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 203 SER OG : rot -90:sc= 1.3 USER MOD Set 1.2: A 207 LYS NZ :NH3+ -168:sc= 0.572 (180deg=0.393) USER MOD Set 2.1: A 179 THR OG1 : rot 112:sc= 0.0265 USER MOD Set 2.2: A 181 SER OG : rot 180:sc= 0.175 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot -116:sc= 0.146 USER MOD Single : A 167 THR OG1 : rot 81:sc= 0.76 USER MOD Single : A 168 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.118) USER MOD Single : A 172 SER OG : rot 86:sc= 1.24 USER MOD Single : A 173 SER OG : rot -48:sc= 1.21 USER MOD Single : A 176 LYS NZ :NH3+ -133:sc= 1.12 (180deg=0.105) USER MOD Single : A 182 GLN : amide:sc= -0.849 X(o=-0.85,f=-1) USER MOD Single : A 184 TYR OH : rot 180:sc= 0 USER MOD Single : A 187 MET CE :methyl -165:sc= 0 (180deg=-0.432) USER MOD Single : A 189 LYS NZ :NH3+ -151:sc= 1.21 (180deg=0.531) USER MOD Single : A 190 SER OG : rot 83:sc= 0.88 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+ -167:sc= 1.24 (180deg=0.974) USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 ASN : amide:sc= -0.0464 K(o=-0.046,f=-0.6) USER MOD Single : A 202 SER OG : rot -110:sc= 0.958 USER MOD Single : A 208 ASN : amide:sc= -0.34 K(o=-0.34,f=-1.9!) USER MOD Single : A 209 SER OG : rot 78:sc= 0.897 USER MOD Single : A 212 HIS : no HD1:sc=-0.000842 X(o=-0.00084,f=0) USER MOD Single : A 213 ASN : amide:sc= 0.821 K(o=0.82,f=-0.89) USER MOD Single : A 215 SER OG : rot -51:sc= 1.23 USER MOD Single : A 217 HIS : no HE2:sc= 0.68 K(o=0.68,f=-2.7!) USER MOD Single : A 218 SER OG : rot 180:sc= 0.00297 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 36:sc= 0.215 USER MOD Single : A 235 MET CE :methyl -177:sc= -0.0785 (180deg=-0.108) USER MOD Single : A 237 ASN : amide:sc= -0.76 K(o=-0.76,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 116 N LEU A 160 -13.128 14.294 -1.786 1.00 0.00 N ATOM 117 CA LEU A 160 -13.780 15.285 -2.641 1.00 0.00 C ATOM 118 C LEU A 160 -15.264 14.975 -2.755 1.00 0.00 C ATOM 119 O LEU A 160 -15.665 13.810 -2.772 1.00 0.00 O ATOM 120 CB LEU A 160 -13.162 15.273 -4.037 1.00 0.00 C ATOM 121 CG LEU A 160 -11.807 15.968 -4.181 1.00 0.00 C ATOM 122 CD1 LEU A 160 -11.339 15.809 -5.627 1.00 0.00 C ATOM 123 CD2 LEU A 160 -11.884 17.450 -3.803 1.00 0.00 C ATOM 0 HA LEU A 160 -13.641 16.269 -2.193 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -13.051 14.236 -4.354 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -13.863 15.743 -4.726 1.00 0.00 H new ATOM 0 HG LEU A 160 -11.095 15.505 -3.497 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -10.373 16.298 -5.753 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -11.243 14.749 -5.864 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -12.067 16.266 -6.297 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.901 17.907 -3.919 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -12.598 17.955 -4.454 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -12.208 17.545 -2.767 1.00 0.00 H new ATOM 135 N SER A 161 -16.068 16.023 -2.842 1.00 0.00 N ATOM 136 CA SER A 161 -17.517 15.891 -2.945 1.00 0.00 C ATOM 137 C SER A 161 -17.918 15.580 -4.380 1.00 0.00 C ATOM 138 O SER A 161 -17.108 15.686 -5.301 1.00 0.00 O ATOM 139 CB SER A 161 -18.183 17.198 -2.512 1.00 0.00 C ATOM 140 OG SER A 161 -17.835 17.517 -1.180 1.00 0.00 O ATOM 0 H SER A 161 -15.738 16.988 -2.843 1.00 0.00 H new ATOM 0 HA SER A 161 -17.841 15.076 -2.297 1.00 0.00 H new ATOM 0 HB2 SER A 161 -17.877 18.006 -3.177 1.00 0.00 H new ATOM 0 HB3 SER A 161 -19.266 17.107 -2.599 1.00 0.00 H new ATOM 0 HG SER A 161 -18.269 18.357 -0.921 1.00 0.00 H new ATOM 146 N TYR A 162 -19.178 15.219 -4.581 1.00 0.00 N ATOM 147 CA TYR A 162 -19.676 14.924 -5.925 1.00 0.00 C ATOM 148 C TYR A 162 -19.434 16.098 -6.867 1.00 0.00 C ATOM 149 O TYR A 162 -18.962 15.901 -7.976 1.00 0.00 O ATOM 150 CB TYR A 162 -21.174 14.613 -5.892 1.00 0.00 C ATOM 151 CG TYR A 162 -21.486 13.135 -5.842 1.00 0.00 C ATOM 152 CD1 TYR A 162 -21.641 12.466 -4.609 1.00 0.00 C ATOM 153 CD2 TYR A 162 -21.635 12.394 -7.031 1.00 0.00 C ATOM 154 CE1 TYR A 162 -21.949 11.076 -4.568 1.00 0.00 C ATOM 155 CE2 TYR A 162 -21.945 11.009 -6.992 1.00 0.00 C ATOM 156 CZ TYR A 162 -22.103 10.364 -5.762 1.00 0.00 C ATOM 157 OH TYR A 162 -22.417 9.030 -5.735 1.00 0.00 O ATOM 0 H TYR A 162 -19.872 15.123 -3.840 1.00 0.00 H new ATOM 0 HA TYR A 162 -19.132 14.053 -6.290 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -21.618 15.099 -5.023 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -21.646 15.045 -6.775 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -21.525 13.014 -3.686 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -21.512 12.886 -7.985 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -22.063 10.574 -3.619 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -22.059 10.454 -7.912 1.00 0.00 H new ATOM 0 HH TYR A 162 -21.681 8.513 -6.124 1.00 0.00 H new ATOM 167 N ALA A 163 -19.742 17.311 -6.426 1.00 0.00 N ATOM 168 CA ALA A 163 -19.565 18.499 -7.262 1.00 0.00 C ATOM 169 C ALA A 163 -18.120 18.638 -7.754 1.00 0.00 C ATOM 170 O ALA A 163 -17.881 18.974 -8.913 1.00 0.00 O ATOM 171 CB ALA A 163 -19.977 19.752 -6.479 1.00 0.00 C ATOM 0 H ALA A 163 -20.115 17.501 -5.496 1.00 0.00 H new ATOM 0 HA ALA A 163 -20.203 18.389 -8.139 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -19.843 20.633 -7.106 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -21.024 19.670 -6.186 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -19.357 19.844 -5.587 1.00 0.00 H new ATOM 177 N ASP A 164 -17.168 18.370 -6.875 1.00 0.00 N ATOM 178 CA ASP A 164 -15.751 18.494 -7.208 1.00 0.00 C ATOM 179 C ASP A 164 -15.349 17.486 -8.271 1.00 0.00 C ATOM 180 O ASP A 164 -14.571 17.784 -9.171 1.00 0.00 O ATOM 181 CB ASP A 164 -14.900 18.231 -5.971 1.00 0.00 C ATOM 182 CG ASP A 164 -15.223 19.166 -4.835 1.00 0.00 C ATOM 183 OD1 ASP A 164 -15.383 18.669 -3.698 1.00 0.00 O ATOM 184 OD2 ASP A 164 -15.327 20.382 -5.065 1.00 0.00 O ATOM 0 H ASP A 164 -17.349 18.063 -5.919 1.00 0.00 H new ATOM 0 HA ASP A 164 -15.590 19.505 -7.581 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -15.050 17.202 -5.644 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -13.846 18.332 -6.231 1.00 0.00 H new ATOM 189 N LEU A 165 -15.875 16.278 -8.159 1.00 0.00 N ATOM 190 CA LEU A 165 -15.549 15.212 -9.101 1.00 0.00 C ATOM 191 C LEU A 165 -16.191 15.466 -10.462 1.00 0.00 C ATOM 192 O LEU A 165 -15.574 15.232 -11.498 1.00 0.00 O ATOM 193 CB LEU A 165 -16.007 13.866 -8.537 1.00 0.00 C ATOM 194 CG LEU A 165 -15.273 13.408 -7.264 1.00 0.00 C ATOM 195 CD1 LEU A 165 -15.946 12.164 -6.722 1.00 0.00 C ATOM 196 CD2 LEU A 165 -13.789 13.126 -7.535 1.00 0.00 C ATOM 0 H LEU A 165 -16.530 16.007 -7.426 1.00 0.00 H new ATOM 0 HA LEU A 165 -14.468 15.193 -9.241 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -17.074 13.924 -8.322 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -15.878 13.104 -9.306 1.00 0.00 H new ATOM 0 HG LEU A 165 -15.325 14.212 -6.530 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -15.430 11.835 -5.820 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -16.986 12.387 -6.484 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -15.907 11.373 -7.471 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -13.305 12.805 -6.612 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -13.699 12.340 -8.284 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -13.307 14.033 -7.901 1.00 0.00 H new ATOM 208 N ILE A 166 -17.420 15.961 -10.461 1.00 0.00 N ATOM 209 CA ILE A 166 -18.112 16.309 -11.707 1.00 0.00 C ATOM 210 C ILE A 166 -17.306 17.408 -12.388 1.00 0.00 C ATOM 211 O ILE A 166 -17.033 17.356 -13.587 1.00 0.00 O ATOM 212 CB ILE A 166 -19.555 16.835 -11.429 1.00 0.00 C ATOM 213 CG1 ILE A 166 -20.420 15.744 -10.789 1.00 0.00 C ATOM 214 CG2 ILE A 166 -20.234 17.297 -12.723 1.00 0.00 C ATOM 215 CD1 ILE A 166 -21.663 16.296 -10.084 1.00 0.00 C ATOM 0 H ILE A 166 -17.964 16.133 -9.615 1.00 0.00 H new ATOM 0 HA ILE A 166 -18.194 15.421 -12.334 1.00 0.00 H new ATOM 0 HB ILE A 166 -19.461 17.679 -10.746 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -20.730 15.037 -11.559 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -19.819 15.188 -10.070 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -21.238 17.658 -12.498 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -19.651 18.101 -13.173 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -20.297 16.461 -13.420 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -22.232 15.473 -9.652 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -21.358 16.981 -9.293 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -22.284 16.828 -10.805 1.00 0.00 H new ATOM 227 N THR A 167 -16.909 18.399 -11.609 1.00 0.00 N ATOM 228 CA THR A 167 -16.106 19.499 -12.117 1.00 0.00 C ATOM 229 C THR A 167 -14.775 19.011 -12.671 1.00 0.00 C ATOM 230 O THR A 167 -14.373 19.407 -13.763 1.00 0.00 O ATOM 231 CB THR A 167 -15.838 20.515 -11.000 1.00 0.00 C ATOM 232 OG1 THR A 167 -17.069 21.122 -10.604 1.00 0.00 O ATOM 233 CG2 THR A 167 -14.876 21.586 -11.437 1.00 0.00 C ATOM 0 H THR A 167 -17.131 18.465 -10.616 1.00 0.00 H new ATOM 0 HA THR A 167 -16.668 19.968 -12.925 1.00 0.00 H new ATOM 0 HB THR A 167 -15.390 19.980 -10.163 1.00 0.00 H new ATOM 0 HG1 THR A 167 -17.544 20.526 -9.988 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.713 22.285 -10.617 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.927 21.130 -11.719 1.00 0.00 H new ATOM 0 HG23 THR A 167 -15.290 22.120 -12.292 1.00 0.00 H new ATOM 241 N LYS A 168 -14.089 18.145 -11.939 1.00 0.00 N ATOM 242 CA LYS A 168 -12.802 17.624 -12.397 1.00 0.00 C ATOM 243 C LYS A 168 -12.946 16.901 -13.720 1.00 0.00 C ATOM 244 O LYS A 168 -12.047 16.961 -14.548 1.00 0.00 O ATOM 245 CB LYS A 168 -12.203 16.662 -11.378 1.00 0.00 C ATOM 246 CG LYS A 168 -11.288 17.320 -10.371 1.00 0.00 C ATOM 247 CD LYS A 168 -10.592 16.263 -9.528 1.00 0.00 C ATOM 248 CE LYS A 168 -9.490 16.884 -8.684 1.00 0.00 C ATOM 249 NZ LYS A 168 -8.729 15.837 -7.923 1.00 0.00 N ATOM 0 H LYS A 168 -14.395 17.789 -11.034 1.00 0.00 H new ATOM 0 HA LYS A 168 -12.139 18.480 -12.520 1.00 0.00 H new ATOM 0 HB2 LYS A 168 -13.013 16.163 -10.845 1.00 0.00 H new ATOM 0 HB3 LYS A 168 -11.646 15.889 -11.908 1.00 0.00 H new ATOM 0 HG2 LYS A 168 -10.547 17.931 -10.886 1.00 0.00 H new ATOM 0 HG3 LYS A 168 -11.862 17.988 -9.729 1.00 0.00 H new ATOM 0 HD2 LYS A 168 -11.318 15.771 -8.881 1.00 0.00 H new ATOM 0 HD3 LYS A 168 -10.171 15.494 -10.176 1.00 0.00 H new ATOM 0 HE2 LYS A 168 -8.806 17.439 -9.326 1.00 0.00 H new ATOM 0 HE3 LYS A 168 -9.924 17.600 -7.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 -8.077 16.298 -7.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 -9.396 15.237 -7.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 -8.186 15.250 -8.588 1.00 0.00 H new ATOM 263 N ALA A 169 -14.066 16.232 -13.932 1.00 0.00 N ATOM 264 CA ALA A 169 -14.299 15.542 -15.191 1.00 0.00 C ATOM 265 C ALA A 169 -14.374 16.546 -16.340 1.00 0.00 C ATOM 266 O ALA A 169 -13.779 16.349 -17.397 1.00 0.00 O ATOM 267 CB ALA A 169 -15.586 14.744 -15.111 1.00 0.00 C ATOM 0 H ALA A 169 -14.824 16.151 -13.255 1.00 0.00 H new ATOM 0 HA ALA A 169 -13.469 14.861 -15.378 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -15.755 14.230 -16.057 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -15.510 14.011 -14.308 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -16.420 15.417 -14.910 1.00 0.00 H new ATOM 273 N ILE A 170 -15.109 17.625 -16.123 1.00 0.00 N ATOM 274 CA ILE A 170 -15.302 18.645 -17.150 1.00 0.00 C ATOM 275 C ILE A 170 -13.963 19.309 -17.464 1.00 0.00 C ATOM 276 O ILE A 170 -13.635 19.549 -18.620 1.00 0.00 O ATOM 277 CB ILE A 170 -16.339 19.701 -16.678 1.00 0.00 C ATOM 278 CG1 ILE A 170 -17.730 19.043 -16.536 1.00 0.00 C ATOM 279 CG2 ILE A 170 -16.406 20.869 -17.668 1.00 0.00 C ATOM 280 CD1 ILE A 170 -18.697 19.803 -15.618 1.00 0.00 C ATOM 0 H ILE A 170 -15.585 17.821 -15.242 1.00 0.00 H new ATOM 0 HA ILE A 170 -15.687 18.175 -18.055 1.00 0.00 H new ATOM 0 HB ILE A 170 -16.027 20.089 -15.708 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -18.180 18.955 -17.525 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -17.603 18.031 -16.152 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -17.138 21.599 -17.321 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -15.427 21.342 -17.739 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -16.701 20.498 -18.649 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -19.649 19.274 -15.574 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -18.272 19.869 -14.616 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -18.858 20.807 -16.011 1.00 0.00 H new ATOM 292 N GLU A 171 -13.184 19.585 -16.434 1.00 0.00 N ATOM 293 CA GLU A 171 -11.864 20.199 -16.598 1.00 0.00 C ATOM 294 C GLU A 171 -10.900 19.285 -17.325 1.00 0.00 C ATOM 295 O GLU A 171 -10.005 19.724 -18.045 1.00 0.00 O ATOM 296 CB GLU A 171 -11.270 20.466 -15.234 1.00 0.00 C ATOM 297 CG GLU A 171 -11.918 21.542 -14.504 1.00 0.00 C ATOM 298 CD GLU A 171 -11.428 22.911 -14.974 1.00 0.00 C ATOM 299 OE1 GLU A 171 -12.262 23.688 -15.471 1.00 0.00 O ATOM 300 OE2 GLU A 171 -10.212 23.205 -14.878 1.00 0.00 O ATOM 0 H GLU A 171 -13.439 19.395 -15.465 1.00 0.00 H new ATOM 0 HA GLU A 171 -12.003 21.113 -17.175 1.00 0.00 H new ATOM 0 HB2 GLU A 171 -11.326 19.554 -14.640 1.00 0.00 H new ATOM 0 HB3 GLU A 171 -10.213 20.706 -15.351 1.00 0.00 H new ATOM 0 HG2 GLU A 171 -12.998 21.475 -14.638 1.00 0.00 H new ATOM 0 HG3 GLU A 171 -11.721 21.430 -13.438 1.00 0.00 H new ATOM 307 N SER A 172 -11.096 17.998 -17.109 1.00 0.00 N ATOM 308 CA SER A 172 -10.257 16.972 -17.746 1.00 0.00 C ATOM 309 C SER A 172 -10.515 16.905 -19.248 1.00 0.00 C ATOM 310 O SER A 172 -9.635 16.490 -20.023 1.00 0.00 O ATOM 311 CB SER A 172 -10.503 15.592 -17.136 1.00 0.00 C ATOM 312 OG SER A 172 -10.118 15.562 -15.773 1.00 0.00 O ATOM 0 H SER A 172 -11.825 17.627 -16.500 1.00 0.00 H new ATOM 0 HA SER A 172 -9.220 17.259 -17.571 1.00 0.00 H new ATOM 0 HB2 SER A 172 -11.558 15.334 -17.225 1.00 0.00 H new ATOM 0 HB3 SER A 172 -9.943 14.840 -17.692 1.00 0.00 H new ATOM 0 HG SER A 172 -10.857 15.885 -15.217 1.00 0.00 H new ATOM 318 N SER A 173 -11.708 17.302 -19.667 1.00 0.00 N ATOM 319 CA SER A 173 -12.035 17.337 -21.089 1.00 0.00 C ATOM 320 C SER A 173 -11.346 18.546 -21.719 1.00 0.00 C ATOM 321 O SER A 173 -11.217 19.592 -21.091 1.00 0.00 O ATOM 322 CB SER A 173 -13.545 17.423 -21.293 1.00 0.00 C ATOM 323 OG SER A 173 -14.022 18.738 -21.137 1.00 0.00 O ATOM 0 H SER A 173 -12.462 17.603 -19.049 1.00 0.00 H new ATOM 0 HA SER A 173 -11.685 16.421 -21.565 1.00 0.00 H new ATOM 0 HB2 SER A 173 -13.798 17.061 -22.290 1.00 0.00 H new ATOM 0 HB3 SER A 173 -14.046 16.768 -20.580 1.00 0.00 H new ATOM 0 HG SER A 173 -13.660 19.122 -20.311 1.00 0.00 H new ATOM 329 N ALA A 174 -10.890 18.406 -22.954 1.00 0.00 N ATOM 330 CA ALA A 174 -10.180 19.496 -23.619 1.00 0.00 C ATOM 331 C ALA A 174 -11.136 20.645 -23.940 1.00 0.00 C ATOM 332 O ALA A 174 -10.784 21.812 -23.828 1.00 0.00 O ATOM 333 CB ALA A 174 -9.531 18.982 -24.898 1.00 0.00 C ATOM 0 H ALA A 174 -10.995 17.560 -23.514 1.00 0.00 H new ATOM 0 HA ALA A 174 -9.407 19.871 -22.948 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -9.002 19.798 -25.391 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -8.826 18.188 -24.654 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -10.300 18.592 -25.565 1.00 0.00 H new ATOM 339 N GLU A 175 -12.345 20.290 -24.350 1.00 0.00 N ATOM 340 CA GLU A 175 -13.356 21.271 -24.749 1.00 0.00 C ATOM 341 C GLU A 175 -14.089 21.888 -23.563 1.00 0.00 C ATOM 342 O GLU A 175 -14.942 22.748 -23.746 1.00 0.00 O ATOM 343 CB GLU A 175 -14.389 20.592 -25.648 1.00 0.00 C ATOM 344 CG GLU A 175 -13.809 19.965 -26.906 1.00 0.00 C ATOM 345 CD GLU A 175 -14.205 18.507 -27.037 1.00 0.00 C ATOM 346 OE1 GLU A 175 -15.062 18.189 -27.896 1.00 0.00 O ATOM 347 OE2 GLU A 175 -13.664 17.676 -26.268 1.00 0.00 O ATOM 0 H GLU A 175 -12.656 19.321 -24.417 1.00 0.00 H new ATOM 0 HA GLU A 175 -12.830 22.071 -25.270 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -14.901 19.820 -25.074 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -15.141 21.326 -25.936 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -14.154 20.516 -27.780 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -12.722 20.047 -26.886 1.00 0.00 H new ATOM 354 N LYS A 176 -13.761 21.430 -22.358 1.00 0.00 N ATOM 355 CA LYS A 176 -14.400 21.878 -21.116 1.00 0.00 C ATOM 356 C LYS A 176 -15.908 21.661 -21.100 1.00 0.00 C ATOM 357 O LYS A 176 -16.639 22.459 -20.538 1.00 0.00 O ATOM 358 CB LYS A 176 -14.066 23.349 -20.815 1.00 0.00 C ATOM 359 CG LYS A 176 -12.586 23.613 -20.600 1.00 0.00 C ATOM 360 CD LYS A 176 -12.075 22.834 -19.388 1.00 0.00 C ATOM 361 CE LYS A 176 -11.073 23.634 -18.603 1.00 0.00 C ATOM 362 NZ LYS A 176 -11.721 24.820 -17.936 1.00 0.00 N ATOM 0 H LYS A 176 -13.035 20.728 -22.211 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.985 21.251 -20.327 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.419 23.968 -21.640 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -14.614 23.661 -19.926 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -12.026 23.323 -21.489 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -12.418 24.680 -20.451 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -12.914 22.568 -18.745 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -11.619 21.901 -19.719 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -10.608 22.999 -17.849 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -10.278 23.976 -19.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -11.145 25.670 -18.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -12.672 24.964 -18.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -11.794 24.646 -16.913 1.00 0.00 H new ATOM 376 N ARG A 177 -16.366 20.568 -21.695 1.00 0.00 N ATOM 377 CA ARG A 177 -17.792 20.206 -21.682 1.00 0.00 C ATOM 378 C ARG A 177 -17.904 18.702 -21.839 1.00 0.00 C ATOM 379 O ARG A 177 -17.245 18.124 -22.694 1.00 0.00 O ATOM 380 CB ARG A 177 -18.577 20.920 -22.801 1.00 0.00 C ATOM 381 CG ARG A 177 -17.881 20.968 -24.156 1.00 0.00 C ATOM 382 CD ARG A 177 -18.871 21.222 -25.291 1.00 0.00 C ATOM 383 NE ARG A 177 -18.186 21.429 -26.580 1.00 0.00 N ATOM 384 CZ ARG A 177 -17.601 20.481 -27.307 1.00 0.00 C ATOM 385 NH1 ARG A 177 -17.574 19.227 -26.942 1.00 0.00 N ATOM 386 NH2 ARG A 177 -17.011 20.804 -28.420 1.00 0.00 N ATOM 0 H ARG A 177 -15.773 19.908 -22.198 1.00 0.00 H new ATOM 0 HA ARG A 177 -18.228 20.525 -20.736 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -19.539 20.422 -22.922 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -18.785 21.941 -22.482 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -17.126 21.754 -24.149 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -17.360 20.027 -24.331 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -19.553 20.376 -25.374 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -19.476 22.098 -25.056 1.00 0.00 H new ATOM 0 HE ARG A 177 -18.158 22.381 -26.946 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -18.013 18.941 -26.067 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -17.113 18.534 -27.532 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -17.000 21.776 -28.728 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -16.559 20.085 -28.985 1.00 0.00 H new ATOM 400 N LEU A 178 -18.724 18.067 -21.012 1.00 0.00 N ATOM 401 CA LEU A 178 -18.911 16.615 -21.069 1.00 0.00 C ATOM 402 C LEU A 178 -20.385 16.249 -20.966 1.00 0.00 C ATOM 403 O LEU A 178 -21.157 16.939 -20.320 1.00 0.00 O ATOM 404 CB LEU A 178 -18.170 15.928 -19.913 1.00 0.00 C ATOM 405 CG LEU A 178 -16.638 15.798 -19.958 1.00 0.00 C ATOM 406 CD1 LEU A 178 -16.201 14.857 -18.863 1.00 0.00 C ATOM 407 CD2 LEU A 178 -16.177 15.243 -21.305 1.00 0.00 C ATOM 0 H LEU A 178 -19.274 18.532 -20.290 1.00 0.00 H new ATOM 0 HA LEU A 178 -18.512 16.278 -22.026 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -18.424 16.465 -18.999 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -18.579 14.922 -19.816 1.00 0.00 H new ATOM 0 HG LEU A 178 -16.196 16.785 -19.820 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -15.116 14.755 -18.883 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -16.511 15.255 -17.897 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -16.660 13.881 -19.018 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -15.090 15.161 -21.312 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -16.617 14.258 -21.462 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -16.495 15.914 -22.103 1.00 0.00 H new ATOM 419 N THR A 179 -20.775 15.150 -21.592 1.00 0.00 N ATOM 420 CA THR A 179 -22.144 14.652 -21.472 1.00 0.00 C ATOM 421 C THR A 179 -22.192 13.828 -20.192 1.00 0.00 C ATOM 422 O THR A 179 -21.146 13.478 -19.644 1.00 0.00 O ATOM 423 CB THR A 179 -22.524 13.747 -22.659 1.00 0.00 C ATOM 424 OG1 THR A 179 -21.528 12.733 -22.814 1.00 0.00 O ATOM 425 CG2 THR A 179 -22.604 14.542 -23.950 1.00 0.00 C ATOM 0 H THR A 179 -20.169 14.585 -22.187 1.00 0.00 H new ATOM 0 HA THR A 179 -22.843 15.488 -21.459 1.00 0.00 H new ATOM 0 HB THR A 179 -23.500 13.307 -22.453 1.00 0.00 H new ATOM 0 HG1 THR A 179 -21.911 11.861 -22.584 1.00 0.00 H new ATOM 0 HG21 THR A 179 -22.874 13.877 -24.771 1.00 0.00 H new ATOM 0 HG22 THR A 179 -23.359 15.322 -23.851 1.00 0.00 H new ATOM 0 HG23 THR A 179 -21.636 14.999 -24.157 1.00 0.00 H new ATOM 433 N LEU A 180 -23.387 13.501 -19.712 1.00 0.00 N ATOM 434 CA LEU A 180 -23.515 12.726 -18.471 1.00 0.00 C ATOM 435 C LEU A 180 -22.760 11.408 -18.554 1.00 0.00 C ATOM 436 O LEU A 180 -22.104 11.010 -17.606 1.00 0.00 O ATOM 437 CB LEU A 180 -24.987 12.423 -18.157 1.00 0.00 C ATOM 438 CG LEU A 180 -25.708 13.370 -17.184 1.00 0.00 C ATOM 439 CD1 LEU A 180 -27.164 12.924 -17.026 1.00 0.00 C ATOM 440 CD2 LEU A 180 -25.039 13.383 -15.814 1.00 0.00 C ATOM 0 H LEU A 180 -24.272 13.753 -20.151 1.00 0.00 H new ATOM 0 HA LEU A 180 -23.086 13.338 -17.677 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -25.539 12.420 -19.097 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -25.045 11.413 -17.750 1.00 0.00 H new ATOM 0 HG LEU A 180 -25.660 14.377 -17.597 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -27.677 13.594 -16.336 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -27.660 12.952 -17.996 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -27.193 11.908 -16.633 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -25.576 14.063 -15.153 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -25.055 12.378 -15.391 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -24.006 13.717 -15.916 1.00 0.00 H new ATOM 452 N SER A 181 -22.845 10.740 -19.693 1.00 0.00 N ATOM 453 CA SER A 181 -22.184 9.455 -19.882 1.00 0.00 C ATOM 454 C SER A 181 -20.668 9.569 -19.760 1.00 0.00 C ATOM 455 O SER A 181 -20.014 8.675 -19.235 1.00 0.00 O ATOM 456 CB SER A 181 -22.548 8.923 -21.263 1.00 0.00 C ATOM 457 OG SER A 181 -23.123 9.968 -22.039 1.00 0.00 O ATOM 0 H SER A 181 -23.368 11.067 -20.506 1.00 0.00 H new ATOM 0 HA SER A 181 -22.522 8.774 -19.101 1.00 0.00 H new ATOM 0 HB2 SER A 181 -21.659 8.534 -21.760 1.00 0.00 H new ATOM 0 HB3 SER A 181 -23.251 8.095 -21.172 1.00 0.00 H new ATOM 0 HG SER A 181 -23.355 9.626 -22.927 1.00 0.00 H new ATOM 463 N GLN A 182 -20.104 10.669 -20.232 1.00 0.00 N ATOM 464 CA GLN A 182 -18.663 10.859 -20.138 1.00 0.00 C ATOM 465 C GLN A 182 -18.231 11.192 -18.712 1.00 0.00 C ATOM 466 O GLN A 182 -17.180 10.755 -18.259 1.00 0.00 O ATOM 467 CB GLN A 182 -18.196 11.942 -21.100 1.00 0.00 C ATOM 468 CG GLN A 182 -17.611 11.355 -22.397 1.00 0.00 C ATOM 469 CD GLN A 182 -16.457 12.166 -22.949 1.00 0.00 C ATOM 470 OE1 GLN A 182 -15.398 12.244 -22.349 1.00 0.00 O ATOM 471 NE2 GLN A 182 -16.661 12.778 -24.087 1.00 0.00 N ATOM 0 H GLN A 182 -20.611 11.434 -20.678 1.00 0.00 H new ATOM 0 HA GLN A 182 -18.192 9.917 -20.418 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -19.034 12.595 -21.344 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -17.443 12.560 -20.611 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -17.273 10.336 -22.208 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -18.398 11.295 -23.149 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -17.560 12.689 -24.560 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -15.921 13.344 -24.502 1.00 0.00 H new ATOM 480 N ILE A 183 -19.046 11.949 -17.993 1.00 0.00 N ATOM 481 CA ILE A 183 -18.753 12.262 -16.593 1.00 0.00 C ATOM 482 C ILE A 183 -18.794 10.948 -15.819 1.00 0.00 C ATOM 483 O ILE A 183 -17.970 10.709 -14.934 1.00 0.00 O ATOM 484 CB ILE A 183 -19.779 13.284 -16.023 1.00 0.00 C ATOM 485 CG1 ILE A 183 -19.633 14.612 -16.787 1.00 0.00 C ATOM 486 CG2 ILE A 183 -19.561 13.523 -14.499 1.00 0.00 C ATOM 487 CD1 ILE A 183 -20.863 15.478 -16.787 1.00 0.00 C ATOM 0 H ILE A 183 -19.911 12.358 -18.348 1.00 0.00 H new ATOM 0 HA ILE A 183 -17.771 12.726 -16.502 1.00 0.00 H new ATOM 0 HB ILE A 183 -20.783 12.880 -16.153 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -18.808 15.177 -16.352 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -19.360 14.393 -17.819 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -20.295 14.242 -14.135 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -19.678 12.581 -13.963 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -18.557 13.913 -14.332 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -20.665 16.391 -17.349 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -21.688 14.938 -17.251 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -21.128 15.734 -15.761 1.00 0.00 H new ATOM 499 N TYR A 184 -19.738 10.085 -16.169 1.00 0.00 N ATOM 500 CA TYR A 184 -19.826 8.778 -15.530 1.00 0.00 C ATOM 501 C TYR A 184 -18.550 7.976 -15.794 1.00 0.00 C ATOM 502 O TYR A 184 -17.953 7.449 -14.862 1.00 0.00 O ATOM 503 CB TYR A 184 -21.039 7.972 -16.031 1.00 0.00 C ATOM 504 CG TYR A 184 -22.423 8.550 -15.725 1.00 0.00 C ATOM 505 CD1 TYR A 184 -22.614 9.585 -14.777 1.00 0.00 C ATOM 506 CD2 TYR A 184 -23.561 8.043 -16.389 1.00 0.00 C ATOM 507 CE1 TYR A 184 -23.914 10.079 -14.490 1.00 0.00 C ATOM 508 CE2 TYR A 184 -24.862 8.547 -16.105 1.00 0.00 C ATOM 509 CZ TYR A 184 -25.020 9.554 -15.154 1.00 0.00 C ATOM 510 OH TYR A 184 -26.272 10.033 -14.859 1.00 0.00 O ATOM 0 H TYR A 184 -20.445 10.262 -16.882 1.00 0.00 H new ATOM 0 HA TYR A 184 -19.948 8.950 -14.461 1.00 0.00 H new ATOM 0 HB2 TYR A 184 -20.949 7.858 -17.111 1.00 0.00 H new ATOM 0 HB3 TYR A 184 -20.985 6.972 -15.600 1.00 0.00 H new ATOM 0 HD1 TYR A 184 -21.760 10.004 -14.266 1.00 0.00 H new ATOM 0 HD2 TYR A 184 -23.443 7.261 -17.124 1.00 0.00 H new ATOM 0 HE1 TYR A 184 -24.045 10.861 -13.757 1.00 0.00 H new ATOM 0 HE2 TYR A 184 -25.722 8.151 -16.624 1.00 0.00 H new ATOM 0 HH TYR A 184 -26.938 9.567 -15.407 1.00 0.00 H new ATOM 520 N GLU A 185 -18.106 7.875 -17.041 1.00 0.00 N ATOM 521 CA GLU A 185 -16.909 7.075 -17.298 1.00 0.00 C ATOM 522 C GLU A 185 -15.693 7.647 -16.590 1.00 0.00 C ATOM 523 O GLU A 185 -14.858 6.905 -16.098 1.00 0.00 O ATOM 524 CB GLU A 185 -16.620 6.869 -18.794 1.00 0.00 C ATOM 525 CG GLU A 185 -15.971 8.014 -19.582 1.00 0.00 C ATOM 526 CD GLU A 185 -15.126 7.494 -20.733 1.00 0.00 C ATOM 527 OE1 GLU A 185 -15.457 7.773 -21.900 1.00 0.00 O ATOM 528 OE2 GLU A 185 -14.117 6.783 -20.462 1.00 0.00 O ATOM 0 H GLU A 185 -18.531 8.313 -17.858 1.00 0.00 H new ATOM 0 HA GLU A 185 -17.121 6.089 -16.885 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -15.976 5.995 -18.889 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -17.563 6.624 -19.282 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -16.746 8.675 -19.969 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -15.349 8.609 -18.914 1.00 0.00 H new ATOM 535 N TRP A 186 -15.604 8.963 -16.523 1.00 0.00 N ATOM 536 CA TRP A 186 -14.479 9.618 -15.879 1.00 0.00 C ATOM 537 C TRP A 186 -14.395 9.204 -14.418 1.00 0.00 C ATOM 538 O TRP A 186 -13.308 8.943 -13.925 1.00 0.00 O ATOM 539 CB TRP A 186 -14.595 11.142 -15.998 1.00 0.00 C ATOM 540 CG TRP A 186 -13.452 11.867 -15.335 1.00 0.00 C ATOM 541 CD1 TRP A 186 -12.309 12.317 -15.908 1.00 0.00 C ATOM 542 CD2 TRP A 186 -13.347 12.227 -13.944 1.00 0.00 C ATOM 543 NE1 TRP A 186 -11.490 12.919 -14.994 1.00 0.00 N ATOM 544 CE2 TRP A 186 -12.091 12.874 -13.767 1.00 0.00 C ATOM 545 CE3 TRP A 186 -14.189 12.065 -12.831 1.00 0.00 C ATOM 546 CZ2 TRP A 186 -11.657 13.349 -12.511 1.00 0.00 C ATOM 547 CZ3 TRP A 186 -13.758 12.532 -11.564 1.00 0.00 C ATOM 548 CH2 TRP A 186 -12.492 13.170 -11.419 1.00 0.00 C ATOM 0 H TRP A 186 -16.300 9.602 -16.908 1.00 0.00 H new ATOM 0 HA TRP A 186 -13.565 9.307 -16.384 1.00 0.00 H new ATOM 0 HB2 TRP A 186 -14.632 11.418 -17.052 1.00 0.00 H new ATOM 0 HB3 TRP A 186 -15.534 11.467 -15.550 1.00 0.00 H new ATOM 0 HD1 TRP A 186 -12.074 12.213 -16.957 1.00 0.00 H new ATOM 0 HE1 TRP A 186 -10.580 13.334 -15.195 1.00 0.00 H new ATOM 0 HE3 TRP A 186 -15.153 11.590 -12.940 1.00 0.00 H new ATOM 0 HZ2 TRP A 186 -10.700 13.839 -12.403 1.00 0.00 H new ATOM 0 HZ3 TRP A 186 -14.395 12.403 -10.701 1.00 0.00 H new ATOM 0 HH2 TRP A 186 -12.179 13.519 -10.446 1.00 0.00 H new ATOM 559 N MET A 187 -15.519 9.121 -13.721 1.00 0.00 N ATOM 560 CA MET A 187 -15.480 8.737 -12.308 1.00 0.00 C ATOM 561 C MET A 187 -15.044 7.289 -12.145 1.00 0.00 C ATOM 562 O MET A 187 -14.288 6.975 -11.236 1.00 0.00 O ATOM 563 CB MET A 187 -16.833 8.958 -11.631 1.00 0.00 C ATOM 564 CG MET A 187 -17.191 10.420 -11.494 1.00 0.00 C ATOM 565 SD MET A 187 -18.587 10.672 -10.404 1.00 0.00 S ATOM 566 CE MET A 187 -18.820 12.422 -10.573 1.00 0.00 C ATOM 0 H MET A 187 -16.450 9.308 -14.094 1.00 0.00 H new ATOM 0 HA MET A 187 -14.745 9.378 -11.821 1.00 0.00 H new ATOM 0 HB2 MET A 187 -17.608 8.452 -12.206 1.00 0.00 H new ATOM 0 HB3 MET A 187 -16.818 8.499 -10.643 1.00 0.00 H new ATOM 0 HG2 MET A 187 -16.330 10.969 -11.113 1.00 0.00 H new ATOM 0 HG3 MET A 187 -17.421 10.830 -12.477 1.00 0.00 H new ATOM 0 HE1 MET A 187 -19.465 12.782 -9.772 1.00 0.00 H new ATOM 0 HE2 MET A 187 -17.855 12.925 -10.516 1.00 0.00 H new ATOM 0 HE3 MET A 187 -19.284 12.636 -11.536 1.00 0.00 H new ATOM 576 N VAL A 188 -15.500 6.411 -13.026 1.00 0.00 N ATOM 577 CA VAL A 188 -15.111 4.997 -12.967 1.00 0.00 C ATOM 578 C VAL A 188 -13.612 4.848 -13.269 1.00 0.00 C ATOM 579 O VAL A 188 -12.915 4.051 -12.644 1.00 0.00 O ATOM 580 CB VAL A 188 -15.940 4.148 -13.990 1.00 0.00 C ATOM 581 CG1 VAL A 188 -15.517 2.677 -13.970 1.00 0.00 C ATOM 582 CG2 VAL A 188 -17.438 4.233 -13.670 1.00 0.00 C ATOM 0 H VAL A 188 -16.136 6.644 -13.788 1.00 0.00 H new ATOM 0 HA VAL A 188 -15.316 4.630 -11.961 1.00 0.00 H new ATOM 0 HB VAL A 188 -15.746 4.560 -14.980 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -16.112 2.117 -14.691 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -14.462 2.598 -14.231 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -15.675 2.266 -12.973 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -17.998 3.637 -14.391 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -17.618 3.850 -12.665 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -17.764 5.272 -13.726 1.00 0.00 H new ATOM 592 N LYS A 189 -13.117 5.617 -14.231 1.00 0.00 N ATOM 593 CA LYS A 189 -11.722 5.568 -14.631 1.00 0.00 C ATOM 594 C LYS A 189 -10.777 6.208 -13.612 1.00 0.00 C ATOM 595 O LYS A 189 -9.655 5.750 -13.443 1.00 0.00 O ATOM 596 CB LYS A 189 -11.573 6.347 -15.942 1.00 0.00 C ATOM 597 CG LYS A 189 -12.166 5.705 -17.215 1.00 0.00 C ATOM 598 CD LYS A 189 -11.397 4.486 -17.706 1.00 0.00 C ATOM 599 CE LYS A 189 -11.563 4.311 -19.232 1.00 0.00 C ATOM 600 NZ LYS A 189 -13.002 4.314 -19.697 1.00 0.00 N ATOM 0 H LYS A 189 -13.675 6.292 -14.754 1.00 0.00 H new ATOM 0 HA LYS A 189 -11.453 4.516 -14.725 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -12.037 7.324 -15.809 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -10.511 6.519 -16.114 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -13.198 5.416 -17.017 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -12.190 6.451 -18.009 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -10.340 4.594 -17.461 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -11.754 3.594 -17.192 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -11.026 5.112 -19.740 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -11.096 3.373 -19.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -13.090 3.736 -20.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -13.609 3.919 -18.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -13.298 5.289 -19.904 1.00 0.00 H new ATOM 614 N SER A 190 -11.217 7.284 -12.972 1.00 0.00 N ATOM 615 CA SER A 190 -10.358 8.068 -12.085 1.00 0.00 C ATOM 616 C SER A 190 -10.473 7.791 -10.590 1.00 0.00 C ATOM 617 O SER A 190 -9.516 8.021 -9.856 1.00 0.00 O ATOM 618 CB SER A 190 -10.656 9.547 -12.305 1.00 0.00 C ATOM 619 OG SER A 190 -10.677 9.852 -13.690 1.00 0.00 O ATOM 0 H SER A 190 -12.170 7.638 -13.050 1.00 0.00 H new ATOM 0 HA SER A 190 -9.345 7.770 -12.356 1.00 0.00 H new ATOM 0 HB2 SER A 190 -11.617 9.800 -11.857 1.00 0.00 H new ATOM 0 HB3 SER A 190 -9.901 10.154 -11.805 1.00 0.00 H new ATOM 0 HG SER A 190 -11.557 9.630 -14.061 1.00 0.00 H new ATOM 625 N VAL A 191 -11.623 7.324 -10.122 1.00 0.00 N ATOM 626 CA VAL A 191 -11.816 7.092 -8.687 1.00 0.00 C ATOM 627 C VAL A 191 -12.158 5.624 -8.434 1.00 0.00 C ATOM 628 O VAL A 191 -13.181 5.122 -8.909 1.00 0.00 O ATOM 629 CB VAL A 191 -12.939 8.000 -8.102 1.00 0.00 C ATOM 630 CG1 VAL A 191 -13.012 7.847 -6.578 1.00 0.00 C ATOM 631 CG2 VAL A 191 -12.669 9.461 -8.427 1.00 0.00 C ATOM 0 H VAL A 191 -12.431 7.099 -10.703 1.00 0.00 H new ATOM 0 HA VAL A 191 -10.882 7.344 -8.184 1.00 0.00 H new ATOM 0 HB VAL A 191 -13.883 7.691 -8.551 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -13.801 8.488 -6.185 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -13.229 6.809 -6.327 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -12.058 8.135 -6.137 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -13.464 10.079 -8.010 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -11.713 9.759 -7.996 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -12.636 9.593 -9.508 1.00 0.00 H new ATOM 641 N PRO A 192 -11.311 4.907 -7.668 1.00 0.00 N ATOM 642 CA PRO A 192 -11.628 3.486 -7.477 1.00 0.00 C ATOM 643 C PRO A 192 -12.894 3.263 -6.657 1.00 0.00 C ATOM 644 O PRO A 192 -13.553 2.247 -6.807 1.00 0.00 O ATOM 645 CB PRO A 192 -10.382 2.946 -6.769 1.00 0.00 C ATOM 646 CG PRO A 192 -9.830 4.117 -6.041 1.00 0.00 C ATOM 647 CD PRO A 192 -10.070 5.285 -6.965 1.00 0.00 C ATOM 0 HA PRO A 192 -11.843 2.979 -8.418 1.00 0.00 H new ATOM 0 HB2 PRO A 192 -10.634 2.136 -6.084 1.00 0.00 H new ATOM 0 HB3 PRO A 192 -9.662 2.547 -7.483 1.00 0.00 H new ATOM 0 HG2 PRO A 192 -10.330 4.260 -5.083 1.00 0.00 H new ATOM 0 HG3 PRO A 192 -8.768 3.989 -5.831 1.00 0.00 H new ATOM 0 HD2 PRO A 192 -10.187 6.218 -6.413 1.00 0.00 H new ATOM 0 HD3 PRO A 192 -9.241 5.427 -7.659 1.00 0.00 H new ATOM 655 N TYR A 193 -13.249 4.225 -5.814 1.00 0.00 N ATOM 656 CA TYR A 193 -14.485 4.141 -5.039 1.00 0.00 C ATOM 657 C TYR A 193 -15.686 4.053 -5.971 1.00 0.00 C ATOM 658 O TYR A 193 -16.583 3.259 -5.767 1.00 0.00 O ATOM 659 CB TYR A 193 -14.652 5.385 -4.160 1.00 0.00 C ATOM 660 CG TYR A 193 -15.874 5.318 -3.270 1.00 0.00 C ATOM 661 CD1 TYR A 193 -17.108 5.859 -3.699 1.00 0.00 C ATOM 662 CD2 TYR A 193 -15.815 4.709 -1.999 1.00 0.00 C ATOM 663 CE1 TYR A 193 -18.261 5.781 -2.877 1.00 0.00 C ATOM 664 CE2 TYR A 193 -16.969 4.641 -1.169 1.00 0.00 C ATOM 665 CZ TYR A 193 -18.180 5.175 -1.622 1.00 0.00 C ATOM 666 OH TYR A 193 -19.300 5.105 -0.835 1.00 0.00 O ATOM 0 H TYR A 193 -12.702 5.070 -5.649 1.00 0.00 H new ATOM 0 HA TYR A 193 -14.428 3.250 -4.414 1.00 0.00 H new ATOM 0 HB2 TYR A 193 -13.764 5.508 -3.540 1.00 0.00 H new ATOM 0 HB3 TYR A 193 -14.721 6.267 -4.797 1.00 0.00 H new ATOM 0 HD1 TYR A 193 -17.173 6.338 -4.665 1.00 0.00 H new ATOM 0 HD2 TYR A 193 -14.883 4.289 -1.651 1.00 0.00 H new ATOM 0 HE1 TYR A 193 -19.200 6.190 -3.221 1.00 0.00 H new ATOM 0 HE2 TYR A 193 -16.910 4.179 -0.194 1.00 0.00 H new ATOM 0 HH TYR A 193 -19.081 4.654 0.007 1.00 0.00 H new ATOM 676 N PHE A 194 -15.704 4.883 -7.000 1.00 0.00 N ATOM 677 CA PHE A 194 -16.837 4.916 -7.912 1.00 0.00 C ATOM 678 C PHE A 194 -16.832 3.715 -8.842 1.00 0.00 C ATOM 679 O PHE A 194 -17.889 3.280 -9.286 1.00 0.00 O ATOM 680 CB PHE A 194 -16.845 6.229 -8.686 1.00 0.00 C ATOM 681 CG PHE A 194 -17.519 7.344 -7.939 1.00 0.00 C ATOM 682 CD1 PHE A 194 -18.864 7.641 -8.197 1.00 0.00 C ATOM 683 CD2 PHE A 194 -16.833 8.087 -6.964 1.00 0.00 C ATOM 684 CE1 PHE A 194 -19.538 8.641 -7.498 1.00 0.00 C ATOM 685 CE2 PHE A 194 -17.495 9.114 -6.245 1.00 0.00 C ATOM 686 CZ PHE A 194 -18.853 9.392 -6.513 1.00 0.00 C ATOM 0 H PHE A 194 -14.955 5.538 -7.225 1.00 0.00 H new ATOM 0 HA PHE A 194 -17.756 4.859 -7.329 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -15.819 6.518 -8.912 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -17.351 6.080 -9.640 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -19.391 7.082 -8.956 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -15.794 7.874 -6.761 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -20.578 8.842 -7.707 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -16.963 9.681 -5.496 1.00 0.00 H new ATOM 0 HZ PHE A 194 -19.366 10.172 -5.970 1.00 0.00 H new ATOM 696 N LYS A 195 -15.659 3.158 -9.112 1.00 0.00 N ATOM 697 CA LYS A 195 -15.574 1.920 -9.889 1.00 0.00 C ATOM 698 C LYS A 195 -16.205 0.790 -9.075 1.00 0.00 C ATOM 699 O LYS A 195 -16.989 0.006 -9.592 1.00 0.00 O ATOM 700 CB LYS A 195 -14.112 1.578 -10.196 1.00 0.00 C ATOM 701 CG LYS A 195 -13.945 0.311 -11.029 1.00 0.00 C ATOM 702 CD LYS A 195 -12.490 -0.111 -11.107 1.00 0.00 C ATOM 703 CE LYS A 195 -12.361 -1.425 -11.874 1.00 0.00 C ATOM 704 NZ LYS A 195 -10.958 -1.964 -11.826 1.00 0.00 N ATOM 0 H LYS A 195 -14.761 3.535 -8.810 1.00 0.00 H new ATOM 0 HA LYS A 195 -16.103 2.048 -10.833 1.00 0.00 H new ATOM 0 HB2 LYS A 195 -13.655 2.414 -10.725 1.00 0.00 H new ATOM 0 HB3 LYS A 195 -13.570 1.460 -9.258 1.00 0.00 H new ATOM 0 HG2 LYS A 195 -14.536 -0.494 -10.593 1.00 0.00 H new ATOM 0 HG3 LYS A 195 -14.331 0.481 -12.034 1.00 0.00 H new ATOM 0 HD2 LYS A 195 -11.905 0.665 -11.600 1.00 0.00 H new ATOM 0 HD3 LYS A 195 -12.083 -0.227 -10.102 1.00 0.00 H new ATOM 0 HE2 LYS A 195 -13.047 -2.160 -11.454 1.00 0.00 H new ATOM 0 HE3 LYS A 195 -12.656 -1.271 -12.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 195 -10.911 -2.857 -12.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 195 -10.306 -1.273 -12.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 195 -10.686 -2.135 -10.837 1.00 0.00 H new ATOM 718 N ASP A 196 -15.857 0.733 -7.798 1.00 0.00 N ATOM 719 CA ASP A 196 -16.372 -0.291 -6.882 1.00 0.00 C ATOM 720 C ASP A 196 -17.878 -0.164 -6.702 1.00 0.00 C ATOM 721 O ASP A 196 -18.598 -1.141 -6.559 1.00 0.00 O ATOM 722 CB ASP A 196 -15.709 -0.101 -5.516 1.00 0.00 C ATOM 723 CG ASP A 196 -16.071 -1.189 -4.537 1.00 0.00 C ATOM 724 OD1 ASP A 196 -15.777 -2.363 -4.809 1.00 0.00 O ATOM 725 OD2 ASP A 196 -16.644 -0.854 -3.474 1.00 0.00 O ATOM 0 H ASP A 196 -15.211 1.391 -7.362 1.00 0.00 H new ATOM 0 HA ASP A 196 -16.150 -1.272 -7.301 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -14.627 -0.077 -5.642 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -16.003 0.865 -5.105 1.00 0.00 H new ATOM 730 N LYS A 197 -18.356 1.068 -6.724 1.00 0.00 N ATOM 731 CA LYS A 197 -19.775 1.351 -6.512 1.00 0.00 C ATOM 732 C LYS A 197 -20.560 1.300 -7.816 1.00 0.00 C ATOM 733 O LYS A 197 -21.665 1.823 -7.912 1.00 0.00 O ATOM 734 CB LYS A 197 -19.921 2.697 -5.785 1.00 0.00 C ATOM 735 CG LYS A 197 -20.013 2.536 -4.259 1.00 0.00 C ATOM 736 CD LYS A 197 -18.762 1.921 -3.608 1.00 0.00 C ATOM 737 CE LYS A 197 -19.030 1.532 -2.165 1.00 0.00 C ATOM 738 NZ LYS A 197 -17.849 0.797 -1.599 1.00 0.00 N ATOM 0 H LYS A 197 -17.783 1.896 -6.887 1.00 0.00 H new ATOM 0 HA LYS A 197 -20.206 0.574 -5.880 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -19.070 3.332 -6.029 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -20.813 3.207 -6.148 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -20.196 3.514 -3.813 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -20.875 1.912 -4.023 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -18.450 1.042 -4.172 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -17.939 2.635 -3.648 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -19.231 2.424 -1.572 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -19.919 0.904 -2.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -18.118 0.347 -0.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -17.539 0.068 -2.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -17.071 1.467 -1.431 1.00 0.00 H new ATOM 752 N GLY A 198 -19.984 0.646 -8.811 1.00 0.00 N ATOM 753 CA GLY A 198 -20.636 0.487 -10.102 1.00 0.00 C ATOM 754 C GLY A 198 -21.643 -0.652 -10.109 1.00 0.00 C ATOM 755 O GLY A 198 -22.236 -0.948 -11.146 1.00 0.00 O ATOM 0 H GLY A 198 -19.062 0.214 -8.750 1.00 0.00 H new ATOM 0 HA2 GLY A 198 -21.141 1.416 -10.367 1.00 0.00 H new ATOM 0 HA3 GLY A 198 -19.881 0.305 -10.867 1.00 0.00 H new ATOM 759 N ASP A 199 -21.840 -1.280 -8.954 1.00 0.00 N ATOM 760 CA ASP A 199 -22.816 -2.365 -8.790 1.00 0.00 C ATOM 761 C ASP A 199 -24.216 -1.906 -9.217 1.00 0.00 C ATOM 762 O ASP A 199 -24.545 -0.735 -9.108 1.00 0.00 O ATOM 763 CB ASP A 199 -22.861 -2.800 -7.322 1.00 0.00 C ATOM 764 CG ASP A 199 -24.213 -3.361 -6.933 1.00 0.00 C ATOM 765 OD1 ASP A 199 -24.967 -2.651 -6.236 1.00 0.00 O ATOM 766 OD2 ASP A 199 -24.545 -4.489 -7.350 1.00 0.00 O ATOM 0 H ASP A 199 -21.329 -1.054 -8.101 1.00 0.00 H new ATOM 0 HA ASP A 199 -22.509 -3.200 -9.419 1.00 0.00 H new ATOM 0 HB2 ASP A 199 -22.092 -3.552 -7.144 1.00 0.00 H new ATOM 0 HB3 ASP A 199 -22.626 -1.947 -6.685 1.00 0.00 H new ATOM 771 N SER A 200 -25.036 -2.834 -9.694 1.00 0.00 N ATOM 772 CA SER A 200 -26.371 -2.517 -10.206 1.00 0.00 C ATOM 773 C SER A 200 -27.243 -1.703 -9.240 1.00 0.00 C ATOM 774 O SER A 200 -27.853 -0.711 -9.648 1.00 0.00 O ATOM 775 CB SER A 200 -27.093 -3.818 -10.566 1.00 0.00 C ATOM 776 OG SER A 200 -28.335 -3.555 -11.196 1.00 0.00 O ATOM 0 H SER A 200 -24.799 -3.825 -9.739 1.00 0.00 H new ATOM 0 HA SER A 200 -26.220 -1.886 -11.082 1.00 0.00 H new ATOM 0 HB2 SER A 200 -26.465 -4.415 -11.228 1.00 0.00 H new ATOM 0 HB3 SER A 200 -27.257 -4.408 -9.664 1.00 0.00 H new ATOM 0 HG SER A 200 -28.775 -4.402 -11.417 1.00 0.00 H new ATOM 782 N ASN A 201 -27.306 -2.092 -7.973 1.00 0.00 N ATOM 783 CA ASN A 201 -28.134 -1.363 -7.007 1.00 0.00 C ATOM 784 C ASN A 201 -27.503 -0.010 -6.700 1.00 0.00 C ATOM 785 O ASN A 201 -28.165 1.029 -6.751 1.00 0.00 O ATOM 786 CB ASN A 201 -28.285 -2.165 -5.710 1.00 0.00 C ATOM 787 CG ASN A 201 -29.232 -1.515 -4.732 1.00 0.00 C ATOM 788 OD1 ASN A 201 -28.904 -0.533 -4.093 1.00 0.00 O ATOM 789 ND2 ASN A 201 -30.408 -2.066 -4.608 1.00 0.00 N ATOM 0 H ASN A 201 -26.805 -2.894 -7.590 1.00 0.00 H new ATOM 0 HA ASN A 201 -29.122 -1.214 -7.444 1.00 0.00 H new ATOM 0 HB2 ASN A 201 -28.644 -3.167 -5.946 1.00 0.00 H new ATOM 0 HB3 ASN A 201 -27.307 -2.279 -5.242 1.00 0.00 H new ATOM 0 HD21 ASN A 201 -31.089 -1.674 -3.958 1.00 0.00 H new ATOM 0 HD22 ASN A 201 -30.646 -2.889 -5.161 1.00 0.00 H new ATOM 796 N SER A 202 -26.213 -0.028 -6.400 1.00 0.00 N ATOM 797 CA SER A 202 -25.467 1.186 -6.068 1.00 0.00 C ATOM 798 C SER A 202 -25.560 2.219 -7.191 1.00 0.00 C ATOM 799 O SER A 202 -25.631 3.430 -6.944 1.00 0.00 O ATOM 800 CB SER A 202 -24.004 0.822 -5.818 1.00 0.00 C ATOM 801 OG SER A 202 -23.219 1.977 -5.592 1.00 0.00 O ATOM 0 H SER A 202 -25.651 -0.879 -6.379 1.00 0.00 H new ATOM 0 HA SER A 202 -25.902 1.627 -5.171 1.00 0.00 H new ATOM 0 HB2 SER A 202 -23.934 0.158 -4.957 1.00 0.00 H new ATOM 0 HB3 SER A 202 -23.611 0.275 -6.675 1.00 0.00 H new ATOM 0 HG SER A 202 -22.620 2.119 -6.354 1.00 0.00 H new ATOM 807 N SER A 203 -25.584 1.736 -8.426 1.00 0.00 N ATOM 808 CA SER A 203 -25.657 2.582 -9.615 1.00 0.00 C ATOM 809 C SER A 203 -26.849 3.544 -9.591 1.00 0.00 C ATOM 810 O SER A 203 -26.805 4.610 -10.221 1.00 0.00 O ATOM 811 CB SER A 203 -25.685 1.738 -10.892 1.00 0.00 C ATOM 812 OG SER A 203 -27.000 1.313 -11.210 1.00 0.00 O ATOM 0 H SER A 203 -25.553 0.738 -8.635 1.00 0.00 H new ATOM 0 HA SER A 203 -24.753 3.191 -9.609 1.00 0.00 H new ATOM 0 HB2 SER A 203 -25.279 2.318 -11.721 1.00 0.00 H new ATOM 0 HB3 SER A 203 -25.041 0.867 -10.767 1.00 0.00 H new ATOM 0 HG SER A 203 -27.177 0.450 -10.782 1.00 0.00 H new ATOM 818 N ALA A 204 -27.916 3.183 -8.893 1.00 0.00 N ATOM 819 CA ALA A 204 -29.089 4.044 -8.796 1.00 0.00 C ATOM 820 C ALA A 204 -28.728 5.389 -8.131 1.00 0.00 C ATOM 821 O ALA A 204 -29.050 6.458 -8.658 1.00 0.00 O ATOM 822 CB ALA A 204 -30.195 3.326 -8.005 1.00 0.00 C ATOM 0 H ALA A 204 -27.995 2.302 -8.386 1.00 0.00 H new ATOM 0 HA ALA A 204 -29.454 4.256 -9.801 1.00 0.00 H new ATOM 0 HB1 ALA A 204 -31.070 3.972 -7.934 1.00 0.00 H new ATOM 0 HB2 ALA A 204 -30.466 2.402 -8.516 1.00 0.00 H new ATOM 0 HB3 ALA A 204 -29.834 3.094 -7.003 1.00 0.00 H new ATOM 828 N GLY A 205 -28.052 5.335 -6.988 1.00 0.00 N ATOM 829 CA GLY A 205 -27.689 6.554 -6.268 1.00 0.00 C ATOM 830 C GLY A 205 -26.506 7.253 -6.908 1.00 0.00 C ATOM 831 O GLY A 205 -26.363 8.475 -6.846 1.00 0.00 O ATOM 0 H GLY A 205 -27.746 4.470 -6.542 1.00 0.00 H new ATOM 0 HA2 GLY A 205 -28.543 7.231 -6.245 1.00 0.00 H new ATOM 0 HA3 GLY A 205 -27.450 6.308 -5.233 1.00 0.00 H new ATOM 835 N TRP A 206 -25.673 6.451 -7.549 1.00 0.00 N ATOM 836 CA TRP A 206 -24.476 6.900 -8.262 1.00 0.00 C ATOM 837 C TRP A 206 -24.856 7.952 -9.316 1.00 0.00 C ATOM 838 O TRP A 206 -24.321 9.060 -9.344 1.00 0.00 O ATOM 839 CB TRP A 206 -23.943 5.638 -8.943 1.00 0.00 C ATOM 840 CG TRP A 206 -22.534 5.510 -9.292 1.00 0.00 C ATOM 841 CD1 TRP A 206 -21.640 4.681 -8.716 1.00 0.00 C ATOM 842 CD2 TRP A 206 -21.837 6.127 -10.381 1.00 0.00 C ATOM 843 NE1 TRP A 206 -20.441 4.709 -9.351 1.00 0.00 N ATOM 844 CE2 TRP A 206 -20.522 5.579 -10.396 1.00 0.00 C ATOM 845 CE3 TRP A 206 -22.188 7.075 -11.360 1.00 0.00 C ATOM 846 CZ2 TRP A 206 -19.568 5.945 -11.350 1.00 0.00 C ATOM 847 CZ3 TRP A 206 -21.225 7.454 -12.309 1.00 0.00 C ATOM 848 CH2 TRP A 206 -19.924 6.883 -12.294 1.00 0.00 C ATOM 0 H TRP A 206 -25.809 5.441 -7.593 1.00 0.00 H new ATOM 0 HA TRP A 206 -23.741 7.359 -7.601 1.00 0.00 H new ATOM 0 HB2 TRP A 206 -24.188 4.797 -8.294 1.00 0.00 H new ATOM 0 HB3 TRP A 206 -24.513 5.507 -9.863 1.00 0.00 H new ATOM 0 HD1 TRP A 206 -21.853 4.068 -7.853 1.00 0.00 H new ATOM 0 HE1 TRP A 206 -19.616 4.169 -9.089 1.00 0.00 H new ATOM 0 HE3 TRP A 206 -23.179 7.503 -11.381 1.00 0.00 H new ATOM 0 HZ2 TRP A 206 -18.581 5.506 -11.347 1.00 0.00 H new ATOM 0 HZ3 TRP A 206 -21.476 8.189 -13.060 1.00 0.00 H new ATOM 0 HH2 TRP A 206 -19.201 7.190 -13.036 1.00 0.00 H new ATOM 859 N LYS A 207 -25.801 7.600 -10.181 1.00 0.00 N ATOM 860 CA LYS A 207 -26.252 8.502 -11.248 1.00 0.00 C ATOM 861 C LYS A 207 -27.086 9.650 -10.698 1.00 0.00 C ATOM 862 O LYS A 207 -26.996 10.782 -11.183 1.00 0.00 O ATOM 863 CB LYS A 207 -27.090 7.729 -12.269 1.00 0.00 C ATOM 864 CG LYS A 207 -26.340 6.590 -12.953 1.00 0.00 C ATOM 865 CD LYS A 207 -27.228 5.902 -13.989 1.00 0.00 C ATOM 866 CE LYS A 207 -26.864 4.425 -14.148 1.00 0.00 C ATOM 867 NZ LYS A 207 -27.424 3.609 -13.012 1.00 0.00 N ATOM 0 H LYS A 207 -26.273 6.696 -10.168 1.00 0.00 H new ATOM 0 HA LYS A 207 -25.362 8.914 -11.723 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -27.969 7.323 -11.769 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -27.448 8.423 -13.030 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -25.443 6.977 -13.436 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -26.013 5.865 -12.208 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -28.273 5.990 -13.690 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -27.127 6.408 -14.949 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -27.251 4.051 -15.096 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -25.780 4.315 -14.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -27.002 2.659 -13.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -27.202 4.073 -12.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -28.456 3.531 -13.116 1.00 0.00 H new ATOM 881 N ASN A 208 -27.908 9.354 -9.700 1.00 0.00 N ATOM 882 CA ASN A 208 -28.809 10.351 -9.119 1.00 0.00 C ATOM 883 C ASN A 208 -28.034 11.513 -8.510 1.00 0.00 C ATOM 884 O ASN A 208 -28.325 12.663 -8.794 1.00 0.00 O ATOM 885 CB ASN A 208 -29.694 9.690 -8.053 1.00 0.00 C ATOM 886 CG ASN A 208 -30.860 10.562 -7.624 1.00 0.00 C ATOM 887 OD1 ASN A 208 -30.743 11.761 -7.484 1.00 0.00 O ATOM 888 ND2 ASN A 208 -31.993 9.948 -7.427 1.00 0.00 N ATOM 0 H ASN A 208 -27.972 8.430 -9.272 1.00 0.00 H new ATOM 0 HA ASN A 208 -29.435 10.750 -9.917 1.00 0.00 H new ATOM 0 HB2 ASN A 208 -30.077 8.746 -8.441 1.00 0.00 H new ATOM 0 HB3 ASN A 208 -29.086 9.452 -7.181 1.00 0.00 H new ATOM 0 HD21 ASN A 208 -32.818 10.478 -7.146 1.00 0.00 H new ATOM 0 HD22 ASN A 208 -32.055 8.938 -7.554 1.00 0.00 H new ATOM 895 N SER A 209 -27.042 11.218 -7.684 1.00 0.00 N ATOM 896 CA SER A 209 -26.290 12.270 -7.001 1.00 0.00 C ATOM 897 C SER A 209 -25.608 13.235 -7.971 1.00 0.00 C ATOM 898 O SER A 209 -25.559 14.440 -7.721 1.00 0.00 O ATOM 899 CB SER A 209 -25.253 11.639 -6.084 1.00 0.00 C ATOM 900 OG SER A 209 -25.867 10.731 -5.187 1.00 0.00 O ATOM 0 H SER A 209 -26.738 10.269 -7.469 1.00 0.00 H new ATOM 0 HA SER A 209 -27.004 12.855 -6.421 1.00 0.00 H new ATOM 0 HB2 SER A 209 -24.502 11.119 -6.679 1.00 0.00 H new ATOM 0 HB3 SER A 209 -24.734 12.417 -5.524 1.00 0.00 H new ATOM 0 HG SER A 209 -26.058 9.890 -5.653 1.00 0.00 H new ATOM 906 N ILE A 210 -25.100 12.725 -9.085 1.00 0.00 N ATOM 907 CA ILE A 210 -24.477 13.591 -10.091 1.00 0.00 C ATOM 908 C ILE A 210 -25.551 14.486 -10.690 1.00 0.00 C ATOM 909 O ILE A 210 -25.365 15.690 -10.842 1.00 0.00 O ATOM 910 CB ILE A 210 -23.787 12.768 -11.217 1.00 0.00 C ATOM 911 CG1 ILE A 210 -22.625 11.969 -10.606 1.00 0.00 C ATOM 912 CG2 ILE A 210 -23.315 13.680 -12.379 1.00 0.00 C ATOM 913 CD1 ILE A 210 -22.104 10.860 -11.472 1.00 0.00 C ATOM 0 H ILE A 210 -25.104 11.732 -9.318 1.00 0.00 H new ATOM 0 HA ILE A 210 -23.704 14.188 -9.606 1.00 0.00 H new ATOM 0 HB ILE A 210 -24.506 12.072 -11.650 1.00 0.00 H new ATOM 0 HG12 ILE A 210 -21.807 12.655 -10.385 1.00 0.00 H new ATOM 0 HG13 ILE A 210 -22.952 11.547 -9.656 1.00 0.00 H new ATOM 0 HG21 ILE A 210 -22.838 13.072 -13.148 1.00 0.00 H new ATOM 0 HG22 ILE A 210 -24.173 14.198 -12.807 1.00 0.00 H new ATOM 0 HG23 ILE A 210 -22.602 14.412 -12.000 1.00 0.00 H new ATOM 0 HD11 ILE A 210 -21.287 10.352 -10.960 1.00 0.00 H new ATOM 0 HD12 ILE A 210 -22.905 10.148 -11.673 1.00 0.00 H new ATOM 0 HD13 ILE A 210 -21.742 11.273 -12.413 1.00 0.00 H new ATOM 925 N ARG A 211 -26.688 13.894 -11.021 1.00 0.00 N ATOM 926 CA ARG A 211 -27.780 14.635 -11.645 1.00 0.00 C ATOM 927 C ARG A 211 -28.332 15.701 -10.702 1.00 0.00 C ATOM 928 O ARG A 211 -28.667 16.797 -11.137 1.00 0.00 O ATOM 929 CB ARG A 211 -28.872 13.654 -12.077 1.00 0.00 C ATOM 930 CG ARG A 211 -29.839 14.233 -13.094 1.00 0.00 C ATOM 931 CD ARG A 211 -30.670 13.127 -13.724 1.00 0.00 C ATOM 932 NE ARG A 211 -31.480 13.631 -14.847 1.00 0.00 N ATOM 933 CZ ARG A 211 -32.214 12.877 -15.661 1.00 0.00 C ATOM 934 NH1 ARG A 211 -32.295 11.575 -15.528 1.00 0.00 N ATOM 935 NH2 ARG A 211 -32.879 13.446 -16.628 1.00 0.00 N ATOM 0 H ARG A 211 -26.881 12.904 -10.869 1.00 0.00 H new ATOM 0 HA ARG A 211 -27.402 15.155 -12.525 1.00 0.00 H new ATOM 0 HB2 ARG A 211 -28.404 12.764 -12.498 1.00 0.00 H new ATOM 0 HB3 ARG A 211 -29.431 13.334 -11.197 1.00 0.00 H new ATOM 0 HG2 ARG A 211 -30.494 14.958 -12.611 1.00 0.00 H new ATOM 0 HG3 ARG A 211 -29.287 14.767 -13.867 1.00 0.00 H new ATOM 0 HD2 ARG A 211 -30.012 12.333 -14.077 1.00 0.00 H new ATOM 0 HD3 ARG A 211 -31.324 12.688 -12.971 1.00 0.00 H new ATOM 0 HE ARG A 211 -31.478 14.637 -15.013 1.00 0.00 H new ATOM 0 HH11 ARG A 211 -31.784 11.106 -14.780 1.00 0.00 H new ATOM 0 HH12 ARG A 211 -32.869 11.031 -16.173 1.00 0.00 H new ATOM 0 HH21 ARG A 211 -32.832 14.457 -16.753 1.00 0.00 H new ATOM 0 HH22 ARG A 211 -33.446 12.880 -17.259 1.00 0.00 H new ATOM 949 N HIS A 212 -28.403 15.388 -9.419 1.00 0.00 N ATOM 950 CA HIS A 212 -28.841 16.351 -8.414 1.00 0.00 C ATOM 951 C HIS A 212 -27.873 17.527 -8.357 1.00 0.00 C ATOM 952 O HIS A 212 -28.290 18.672 -8.407 1.00 0.00 O ATOM 953 CB HIS A 212 -28.913 15.692 -7.034 1.00 0.00 C ATOM 954 CG HIS A 212 -29.203 16.659 -5.928 1.00 0.00 C ATOM 955 ND1 HIS A 212 -30.452 17.130 -5.611 1.00 0.00 N ATOM 956 CD2 HIS A 212 -28.362 17.275 -5.050 1.00 0.00 C ATOM 957 CE1 HIS A 212 -30.330 17.981 -4.596 1.00 0.00 C ATOM 958 NE2 HIS A 212 -29.078 18.102 -4.210 1.00 0.00 N ATOM 0 H HIS A 212 -28.162 14.470 -9.044 1.00 0.00 H new ATOM 0 HA HIS A 212 -29.833 16.707 -8.693 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -29.686 14.923 -7.046 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -27.967 15.190 -6.829 1.00 0.00 H new ATOM 0 HD2 HIS A 212 -27.292 17.136 -5.017 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -31.157 18.508 -4.144 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -28.715 18.682 -3.453 1.00 0.00 H new ATOM 966 N ASN A 213 -26.581 17.249 -8.269 1.00 0.00 N ATOM 967 CA ASN A 213 -25.582 18.320 -8.180 1.00 0.00 C ATOM 968 C ASN A 213 -25.630 19.212 -9.423 1.00 0.00 C ATOM 969 O ASN A 213 -25.466 20.424 -9.332 1.00 0.00 O ATOM 970 CB ASN A 213 -24.180 17.728 -8.010 1.00 0.00 C ATOM 971 CG ASN A 213 -23.824 17.486 -6.563 1.00 0.00 C ATOM 972 OD1 ASN A 213 -23.124 18.270 -5.956 1.00 0.00 O ATOM 973 ND2 ASN A 213 -24.290 16.402 -6.012 1.00 0.00 N ATOM 0 H ASN A 213 -26.196 16.305 -8.257 1.00 0.00 H new ATOM 0 HA ASN A 213 -25.815 18.931 -7.308 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -24.118 16.788 -8.558 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -23.448 18.404 -8.452 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -24.069 16.189 -5.039 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -24.876 15.766 -6.553 1.00 0.00 H new ATOM 980 N LEU A 214 -25.871 18.615 -10.582 1.00 0.00 N ATOM 981 CA LEU A 214 -25.988 19.384 -11.822 1.00 0.00 C ATOM 982 C LEU A 214 -27.242 20.257 -11.827 1.00 0.00 C ATOM 983 O LEU A 214 -27.237 21.339 -12.399 1.00 0.00 O ATOM 984 CB LEU A 214 -26.042 18.445 -13.031 1.00 0.00 C ATOM 985 CG LEU A 214 -24.734 17.734 -13.410 1.00 0.00 C ATOM 986 CD1 LEU A 214 -25.031 16.697 -14.476 1.00 0.00 C ATOM 987 CD2 LEU A 214 -23.689 18.710 -13.924 1.00 0.00 C ATOM 0 H LEU A 214 -25.989 17.608 -10.694 1.00 0.00 H new ATOM 0 HA LEU A 214 -25.109 20.026 -11.884 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -26.799 17.685 -12.838 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -26.379 19.020 -13.894 1.00 0.00 H new ATOM 0 HG LEU A 214 -24.329 17.260 -12.516 1.00 0.00 H new ATOM 0 HD11 LEU A 214 -24.109 16.186 -14.753 1.00 0.00 H new ATOM 0 HD12 LEU A 214 -25.746 15.971 -14.088 1.00 0.00 H new ATOM 0 HD13 LEU A 214 -25.452 17.188 -15.354 1.00 0.00 H new ATOM 0 HD21 LEU A 214 -22.779 18.167 -14.181 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -24.070 19.219 -14.809 1.00 0.00 H new ATOM 0 HD23 LEU A 214 -23.467 19.445 -13.151 1.00 0.00 H new ATOM 999 N SER A 215 -28.314 19.792 -11.199 1.00 0.00 N ATOM 1000 CA SER A 215 -29.574 20.545 -11.178 1.00 0.00 C ATOM 1001 C SER A 215 -29.485 21.800 -10.314 1.00 0.00 C ATOM 1002 O SER A 215 -30.281 22.722 -10.478 1.00 0.00 O ATOM 1003 CB SER A 215 -30.737 19.666 -10.701 1.00 0.00 C ATOM 1004 OG SER A 215 -30.673 19.381 -9.314 1.00 0.00 O ATOM 0 H SER A 215 -28.343 18.904 -10.699 1.00 0.00 H new ATOM 0 HA SER A 215 -29.762 20.859 -12.205 1.00 0.00 H new ATOM 0 HB2 SER A 215 -31.680 20.166 -10.922 1.00 0.00 H new ATOM 0 HB3 SER A 215 -30.734 18.731 -11.261 1.00 0.00 H new ATOM 0 HG SER A 215 -29.783 19.037 -9.091 1.00 0.00 H new ATOM 1010 N LEU A 216 -28.509 21.845 -9.412 1.00 0.00 N ATOM 1011 CA LEU A 216 -28.306 23.020 -8.559 1.00 0.00 C ATOM 1012 C LEU A 216 -27.783 24.181 -9.400 1.00 0.00 C ATOM 1013 O LEU A 216 -27.920 25.329 -9.016 1.00 0.00 O ATOM 1014 CB LEU A 216 -27.313 22.712 -7.429 1.00 0.00 C ATOM 1015 CG LEU A 216 -27.688 21.557 -6.482 1.00 0.00 C ATOM 1016 CD1 LEU A 216 -26.564 21.340 -5.472 1.00 0.00 C ATOM 1017 CD2 LEU A 216 -29.005 21.817 -5.747 1.00 0.00 C ATOM 0 H LEU A 216 -27.847 21.086 -9.250 1.00 0.00 H new ATOM 0 HA LEU A 216 -29.263 23.291 -8.113 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -26.345 22.486 -7.877 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -27.184 23.615 -6.832 1.00 0.00 H new ATOM 0 HG LEU A 216 -27.825 20.662 -7.088 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -26.830 20.522 -4.802 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -25.643 21.092 -6.000 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -26.415 22.251 -4.892 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -29.228 20.975 -5.091 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -28.917 22.727 -5.153 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -29.810 21.934 -6.473 1.00 0.00 H new ATOM 1029 N HIS A 217 -27.203 23.830 -10.547 1.00 0.00 N ATOM 1030 CA HIS A 217 -26.700 24.742 -11.599 1.00 0.00 C ATOM 1031 C HIS A 217 -25.921 26.038 -11.258 1.00 0.00 C ATOM 1032 O HIS A 217 -25.643 26.835 -12.145 1.00 0.00 O ATOM 1033 CB HIS A 217 -27.845 25.065 -12.578 1.00 0.00 C ATOM 1034 CG HIS A 217 -28.902 25.966 -12.016 1.00 0.00 C ATOM 1035 ND1 HIS A 217 -29.990 25.534 -11.298 1.00 0.00 N ATOM 1036 CD2 HIS A 217 -29.042 27.318 -12.089 1.00 0.00 C ATOM 1037 CE1 HIS A 217 -30.722 26.594 -10.972 1.00 0.00 C ATOM 1038 NE2 HIS A 217 -30.195 27.710 -11.435 1.00 0.00 N ATOM 0 H HIS A 217 -27.059 22.850 -10.790 1.00 0.00 H new ATOM 0 HA HIS A 217 -25.889 24.142 -12.011 1.00 0.00 H new ATOM 0 HB2 HIS A 217 -27.424 25.530 -13.470 1.00 0.00 H new ATOM 0 HB3 HIS A 217 -28.311 24.132 -12.895 1.00 0.00 H new ATOM 0 HD1 HIS A 217 -30.200 24.566 -11.056 1.00 0.00 H new ATOM 0 HD2 HIS A 217 -28.354 27.986 -12.585 1.00 0.00 H new ATOM 0 HE1 HIS A 217 -31.636 26.547 -10.398 1.00 0.00 H new ATOM 1046 N SER A 218 -25.546 26.249 -10.007 1.00 0.00 N ATOM 1047 CA SER A 218 -24.783 27.439 -9.626 1.00 0.00 C ATOM 1048 C SER A 218 -23.393 27.460 -10.265 1.00 0.00 C ATOM 1049 O SER A 218 -22.890 28.507 -10.654 1.00 0.00 O ATOM 1050 CB SER A 218 -24.649 27.480 -8.107 1.00 0.00 C ATOM 1051 OG SER A 218 -24.147 26.240 -7.623 1.00 0.00 O ATOM 0 H SER A 218 -25.754 25.616 -9.235 1.00 0.00 H new ATOM 0 HA SER A 218 -25.322 28.315 -9.987 1.00 0.00 H new ATOM 0 HB2 SER A 218 -23.980 28.290 -7.816 1.00 0.00 H new ATOM 0 HB3 SER A 218 -25.619 27.689 -7.655 1.00 0.00 H new ATOM 0 HG SER A 218 -24.064 26.279 -6.647 1.00 0.00 H new ATOM 1057 N LYS A 219 -22.770 26.291 -10.365 1.00 0.00 N ATOM 1058 CA LYS A 219 -21.442 26.172 -10.985 1.00 0.00 C ATOM 1059 C LYS A 219 -21.473 25.415 -12.297 1.00 0.00 C ATOM 1060 O LYS A 219 -20.485 25.422 -13.034 1.00 0.00 O ATOM 1061 CB LYS A 219 -20.469 25.478 -10.022 1.00 0.00 C ATOM 1062 CG LYS A 219 -19.621 26.458 -9.201 1.00 0.00 C ATOM 1063 CD LYS A 219 -18.143 26.484 -9.650 1.00 0.00 C ATOM 1064 CE LYS A 219 -17.953 27.105 -11.046 1.00 0.00 C ATOM 1065 NZ LYS A 219 -16.497 27.156 -11.430 1.00 0.00 N ATOM 0 H LYS A 219 -23.157 25.410 -10.027 1.00 0.00 H new ATOM 0 HA LYS A 219 -21.105 27.186 -11.198 1.00 0.00 H new ATOM 0 HB2 LYS A 219 -21.035 24.841 -9.342 1.00 0.00 H new ATOM 0 HB3 LYS A 219 -19.807 24.827 -10.593 1.00 0.00 H new ATOM 0 HG2 LYS A 219 -20.042 27.460 -9.290 1.00 0.00 H new ATOM 0 HG3 LYS A 219 -19.672 26.183 -8.148 1.00 0.00 H new ATOM 0 HD2 LYS A 219 -17.558 27.048 -8.924 1.00 0.00 H new ATOM 0 HD3 LYS A 219 -17.751 25.467 -9.654 1.00 0.00 H new ATOM 0 HE2 LYS A 219 -18.505 26.523 -11.783 1.00 0.00 H new ATOM 0 HE3 LYS A 219 -18.370 28.112 -11.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 219 -16.402 27.579 -12.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 219 -15.976 27.732 -10.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 219 -16.107 26.192 -11.442 1.00 0.00 H new ATOM 1079 N PHE A 220 -22.586 24.760 -12.583 1.00 0.00 N ATOM 1080 CA PHE A 220 -22.718 23.943 -13.786 1.00 0.00 C ATOM 1081 C PHE A 220 -23.754 24.551 -14.713 1.00 0.00 C ATOM 1082 O PHE A 220 -24.851 24.865 -14.288 1.00 0.00 O ATOM 1083 CB PHE A 220 -23.165 22.523 -13.419 1.00 0.00 C ATOM 1084 CG PHE A 220 -22.263 21.837 -12.428 1.00 0.00 C ATOM 1085 CD1 PHE A 220 -20.948 21.480 -12.781 1.00 0.00 C ATOM 1086 CD2 PHE A 220 -22.727 21.529 -11.133 1.00 0.00 C ATOM 1087 CE1 PHE A 220 -20.099 20.835 -11.852 1.00 0.00 C ATOM 1088 CE2 PHE A 220 -21.887 20.880 -10.196 1.00 0.00 C ATOM 1089 CZ PHE A 220 -20.569 20.540 -10.557 1.00 0.00 C ATOM 0 H PHE A 220 -23.420 24.777 -11.995 1.00 0.00 H new ATOM 0 HA PHE A 220 -21.748 23.906 -14.282 1.00 0.00 H new ATOM 0 HB2 PHE A 220 -24.174 22.565 -13.009 1.00 0.00 H new ATOM 0 HB3 PHE A 220 -23.215 21.922 -14.327 1.00 0.00 H new ATOM 0 HD1 PHE A 220 -20.583 21.701 -13.773 1.00 0.00 H new ATOM 0 HD2 PHE A 220 -23.736 21.791 -10.852 1.00 0.00 H new ATOM 0 HE1 PHE A 220 -19.091 20.569 -12.135 1.00 0.00 H new ATOM 0 HE2 PHE A 220 -22.256 20.647 -9.208 1.00 0.00 H new ATOM 0 HZ PHE A 220 -19.920 20.054 -9.843 1.00 0.00 H new ATOM 1099 N ILE A 221 -23.407 24.698 -15.980 1.00 0.00 N ATOM 1100 CA ILE A 221 -24.325 25.244 -16.972 1.00 0.00 C ATOM 1101 C ILE A 221 -24.525 24.151 -18.023 1.00 0.00 C ATOM 1102 O ILE A 221 -23.771 23.169 -18.062 1.00 0.00 O ATOM 1103 CB ILE A 221 -23.811 26.605 -17.566 1.00 0.00 C ATOM 1104 CG1 ILE A 221 -22.610 26.393 -18.497 1.00 0.00 C ATOM 1105 CG2 ILE A 221 -23.419 27.572 -16.423 1.00 0.00 C ATOM 1106 CD1 ILE A 221 -22.233 27.627 -19.330 1.00 0.00 C ATOM 0 H ILE A 221 -22.491 24.446 -16.350 1.00 0.00 H new ATOM 0 HA ILE A 221 -25.285 25.503 -16.525 1.00 0.00 H new ATOM 0 HB ILE A 221 -24.623 27.039 -18.150 1.00 0.00 H new ATOM 0 HG12 ILE A 221 -21.749 26.096 -17.899 1.00 0.00 H new ATOM 0 HG13 ILE A 221 -22.830 25.566 -19.172 1.00 0.00 H new ATOM 0 HG21 ILE A 221 -23.064 28.512 -16.847 1.00 0.00 H new ATOM 0 HG22 ILE A 221 -24.288 27.763 -15.794 1.00 0.00 H new ATOM 0 HG23 ILE A 221 -22.628 27.123 -15.822 1.00 0.00 H new ATOM 0 HD11 ILE A 221 -21.375 27.392 -19.960 1.00 0.00 H new ATOM 0 HD12 ILE A 221 -23.077 27.914 -19.958 1.00 0.00 H new ATOM 0 HD13 ILE A 221 -21.979 28.452 -18.664 1.00 0.00 H new ATOM 1118 N ARG A 222 -25.546 24.299 -18.855 1.00 0.00 N ATOM 1119 CA ARG A 222 -25.918 23.260 -19.819 1.00 0.00 C ATOM 1120 C ARG A 222 -25.897 23.800 -21.239 1.00 0.00 C ATOM 1121 O ARG A 222 -26.417 24.877 -21.497 1.00 0.00 O ATOM 1122 CB ARG A 222 -27.324 22.771 -19.471 1.00 0.00 C ATOM 1123 CG ARG A 222 -27.821 21.587 -20.292 1.00 0.00 C ATOM 1124 CD ARG A 222 -29.262 21.219 -19.912 1.00 0.00 C ATOM 1125 NE ARG A 222 -30.223 22.289 -20.259 1.00 0.00 N ATOM 1126 CZ ARG A 222 -30.738 23.179 -19.410 1.00 0.00 C ATOM 1127 NH1 ARG A 222 -30.447 23.191 -18.130 1.00 0.00 N ATOM 1128 NH2 ARG A 222 -31.562 24.082 -19.863 1.00 0.00 N ATOM 0 H ARG A 222 -26.137 25.130 -18.886 1.00 0.00 H new ATOM 0 HA ARG A 222 -25.201 22.441 -19.765 1.00 0.00 H new ATOM 0 HB2 ARG A 222 -27.345 22.496 -18.417 1.00 0.00 H new ATOM 0 HB3 ARG A 222 -28.021 23.599 -19.598 1.00 0.00 H new ATOM 0 HG2 ARG A 222 -27.772 21.830 -21.353 1.00 0.00 H new ATOM 0 HG3 ARG A 222 -27.168 20.729 -20.131 1.00 0.00 H new ATOM 0 HD2 ARG A 222 -29.546 20.298 -20.422 1.00 0.00 H new ATOM 0 HD3 ARG A 222 -29.314 21.020 -18.842 1.00 0.00 H new ATOM 0 HE ARG A 222 -30.518 22.351 -21.234 1.00 0.00 H new ATOM 0 HH11 ARG A 222 -29.802 22.500 -17.747 1.00 0.00 H new ATOM 0 HH12 ARG A 222 -30.866 23.892 -17.518 1.00 0.00 H new ATOM 0 HH21 ARG A 222 -31.804 24.100 -20.854 1.00 0.00 H new ATOM 0 HH22 ARG A 222 -31.965 24.770 -19.227 1.00 0.00 H new ATOM 1142 N VAL A 223 -25.309 23.040 -22.148 1.00 0.00 N ATOM 1143 CA VAL A 223 -25.226 23.416 -23.559 1.00 0.00 C ATOM 1144 C VAL A 223 -26.019 22.436 -24.387 1.00 0.00 C ATOM 1145 O VAL A 223 -26.014 21.223 -24.124 1.00 0.00 O ATOM 1146 CB VAL A 223 -23.781 23.375 -24.126 1.00 0.00 C ATOM 1147 CG1 VAL A 223 -23.644 24.286 -25.320 1.00 0.00 C ATOM 1148 CG2 VAL A 223 -22.766 23.731 -23.072 1.00 0.00 C ATOM 0 H VAL A 223 -24.874 22.143 -21.933 1.00 0.00 H new ATOM 0 HA VAL A 223 -25.606 24.436 -23.614 1.00 0.00 H new ATOM 0 HB VAL A 223 -23.585 22.352 -24.448 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -22.623 24.239 -25.698 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -24.335 23.969 -26.101 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -23.875 25.310 -25.025 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -21.765 23.692 -23.503 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -22.963 24.737 -22.702 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -22.834 23.021 -22.247 1.00 0.00 H new ATOM 1158 N GLN A 224 -26.694 22.952 -25.397 1.00 0.00 N ATOM 1159 CA GLN A 224 -27.361 22.095 -26.356 1.00 0.00 C ATOM 1160 C GLN A 224 -26.258 21.318 -27.073 1.00 0.00 C ATOM 1161 O GLN A 224 -25.116 21.756 -27.140 1.00 0.00 O ATOM 1162 CB GLN A 224 -28.171 22.908 -27.368 1.00 0.00 C ATOM 1163 CG GLN A 224 -29.295 23.712 -26.740 1.00 0.00 C ATOM 1164 CD GLN A 224 -30.310 24.170 -27.763 1.00 0.00 C ATOM 1165 OE1 GLN A 224 -31.407 23.647 -27.822 1.00 0.00 O ATOM 1166 NE2 GLN A 224 -29.951 25.138 -28.565 1.00 0.00 N ATOM 0 H GLN A 224 -26.794 23.952 -25.573 1.00 0.00 H new ATOM 0 HA GLN A 224 -28.064 21.433 -25.851 1.00 0.00 H new ATOM 0 HB2 GLN A 224 -27.501 23.587 -27.896 1.00 0.00 H new ATOM 0 HB3 GLN A 224 -28.591 22.231 -28.112 1.00 0.00 H new ATOM 0 HG2 GLN A 224 -29.793 23.107 -25.982 1.00 0.00 H new ATOM 0 HG3 GLN A 224 -28.878 24.581 -26.231 1.00 0.00 H new ATOM 0 HE21 GLN A 224 -29.022 25.550 -28.483 1.00 0.00 H new ATOM 0 HE22 GLN A 224 -30.600 25.481 -29.273 1.00 0.00 H new ATOM 1265 N SER A 232 -27.344 16.276 -23.606 1.00 0.00 N ATOM 1266 CA SER A 232 -26.855 17.645 -23.500 1.00 0.00 C ATOM 1267 C SER A 232 -25.467 17.666 -22.885 1.00 0.00 C ATOM 1268 O SER A 232 -25.084 16.744 -22.150 1.00 0.00 O ATOM 1269 CB SER A 232 -27.789 18.462 -22.608 1.00 0.00 C ATOM 1270 OG SER A 232 -29.134 18.328 -23.037 1.00 0.00 O ATOM 0 HA SER A 232 -26.819 18.072 -24.502 1.00 0.00 H new ATOM 0 HB2 SER A 232 -27.697 18.129 -21.574 1.00 0.00 H new ATOM 0 HB3 SER A 232 -27.497 19.512 -22.632 1.00 0.00 H new ATOM 0 HG SER A 232 -29.285 17.415 -23.361 1.00 0.00 H new ATOM 1276 N TRP A 233 -24.726 18.724 -23.167 1.00 0.00 N ATOM 1277 CA TRP A 233 -23.415 18.920 -22.576 1.00 0.00 C ATOM 1278 C TRP A 233 -23.618 19.576 -21.232 1.00 0.00 C ATOM 1279 O TRP A 233 -24.528 20.392 -21.061 1.00 0.00 O ATOM 1280 CB TRP A 233 -22.599 19.900 -23.399 1.00 0.00 C ATOM 1281 CG TRP A 233 -22.194 19.428 -24.741 1.00 0.00 C ATOM 1282 CD1 TRP A 233 -22.621 19.900 -25.938 1.00 0.00 C ATOM 1283 CD2 TRP A 233 -21.232 18.403 -25.057 1.00 0.00 C ATOM 1284 NE1 TRP A 233 -22.014 19.262 -26.973 1.00 0.00 N ATOM 1285 CE2 TRP A 233 -21.160 18.322 -26.477 1.00 0.00 C ATOM 1286 CE3 TRP A 233 -20.415 17.556 -24.285 1.00 0.00 C ATOM 1287 CZ2 TRP A 233 -20.314 17.410 -27.138 1.00 0.00 C ATOM 1288 CZ3 TRP A 233 -19.553 16.640 -24.945 1.00 0.00 C ATOM 1289 CH2 TRP A 233 -19.519 16.576 -26.370 1.00 0.00 C ATOM 0 H TRP A 233 -25.014 19.465 -23.806 1.00 0.00 H new ATOM 0 HA TRP A 233 -22.906 17.958 -22.516 1.00 0.00 H new ATOM 0 HB2 TRP A 233 -23.176 20.817 -23.515 1.00 0.00 H new ATOM 0 HB3 TRP A 233 -21.701 20.158 -22.838 1.00 0.00 H new ATOM 0 HD1 TRP A 233 -23.353 20.686 -26.055 1.00 0.00 H new ATOM 0 HE1 TRP A 233 -22.172 19.455 -27.962 1.00 0.00 H new ATOM 0 HE3 TRP A 233 -20.443 17.602 -23.206 1.00 0.00 H new ATOM 0 HZ2 TRP A 233 -20.286 17.362 -28.217 1.00 0.00 H new ATOM 0 HZ3 TRP A 233 -18.919 15.987 -24.364 1.00 0.00 H new ATOM 0 HH2 TRP A 233 -18.864 15.868 -26.856 1.00 0.00 H new ATOM 1300 N TRP A 234 -22.751 19.253 -20.296 1.00 0.00 N ATOM 1301 CA TRP A 234 -22.728 19.899 -19.004 1.00 0.00 C ATOM 1302 C TRP A 234 -21.321 20.439 -18.893 1.00 0.00 C ATOM 1303 O TRP A 234 -20.353 19.740 -19.214 1.00 0.00 O ATOM 1304 CB TRP A 234 -23.042 18.896 -17.901 1.00 0.00 C ATOM 1305 CG TRP A 234 -24.398 18.285 -18.085 1.00 0.00 C ATOM 1306 CD1 TRP A 234 -24.699 17.154 -18.770 1.00 0.00 C ATOM 1307 CD2 TRP A 234 -25.659 18.786 -17.601 1.00 0.00 C ATOM 1308 NE1 TRP A 234 -26.037 16.897 -18.755 1.00 0.00 N ATOM 1309 CE2 TRP A 234 -26.668 17.876 -18.038 1.00 0.00 C ATOM 1310 CE3 TRP A 234 -26.042 19.911 -16.842 1.00 0.00 C ATOM 1311 CZ2 TRP A 234 -28.032 18.055 -17.729 1.00 0.00 C ATOM 1312 CZ3 TRP A 234 -27.415 20.093 -16.524 1.00 0.00 C ATOM 1313 CH2 TRP A 234 -28.393 19.154 -16.970 1.00 0.00 C ATOM 0 H TRP A 234 -22.040 18.531 -20.412 1.00 0.00 H new ATOM 0 HA TRP A 234 -23.475 20.687 -18.902 1.00 0.00 H new ATOM 0 HB2 TRP A 234 -22.286 18.111 -17.895 1.00 0.00 H new ATOM 0 HB3 TRP A 234 -22.994 19.392 -16.932 1.00 0.00 H new ATOM 0 HD1 TRP A 234 -23.968 16.533 -19.266 1.00 0.00 H new ATOM 0 HE1 TRP A 234 -26.494 16.104 -19.205 1.00 0.00 H new ATOM 0 HE3 TRP A 234 -25.303 20.624 -16.507 1.00 0.00 H new ATOM 0 HZ2 TRP A 234 -28.776 17.353 -18.076 1.00 0.00 H new ATOM 0 HZ3 TRP A 234 -27.721 20.949 -15.940 1.00 0.00 H new ATOM 0 HH2 TRP A 234 -29.431 19.304 -16.711 1.00 0.00 H new ATOM 1324 N MET A 235 -21.199 21.681 -18.472 1.00 0.00 N ATOM 1325 CA MET A 235 -19.903 22.324 -18.366 1.00 0.00 C ATOM 1326 C MET A 235 -19.936 23.280 -17.204 1.00 0.00 C ATOM 1327 O MET A 235 -20.977 23.474 -16.594 1.00 0.00 O ATOM 1328 CB MET A 235 -19.552 23.064 -19.657 1.00 0.00 C ATOM 1329 CG MET A 235 -20.502 24.154 -20.046 1.00 0.00 C ATOM 1330 SD MET A 235 -19.935 25.048 -21.510 1.00 0.00 S ATOM 1331 CE MET A 235 -18.611 26.071 -20.829 1.00 0.00 C ATOM 0 H MET A 235 -21.985 22.269 -18.196 1.00 0.00 H new ATOM 0 HA MET A 235 -19.135 21.567 -18.203 1.00 0.00 H new ATOM 0 HB2 MET A 235 -18.556 23.493 -19.551 1.00 0.00 H new ATOM 0 HB3 MET A 235 -19.503 22.340 -20.470 1.00 0.00 H new ATOM 0 HG2 MET A 235 -21.486 23.727 -20.240 1.00 0.00 H new ATOM 0 HG3 MET A 235 -20.615 24.851 -19.216 1.00 0.00 H new ATOM 0 HE1 MET A 235 -18.208 26.713 -21.612 1.00 0.00 H new ATOM 0 HE2 MET A 235 -19.006 26.687 -20.021 1.00 0.00 H new ATOM 0 HE3 MET A 235 -17.819 25.430 -20.442 1.00 0.00 H new ATOM 1341 N LEU A 236 -18.801 23.872 -16.887 1.00 0.00 N ATOM 1342 CA LEU A 236 -18.728 24.811 -15.783 1.00 0.00 C ATOM 1343 C LEU A 236 -19.100 26.173 -16.320 1.00 0.00 C ATOM 1344 O LEU A 236 -18.942 26.422 -17.512 1.00 0.00 O ATOM 1345 CB LEU A 236 -17.302 24.861 -15.224 1.00 0.00 C ATOM 1346 CG LEU A 236 -16.711 23.503 -14.823 1.00 0.00 C ATOM 1347 CD1 LEU A 236 -15.252 23.665 -14.422 1.00 0.00 C ATOM 1348 CD2 LEU A 236 -17.505 22.844 -13.700 1.00 0.00 C ATOM 0 H LEU A 236 -17.919 23.721 -17.376 1.00 0.00 H new ATOM 0 HA LEU A 236 -19.403 24.505 -14.983 1.00 0.00 H new ATOM 0 HB2 LEU A 236 -16.652 25.316 -15.971 1.00 0.00 H new ATOM 0 HB3 LEU A 236 -17.293 25.515 -14.352 1.00 0.00 H new ATOM 0 HG LEU A 236 -16.773 22.846 -15.690 1.00 0.00 H new ATOM 0 HD11 LEU A 236 -14.843 22.695 -14.139 1.00 0.00 H new ATOM 0 HD12 LEU A 236 -14.686 24.067 -15.263 1.00 0.00 H new ATOM 0 HD13 LEU A 236 -15.181 24.349 -13.577 1.00 0.00 H new ATOM 0 HD21 LEU A 236 -17.052 21.885 -13.448 1.00 0.00 H new ATOM 0 HD22 LEU A 236 -17.499 23.490 -12.822 1.00 0.00 H new ATOM 0 HD23 LEU A 236 -18.533 22.685 -14.026 1.00 0.00 H new ATOM 1360 N ASN A 237 -19.566 27.062 -15.461 1.00 0.00 N ATOM 1361 CA ASN A 237 -19.790 28.438 -15.887 1.00 0.00 C ATOM 1362 C ASN A 237 -18.381 28.960 -16.253 1.00 0.00 C ATOM 1363 O ASN A 237 -17.438 28.786 -15.467 1.00 0.00 O ATOM 1364 CB ASN A 237 -20.449 29.265 -14.770 1.00 0.00 C ATOM 1365 CG ASN A 237 -20.480 30.739 -15.090 1.00 0.00 C ATOM 1366 OD1 ASN A 237 -19.445 31.336 -15.271 1.00 0.00 O ATOM 1367 ND2 ASN A 237 -21.640 31.318 -15.171 1.00 0.00 N ATOM 0 H ASN A 237 -19.793 26.866 -14.486 1.00 0.00 H new ATOM 0 HA ASN A 237 -20.476 28.512 -16.730 1.00 0.00 H new ATOM 0 HB2 ASN A 237 -21.467 28.909 -14.610 1.00 0.00 H new ATOM 0 HB3 ASN A 237 -19.906 29.109 -13.838 1.00 0.00 H new ATOM 0 HD21 ASN A 237 -21.700 32.311 -15.394 1.00 0.00 H new ATOM 0 HD22 ASN A 237 -22.491 30.779 -15.011 1.00 0.00 H new ATOM 1374 N PRO A 238 -18.216 29.576 -17.445 1.00 0.00 N ATOM 1375 CA PRO A 238 -16.875 29.984 -17.899 1.00 0.00 C ATOM 1376 C PRO A 238 -16.194 31.083 -17.099 1.00 0.00 C ATOM 1377 O PRO A 238 -14.968 31.101 -16.968 1.00 0.00 O ATOM 1378 CB PRO A 238 -17.139 30.494 -19.313 1.00 0.00 C ATOM 1379 CG PRO A 238 -18.563 30.904 -19.319 1.00 0.00 C ATOM 1380 CD PRO A 238 -19.243 29.902 -18.455 1.00 0.00 C ATOM 0 HA PRO A 238 -16.190 29.142 -17.800 1.00 0.00 H new ATOM 0 HB2 PRO A 238 -16.487 31.333 -19.557 1.00 0.00 H new ATOM 0 HB3 PRO A 238 -16.950 29.717 -20.054 1.00 0.00 H new ATOM 0 HG2 PRO A 238 -18.687 31.914 -18.928 1.00 0.00 H new ATOM 0 HG3 PRO A 238 -18.973 30.900 -20.329 1.00 0.00 H new ATOM 0 HD2 PRO A 238 -20.143 30.311 -17.996 1.00 0.00 H new ATOM 0 HD3 PRO A 238 -19.545 29.021 -19.021 1.00 0.00 H new