A 195 -9.834 0.530 -10.549 1.00 0.00 N ATOM 0 H LYS A 195 -15.053 3.466 -8.603 1.00 0.00 H new ATOM 0 HA LYS A 195 -15.985 1.890 -10.783 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.602 2.450 -10.141 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.757 1.345 -8.789 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -14.374 -0.454 -10.549 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -13.790 0.684 -11.747 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -12.163 -0.344 -9.377 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -12.036 -0.951 -11.017 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -11.365 1.361 -11.784 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -11.413 1.901 -10.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -9.158 1.287 -10.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -9.709 0.239 -9.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -9.663 -0.284 -11.173 1.00 0.00 H new ATOM 718 N ASP A 196 -16.197 0.632 -7.730 1.00 0.00 N ATOM 719 CA ASP A 196 -16.819 -0.400 -6.893 1.00 0.00 C ATOM 720 C ASP A 196 -18.342 -0.334 -6.948 1.00 0.00 C ATOM 721 O ASP A 196 -19.032 -1.343 -6.905 1.00 0.00 O ATOM 722 CB ASP A 196 -16.380 -0.177 -5.444 1.00 0.00 C ATOM 723 CG ASP A 196 -16.985 -1.181 -4.487 1.00 0.00 C ATOM 724 OD1 ASP A 196 -17.820 -0.764 -3.648 1.00 0.00 O ATOM 725 OD2 ASP A 196 -16.627 -2.370 -4.558 1.00 0.00 O ATOM 0 H ASP A 196 -15.662 1.323 -7.204 1.00 0.00 H new ATOM 0 HA ASP A 196 -16.505 -1.375 -7.265 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -15.293 -0.235 -5.385 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -16.662 0.829 -5.134 1.00 0.00 H new ATOM 730 N LYS A 197 -18.869 0.875 -7.056 1.00 0.00 N ATOM 731 CA LYS A 197 -20.317 1.086 -7.027 1.00 0.00 C ATOM 732 C LYS A 197 -20.974 0.946 -8.399 1.00 0.00 C ATOM 733 O LYS A 197 -22.086 1.410 -8.603 1.00 0.00 O ATOM 734 CB LYS A 197 -20.624 2.453 -6.386 1.00 0.00 C ATOM 735 CG LYS A 197 -20.855 2.366 -4.870 1.00 0.00 C ATOM 736 CD LYS A 197 -19.572 2.130 -4.064 1.00 0.00 C ATOM 737 CE LYS A 197 -19.864 1.587 -2.680 1.00 0.00 C ATOM 738 NZ LYS A 197 -20.687 2.533 -1.871 1.00 0.00 N ATOM 0 H LYS A 197 -18.321 1.728 -7.165 1.00 0.00 H new ATOM 0 HA LYS A 197 -20.754 0.295 -6.418 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.797 3.135 -6.583 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -21.509 2.880 -6.859 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -21.323 3.289 -4.529 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -21.557 1.558 -4.664 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -18.930 1.431 -4.600 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -19.021 3.066 -3.977 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -20.387 0.635 -2.767 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -18.925 1.389 -2.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -20.694 2.225 -0.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -20.281 3.488 -1.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -21.661 2.546 -2.236 1.00 0.00 H new ATOM 752 N GLY A 198 -20.293 0.296 -9.331 1.00 0.00 N ATOM 753 CA GLY A 198 -20.828 0.124 -10.678 1.00 0.00 C ATOM 754 C GLY A 198 -21.936 -0.916 -10.801 1.00 0.00 C ATOM 755 O GLY A 198 -22.392 -1.214 -11.900 1.00 0.00 O ATOM 0 H GLY A 198 -19.373 -0.120 -9.183 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -21.210 1.083 -11.027 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -20.012 -0.155 -11.344 1.00 0.00 H new ATOM 759 N ASP A 199 -22.378 -1.460 -9.674 1.00 0.00 N ATOM 760 CA ASP A 199 -23.474 -2.437 -9.645 1.00 0.00 C ATOM 761 C ASP A 199 -24.761 -1.831 -10.235 1.00 0.00 C ATOM 762 O ASP A 199 -25.031 -0.636 -10.086 1.00 0.00 O ATOM 763 CB ASP A 199 -23.708 -2.882 -8.198 1.00 0.00 C ATOM 764 CG ASP A 199 -25.143 -3.291 -7.939 1.00 0.00 C ATOM 765 OD1 ASP A 199 -25.804 -2.598 -7.141 1.00 0.00 O ATOM 766 OD2 ASP A 199 -25.625 -4.273 -8.532 1.00 0.00 O ATOM 0 H ASP A 199 -21.993 -1.242 -8.755 1.00 0.00 H new ATOM 0 HA ASP A 199 -23.202 -3.300 -10.253 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -23.048 -3.719 -7.968 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -23.438 -2.069 -7.524 1.00 0.00 H new ATOM 771 N SER A 200 -25.548 -2.656 -10.911 1.00 0.00 N ATOM 772 CA SER A 200 -26.753 -2.201 -11.603 1.00 0.00 C ATOM 773 C SER A 200 -27.789 -1.549 -10.682 1.00 0.00 C ATOM 774 O SER A 200 -28.441 -0.582 -11.079 1.00 0.00 O ATOM 775 CB SER A 200 -27.396 -3.384 -12.327 1.00 0.00 C ATOM 776 OG SER A 200 -27.689 -4.427 -11.412 1.00 0.00 O ATOM 0 H SER A 200 -25.373 -3.657 -10.997 1.00 0.00 H new ATOM 0 HA SER A 200 -26.434 -1.431 -12.305 1.00 0.00 H new ATOM 0 HB2 SER A 200 -28.311 -3.060 -12.824 1.00 0.00 H new ATOM 0 HB3 SER A 200 -26.725 -3.751 -13.103 1.00 0.00 H new ATOM 0 HG SER A 200 -28.102 -5.176 -11.891 1.00 0.00 H new ATOM 782 N ASN A 201 -27.949 -2.045 -9.463 1.00 0.00 N ATOM 783 CA ASN A 201 -28.900 -1.427 -8.535 1.00 0.00 C ATOM 784 C ASN A 201 -28.320 -0.128 -7.973 1.00 0.00 C ATOM 785 O ASN A 201 -29.009 0.885 -7.849 1.00 0.00 O ATOM 786 CB ASN A 201 -29.250 -2.380 -7.396 1.00 0.00 C ATOM 787 CG ASN A 201 -30.350 -1.843 -6.518 1.00 0.00 C ATOM 788 OD1 ASN A 201 -31.301 -1.242 -6.992 1.00 0.00 O ATOM 789 ND2 ASN A 201 -30.228 -2.056 -5.238 1.00 0.00 N ATOM 0 H ASN A 201 -27.448 -2.854 -9.095 1.00 0.00 H new ATOM 0 HA ASN A 201 -29.814 -1.202 -9.085 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -29.555 -3.341 -7.810 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -28.362 -2.561 -6.791 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -30.942 -1.716 -4.594 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -29.418 -2.563 -4.880 1.00 0.00 H new ATOM 796 N SER A 202 -27.036 -0.159 -7.648 1.00 0.00 N ATOM 797 CA SER A 202 -26.329 1.007 -7.115 1.00 0.00 C ATOM 798 C SER A 202 -26.334 2.142 -8.125 1.00 0.00 C ATOM 799 O SER A 202 -26.295 3.321 -7.752 1.00 0.00 O ATOM 800 CB SER A 202 -24.886 0.634 -6.772 1.00 0.00 C ATOM 801 OG SER A 202 -24.859 -0.374 -5.775 1.00 0.00 O ATOM 0 H SER A 202 -26.451 -0.989 -7.744 1.00 0.00 H new ATOM 0 HA SER A 202 -26.842 1.336 -6.212 1.00 0.00 H new ATOM 0 HB2 SER A 202 -24.372 0.283 -7.667 1.00 0.00 H new ATOM 0 HB3 SER A 202 -24.349 1.516 -6.421 1.00 0.00 H new ATOM 0 HG SER A 202 -25.165 -1.222 -6.159 1.00 0.00 H new ATOM 807 N SER A 203 -26.414 1.785 -9.402 1.00 0.00 N ATOM 808 CA SER A 203 -26.468 2.751 -10.496 1.00 0.00 C ATOM 809 C SER A 203 -27.608 3.751 -10.310 1.00 0.00 C ATOM 810 O SER A 203 -27.524 4.884 -10.788 1.00 0.00 O ATOM 811 CB SER A 203 -26.620 2.044 -11.840 1.00 0.00 C ATOM 812 OG SER A 203 -25.495 1.230 -12.122 1.00 0.00 O ATOM 0 H SER A 203 -26.443 0.813 -9.710 1.00 0.00 H new ATOM 0 HA SER A 203 -25.526 3.299 -10.485 1.00 0.00 H new ATOM 0 HB2 SER A 203 -27.522 1.432 -11.832 1.00 0.00 H new ATOM 0 HB3 SER A 203 -26.744 2.784 -12.631 1.00 0.00 H new ATOM 0 HG SER A 203 -25.371 0.581 -11.398 1.00 0.00 H new ATOM 818 N ALA A 204 -28.668 3.353 -9.614 1.00 0.00 N ATOM 819 CA ALA A 204 -29.788 4.249 -9.348 1.00 0.00 C ATOM 820 C ALA A 204 -29.328 5.506 -8.588 1.00 0.00 C ATOM 821 O ALA A 204 -29.653 6.628 -8.981 1.00 0.00 O ATOM 822 CB ALA A 204 -30.876 3.508 -8.557 1.00 0.00 C ATOM 0 H ALA A 204 -28.775 2.417 -9.224 1.00 0.00 H new ATOM 0 HA ALA A 204 -30.202 4.573 -10.303 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.709 4.184 -8.363 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -31.229 2.655 -9.136 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -30.464 3.159 -7.610 1.00 0.00 H new ATOM 828 N GLY A 205 -28.568 5.322 -7.515 1.00 0.00 N ATOM 829 CA GLY A 205 -28.103 6.456 -6.725 1.00 0.00 C ATOM 830 C GLY A 205 -26.915 7.135 -7.375 1.00 0.00 C ATOM 831 O GLY A 205 -26.719 8.345 -7.247 1.00 0.00 O ATOM 0 H GLY A 205 -28.263 4.410 -7.175 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -28.914 7.175 -6.606 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.828 6.117 -5.726 1.00 0.00 H new ATOM 835 N TRP A 206 -26.139 6.341 -8.092 1.00 0.00 N ATOM 836 CA TRP A 206 -24.946 6.792 -8.813 1.00 0.00 C ATOM 837 C TRP A 206 -25.315 7.926 -9.780 1.00 0.00 C ATOM 838 O TRP A 206 -24.771 9.032 -9.720 1.00 0.00 O ATOM 839 CB TRP A 206 -24.479 5.572 -9.613 1.00 0.00 C ATOM 840 CG TRP A 206 -23.050 5.315 -9.821 1.00 0.00 C ATOM 841 CD1 TRP A 206 -22.348 4.261 -9.348 1.00 0.00 C ATOM 842 CD2 TRP A 206 -22.134 6.038 -10.651 1.00 0.00 C ATOM 843 NE1 TRP A 206 -21.074 4.248 -9.817 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.907 5.311 -10.647 1.00 0.00 C ATOM 845 CE3 TRP A 206 -22.223 7.215 -11.418 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.799 5.712 -11.391 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -21.094 7.634 -12.145 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.895 6.871 -12.128 1.00 0.00 C ATOM 0 H TRP A 206 -26.319 5.342 -8.196 1.00 0.00 H new ATOM 0 HA TRP A 206 -24.178 7.167 -8.137 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -24.896 4.690 -9.126 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.940 5.639 -10.599 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -22.752 3.518 -8.677 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -20.361 3.556 -9.585 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -23.140 7.785 -11.448 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.890 5.129 -11.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -21.139 8.546 -12.722 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -19.045 7.206 -12.703 1.00 0.00 H new ATOM 859 N LYS A 207 -26.263 7.649 -10.670 1.00 0.00 N ATOM 860 CA LYS A 207 -26.682 8.629 -11.672 1.00 0.00 C ATOM 861 C LYS A 207 -27.497 9.761 -11.061 1.00 0.00 C ATOM 862 O LYS A 207 -27.410 10.904 -11.515 1.00 0.00 O ATOM 863 CB LYS A 207 -27.456 7.929 -12.808 1.00 0.00 C ATOM 864 CG LYS A 207 -28.833 7.372 -12.431 1.00 0.00 C ATOM 865 CD LYS A 207 -29.260 6.268 -13.397 1.00 0.00 C ATOM 866 CE LYS A 207 -30.620 5.694 -13.004 1.00 0.00 C ATOM 867 NZ LYS A 207 -30.923 4.412 -13.743 1.00 0.00 N ATOM 0 H LYS A 207 -26.756 6.757 -10.720 1.00 0.00 H new ATOM 0 HA LYS A 207 -25.784 9.084 -12.090 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -27.583 8.638 -13.626 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -26.845 7.110 -13.188 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -28.805 6.980 -11.414 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -29.570 8.175 -12.442 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -29.308 6.665 -14.411 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -28.513 5.474 -13.401 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -30.639 5.508 -11.930 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -31.398 6.427 -13.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -31.854 4.054 -13.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -30.930 4.595 -14.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -30.194 3.704 -13.523 1.00 0.00 H new ATOM 881 N ASN A 208 -28.295 9.457 -10.045 1.00 0.00 N ATOM 882 CA ASN A 208 -29.157 10.468 -9.444 1.00 0.00 C ATOM 883 C ASN A 208 -28.370 11.535 -8.704 1.00 0.00 C ATOM 884 O ASN A 208 -28.707 12.705 -8.775 1.00 0.00 O ATOM 885 CB ASN A 208 -30.155 9.832 -8.475 1.00 0.00 C ATOM 886 CG ASN A 208 -31.217 10.805 -8.034 1.00 0.00 C ATOM 887 OD1 ASN A 208 -31.784 11.515 -8.846 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.482 10.852 -6.757 1.00 0.00 N ATOM 0 H ASN A 208 -28.364 8.531 -9.624 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.689 10.941 -10.269 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.627 8.974 -8.953 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.622 9.457 -7.601 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -32.187 11.500 -6.406 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -30.984 10.240 -6.110 1.00 0.00 H new ATOM 895 N SER A 209 -27.322 11.147 -7.996 1.00 0.00 N ATOM 896 CA SER A 209 -26.544 12.115 -7.225 1.00 0.00 C ATOM 897 C SER A 209 -25.854 13.131 -8.132 1.00 0.00 C ATOM 898 O SER A 209 -25.812 14.325 -7.826 1.00 0.00 O ATOM 899 CB SER A 209 -25.507 11.393 -6.377 1.00 0.00 C ATOM 900 OG SER A 209 -26.134 10.453 -5.522 1.00 0.00 O ATOM 0 H SER A 209 -26.990 10.184 -7.936 1.00 0.00 H new ATOM 0 HA SER A 209 -27.234 12.656 -6.577 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.790 10.885 -7.022 1.00 0.00 H new ATOM 0 HB3 SER A 209 -24.946 12.116 -5.784 1.00 0.00 H new ATOM 0 HG SER A 209 -26.386 9.659 -6.038 1.00 0.00 H new ATOM 906 N ILE A 210 -25.326 12.671 -9.258 1.00 0.00 N ATOM 907 CA ILE A 210 -24.679 13.575 -10.211 1.00 0.00 C ATOM 908 C ILE A 210 -25.738 14.480 -10.816 1.00 0.00 C ATOM 909 O ILE A 210 -25.543 15.686 -10.935 1.00 0.00 O ATOM 910 CB ILE A 210 -23.934 12.789 -11.330 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.755 12.032 -10.696 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.471 13.728 -12.476 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.151 10.968 -11.564 1.00 0.00 C ATOM 0 H ILE A 210 -25.330 11.690 -9.536 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.932 14.170 -9.684 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.616 12.071 -11.786 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -21.979 12.751 -10.433 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -23.093 11.574 -9.766 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -22.955 13.144 -13.239 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.339 14.217 -12.919 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.794 14.483 -12.077 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.328 10.489 -11.033 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -22.909 10.223 -11.806 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.777 11.418 -12.484 1.00 0.00 H new ATOM 925 N ARG A 211 -26.875 13.909 -11.187 1.00 0.00 N ATOM 926 CA ARG A 211 -27.943 14.696 -11.795 1.00 0.00 C ATOM 927 C ARG A 211 -28.464 15.745 -10.822 1.00 0.00 C ATOM 928 O ARG A 211 -28.749 16.861 -11.228 1.00 0.00 O ATOM 929 CB ARG A 211 -29.069 13.779 -12.270 1.00 0.00 C ATOM 930 CG ARG A 211 -30.096 14.485 -13.139 1.00 0.00 C ATOM 931 CD ARG A 211 -30.987 13.473 -13.828 1.00 0.00 C ATOM 932 NE ARG A 211 -31.972 14.133 -14.704 1.00 0.00 N ATOM 933 CZ ARG A 211 -32.839 13.506 -15.494 1.00 0.00 C ATOM 934 NH1 ARG A 211 -32.898 12.199 -15.571 1.00 0.00 N ATOM 935 NH2 ARG A 211 -33.660 14.210 -16.223 1.00 0.00 N ATOM 0 H ARG A 211 -27.083 12.916 -11.080 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.539 15.220 -12.661 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -28.639 12.949 -12.830 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -29.571 13.352 -11.402 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -30.700 15.155 -12.528 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -29.591 15.101 -13.883 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -30.376 12.788 -14.416 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -31.507 12.874 -13.080 1.00 0.00 H new ATOM 0 HE ARG A 211 -31.990 15.153 -14.704 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -32.265 11.626 -15.013 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -33.577 11.755 -16.189 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -33.632 15.229 -16.183 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -34.330 13.742 -16.833 1.00 0.00 H new ATOM 949 N HIS A 212 -28.568 15.403 -9.547 1.00 0.00 N ATOM 950 CA HIS A 212 -29.000 16.360 -8.531 1.00 0.00 C ATOM 951 C HIS A 212 -28.003 17.514 -8.455 1.00 0.00 C ATOM 952 O HIS A 212 -28.396 18.669 -8.482 1.00 0.00 O ATOM 953 CB HIS A 212 -29.112 15.672 -7.164 1.00 0.00 C ATOM 954 CG HIS A 212 -29.599 16.574 -6.070 1.00 0.00 C ATOM 955 ND1 HIS A 212 -29.449 16.314 -4.730 1.00 0.00 N ATOM 956 CD2 HIS A 212 -30.254 17.769 -6.125 1.00 0.00 C ATOM 957 CE1 HIS A 212 -29.995 17.318 -4.047 1.00 0.00 C ATOM 958 NE2 HIS A 212 -30.500 18.231 -4.849 1.00 0.00 N ATOM 0 H HIS A 212 -28.360 14.471 -9.188 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.980 16.749 -8.806 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -29.789 14.822 -7.250 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -28.136 15.275 -6.887 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -30.538 18.278 -7.034 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -30.020 17.376 -2.969 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -30.972 19.095 -4.584 1.00 0.00 H new ATOM 966 N ASN A 213 -26.715 17.202 -8.384 1.00 0.00 N ATOM 967 CA ASN A 213 -25.682 18.240 -8.295 1.00 0.00 C ATOM 968 C ASN A 213 -25.728 19.165 -9.514 1.00 0.00 C ATOM 969 O ASN A 213 -25.567 20.374 -9.393 1.00 0.00 O ATOM 970 CB ASN A 213 -24.291 17.605 -8.186 1.00 0.00 C ATOM 971 CG ASN A 213 -23.882 17.341 -6.758 1.00 0.00 C ATOM 972 OD1 ASN A 213 -23.164 18.119 -6.161 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.323 16.243 -6.211 1.00 0.00 N ATOM 0 H ASN A 213 -26.357 16.247 -8.386 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.879 18.830 -7.400 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -24.279 16.668 -8.742 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.558 18.262 -8.654 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -24.067 16.013 -5.251 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -24.924 15.614 -6.743 1.00 0.00 H new ATOM 980 N LEU A 214 -25.964 18.596 -10.688 1.00 0.00 N ATOM 981 CA LEU A 214 -26.075 19.391 -11.912 1.00 0.00 C ATOM 982 C LEU A 214 -27.340 20.249 -11.901 1.00 0.00 C ATOM 983 O LEU A 214 -27.346 21.351 -12.428 1.00 0.00 O ATOM 984 CB LEU A 214 -26.109 18.477 -13.143 1.00 0.00 C ATOM 985 CG LEU A 214 -24.805 17.745 -13.497 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.095 16.719 -14.577 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.729 18.708 -13.980 1.00 0.00 C ATOM 0 H LEU A 214 -26.082 17.592 -10.823 1.00 0.00 H new ATOM 0 HA LEU A 214 -25.202 20.043 -11.958 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.888 17.730 -12.990 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.407 19.076 -14.003 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.430 17.257 -12.597 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.176 16.193 -14.836 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -25.831 16.003 -14.211 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.487 17.222 -15.461 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -22.823 18.151 -14.220 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.081 19.230 -14.870 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.512 19.434 -13.196 1.00 0.00 H new ATOM 999 N SER A 215 -28.406 19.743 -11.293 1.00 0.00 N ATOM 1000 CA SER A 215 -29.683 20.462 -11.234 1.00 0.00 C ATOM 1001 C SER A 215 -29.628 21.649 -10.276 1.00 0.00 C ATOM 1002 O SER A 215 -30.391 22.598 -10.424 1.00 0.00 O ATOM 1003 CB SER A 215 -30.808 19.520 -10.799 1.00 0.00 C ATOM 1004 OG SER A 215 -30.905 18.415 -11.686 1.00 0.00 O ATOM 0 H SER A 215 -28.416 18.834 -10.831 1.00 0.00 H new ATOM 0 HA SER A 215 -29.881 20.840 -12.237 1.00 0.00 H new ATOM 0 HB2 SER A 215 -30.621 19.165 -9.786 1.00 0.00 H new ATOM 0 HB3 SER A 215 -31.754 20.060 -10.778 1.00 0.00 H new ATOM 0 HG SER A 215 -30.210 17.759 -11.469 1.00 0.00 H new ATOM 1010 N LEU A 216 -28.716 21.604 -9.310 1.00 0.00 N ATOM 1011 CA LEU A 216 -28.532 22.723 -8.379 1.00 0.00 C ATOM 1012 C LEU A 216 -27.923 23.898 -9.135 1.00 0.00 C ATOM 1013 O LEU A 216 -28.036 25.033 -8.703 1.00 0.00 O ATOM 1014 CB LEU A 216 -27.613 22.331 -7.213 1.00 0.00 C ATOM 1015 CG LEU A 216 -28.159 21.283 -6.226 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -27.053 20.861 -5.262 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -29.354 21.820 -5.436 1.00 0.00 C ATOM 0 H LEU A 216 -28.094 20.812 -9.148 1.00 0.00 H new ATOM 0 HA LEU A 216 -29.503 22.998 -7.966 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.679 21.953 -7.628 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -27.371 23.234 -6.652 1.00 0.00 H new ATOM 0 HG LEU A 216 -28.498 20.423 -6.803 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -27.442 20.119 -4.564 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -26.225 20.431 -5.825 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -26.702 21.731 -4.708 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -29.712 21.052 -4.750 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -29.050 22.700 -4.869 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -30.154 22.091 -6.125 1.00 0.00 H new ATOM 1029 N HIS A 217 -27.297 23.577 -10.267 1.00 0.00 N ATOM 1030 CA HIS A 217 -26.713 24.524 -11.238 1.00 0.00 C ATOM 1031 C HIS A 217 -25.913 25.746 -10.742 1.00 0.00 C ATOM 1032 O HIS A 217 -25.662 26.672 -11.506 1.00 0.00 O ATOM 1033 CB HIS A 217 -27.798 24.967 -12.241 1.00 0.00 C ATOM 1034 CG HIS A 217 -28.840 25.875 -11.662 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -29.994 25.445 -11.053 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -28.903 27.234 -11.617 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -30.687 26.514 -10.677 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -30.073 27.634 -11.003 1.00 0.00 N ATOM 0 H HIS A 217 -27.173 22.606 -10.553 1.00 0.00 H new ATOM 0 HA HIS A 217 -25.920 23.926 -11.687 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -27.317 25.473 -13.078 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -28.288 24.080 -12.643 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -30.271 24.473 -10.914 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -28.148 27.902 -12.005 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -31.638 26.471 -10.166 1.00 0.00 H new ATOM 1046 N SER A 218 -25.489 25.748 -9.486 1.00 0.00 N ATOM 1047 CA SER A 218 -24.731 26.867 -8.934 1.00 0.00 C ATOM 1048 C SER A 218 -23.425 27.082 -9.695 1.00 0.00 C ATOM 1049 O SER A 218 -23.056 28.208 -10.016 1.00 0.00 O ATOM 1050 CB SER A 218 -24.445 26.599 -7.459 1.00 0.00 C ATOM 1051 OG SER A 218 -23.896 25.297 -7.290 1.00 0.00 O ATOM 0 H SER A 218 -25.656 24.987 -8.828 1.00 0.00 H new ATOM 0 HA SER A 218 -25.325 27.775 -9.036 1.00 0.00 H new ATOM 0 HB2 SER A 218 -23.751 27.346 -7.075 1.00 0.00 H new ATOM 0 HB3 SER A 218 -25.364 26.691 -6.881 1.00 0.00 H new ATOM 0 HG SER A 218 -23.716 25.139 -6.340 1.00 0.00 H new ATOM 1057 N LYS A 219 -22.723 25.994 -9.989 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.496 26.064 -10.786 1.00 0.00 C ATOM 1059 C LYS A 219 -21.578 25.347 -12.124 1.00 0.00 C ATOM 1060 O LYS A 219 -20.627 25.400 -12.906 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.308 25.528 -9.980 1.00 0.00 C ATOM 1062 CG LYS A 219 -19.401 26.630 -9.387 1.00 0.00 C ATOM 1063 CD LYS A 219 -18.756 27.568 -10.447 1.00 0.00 C ATOM 1064 CE LYS A 219 -17.895 26.812 -11.462 1.00 0.00 C ATOM 1065 NZ LYS A 219 -17.216 27.759 -12.399 1.00 0.00 N ATOM 0 H LYS A 219 -22.979 25.053 -9.690 1.00 0.00 H new ATOM 0 HA LYS A 219 -21.355 27.120 -11.017 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -20.684 24.906 -9.168 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -19.707 24.884 -10.623 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -19.988 27.233 -8.694 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -18.608 26.158 -8.806 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -19.542 28.107 -10.975 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -18.143 28.313 -9.941 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -17.148 26.215 -10.938 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -18.518 26.119 -12.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -16.422 27.276 -12.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -17.895 28.084 -13.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.858 28.577 -11.866 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.686 24.675 -12.390 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.829 23.879 -13.609 1.00 0.00 C ATOM 1081 C PHE A 220 -23.884 24.468 -14.519 1.00 0.00 C ATOM 1082 O PHE A 220 -24.933 24.883 -14.061 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.230 22.446 -13.258 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.290 21.775 -12.299 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -20.978 21.444 -12.692 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -22.712 21.458 -10.993 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -20.092 20.815 -11.789 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -21.834 20.826 -10.084 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.523 20.510 -10.483 1.00 0.00 C ATOM 0 H PHE A 220 -23.504 24.662 -11.780 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.868 23.883 -14.123 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.231 22.453 -12.827 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.282 21.858 -14.174 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -20.646 21.673 -13.694 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -23.718 21.701 -10.683 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -19.087 20.569 -12.099 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -22.169 20.586 -9.086 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.847 20.034 -9.788 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.604 24.494 -15.812 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.546 25.012 -16.797 1.00 0.00 C ATOM 1101 C ILE A 221 -24.713 23.949 -17.884 1.00 0.00 C ATOM 1102 O ILE A 221 -23.899 23.023 -17.988 1.00 0.00 O ATOM 1103 CB ILE A 221 -24.065 26.386 -17.385 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.843 26.212 -18.302 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.712 27.353 -16.242 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.482 27.462 -19.120 1.00 0.00 C ATOM 0 H ILE A 221 -22.725 24.160 -16.208 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.510 25.212 -16.329 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.882 26.796 -17.979 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -21.984 25.930 -17.693 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -23.033 25.386 -18.987 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.379 28.303 -16.659 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.592 27.518 -15.620 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.914 26.924 -15.636 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.610 27.252 -19.739 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.323 27.734 -19.758 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -22.258 28.287 -18.444 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.765 24.068 -18.682 1.00 0.00 N ATOM 1119 CA ARG A 222 -26.063 23.092 -19.734 1.00 0.00 C ATOM 1120 C ARG A 222 -25.964 23.768 -21.093 1.00 0.00 C ATOM 1121 O ARG A 222 -26.580 24.805 -21.312 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.474 22.533 -19.524 1.00 0.00 C ATOM 1123 CG ARG A 222 -27.839 21.372 -20.450 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.298 20.970 -20.269 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.211 22.039 -20.718 1.00 0.00 N ATOM 1126 CZ ARG A 222 -31.536 22.005 -20.631 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -32.179 20.980 -20.128 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -32.228 23.025 -21.058 1.00 0.00 N ATOM 0 H ARG A 222 -26.434 24.836 -18.624 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.346 22.272 -19.692 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.570 22.201 -18.490 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.195 23.337 -19.668 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -27.663 21.659 -21.487 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.194 20.519 -20.241 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.498 20.058 -20.832 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.487 20.745 -19.219 1.00 0.00 H new ATOM 0 HE ARG A 222 -29.790 22.872 -21.129 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -31.661 20.171 -19.786 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -33.198 20.991 -20.078 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -31.751 23.836 -21.453 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -33.246 23.012 -20.997 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.199 23.182 -22.001 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.015 23.757 -23.337 1.00 0.00 C ATOM 1144 C VAL A 223 -25.923 23.080 -24.340 1.00 0.00 C ATOM 1145 O VAL A 223 -26.153 21.864 -24.282 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.562 23.602 -23.889 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -23.240 24.727 -24.885 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -22.543 23.590 -22.766 1.00 0.00 C ATOM 0 H VAL A 223 -24.694 22.310 -21.844 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.246 24.816 -23.219 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.505 22.645 -24.407 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -22.224 24.602 -25.259 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -23.941 24.686 -25.719 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -23.327 25.692 -24.385 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -21.542 23.481 -23.184 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -22.604 24.525 -22.210 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -22.750 22.755 -22.096 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.421 23.875 -25.273 1.00 0.00 N ATOM 1159 CA GLN A 224 -27.182 23.357 -26.397 1.00 0.00 C ATOM 1160 C GLN A 224 -26.198 22.550 -27.249 1.00 0.00 C ATOM 1161 O GLN A 224 -24.981 22.701 -27.128 1.00 0.00 O ATOM 1162 CB GLN A 224 -27.767 24.507 -27.223 1.00 0.00 C ATOM 1163 CG GLN A 224 -28.781 25.366 -26.461 1.00 0.00 C ATOM 1164 CD GLN A 224 -29.279 26.540 -27.286 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -29.394 26.458 -28.495 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -29.564 27.636 -26.633 1.00 0.00 N ATOM 0 H GLN A 224 -26.310 24.889 -25.273 1.00 0.00 H new ATOM 0 HA GLN A 224 -28.014 22.741 -26.056 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -26.953 25.144 -27.568 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -28.248 24.096 -28.110 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -29.628 24.747 -26.166 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -28.323 25.738 -25.544 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -29.456 27.668 -25.619 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -29.895 28.459 -27.137 1.00 0.00 H new ATOM 1265 N SER A 232 -27.068 15.871 -23.834 1.00 0.00 N ATOM 1266 CA SER A 232 -26.830 17.297 -23.632 1.00 0.00 C ATOM 1267 C SER A 232 -25.448 17.481 -23.019 1.00 0.00 C ATOM 1268 O SER A 232 -24.934 16.581 -22.346 1.00 0.00 O ATOM 1269 CB SER A 232 -27.883 17.875 -22.685 1.00 0.00 C ATOM 1270 OG SER A 232 -27.854 17.207 -21.434 1.00 0.00 O ATOM 0 HA SER A 232 -26.891 17.815 -24.589 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.702 18.940 -22.538 1.00 0.00 H new ATOM 0 HB3 SER A 232 -28.873 17.778 -23.131 1.00 0.00 H new ATOM 0 HG SER A 232 -27.511 16.297 -21.557 1.00 0.00 H new ATOM 1276 N TRP A 233 -24.857 18.644 -23.239 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.559 18.960 -22.658 1.00 0.00 C ATOM 1278 C TRP A 233 -23.742 19.588 -21.299 1.00 0.00 C ATOM 1279 O TRP A 233 -24.707 20.315 -21.070 1.00 0.00 O ATOM 1280 CB TRP A 233 -22.850 20.013 -23.481 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.386 19.584 -24.810 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.830 20.023 -26.011 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.328 18.655 -25.107 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -22.147 19.453 -27.038 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -21.204 18.602 -26.526 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.455 17.877 -24.318 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -20.240 17.805 -27.170 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.482 17.070 -24.962 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.387 17.047 -26.385 1.00 0.00 C ATOM 0 H TRP A 233 -25.254 19.386 -23.815 1.00 0.00 H new ATOM 0 HA TRP A 233 -22.994 18.029 -22.615 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.523 20.861 -23.608 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -21.990 20.371 -22.915 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.629 20.739 -26.137 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -22.310 19.630 -28.029 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.526 17.895 -23.241 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -20.167 17.785 -28.247 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.808 16.468 -24.370 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.638 16.429 -26.858 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.792 19.341 -20.419 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.760 19.955 -19.109 1.00 0.00 C ATOM 1302 C TRP A 234 -21.364 20.525 -18.974 1.00 0.00 C ATOM 1303 O TRP A 234 -20.386 19.866 -19.334 1.00 0.00 O ATOM 1304 CB TRP A 234 -23.035 18.909 -18.035 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.343 18.220 -18.264 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.558 17.075 -18.961 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.645 18.646 -17.818 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -25.879 16.742 -18.988 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.584 17.681 -18.289 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -26.115 19.741 -17.066 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -27.964 17.778 -18.022 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.503 19.843 -16.792 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.413 18.853 -17.271 1.00 0.00 C ATOM 0 H TRP A 234 -22.015 18.704 -20.596 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.519 20.729 -18.992 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.231 18.173 -18.028 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -23.040 19.385 -17.054 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -23.778 16.499 -19.436 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.276 15.926 -19.453 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.428 20.492 -16.703 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.654 17.034 -18.393 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.875 20.677 -16.216 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.465 18.943 -17.045 1.00 0.00 H new ATOM 1324 N MET A 235 -21.263 21.744 -18.481 1.00 0.00 N ATOM 1325 CA MET A 235 -19.970 22.392 -18.312 1.00 0.00 C ATOM 1326 C MET A 235 -20.024 23.334 -17.129 1.00 0.00 C ATOM 1327 O MET A 235 -21.065 23.493 -16.506 1.00 0.00 O ATOM 1328 CB MET A 235 -19.564 23.156 -19.573 1.00 0.00 C ATOM 1329 CG MET A 235 -20.444 24.322 -19.909 1.00 0.00 C ATOM 1330 SD MET A 235 -19.803 25.271 -21.312 1.00 0.00 S ATOM 1331 CE MET A 235 -18.429 26.166 -20.539 1.00 0.00 C ATOM 0 H MET A 235 -22.060 22.309 -18.189 1.00 0.00 H new ATOM 0 HA MET A 235 -19.221 21.621 -18.131 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.541 23.513 -19.452 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.562 22.465 -20.416 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.447 23.964 -20.141 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.531 24.974 -19.040 1.00 0.00 H new ATOM 0 HE1 MET A 235 -18.654 27.232 -20.521 1.00 0.00 H new ATOM 0 HE2 MET A 235 -18.289 25.807 -19.519 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.517 25.997 -21.112 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.897 23.948 -16.815 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.816 24.856 -15.683 1.00 0.00 C ATOM 1343 C LEU A 236 -19.250 26.247 -16.099 1.00 0.00 C ATOM 1344 O LEU A 236 -19.028 26.649 -17.232 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.372 24.919 -15.177 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.751 23.561 -14.829 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.284 23.739 -14.478 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.488 22.874 -13.688 1.00 0.00 C ATOM 0 H LEU A 236 -18.023 23.834 -17.329 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.472 24.491 -14.893 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.756 25.400 -15.937 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.340 25.555 -14.292 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.840 22.919 -15.706 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.849 22.771 -14.232 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.756 24.168 -15.329 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.193 24.406 -13.621 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -17.015 21.916 -13.474 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.450 23.504 -12.799 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.527 22.710 -13.973 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.850 26.984 -15.179 1.00 0.00 N ATOM 1361 CA ASN A 237 -20.232 28.370 -15.446 1.00 0.00 C ATOM 1362 C ASN A 237 -18.940 29.188 -15.673 1.00 0.00 C ATOM 1363 O ASN A 237 -18.078 29.236 -14.783 1.00 0.00 O ATOM 1364 CB ASN A 237 -21.043 28.928 -14.261 1.00 0.00 C ATOM 1365 CG ASN A 237 -21.550 30.328 -14.515 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -20.852 31.145 -15.081 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -22.751 30.607 -14.104 1.00 0.00 N ATOM 0 H ASN A 237 -20.084 26.652 -14.243 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.861 28.432 -16.334 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.888 28.270 -14.061 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -20.420 28.927 -13.366 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -23.137 31.539 -14.253 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -23.307 29.894 -13.632 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.778 29.818 -16.861 1.00 0.00 N ATOM 1375 CA PRO A 238 -17.550 30.579 -17.142 1.00 0.00 C ATOM 1376 C PRO A 238 -17.418 31.926 -16.450 1.00 0.00 C ATOM 1377 O PRO A 238 -16.320 32.358 -16.125 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.641 30.814 -18.640 1.00 0.00 C ATOM 1379 CG PRO A 238 -19.086 30.841 -18.941 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.702 29.844 -18.015 1.00 0.00 C ATOM 0 HA PRO A 238 -16.688 30.020 -16.779 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -17.163 31.752 -18.921 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -17.138 30.021 -19.194 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -19.502 31.836 -18.781 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -19.276 30.580 -19.982 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.707 30.143 -17.716 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.787 28.863 -18.482 1.00 0.00 H new