USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 598 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 185 LYS NZ :NH3+ -157:sc= -0.122 (180deg=-0.257) USER MOD Set 1.2: A 186 GLN : amide:sc=-2.53e-05 X(o=-0.12,f=-0.25) USER MOD Set 2.1: A 159 ASN :FLIP amide:sc= -0.331 F(o=-0.74,f=0.57) USER MOD Set 2.2: A 160 GLN :FLIP amide:sc= 0.901 F(o=-0.4,f=0.57) USER MOD Single : A 134 MET CE :methyl -126:sc= 0 (180deg=-1.95) USER MOD Single : A 135 SER OG : rot 180:sc= 0.104 USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 150:sc= -2.52! USER MOD Single : A 153 ASN :FLIP amide:sc= 0.164 F(o=-1.7,f=0.16) USER MOD Single : A 154 MET CE :methyl -164:sc= -0.114 (180deg=-0.646) USER MOD Single : A 155 HIS :FLIP no HD1:sc= -0.34 F(o=-2.2,f=-0.34) USER MOD Single : A 157 TYR OH : rot 120:sc= -0.143 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 HIS : no HD1:sc=-0.00622 X(o=-0.0062,f=0) USER MOD Single : A 178 ASN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 179 CYS SG : rot 180:sc= 0 USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 111:sc= 0.00981 USER MOD Single : A 187 HIS : no HD1:sc= -0.034 X(o=-0.034,f=0) USER MOD Single : A 188 THR OG1 : rot -69:sc= 1.27 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot -170:sc= -0.48 USER MOD Single : A 192 THR OG1 : rot 96:sc= 1.28 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.064 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl 180:sc= -0.0812 (180deg=-0.0812) USER MOD Single : A 206 MET CE :methyl -174:sc= 0 (180deg=-0.058) USER MOD Single : A 212 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.18) USER MOD Single : A 213 MET CE :methyl 164:sc= -1.41 (180deg=-2.13!) USER MOD Single : A 214 CYS SG : rot -44:sc= 1.07 USER MOD Single : A 216 THR OG1 : rot 60:sc= 0.388 USER MOD Single : A 217 GLN : amide:sc= -0.0257 X(o=-0.026,f=-0.31) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 108 N ALA A 133 13.513 -10.534 -14.386 1.00 0.00 N ATOM 109 CA ALA A 133 14.227 -9.627 -15.275 1.00 0.00 C ATOM 110 C ALA A 133 13.777 -9.808 -16.721 1.00 0.00 C ATOM 111 O ALA A 133 12.794 -10.496 -16.993 1.00 0.00 O ATOM 112 CB ALA A 133 15.729 -9.845 -15.157 1.00 0.00 C ATOM 0 HA ALA A 133 13.994 -8.606 -14.974 1.00 0.00 H new ATOM 0 HB1 ALA A 133 16.250 -9.161 -15.827 1.00 0.00 H new ATOM 0 HB2 ALA A 133 16.044 -9.658 -14.130 1.00 0.00 H new ATOM 0 HB3 ALA A 133 15.970 -10.873 -15.429 1.00 0.00 H new ATOM 118 N MET A 134 14.503 -9.186 -17.644 1.00 0.00 N ATOM 119 CA MET A 134 14.177 -9.280 -19.063 1.00 0.00 C ATOM 120 C MET A 134 15.097 -10.272 -19.767 1.00 0.00 C ATOM 121 O MET A 134 16.240 -10.473 -19.357 1.00 0.00 O ATOM 122 CB MET A 134 14.288 -7.905 -19.725 1.00 0.00 C ATOM 123 CG MET A 134 13.636 -6.790 -18.924 1.00 0.00 C ATOM 124 SD MET A 134 11.875 -7.066 -18.655 1.00 0.00 S ATOM 125 CE MET A 134 11.378 -5.473 -18.003 1.00 0.00 C ATOM 0 H MET A 134 15.320 -8.612 -17.436 1.00 0.00 H new ATOM 0 HA MET A 134 13.151 -9.637 -19.152 1.00 0.00 H new ATOM 0 HB2 MET A 134 15.341 -7.666 -19.874 1.00 0.00 H new ATOM 0 HB3 MET A 134 13.829 -7.948 -20.713 1.00 0.00 H new ATOM 0 HG2 MET A 134 14.137 -6.700 -17.960 1.00 0.00 H new ATOM 0 HG3 MET A 134 13.776 -5.843 -19.446 1.00 0.00 H new ATOM 0 HE1 MET A 134 10.868 -5.613 -17.050 1.00 0.00 H new ATOM 0 HE2 MET A 134 12.260 -4.849 -17.855 1.00 0.00 H new ATOM 0 HE3 MET A 134 10.703 -4.986 -18.707 1.00 0.00 H new ATOM 135 N SER A 135 14.590 -10.891 -20.829 1.00 0.00 N ATOM 136 CA SER A 135 15.365 -11.865 -21.588 1.00 0.00 C ATOM 137 C SER A 135 16.263 -11.171 -22.607 1.00 0.00 C ATOM 138 O SER A 135 15.946 -10.085 -23.092 1.00 0.00 O ATOM 139 CB SER A 135 14.432 -12.848 -22.299 1.00 0.00 C ATOM 140 OG SER A 135 13.114 -12.333 -22.378 1.00 0.00 O ATOM 0 H SER A 135 13.646 -10.735 -21.183 1.00 0.00 H new ATOM 0 HA SER A 135 15.996 -12.414 -20.889 1.00 0.00 H new ATOM 0 HB2 SER A 135 14.808 -13.050 -23.302 1.00 0.00 H new ATOM 0 HB3 SER A 135 14.423 -13.798 -21.764 1.00 0.00 H new ATOM 0 HG SER A 135 12.538 -12.979 -22.838 1.00 0.00 H new ATOM 146 N ARG A 136 17.386 -11.806 -22.926 1.00 0.00 N ATOM 147 CA ARG A 136 18.332 -11.250 -23.886 1.00 0.00 C ATOM 148 C ARG A 136 18.741 -9.834 -23.489 1.00 0.00 C ATOM 149 O ARG A 136 18.359 -8.850 -24.123 1.00 0.00 O ATOM 150 CB ARG A 136 17.721 -11.241 -25.289 1.00 0.00 C ATOM 151 CG ARG A 136 17.910 -12.546 -26.044 1.00 0.00 C ATOM 152 CD ARG A 136 17.475 -12.419 -27.495 1.00 0.00 C ATOM 153 NE ARG A 136 18.609 -12.195 -28.389 1.00 0.00 N ATOM 154 CZ ARG A 136 19.466 -13.147 -28.741 1.00 0.00 C ATOM 155 NH1 ARG A 136 19.318 -14.381 -28.279 1.00 0.00 N ATOM 156 NH2 ARG A 136 20.472 -12.866 -29.559 1.00 0.00 N ATOM 0 H ARG A 136 17.663 -12.706 -22.534 1.00 0.00 H new ATOM 0 HA ARG A 136 19.222 -11.880 -23.888 1.00 0.00 H new ATOM 0 HB2 ARG A 136 16.655 -11.028 -25.210 1.00 0.00 H new ATOM 0 HB3 ARG A 136 18.167 -10.430 -25.865 1.00 0.00 H new ATOM 0 HG2 ARG A 136 18.958 -12.843 -26.002 1.00 0.00 H new ATOM 0 HG3 ARG A 136 17.335 -13.335 -25.559 1.00 0.00 H new ATOM 0 HD2 ARG A 136 16.949 -13.325 -27.796 1.00 0.00 H new ATOM 0 HD3 ARG A 136 16.769 -11.594 -27.591 1.00 0.00 H new ATOM 0 HE ARG A 136 18.750 -11.257 -28.763 1.00 0.00 H new ATOM 0 HH11 ARG A 136 18.545 -14.601 -27.652 1.00 0.00 H new ATOM 0 HH12 ARG A 136 19.978 -15.110 -28.551 1.00 0.00 H new ATOM 0 HH21 ARG A 136 20.588 -11.918 -29.918 1.00 0.00 H new ATOM 0 HH22 ARG A 136 21.130 -13.598 -29.829 1.00 0.00 H new ATOM 170 N PRO A 137 19.535 -9.728 -22.413 1.00 0.00 N ATOM 171 CA PRO A 137 20.013 -8.438 -21.907 1.00 0.00 C ATOM 172 C PRO A 137 21.027 -7.788 -22.842 1.00 0.00 C ATOM 173 O PRO A 137 21.295 -6.589 -22.746 1.00 0.00 O ATOM 174 CB PRO A 137 20.672 -8.802 -20.574 1.00 0.00 C ATOM 175 CG PRO A 137 21.070 -10.229 -20.726 1.00 0.00 C ATOM 176 CD PRO A 137 20.028 -10.858 -21.609 1.00 0.00 C ATOM 0 HA PRO A 137 19.205 -7.712 -21.815 1.00 0.00 H new ATOM 0 HB2 PRO A 137 21.536 -8.169 -20.374 1.00 0.00 H new ATOM 0 HB3 PRO A 137 19.981 -8.670 -19.742 1.00 0.00 H new ATOM 0 HG2 PRO A 137 22.061 -10.312 -21.172 1.00 0.00 H new ATOM 0 HG3 PRO A 137 21.113 -10.727 -19.758 1.00 0.00 H new ATOM 0 HD2 PRO A 137 20.453 -11.642 -22.236 1.00 0.00 H new ATOM 0 HD3 PRO A 137 19.229 -11.315 -21.025 1.00 0.00 H new ATOM 184 N ILE A 138 21.587 -8.584 -23.746 1.00 0.00 N ATOM 185 CA ILE A 138 22.571 -8.085 -24.699 1.00 0.00 C ATOM 186 C ILE A 138 21.930 -7.128 -25.698 1.00 0.00 C ATOM 187 O ILE A 138 21.238 -7.553 -26.624 1.00 0.00 O ATOM 188 CB ILE A 138 23.245 -9.237 -25.468 1.00 0.00 C ATOM 189 CG1 ILE A 138 23.927 -10.199 -24.493 1.00 0.00 C ATOM 190 CG2 ILE A 138 24.250 -8.688 -26.469 1.00 0.00 C ATOM 191 CD1 ILE A 138 23.061 -11.376 -24.101 1.00 0.00 C ATOM 0 H ILE A 138 21.376 -9.578 -23.839 1.00 0.00 H new ATOM 0 HA ILE A 138 23.328 -7.553 -24.123 1.00 0.00 H new ATOM 0 HB ILE A 138 22.479 -9.787 -26.016 1.00 0.00 H new ATOM 0 HG12 ILE A 138 24.847 -10.570 -24.945 1.00 0.00 H new ATOM 0 HG13 ILE A 138 24.211 -9.652 -23.594 1.00 0.00 H new ATOM 0 HG21 ILE A 138 24.718 -9.514 -27.005 1.00 0.00 H new ATOM 0 HG22 ILE A 138 23.738 -8.038 -27.179 1.00 0.00 H new ATOM 0 HG23 ILE A 138 25.015 -8.118 -25.941 1.00 0.00 H new ATOM 0 HD11 ILE A 138 23.608 -12.016 -23.409 1.00 0.00 H new ATOM 0 HD12 ILE A 138 22.152 -11.015 -23.620 1.00 0.00 H new ATOM 0 HD13 ILE A 138 22.798 -11.947 -24.992 1.00 0.00 H new ATOM 203 N ILE A 139 22.168 -5.835 -25.507 1.00 0.00 N ATOM 204 CA ILE A 139 21.617 -4.817 -26.393 1.00 0.00 C ATOM 205 C ILE A 139 22.480 -4.648 -27.639 1.00 0.00 C ATOM 206 O ILE A 139 23.691 -4.867 -27.603 1.00 0.00 O ATOM 207 CB ILE A 139 21.492 -3.458 -25.681 1.00 0.00 C ATOM 208 CG1 ILE A 139 20.701 -2.475 -26.546 1.00 0.00 C ATOM 209 CG2 ILE A 139 22.870 -2.899 -25.359 1.00 0.00 C ATOM 210 CD1 ILE A 139 20.401 -1.165 -25.852 1.00 0.00 C ATOM 0 H ILE A 139 22.739 -5.467 -24.746 1.00 0.00 H new ATOM 0 HA ILE A 139 20.623 -5.157 -26.685 1.00 0.00 H new ATOM 0 HB ILE A 139 20.953 -3.604 -24.745 1.00 0.00 H new ATOM 0 HG12 ILE A 139 21.262 -2.273 -27.458 1.00 0.00 H new ATOM 0 HG13 ILE A 139 19.762 -2.941 -26.846 1.00 0.00 H new ATOM 0 HG21 ILE A 139 22.764 -1.938 -24.856 1.00 0.00 H new ATOM 0 HG22 ILE A 139 23.401 -3.593 -24.708 1.00 0.00 H new ATOM 0 HG23 ILE A 139 23.433 -2.765 -26.283 1.00 0.00 H new ATOM 0 HD11 ILE A 139 19.838 -0.518 -26.524 1.00 0.00 H new ATOM 0 HD12 ILE A 139 19.813 -1.355 -24.954 1.00 0.00 H new ATOM 0 HD13 ILE A 139 21.336 -0.677 -25.576 1.00 0.00 H new ATOM 222 N HIS A 140 21.849 -4.255 -28.741 1.00 0.00 N ATOM 223 CA HIS A 140 22.559 -4.054 -29.999 1.00 0.00 C ATOM 224 C HIS A 140 23.762 -3.136 -29.802 1.00 0.00 C ATOM 225 O HIS A 140 23.609 -1.933 -29.586 1.00 0.00 O ATOM 226 CB HIS A 140 21.619 -3.464 -31.051 1.00 0.00 C ATOM 227 CG HIS A 140 20.771 -4.490 -31.738 1.00 0.00 C ATOM 228 ND1 HIS A 140 20.498 -4.458 -33.089 1.00 0.00 N ATOM 229 CD2 HIS A 140 20.136 -5.582 -31.253 1.00 0.00 C ATOM 230 CE1 HIS A 140 19.729 -5.485 -33.405 1.00 0.00 C ATOM 231 NE2 HIS A 140 19.496 -6.183 -32.309 1.00 0.00 N ATOM 0 H HIS A 140 20.847 -4.069 -28.788 1.00 0.00 H new ATOM 0 HA HIS A 140 22.916 -5.024 -30.346 1.00 0.00 H new ATOM 0 HB2 HIS A 140 20.971 -2.728 -30.575 1.00 0.00 H new ATOM 0 HB3 HIS A 140 22.210 -2.933 -31.798 1.00 0.00 H new ATOM 0 HD2 HIS A 140 20.133 -5.918 -30.227 1.00 0.00 H new ATOM 0 HE1 HIS A 140 19.355 -5.714 -34.392 1.00 0.00 H new ATOM 0 HE2 HIS A 140 18.932 -7.031 -32.255 1.00 0.00 H new ATOM 239 N PHE A 141 24.957 -3.711 -29.878 1.00 0.00 N ATOM 240 CA PHE A 141 26.186 -2.944 -29.707 1.00 0.00 C ATOM 241 C PHE A 141 26.219 -1.750 -30.656 1.00 0.00 C ATOM 242 O PHE A 141 26.118 -0.601 -30.228 1.00 0.00 O ATOM 243 CB PHE A 141 27.406 -3.836 -29.949 1.00 0.00 C ATOM 244 CG PHE A 141 27.369 -5.125 -29.179 1.00 0.00 C ATOM 245 CD1 PHE A 141 27.375 -5.120 -27.793 1.00 0.00 C ATOM 246 CD2 PHE A 141 27.327 -6.341 -29.840 1.00 0.00 C ATOM 247 CE1 PHE A 141 27.341 -6.305 -27.082 1.00 0.00 C ATOM 248 CE2 PHE A 141 27.293 -7.530 -29.135 1.00 0.00 C ATOM 249 CZ PHE A 141 27.299 -7.511 -27.754 1.00 0.00 C ATOM 0 H PHE A 141 25.101 -4.705 -30.057 1.00 0.00 H new ATOM 0 HA PHE A 141 26.213 -2.572 -28.683 1.00 0.00 H new ATOM 0 HB2 PHE A 141 27.477 -4.060 -31.013 1.00 0.00 H new ATOM 0 HB3 PHE A 141 28.307 -3.286 -29.678 1.00 0.00 H new ATOM 0 HD1 PHE A 141 27.407 -4.180 -27.263 1.00 0.00 H new ATOM 0 HD2 PHE A 141 27.321 -6.361 -30.920 1.00 0.00 H new ATOM 0 HE1 PHE A 141 27.347 -6.288 -26.002 1.00 0.00 H new ATOM 0 HE2 PHE A 141 27.262 -8.472 -29.663 1.00 0.00 H new ATOM 0 HZ PHE A 141 27.271 -8.438 -27.200 1.00 0.00 H new ATOM 259 N GLY A 142 26.362 -2.031 -31.947 1.00 0.00 N ATOM 260 CA GLY A 142 26.406 -0.971 -32.937 1.00 0.00 C ATOM 261 C GLY A 142 27.823 -0.535 -33.256 1.00 0.00 C ATOM 262 O GLY A 142 28.073 0.070 -34.299 1.00 0.00 O ATOM 0 H GLY A 142 26.448 -2.974 -32.325 1.00 0.00 H new ATOM 0 HA2 GLY A 142 25.919 -1.311 -33.851 1.00 0.00 H new ATOM 0 HA3 GLY A 142 25.839 -0.114 -32.573 1.00 0.00 H new ATOM 266 N SER A 143 28.752 -0.841 -32.356 1.00 0.00 N ATOM 267 CA SER A 143 30.150 -0.472 -32.545 1.00 0.00 C ATOM 268 C SER A 143 31.073 -1.476 -31.862 1.00 0.00 C ATOM 269 O SER A 143 30.990 -1.691 -30.653 1.00 0.00 O ATOM 270 CB SER A 143 30.407 0.932 -31.993 1.00 0.00 C ATOM 271 OG SER A 143 30.693 1.846 -33.038 1.00 0.00 O ATOM 0 H SER A 143 28.562 -1.343 -31.489 1.00 0.00 H new ATOM 0 HA SER A 143 30.362 -0.479 -33.614 1.00 0.00 H new ATOM 0 HB2 SER A 143 29.534 1.273 -31.436 1.00 0.00 H new ATOM 0 HB3 SER A 143 31.241 0.904 -31.292 1.00 0.00 H new ATOM 0 HG SER A 143 30.852 2.736 -32.660 1.00 0.00 H new ATOM 277 N ASP A 144 31.954 -2.088 -32.647 1.00 0.00 N ATOM 278 CA ASP A 144 32.895 -3.070 -32.120 1.00 0.00 C ATOM 279 C ASP A 144 33.815 -2.436 -31.081 1.00 0.00 C ATOM 280 O ASP A 144 34.327 -3.118 -30.193 1.00 0.00 O ATOM 281 CB ASP A 144 33.724 -3.673 -33.254 1.00 0.00 C ATOM 282 CG ASP A 144 33.111 -4.945 -33.806 1.00 0.00 C ATOM 283 OD1 ASP A 144 33.398 -6.029 -33.256 1.00 0.00 O ATOM 284 OD2 ASP A 144 32.344 -4.857 -34.787 1.00 0.00 O ATOM 0 H ASP A 144 32.036 -1.921 -33.650 1.00 0.00 H new ATOM 0 HA ASP A 144 32.324 -3.863 -31.638 1.00 0.00 H new ATOM 0 HB2 ASP A 144 33.822 -2.942 -34.057 1.00 0.00 H new ATOM 0 HB3 ASP A 144 34.730 -3.885 -32.892 1.00 0.00 H new ATOM 289 N TYR A 145 34.022 -1.130 -31.200 1.00 0.00 N ATOM 290 CA TYR A 145 34.884 -0.405 -30.274 1.00 0.00 C ATOM 291 C TYR A 145 34.221 -0.268 -28.906 1.00 0.00 C ATOM 292 O TYR A 145 34.815 -0.603 -27.882 1.00 0.00 O ATOM 293 CB TYR A 145 35.217 0.980 -30.832 1.00 0.00 C ATOM 294 CG TYR A 145 35.684 0.957 -32.270 1.00 0.00 C ATOM 295 CD1 TYR A 145 36.976 0.562 -32.596 1.00 0.00 C ATOM 296 CD2 TYR A 145 34.832 1.329 -33.303 1.00 0.00 C ATOM 297 CE1 TYR A 145 37.406 0.540 -33.908 1.00 0.00 C ATOM 298 CE2 TYR A 145 35.254 1.309 -34.618 1.00 0.00 C ATOM 299 CZ TYR A 145 36.542 0.914 -34.916 1.00 0.00 C ATOM 300 OH TYR A 145 36.966 0.893 -36.224 1.00 0.00 O ATOM 0 H TYR A 145 33.605 -0.551 -31.929 1.00 0.00 H new ATOM 0 HA TYR A 145 35.806 -0.973 -30.156 1.00 0.00 H new ATOM 0 HB2 TYR A 145 34.334 1.615 -30.755 1.00 0.00 H new ATOM 0 HB3 TYR A 145 35.992 1.435 -30.214 1.00 0.00 H new ATOM 0 HD1 TYR A 145 37.655 0.267 -31.810 1.00 0.00 H new ATOM 0 HD2 TYR A 145 33.823 1.639 -33.074 1.00 0.00 H new ATOM 0 HE1 TYR A 145 38.414 0.231 -34.144 1.00 0.00 H new ATOM 0 HE2 TYR A 145 34.579 1.601 -35.409 1.00 0.00 H new ATOM 0 HH TYR A 145 36.236 1.184 -36.809 1.00 0.00 H new ATOM 310 N GLU A 146 32.987 0.225 -28.901 1.00 0.00 N ATOM 311 CA GLU A 146 32.243 0.406 -27.660 1.00 0.00 C ATOM 312 C GLU A 146 31.835 -0.940 -27.068 1.00 0.00 C ATOM 313 O GLU A 146 31.715 -1.085 -25.852 1.00 0.00 O ATOM 314 CB GLU A 146 31.001 1.265 -27.904 1.00 0.00 C ATOM 315 CG GLU A 146 31.313 2.637 -28.478 1.00 0.00 C ATOM 316 CD GLU A 146 30.239 3.660 -28.160 1.00 0.00 C ATOM 317 OE1 GLU A 146 29.097 3.248 -27.867 1.00 0.00 O ATOM 318 OE2 GLU A 146 30.540 4.871 -28.206 1.00 0.00 O ATOM 0 H GLU A 146 32.482 0.506 -29.741 1.00 0.00 H new ATOM 0 HA GLU A 146 32.894 0.914 -26.948 1.00 0.00 H new ATOM 0 HB2 GLU A 146 30.334 0.738 -28.586 1.00 0.00 H new ATOM 0 HB3 GLU A 146 30.464 1.387 -26.964 1.00 0.00 H new ATOM 0 HG2 GLU A 146 32.268 2.983 -28.083 1.00 0.00 H new ATOM 0 HG3 GLU A 146 31.425 2.558 -29.559 1.00 0.00 H new ATOM 325 N ASP A 147 31.624 -1.922 -27.938 1.00 0.00 N ATOM 326 CA ASP A 147 31.231 -3.257 -27.504 1.00 0.00 C ATOM 327 C ASP A 147 32.214 -3.806 -26.475 1.00 0.00 C ATOM 328 O ASP A 147 31.833 -4.553 -25.574 1.00 0.00 O ATOM 329 CB ASP A 147 31.147 -4.203 -28.703 1.00 0.00 C ATOM 330 CG ASP A 147 30.729 -5.605 -28.306 1.00 0.00 C ATOM 331 OD1 ASP A 147 30.196 -5.772 -27.188 1.00 0.00 O ATOM 332 OD2 ASP A 147 30.934 -6.536 -29.113 1.00 0.00 O ATOM 0 H ASP A 147 31.719 -1.818 -28.948 1.00 0.00 H new ATOM 0 HA ASP A 147 30.248 -3.185 -27.038 1.00 0.00 H new ATOM 0 HB2 ASP A 147 30.435 -3.806 -29.426 1.00 0.00 H new ATOM 0 HB3 ASP A 147 32.117 -4.243 -29.199 1.00 0.00 H new ATOM 337 N ARG A 148 33.481 -3.431 -26.616 1.00 0.00 N ATOM 338 CA ARG A 148 34.520 -3.887 -25.701 1.00 0.00 C ATOM 339 C ARG A 148 34.244 -3.403 -24.280 1.00 0.00 C ATOM 340 O ARG A 148 34.285 -4.183 -23.328 1.00 0.00 O ATOM 341 CB ARG A 148 35.891 -3.390 -26.163 1.00 0.00 C ATOM 342 CG ARG A 148 36.344 -3.991 -27.483 1.00 0.00 C ATOM 343 CD ARG A 148 37.132 -2.988 -28.311 1.00 0.00 C ATOM 344 NE ARG A 148 38.497 -2.824 -27.817 1.00 0.00 N ATOM 345 CZ ARG A 148 39.433 -2.135 -28.459 1.00 0.00 C ATOM 346 NH1 ARG A 148 39.153 -1.548 -29.615 1.00 0.00 N ATOM 347 NH2 ARG A 148 40.652 -2.031 -27.946 1.00 0.00 N ATOM 0 H ARG A 148 33.813 -2.812 -27.356 1.00 0.00 H new ATOM 0 HA ARG A 148 34.517 -4.977 -25.702 1.00 0.00 H new ATOM 0 HB2 ARG A 148 35.861 -2.305 -26.259 1.00 0.00 H new ATOM 0 HB3 ARG A 148 36.630 -3.622 -25.396 1.00 0.00 H new ATOM 0 HG2 ARG A 148 36.960 -4.870 -27.292 1.00 0.00 H new ATOM 0 HG3 ARG A 148 35.475 -4.328 -28.048 1.00 0.00 H new ATOM 0 HD2 ARG A 148 37.159 -3.317 -29.350 1.00 0.00 H new ATOM 0 HD3 ARG A 148 36.622 -2.025 -28.295 1.00 0.00 H new ATOM 0 HE ARG A 148 38.745 -3.263 -26.930 1.00 0.00 H new ATOM 0 HH11 ARG A 148 38.217 -1.625 -30.013 1.00 0.00 H new ATOM 0 HH12 ARG A 148 39.874 -1.019 -30.106 1.00 0.00 H new ATOM 0 HH21 ARG A 148 40.871 -2.481 -27.057 1.00 0.00 H new ATOM 0 HH22 ARG A 148 41.370 -1.501 -28.440 1.00 0.00 H new ATOM 361 N TYR A 149 33.963 -2.112 -24.145 1.00 0.00 N ATOM 362 CA TYR A 149 33.682 -1.523 -22.841 1.00 0.00 C ATOM 363 C TYR A 149 32.293 -1.920 -22.351 1.00 0.00 C ATOM 364 O TYR A 149 32.050 -2.013 -21.148 1.00 0.00 O ATOM 365 CB TYR A 149 33.795 0.001 -22.911 1.00 0.00 C ATOM 366 CG TYR A 149 34.292 0.631 -21.630 1.00 0.00 C ATOM 367 CD1 TYR A 149 35.550 0.325 -21.125 1.00 0.00 C ATOM 368 CD2 TYR A 149 33.504 1.532 -20.924 1.00 0.00 C ATOM 369 CE1 TYR A 149 36.008 0.898 -19.954 1.00 0.00 C ATOM 370 CE2 TYR A 149 33.955 2.111 -19.754 1.00 0.00 C ATOM 371 CZ TYR A 149 35.207 1.790 -19.273 1.00 0.00 C ATOM 372 OH TYR A 149 35.659 2.364 -18.106 1.00 0.00 O ATOM 0 H TYR A 149 33.924 -1.453 -24.923 1.00 0.00 H new ATOM 0 HA TYR A 149 34.419 -1.903 -22.133 1.00 0.00 H new ATOM 0 HB2 TYR A 149 34.470 0.270 -23.724 1.00 0.00 H new ATOM 0 HB3 TYR A 149 32.818 0.418 -23.156 1.00 0.00 H new ATOM 0 HD1 TYR A 149 36.180 -0.372 -21.657 1.00 0.00 H new ATOM 0 HD2 TYR A 149 32.522 1.784 -21.297 1.00 0.00 H new ATOM 0 HE1 TYR A 149 36.988 0.649 -19.574 1.00 0.00 H new ATOM 0 HE2 TYR A 149 33.331 2.811 -19.219 1.00 0.00 H new ATOM 0 HH TYR A 149 34.974 2.969 -17.753 1.00 0.00 H new ATOM 382 N TYR A 150 31.386 -2.153 -23.293 1.00 0.00 N ATOM 383 CA TYR A 150 30.020 -2.538 -22.959 1.00 0.00 C ATOM 384 C TYR A 150 29.984 -3.925 -22.324 1.00 0.00 C ATOM 385 O TYR A 150 29.260 -4.159 -21.357 1.00 0.00 O ATOM 386 CB TYR A 150 29.141 -2.515 -24.211 1.00 0.00 C ATOM 387 CG TYR A 150 27.766 -3.106 -23.996 1.00 0.00 C ATOM 388 CD1 TYR A 150 27.542 -4.469 -24.151 1.00 0.00 C ATOM 389 CD2 TYR A 150 26.691 -2.302 -23.637 1.00 0.00 C ATOM 390 CE1 TYR A 150 26.287 -5.013 -23.957 1.00 0.00 C ATOM 391 CE2 TYR A 150 25.433 -2.838 -23.439 1.00 0.00 C ATOM 392 CZ TYR A 150 25.236 -4.194 -23.601 1.00 0.00 C ATOM 393 OH TYR A 150 23.985 -4.732 -23.405 1.00 0.00 O ATOM 0 H TYR A 150 31.572 -2.082 -24.293 1.00 0.00 H new ATOM 0 HA TYR A 150 29.633 -1.818 -22.238 1.00 0.00 H new ATOM 0 HB2 TYR A 150 29.035 -1.485 -24.552 1.00 0.00 H new ATOM 0 HB3 TYR A 150 29.643 -3.064 -25.007 1.00 0.00 H new ATOM 0 HD1 TYR A 150 28.363 -5.114 -24.428 1.00 0.00 H new ATOM 0 HD2 TYR A 150 26.841 -1.240 -23.511 1.00 0.00 H new ATOM 0 HE1 TYR A 150 26.130 -6.074 -24.083 1.00 0.00 H new ATOM 0 HE2 TYR A 150 24.608 -2.199 -23.159 1.00 0.00 H new ATOM 0 HH TYR A 150 23.501 -4.201 -22.739 1.00 0.00 H new ATOM 403 N ARG A 151 30.773 -4.841 -22.876 1.00 0.00 N ATOM 404 CA ARG A 151 30.832 -6.206 -22.366 1.00 0.00 C ATOM 405 C ARG A 151 31.546 -6.251 -21.018 1.00 0.00 C ATOM 406 O ARG A 151 31.285 -7.129 -20.196 1.00 0.00 O ATOM 407 CB ARG A 151 31.549 -7.116 -23.365 1.00 0.00 C ATOM 408 CG ARG A 151 31.230 -8.591 -23.182 1.00 0.00 C ATOM 409 CD ARG A 151 30.186 -9.064 -24.181 1.00 0.00 C ATOM 410 NE ARG A 151 30.665 -8.971 -25.558 1.00 0.00 N ATOM 411 CZ ARG A 151 30.051 -9.540 -26.589 1.00 0.00 C ATOM 412 NH1 ARG A 151 28.939 -10.238 -26.401 1.00 0.00 N ATOM 413 NH2 ARG A 151 30.548 -9.410 -27.813 1.00 0.00 N ATOM 0 H ARG A 151 31.380 -4.663 -23.676 1.00 0.00 H new ATOM 0 HA ARG A 151 29.811 -6.561 -22.230 1.00 0.00 H new ATOM 0 HB2 ARG A 151 31.276 -6.817 -24.377 1.00 0.00 H new ATOM 0 HB3 ARG A 151 32.625 -6.971 -23.269 1.00 0.00 H new ATOM 0 HG2 ARG A 151 32.140 -9.179 -23.300 1.00 0.00 H new ATOM 0 HG3 ARG A 151 30.869 -8.763 -22.168 1.00 0.00 H new ATOM 0 HD2 ARG A 151 29.915 -10.096 -23.960 1.00 0.00 H new ATOM 0 HD3 ARG A 151 29.281 -8.466 -24.071 1.00 0.00 H new ATOM 0 HE ARG A 151 31.517 -8.440 -25.737 1.00 0.00 H new ATOM 0 HH11 ARG A 151 28.553 -10.339 -25.462 1.00 0.00 H new ATOM 0 HH12 ARG A 151 28.470 -10.674 -27.195 1.00 0.00 H new ATOM 0 HH21 ARG A 151 31.402 -8.873 -27.962 1.00 0.00 H new ATOM 0 HH22 ARG A 151 30.076 -9.847 -28.604 1.00 0.00 H new ATOM 427 N GLU A 152 32.448 -5.299 -20.799 1.00 0.00 N ATOM 428 CA GLU A 152 33.200 -5.232 -19.552 1.00 0.00 C ATOM 429 C GLU A 152 32.442 -4.426 -18.502 1.00 0.00 C ATOM 430 O GLU A 152 32.690 -4.558 -17.304 1.00 0.00 O ATOM 431 CB GLU A 152 34.577 -4.609 -19.793 1.00 0.00 C ATOM 432 CG GLU A 152 35.507 -5.487 -20.613 1.00 0.00 C ATOM 433 CD GLU A 152 36.910 -5.547 -20.038 1.00 0.00 C ATOM 434 OE1 GLU A 152 37.058 -5.988 -18.880 1.00 0.00 O ATOM 435 OE2 GLU A 152 37.858 -5.152 -20.748 1.00 0.00 O ATOM 0 H GLU A 152 32.675 -4.564 -21.469 1.00 0.00 H new ATOM 0 HA GLU A 152 33.329 -6.249 -19.181 1.00 0.00 H new ATOM 0 HB2 GLU A 152 34.450 -3.654 -20.302 1.00 0.00 H new ATOM 0 HB3 GLU A 152 35.044 -4.398 -18.831 1.00 0.00 H new ATOM 0 HG2 GLU A 152 35.096 -6.495 -20.666 1.00 0.00 H new ATOM 0 HG3 GLU A 152 35.553 -5.108 -21.634 1.00 0.00 H new ATOM 442 N ASN A 153 31.516 -3.590 -18.961 1.00 0.00 N ATOM 443 CA ASN A 153 30.722 -2.760 -18.062 1.00 0.00 C ATOM 444 C ASN A 153 29.368 -3.406 -17.781 1.00 0.00 C ATOM 445 O ASN A 153 28.688 -3.050 -16.819 1.00 0.00 O ATOM 446 CB ASN A 153 30.521 -1.368 -18.663 1.00 0.00 C ATOM 447 CG ASN A 153 31.732 -0.476 -18.474 1.00 0.00 C ATOM 448 OD1 ASN A 153 32.915 -1.021 -18.733 1.00 0.00 O flip ATOM 449 ND2 ASN A 153 31.606 0.690 -18.098 1.00 0.00 N flip ATOM 0 H ASN A 153 31.297 -3.469 -19.950 1.00 0.00 H new ATOM 0 HA ASN A 153 31.263 -2.666 -17.120 1.00 0.00 H new ATOM 0 HB2 ASN A 153 30.305 -1.463 -19.727 1.00 0.00 H new ATOM 0 HB3 ASN A 153 29.652 -0.898 -18.202 1.00 0.00 H new ATOM 0 HD21 ASN A 153 30.677 1.068 -17.910 1.00 0.00 H new ATOM 0 HD22 ASN A 153 32.430 1.278 -17.974 1.00 0.00 H new ATOM 456 N MET A 154 28.984 -4.356 -18.628 1.00 0.00 N ATOM 457 CA MET A 154 27.712 -5.052 -18.469 1.00 0.00 C ATOM 458 C MET A 154 27.581 -5.630 -17.064 1.00 0.00 C ATOM 459 O MET A 154 26.475 -5.770 -16.541 1.00 0.00 O ATOM 460 CB MET A 154 27.585 -6.168 -19.507 1.00 0.00 C ATOM 461 CG MET A 154 28.410 -7.402 -19.177 1.00 0.00 C ATOM 462 SD MET A 154 28.554 -8.535 -20.572 1.00 0.00 S ATOM 463 CE MET A 154 26.870 -8.537 -21.181 1.00 0.00 C ATOM 0 H MET A 154 29.535 -4.661 -19.430 1.00 0.00 H new ATOM 0 HA MET A 154 26.909 -4.331 -18.622 1.00 0.00 H new ATOM 0 HB2 MET A 154 26.537 -6.454 -19.594 1.00 0.00 H new ATOM 0 HB3 MET A 154 27.893 -5.785 -20.480 1.00 0.00 H new ATOM 0 HG2 MET A 154 29.406 -7.094 -18.860 1.00 0.00 H new ATOM 0 HG3 MET A 154 27.955 -7.924 -18.335 1.00 0.00 H new ATOM 0 HE1 MET A 154 26.725 -9.387 -21.848 1.00 0.00 H new ATOM 0 HE2 MET A 154 26.179 -8.613 -20.341 1.00 0.00 H new ATOM 0 HE3 MET A 154 26.679 -7.612 -21.725 1.00 0.00 H new ATOM 473 N HIS A 155 28.715 -5.965 -16.458 1.00 0.00 N ATOM 474 CA HIS A 155 28.726 -6.528 -15.112 1.00 0.00 C ATOM 475 C HIS A 155 28.089 -5.564 -14.115 1.00 0.00 C ATOM 476 O HIS A 155 27.566 -5.982 -13.082 1.00 0.00 O ATOM 477 CB HIS A 155 30.158 -6.851 -14.683 1.00 0.00 C ATOM 478 CG HIS A 155 30.941 -5.649 -14.256 1.00 0.00 C ATOM 479 ND1 HIS A 155 31.144 -4.460 -14.870 1.00 0.00 N flip ATOM 480 CD2 HIS A 155 31.630 -5.585 -13.063 1.00 0.00 C flip ATOM 481 CE1 HIS A 155 31.943 -3.706 -14.045 1.00 0.00 C flip ATOM 482 NE2 HIS A 155 32.222 -4.408 -12.961 1.00 0.00 N flip ATOM 0 H HIS A 155 29.639 -5.857 -16.877 1.00 0.00 H new ATOM 0 HA HIS A 155 28.142 -7.448 -15.125 1.00 0.00 H new ATOM 0 HB2 HIS A 155 30.130 -7.566 -13.861 1.00 0.00 H new ATOM 0 HB3 HIS A 155 30.676 -7.336 -15.510 1.00 0.00 H new ATOM 0 HD2 HIS A 155 31.678 -6.374 -12.327 1.00 0.00 H new ATOM 0 HE1 HIS A 155 32.287 -2.703 -14.249 1.00 0.00 H new ATOM 0 HE2 HIS A 155 32.797 -4.095 -12.179 1.00 0.00 H new ATOM 490 N ARG A 156 28.139 -4.275 -14.432 1.00 0.00 N ATOM 491 CA ARG A 156 27.569 -3.252 -13.562 1.00 0.00 C ATOM 492 C ARG A 156 26.371 -2.580 -14.227 1.00 0.00 C ATOM 493 O ARG A 156 25.902 -1.535 -13.774 1.00 0.00 O ATOM 494 CB ARG A 156 28.626 -2.203 -13.212 1.00 0.00 C ATOM 495 CG ARG A 156 29.231 -1.518 -14.426 1.00 0.00 C ATOM 496 CD ARG A 156 30.151 -0.378 -14.021 1.00 0.00 C ATOM 497 NE ARG A 156 29.511 0.533 -13.076 1.00 0.00 N ATOM 498 CZ ARG A 156 28.686 1.508 -13.439 1.00 0.00 C ATOM 499 NH1 ARG A 156 28.401 1.698 -14.720 1.00 0.00 N ATOM 500 NH2 ARG A 156 28.142 2.296 -12.519 1.00 0.00 N ATOM 0 H ARG A 156 28.568 -3.914 -15.284 1.00 0.00 H new ATOM 0 HA ARG A 156 27.231 -3.736 -12.646 1.00 0.00 H new ATOM 0 HB2 ARG A 156 28.177 -1.449 -12.566 1.00 0.00 H new ATOM 0 HB3 ARG A 156 29.422 -2.679 -12.640 1.00 0.00 H new ATOM 0 HG2 ARG A 156 29.789 -2.246 -15.015 1.00 0.00 H new ATOM 0 HG3 ARG A 156 28.434 -1.135 -15.064 1.00 0.00 H new ATOM 0 HD2 ARG A 156 31.058 -0.785 -13.574 1.00 0.00 H new ATOM 0 HD3 ARG A 156 30.455 0.176 -14.909 1.00 0.00 H new ATOM 0 HE ARG A 156 29.709 0.414 -12.082 1.00 0.00 H new ATOM 0 HH11 ARG A 156 28.816 1.094 -15.430 1.00 0.00 H new ATOM 0 HH12 ARG A 156 27.767 2.448 -14.996 1.00 0.00 H new ATOM 0 HH21 ARG A 156 28.358 2.153 -11.532 1.00 0.00 H new ATOM 0 HH22 ARG A 156 27.508 3.045 -12.799 1.00 0.00 H new ATOM 514 N TYR A 157 25.881 -3.186 -15.302 1.00 0.00 N ATOM 515 CA TYR A 157 24.739 -2.645 -16.031 1.00 0.00 C ATOM 516 C TYR A 157 23.429 -3.019 -15.346 1.00 0.00 C ATOM 517 O TYR A 157 23.360 -3.955 -14.549 1.00 0.00 O ATOM 518 CB TYR A 157 24.739 -3.157 -17.472 1.00 0.00 C ATOM 519 CG TYR A 157 25.359 -2.192 -18.458 1.00 0.00 C ATOM 520 CD1 TYR A 157 26.498 -1.467 -18.128 1.00 0.00 C ATOM 521 CD2 TYR A 157 24.805 -2.004 -19.718 1.00 0.00 C ATOM 522 CE1 TYR A 157 27.067 -0.584 -19.025 1.00 0.00 C ATOM 523 CE2 TYR A 157 25.368 -1.124 -20.622 1.00 0.00 C ATOM 524 CZ TYR A 157 26.499 -0.416 -20.270 1.00 0.00 C ATOM 525 OH TYR A 157 27.062 0.463 -21.167 1.00 0.00 O ATOM 0 H TYR A 157 26.256 -4.052 -15.689 1.00 0.00 H new ATOM 0 HA TYR A 157 24.826 -1.559 -16.039 1.00 0.00 H new ATOM 0 HB2 TYR A 157 25.280 -4.102 -17.513 1.00 0.00 H new ATOM 0 HB3 TYR A 157 23.713 -3.364 -17.775 1.00 0.00 H new ATOM 0 HD1 TYR A 157 26.946 -1.596 -17.154 1.00 0.00 H new ATOM 0 HD2 TYR A 157 23.919 -2.555 -19.996 1.00 0.00 H new ATOM 0 HE1 TYR A 157 27.952 -0.028 -18.753 1.00 0.00 H new ATOM 0 HE2 TYR A 157 24.926 -0.991 -21.598 1.00 0.00 H new ATOM 0 HH TYR A 157 27.328 -0.021 -21.977 1.00 0.00 H new ATOM 535 N PRO A 158 22.362 -2.271 -15.664 1.00 0.00 N ATOM 536 CA PRO A 158 21.032 -2.505 -15.093 1.00 0.00 C ATOM 537 C PRO A 158 20.401 -3.796 -15.602 1.00 0.00 C ATOM 538 O PRO A 158 20.759 -4.295 -16.668 1.00 0.00 O ATOM 539 CB PRO A 158 20.225 -1.293 -15.565 1.00 0.00 C ATOM 540 CG PRO A 158 20.911 -0.842 -16.808 1.00 0.00 C ATOM 541 CD PRO A 158 22.371 -1.140 -16.607 1.00 0.00 C ATOM 0 HA PRO A 158 21.068 -2.615 -14.009 1.00 0.00 H new ATOM 0 HB2 PRO A 158 19.187 -1.561 -15.761 1.00 0.00 H new ATOM 0 HB3 PRO A 158 20.215 -0.506 -14.811 1.00 0.00 H new ATOM 0 HG2 PRO A 158 20.522 -1.367 -17.681 1.00 0.00 H new ATOM 0 HG3 PRO A 158 20.750 0.222 -16.978 1.00 0.00 H new ATOM 0 HD2 PRO A 158 22.860 -1.403 -17.545 1.00 0.00 H new ATOM 0 HD3 PRO A 158 22.904 -0.281 -16.199 1.00 0.00 H new ATOM 549 N ASN A 159 19.459 -4.333 -14.833 1.00 0.00 N ATOM 550 CA ASN A 159 18.778 -5.567 -15.207 1.00 0.00 C ATOM 551 C ASN A 159 17.307 -5.519 -14.806 1.00 0.00 C ATOM 552 O ASN A 159 16.681 -6.554 -14.583 1.00 0.00 O ATOM 553 CB ASN A 159 19.458 -6.769 -14.548 1.00 0.00 C ATOM 554 CG ASN A 159 19.272 -6.786 -13.043 1.00 0.00 C ATOM 555 OD1 ASN A 159 18.481 -7.734 -12.556 1.00 0.00 O flip ATOM 556 ND2 ASN A 159 19.834 -5.956 -12.328 1.00 0.00 N flip ATOM 0 H ASN A 159 19.150 -3.933 -13.947 1.00 0.00 H new ATOM 0 HA ASN A 159 18.838 -5.672 -16.290 1.00 0.00 H new ATOM 0 HB2 ASN A 159 19.054 -7.689 -14.972 1.00 0.00 H new ATOM 0 HB3 ASN A 159 20.523 -6.752 -14.779 1.00 0.00 H new ATOM 0 HD21 ASN A 159 20.434 -5.245 -12.747 1.00 0.00 H new ATOM 0 HD22 ASN A 159 19.700 -5.980 -11.317 1.00 0.00 H new ATOM 563 N GLN A 160 16.762 -4.310 -14.719 1.00 0.00 N ATOM 564 CA GLN A 160 15.364 -4.127 -14.346 1.00 0.00 C ATOM 565 C GLN A 160 14.986 -2.650 -14.360 1.00 0.00 C ATOM 566 O GLN A 160 15.848 -1.778 -14.475 1.00 0.00 O ATOM 567 CB GLN A 160 15.103 -4.719 -12.960 1.00 0.00 C ATOM 568 CG GLN A 160 14.108 -5.869 -12.967 1.00 0.00 C ATOM 569 CD GLN A 160 14.585 -7.059 -12.158 1.00 0.00 C ATOM 570 OE1 GLN A 160 13.753 -7.515 -11.229 1.00 0.00 O flip ATOM 571 NE2 GLN A 160 15.689 -7.563 -12.365 1.00 0.00 N flip ATOM 0 H GLN A 160 17.267 -3.443 -14.902 1.00 0.00 H new ATOM 0 HA GLN A 160 14.747 -4.648 -15.078 1.00 0.00 H new ATOM 0 HB2 GLN A 160 16.046 -5.068 -12.540 1.00 0.00 H new ATOM 0 HB3 GLN A 160 14.732 -3.933 -12.302 1.00 0.00 H new ATOM 0 HG2 GLN A 160 13.155 -5.522 -12.568 1.00 0.00 H new ATOM 0 HG3 GLN A 160 13.928 -6.182 -13.995 1.00 0.00 H new ATOM 0 HE21 GLN A 160 16.297 -7.180 -13.089 1.00 0.00 H new ATOM 0 HE22 GLN A 160 15.996 -8.363 -11.812 1.00 0.00 H new ATOM 580 N VAL A 161 13.690 -2.375 -14.243 1.00 0.00 N ATOM 581 CA VAL A 161 13.197 -1.003 -14.241 1.00 0.00 C ATOM 582 C VAL A 161 12.231 -0.767 -13.086 1.00 0.00 C ATOM 583 O VAL A 161 11.370 -1.600 -12.803 1.00 0.00 O ATOM 584 CB VAL A 161 12.490 -0.659 -15.566 1.00 0.00 C ATOM 585 CG1 VAL A 161 13.506 -0.480 -16.683 1.00 0.00 C ATOM 586 CG2 VAL A 161 11.477 -1.737 -15.923 1.00 0.00 C ATOM 0 H VAL A 161 12.963 -3.084 -14.148 1.00 0.00 H new ATOM 0 HA VAL A 161 14.065 -0.355 -14.122 1.00 0.00 H new ATOM 0 HB VAL A 161 11.956 0.283 -15.440 1.00 0.00 H new ATOM 0 HG11 VAL A 161 12.988 -0.238 -17.611 1.00 0.00 H new ATOM 0 HG12 VAL A 161 14.189 0.330 -16.427 1.00 0.00 H new ATOM 0 HG13 VAL A 161 14.070 -1.404 -16.813 1.00 0.00 H new ATOM 0 HG21 VAL A 161 10.986 -1.479 -16.861 1.00 0.00 H new ATOM 0 HG22 VAL A 161 11.987 -2.694 -16.032 1.00 0.00 H new ATOM 0 HG23 VAL A 161 10.731 -1.811 -15.132 1.00 0.00 H new ATOM 596 N TYR A 162 12.380 0.373 -12.421 1.00 0.00 N ATOM 597 CA TYR A 162 11.521 0.719 -11.294 1.00 0.00 C ATOM 598 C TYR A 162 10.954 2.126 -11.453 1.00 0.00 C ATOM 599 O TYR A 162 11.520 2.960 -12.159 1.00 0.00 O ATOM 600 CB TYR A 162 12.301 0.616 -9.982 1.00 0.00 C ATOM 601 CG TYR A 162 13.109 -0.656 -9.855 1.00 0.00 C ATOM 602 CD1 TYR A 162 14.382 -0.752 -10.404 1.00 0.00 C ATOM 603 CD2 TYR A 162 12.598 -1.763 -9.188 1.00 0.00 C ATOM 604 CE1 TYR A 162 15.123 -1.912 -10.292 1.00 0.00 C ATOM 605 CE2 TYR A 162 13.333 -2.927 -9.069 1.00 0.00 C ATOM 606 CZ TYR A 162 14.594 -2.996 -9.623 1.00 0.00 C ATOM 607 OH TYR A 162 15.329 -4.155 -9.508 1.00 0.00 O ATOM 0 H TYR A 162 13.088 1.074 -12.643 1.00 0.00 H new ATOM 0 HA TYR A 162 10.691 0.013 -11.272 1.00 0.00 H new ATOM 0 HB2 TYR A 162 12.971 1.472 -9.900 1.00 0.00 H new ATOM 0 HB3 TYR A 162 11.602 0.677 -9.148 1.00 0.00 H new ATOM 0 HD1 TYR A 162 14.799 0.096 -10.927 1.00 0.00 H new ATOM 0 HD2 TYR A 162 11.610 -1.713 -8.755 1.00 0.00 H new ATOM 0 HE1 TYR A 162 16.110 -1.970 -10.726 1.00 0.00 H new ATOM 0 HE2 TYR A 162 12.922 -3.778 -8.545 1.00 0.00 H new ATOM 0 HH TYR A 162 14.813 -4.821 -9.008 1.00 0.00 H new ATOM 797 N ASN A 174 5.058 10.729 -22.664 1.00 0.00 N ATOM 798 CA ASN A 174 6.071 11.260 -21.760 1.00 0.00 C ATOM 799 C ASN A 174 6.223 10.369 -20.530 1.00 0.00 C ATOM 800 O ASN A 174 7.286 10.324 -19.911 1.00 0.00 O ATOM 801 CB ASN A 174 5.707 12.682 -21.331 1.00 0.00 C ATOM 802 CG ASN A 174 6.930 13.549 -21.102 1.00 0.00 C ATOM 803 OD1 ASN A 174 7.319 13.804 -19.962 1.00 0.00 O ATOM 804 ND2 ASN A 174 7.544 14.005 -22.187 1.00 0.00 N ATOM 0 HA ASN A 174 7.022 11.281 -22.292 1.00 0.00 H new ATOM 0 HB2 ASN A 174 5.079 13.139 -22.096 1.00 0.00 H new ATOM 0 HB3 ASN A 174 5.117 12.642 -20.415 1.00 0.00 H new ATOM 0 HD21 ASN A 174 8.373 14.592 -22.095 1.00 0.00 H new ATOM 0 HD22 ASN A 174 7.187 13.768 -23.113 1.00 0.00 H new ATOM 811 N PHE A 175 5.153 9.663 -20.182 1.00 0.00 N ATOM 812 CA PHE A 175 5.166 8.773 -19.027 1.00 0.00 C ATOM 813 C PHE A 175 6.186 7.654 -19.214 1.00 0.00 C ATOM 814 O PHE A 175 6.806 7.196 -18.253 1.00 0.00 O ATOM 815 CB PHE A 175 3.775 8.178 -18.798 1.00 0.00 C ATOM 816 CG PHE A 175 3.647 7.435 -17.499 1.00 0.00 C ATOM 817 CD1 PHE A 175 3.618 8.119 -16.294 1.00 0.00 C ATOM 818 CD2 PHE A 175 3.556 6.053 -17.482 1.00 0.00 C ATOM 819 CE1 PHE A 175 3.501 7.438 -15.098 1.00 0.00 C ATOM 820 CE2 PHE A 175 3.438 5.366 -16.289 1.00 0.00 C ATOM 821 CZ PHE A 175 3.410 6.060 -15.095 1.00 0.00 C ATOM 0 H PHE A 175 4.265 9.690 -20.683 1.00 0.00 H new ATOM 0 HA PHE A 175 5.451 9.358 -18.153 1.00 0.00 H new ATOM 0 HB2 PHE A 175 3.037 8.980 -18.823 1.00 0.00 H new ATOM 0 HB3 PHE A 175 3.538 7.501 -19.619 1.00 0.00 H new ATOM 0 HD1 PHE A 175 3.688 9.197 -16.290 1.00 0.00 H new ATOM 0 HD2 PHE A 175 3.578 5.506 -18.413 1.00 0.00 H new ATOM 0 HE1 PHE A 175 3.481 7.983 -14.166 1.00 0.00 H new ATOM 0 HE2 PHE A 175 3.368 4.288 -16.290 1.00 0.00 H new ATOM 0 HZ PHE A 175 3.317 5.526 -14.161 1.00 0.00 H new ATOM 831 N VAL A 176 6.355 7.217 -20.458 1.00 0.00 N ATOM 832 CA VAL A 176 7.300 6.152 -20.772 1.00 0.00 C ATOM 833 C VAL A 176 8.739 6.645 -20.669 1.00 0.00 C ATOM 834 O VAL A 176 9.578 6.013 -20.026 1.00 0.00 O ATOM 835 CB VAL A 176 7.061 5.590 -22.186 1.00 0.00 C ATOM 836 CG1 VAL A 176 7.950 4.381 -22.438 1.00 0.00 C ATOM 837 CG2 VAL A 176 5.595 5.232 -22.377 1.00 0.00 C ATOM 0 H VAL A 176 5.850 7.584 -21.265 1.00 0.00 H new ATOM 0 HA VAL A 176 7.138 5.359 -20.041 1.00 0.00 H new ATOM 0 HB VAL A 176 7.321 6.360 -22.912 1.00 0.00 H new ATOM 0 HG11 VAL A 176 7.767 3.998 -23.442 1.00 0.00 H new ATOM 0 HG12 VAL A 176 8.996 4.673 -22.346 1.00 0.00 H new ATOM 0 HG13 VAL A 176 7.725 3.605 -21.707 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.445 4.837 -23.382 1.00 0.00 H new ATOM 0 HG22 VAL A 176 5.306 4.479 -21.644 1.00 0.00 H new ATOM 0 HG23 VAL A 176 4.982 6.123 -22.243 1.00 0.00 H new ATOM 847 N HIS A 177 9.017 7.777 -21.306 1.00 0.00 N ATOM 848 CA HIS A 177 10.356 8.357 -21.286 1.00 0.00 C ATOM 849 C HIS A 177 10.823 8.594 -19.853 1.00 0.00 C ATOM 850 O HIS A 177 11.993 8.395 -19.531 1.00 0.00 O ATOM 851 CB HIS A 177 10.377 9.672 -22.066 1.00 0.00 C ATOM 852 CG HIS A 177 10.114 9.503 -23.531 1.00 0.00 C ATOM 853 ND1 HIS A 177 9.611 10.512 -24.325 1.00 0.00 N ATOM 854 CD2 HIS A 177 10.289 8.436 -24.345 1.00 0.00 C ATOM 855 CE1 HIS A 177 9.486 10.071 -25.565 1.00 0.00 C ATOM 856 NE2 HIS A 177 9.891 8.815 -25.603 1.00 0.00 N ATOM 0 H HIS A 177 8.334 8.312 -21.843 1.00 0.00 H new ATOM 0 HA HIS A 177 11.038 7.652 -21.760 1.00 0.00 H new ATOM 0 HB2 HIS A 177 9.630 10.346 -21.646 1.00 0.00 H new ATOM 0 HB3 HIS A 177 11.348 10.149 -21.932 1.00 0.00 H new ATOM 0 HD2 HIS A 177 10.671 7.467 -24.058 1.00 0.00 H new ATOM 0 HE1 HIS A 177 9.116 10.641 -26.404 1.00 0.00 H new ATOM 0 HE2 HIS A 177 9.906 8.222 -26.433 1.00 0.00 H new ATOM 864 N ASN A 178 9.900 9.021 -18.998 1.00 0.00 N ATOM 865 CA ASN A 178 10.218 9.287 -17.599 1.00 0.00 C ATOM 866 C ASN A 178 10.682 8.015 -16.896 1.00 0.00 C ATOM 867 O ASN A 178 11.652 8.031 -16.138 1.00 0.00 O ATOM 868 CB ASN A 178 8.999 9.866 -16.878 1.00 0.00 C ATOM 869 CG ASN A 178 8.906 11.373 -17.019 1.00 0.00 C ATOM 870 OD1 ASN A 178 8.998 11.912 -18.122 1.00 0.00 O ATOM 871 ND2 ASN A 178 8.722 12.061 -15.898 1.00 0.00 N ATOM 0 H ASN A 178 8.926 9.190 -19.249 1.00 0.00 H new ATOM 0 HA ASN A 178 11.029 10.015 -17.568 1.00 0.00 H new ATOM 0 HB2 ASN A 178 8.093 9.410 -17.278 1.00 0.00 H new ATOM 0 HB3 ASN A 178 9.048 9.605 -15.821 1.00 0.00 H new ATOM 0 HD21 ASN A 178 8.651 13.078 -15.930 1.00 0.00 H new ATOM 0 HD22 ASN A 178 8.651 11.572 -15.005 1.00 0.00 H new ATOM 878 N CYS A 179 9.983 6.915 -17.153 1.00 0.00 N ATOM 879 CA CYS A 179 10.323 5.633 -16.546 1.00 0.00 C ATOM 880 C CYS A 179 11.783 5.276 -16.809 1.00 0.00 C ATOM 881 O CYS A 179 12.422 4.598 -16.004 1.00 0.00 O ATOM 882 CB CYS A 179 9.411 4.531 -17.088 1.00 0.00 C ATOM 883 SG CYS A 179 8.430 3.681 -15.810 1.00 0.00 S ATOM 0 H CYS A 179 9.177 6.885 -17.778 1.00 0.00 H new ATOM 0 HA CYS A 179 10.177 5.719 -15.469 1.00 0.00 H new ATOM 0 HB2 CYS A 179 8.733 4.964 -17.823 1.00 0.00 H new ATOM 0 HB3 CYS A 179 10.021 3.795 -17.612 1.00 0.00 H new ATOM 0 HG CYS A 179 7.690 2.769 -16.367 1.00 0.00 H new ATOM 888 N VAL A 180 12.305 5.738 -17.941 1.00 0.00 N ATOM 889 CA VAL A 180 13.689 5.470 -18.310 1.00 0.00 C ATOM 890 C VAL A 180 14.653 6.293 -17.463 1.00 0.00 C ATOM 891 O VAL A 180 15.749 5.840 -17.136 1.00 0.00 O ATOM 892 CB VAL A 180 13.942 5.774 -19.799 1.00 0.00 C ATOM 893 CG1 VAL A 180 15.383 5.458 -20.171 1.00 0.00 C ATOM 894 CG2 VAL A 180 12.974 4.992 -20.674 1.00 0.00 C ATOM 0 H VAL A 180 11.789 6.300 -18.618 1.00 0.00 H new ATOM 0 HA VAL A 180 13.865 4.410 -18.129 1.00 0.00 H new ATOM 0 HB VAL A 180 13.772 6.837 -19.969 1.00 0.00 H new ATOM 0 HG11 VAL A 180 15.543 5.679 -21.226 1.00 0.00 H new ATOM 0 HG12 VAL A 180 16.056 6.066 -19.567 1.00 0.00 H new ATOM 0 HG13 VAL A 180 15.583 4.403 -19.987 1.00 0.00 H new ATOM 0 HG21 VAL A 180 13.167 5.219 -21.723 1.00 0.00 H new ATOM 0 HG22 VAL A 180 13.110 3.924 -20.503 1.00 0.00 H new ATOM 0 HG23 VAL A 180 11.951 5.272 -20.425 1.00 0.00 H new ATOM 904 N ASN A 181 14.237 7.505 -17.112 1.00 0.00 N ATOM 905 CA ASN A 181 15.064 8.393 -16.303 1.00 0.00 C ATOM 906 C ASN A 181 15.127 7.910 -14.857 1.00 0.00 C ATOM 907 O ASN A 181 16.173 7.984 -14.212 1.00 0.00 O ATOM 908 CB ASN A 181 14.516 9.821 -16.352 1.00 0.00 C ATOM 909 CG ASN A 181 15.607 10.852 -16.560 1.00 0.00 C ATOM 910 OD1 ASN A 181 16.605 10.871 -15.838 1.00 0.00 O ATOM 911 ND2 ASN A 181 15.423 11.717 -17.551 1.00 0.00 N ATOM 0 H ASN A 181 13.332 7.895 -17.375 1.00 0.00 H new ATOM 0 HA ASN A 181 16.073 8.384 -16.715 1.00 0.00 H new ATOM 0 HB2 ASN A 181 13.787 9.900 -17.158 1.00 0.00 H new ATOM 0 HB3 ASN A 181 13.988 10.037 -15.423 1.00 0.00 H new ATOM 0 HD21 ASN A 181 16.124 12.434 -17.739 1.00 0.00 H new ATOM 0 HD22 ASN A 181 14.581 11.664 -18.124 1.00 0.00 H new ATOM 918 N ILE A 182 14.000 7.416 -14.355 1.00 0.00 N ATOM 919 CA ILE A 182 13.928 6.919 -12.986 1.00 0.00 C ATOM 920 C ILE A 182 14.918 5.781 -12.761 1.00 0.00 C ATOM 921 O ILE A 182 15.605 5.733 -11.741 1.00 0.00 O ATOM 922 CB ILE A 182 12.510 6.428 -12.640 1.00 0.00 C ATOM 923 CG1 ILE A 182 11.491 7.547 -12.860 1.00 0.00 C ATOM 924 CG2 ILE A 182 12.458 5.932 -11.202 1.00 0.00 C ATOM 925 CD1 ILE A 182 10.057 7.065 -12.873 1.00 0.00 C ATOM 0 H ILE A 182 13.125 7.349 -14.875 1.00 0.00 H new ATOM 0 HA ILE A 182 14.184 7.753 -12.333 1.00 0.00 H new ATOM 0 HB ILE A 182 12.258 5.598 -13.300 1.00 0.00 H new ATOM 0 HG12 ILE A 182 11.608 8.293 -12.074 1.00 0.00 H new ATOM 0 HG13 ILE A 182 11.707 8.044 -13.806 1.00 0.00 H new ATOM 0 HG21 ILE A 182 11.450 5.588 -10.972 1.00 0.00 H new ATOM 0 HG22 ILE A 182 13.160 5.108 -11.076 1.00 0.00 H new ATOM 0 HG23 ILE A 182 12.727 6.744 -10.527 1.00 0.00 H new ATOM 0 HD11 ILE A 182 9.390 7.912 -13.033 1.00 0.00 H new ATOM 0 HD12 ILE A 182 9.924 6.341 -13.677 1.00 0.00 H new ATOM 0 HD13 ILE A 182 9.823 6.594 -11.918 1.00 0.00 H new ATOM 937 N THR A 183 14.987 4.865 -13.723 1.00 0.00 N ATOM 938 CA THR A 183 15.892 3.727 -13.631 1.00 0.00 C ATOM 939 C THR A 183 17.330 4.185 -13.415 1.00 0.00 C ATOM 940 O THR A 183 17.998 3.742 -12.480 1.00 0.00 O ATOM 941 CB THR A 183 15.828 2.855 -14.899 1.00 0.00 C ATOM 942 OG1 THR A 183 14.466 2.681 -15.305 1.00 0.00 O ATOM 943 CG2 THR A 183 16.467 1.496 -14.653 1.00 0.00 C ATOM 0 H THR A 183 14.426 4.890 -14.575 1.00 0.00 H new ATOM 0 HA THR A 183 15.570 3.134 -12.775 1.00 0.00 H new ATOM 0 HB THR A 183 16.381 3.361 -15.691 1.00 0.00 H new ATOM 0 HG1 THR A 183 14.310 3.166 -16.142 1.00 0.00 H new ATOM 0 HG21 THR A 183 16.410 0.897 -15.562 1.00 0.00 H new ATOM 0 HG22 THR A 183 17.511 1.631 -14.372 1.00 0.00 H new ATOM 0 HG23 THR A 183 15.938 0.985 -13.849 1.00 0.00 H new ATOM 951 N ILE A 184 17.800 5.074 -14.283 1.00 0.00 N ATOM 952 CA ILE A 184 19.159 5.593 -14.185 1.00 0.00 C ATOM 953 C ILE A 184 19.350 6.394 -12.903 1.00 0.00 C ATOM 954 O ILE A 184 20.400 6.324 -12.263 1.00 0.00 O ATOM 955 CB ILE A 184 19.509 6.484 -15.392 1.00 0.00 C ATOM 956 CG1 ILE A 184 19.330 5.706 -16.697 1.00 0.00 C ATOM 957 CG2 ILE A 184 20.934 7.004 -15.269 1.00 0.00 C ATOM 958 CD1 ILE A 184 20.232 4.496 -16.808 1.00 0.00 C ATOM 0 H ILE A 184 17.260 5.450 -15.062 1.00 0.00 H new ATOM 0 HA ILE A 184 19.826 4.731 -14.174 1.00 0.00 H new ATOM 0 HB ILE A 184 18.831 7.337 -15.405 1.00 0.00 H new ATOM 0 HG12 ILE A 184 18.292 5.384 -16.779 1.00 0.00 H new ATOM 0 HG13 ILE A 184 19.524 6.372 -17.537 1.00 0.00 H new ATOM 0 HG21 ILE A 184 21.168 7.632 -16.129 1.00 0.00 H new ATOM 0 HG22 ILE A 184 21.030 7.590 -14.355 1.00 0.00 H new ATOM 0 HG23 ILE A 184 21.627 6.163 -15.235 1.00 0.00 H new ATOM 0 HD11 ILE A 184 20.051 3.993 -17.758 1.00 0.00 H new ATOM 0 HD12 ILE A 184 21.274 4.813 -16.758 1.00 0.00 H new ATOM 0 HD13 ILE A 184 20.022 3.809 -15.988 1.00 0.00 H new ATOM 970 N LYS A 185 18.327 7.156 -12.530 1.00 0.00 N ATOM 971 CA LYS A 185 18.379 7.970 -11.321 1.00 0.00 C ATOM 972 C LYS A 185 18.769 7.125 -10.112 1.00 0.00 C ATOM 973 O LYS A 185 19.798 7.367 -9.481 1.00 0.00 O ATOM 974 CB LYS A 185 17.026 8.640 -11.073 1.00 0.00 C ATOM 975 CG LYS A 185 17.072 9.733 -10.019 1.00 0.00 C ATOM 976 CD LYS A 185 16.208 9.385 -8.818 1.00 0.00 C ATOM 977 CE LYS A 185 14.767 9.827 -9.021 1.00 0.00 C ATOM 978 NZ LYS A 185 13.848 8.666 -9.177 1.00 0.00 N ATOM 0 H LYS A 185 17.451 7.227 -13.048 1.00 0.00 H new ATOM 0 HA LYS A 185 19.137 8.740 -11.464 1.00 0.00 H new ATOM 0 HB2 LYS A 185 16.663 9.065 -12.009 1.00 0.00 H new ATOM 0 HB3 LYS A 185 16.305 7.882 -10.767 1.00 0.00 H new ATOM 0 HG2 LYS A 185 18.102 9.885 -9.696 1.00 0.00 H new ATOM 0 HG3 LYS A 185 16.732 10.673 -10.453 1.00 0.00 H new ATOM 0 HD2 LYS A 185 16.239 8.309 -8.646 1.00 0.00 H new ATOM 0 HD3 LYS A 185 16.614 9.862 -7.926 1.00 0.00 H new ATOM 0 HE2 LYS A 185 14.449 10.430 -8.171 1.00 0.00 H new ATOM 0 HE3 LYS A 185 14.703 10.462 -9.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 12.991 8.967 -9.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 14.325 7.916 -9.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 13.585 8.303 -8.239 1.00 0.00 H new ATOM 992 N GLN A 186 17.941 6.134 -9.797 1.00 0.00 N ATOM 993 CA GLN A 186 18.201 5.253 -8.665 1.00 0.00 C ATOM 994 C GLN A 186 19.525 4.517 -8.840 1.00 0.00 C ATOM 995 O GLN A 186 20.168 4.134 -7.862 1.00 0.00 O ATOM 996 CB GLN A 186 17.061 4.246 -8.503 1.00 0.00 C ATOM 997 CG GLN A 186 15.708 4.893 -8.255 1.00 0.00 C ATOM 998 CD GLN A 186 15.462 5.187 -6.788 1.00 0.00 C ATOM 999 OE1 GLN A 186 15.545 4.296 -5.942 1.00 0.00 O ATOM 1000 NE2 GLN A 186 15.156 6.442 -6.479 1.00 0.00 N ATOM 0 H GLN A 186 17.085 5.921 -10.310 1.00 0.00 H new ATOM 0 HA GLN A 186 18.264 5.867 -7.767 1.00 0.00 H new ATOM 0 HB2 GLN A 186 17.001 3.630 -9.401 1.00 0.00 H new ATOM 0 HB3 GLN A 186 17.293 3.578 -7.673 1.00 0.00 H new ATOM 0 HG2 GLN A 186 15.644 5.821 -8.823 1.00 0.00 H new ATOM 0 HG3 GLN A 186 14.922 4.236 -8.627 1.00 0.00 H new ATOM 0 HE21 GLN A 186 15.098 7.148 -7.213 1.00 0.00 H new ATOM 0 HE22 GLN A 186 14.979 6.699 -5.508 1.00 0.00 H new ATOM 1009 N HIS A 187 19.927 4.322 -10.092 1.00 0.00 N ATOM 1010 CA HIS A 187 21.175 3.631 -10.395 1.00 0.00 C ATOM 1011 C HIS A 187 22.375 4.440 -9.912 1.00 0.00 C ATOM 1012 O HIS A 187 23.337 3.887 -9.378 1.00 0.00 O ATOM 1013 CB HIS A 187 21.289 3.376 -11.899 1.00 0.00 C ATOM 1014 CG HIS A 187 21.676 1.970 -12.240 1.00 0.00 C ATOM 1015 ND1 HIS A 187 22.778 1.658 -13.008 1.00 0.00 N ATOM 1016 CD2 HIS A 187 21.102 0.789 -11.911 1.00 0.00 C ATOM 1017 CE1 HIS A 187 22.863 0.346 -13.139 1.00 0.00 C ATOM 1018 NE2 HIS A 187 21.859 -0.204 -12.482 1.00 0.00 N ATOM 0 H HIS A 187 19.407 4.633 -10.913 1.00 0.00 H new ATOM 0 HA HIS A 187 21.169 2.675 -9.871 1.00 0.00 H new ATOM 0 HB2 HIS A 187 20.334 3.606 -12.372 1.00 0.00 H new ATOM 0 HB3 HIS A 187 22.026 4.059 -12.320 1.00 0.00 H new ATOM 0 HD2 HIS A 187 20.214 0.653 -11.311 1.00 0.00 H new ATOM 0 HE1 HIS A 187 23.624 -0.186 -13.690 1.00 0.00 H new ATOM 0 HE2 HIS A 187 21.675 -1.205 -12.410 1.00 0.00 H new ATOM 1026 N THR A 188 22.313 5.754 -10.105 1.00 0.00 N ATOM 1027 CA THR A 188 23.395 6.639 -9.691 1.00 0.00 C ATOM 1028 C THR A 188 23.586 6.604 -8.179 1.00 0.00 C ATOM 1029 O THR A 188 24.678 6.865 -7.675 1.00 0.00 O ATOM 1030 CB THR A 188 23.131 8.092 -10.131 1.00 0.00 C ATOM 1031 OG1 THR A 188 22.083 8.661 -9.338 1.00 0.00 O ATOM 1032 CG2 THR A 188 22.751 8.152 -11.602 1.00 0.00 C ATOM 0 H THR A 188 21.525 6.229 -10.545 1.00 0.00 H new ATOM 0 HA THR A 188 24.302 6.279 -10.177 1.00 0.00 H new ATOM 0 HB THR A 188 24.047 8.664 -9.986 1.00 0.00 H new ATOM 0 HG1 THR A 188 21.232 8.230 -9.563 1.00 0.00 H new ATOM 0 HG21 THR A 188 22.570 9.188 -11.889 1.00 0.00 H new ATOM 0 HG22 THR A 188 23.563 7.745 -12.205 1.00 0.00 H new ATOM 0 HG23 THR A 188 21.847 7.566 -11.769 1.00 0.00 H new ATOM 1040 N VAL A 189 22.516 6.280 -7.459 1.00 0.00 N ATOM 1041 CA VAL A 189 22.567 6.209 -6.004 1.00 0.00 C ATOM 1042 C VAL A 189 23.432 5.043 -5.540 1.00 0.00 C ATOM 1043 O VAL A 189 24.153 5.145 -4.547 1.00 0.00 O ATOM 1044 CB VAL A 189 21.158 6.061 -5.400 1.00 0.00 C ATOM 1045 CG1 VAL A 189 21.233 5.983 -3.883 1.00 0.00 C ATOM 1046 CG2 VAL A 189 20.267 7.213 -5.840 1.00 0.00 C ATOM 0 H VAL A 189 21.604 6.063 -7.860 1.00 0.00 H new ATOM 0 HA VAL A 189 23.007 7.144 -5.657 1.00 0.00 H new ATOM 0 HB VAL A 189 20.720 5.132 -5.766 1.00 0.00 H new ATOM 0 HG11 VAL A 189 20.228 5.879 -3.474 1.00 0.00 H new ATOM 0 HG12 VAL A 189 21.834 5.122 -3.592 1.00 0.00 H new ATOM 0 HG13 VAL A 189 21.690 6.893 -3.494 1.00 0.00 H new ATOM 0 HG21 VAL A 189 19.275 7.093 -5.404 1.00 0.00 H new ATOM 0 HG22 VAL A 189 20.699 8.156 -5.504 1.00 0.00 H new ATOM 0 HG23 VAL A 189 20.188 7.217 -6.927 1.00 0.00 H new ATOM 1056 N THR A 190 23.356 3.931 -6.266 1.00 0.00 N ATOM 1057 CA THR A 190 24.131 2.744 -5.930 1.00 0.00 C ATOM 1058 C THR A 190 25.600 2.924 -6.298 1.00 0.00 C ATOM 1059 O THR A 190 26.480 2.294 -5.710 1.00 0.00 O ATOM 1060 CB THR A 190 23.584 1.494 -6.644 1.00 0.00 C ATOM 1061 OG1 THR A 190 22.203 1.306 -6.314 1.00 0.00 O ATOM 1062 CG2 THR A 190 24.377 0.256 -6.254 1.00 0.00 C ATOM 0 H THR A 190 22.765 3.829 -7.091 1.00 0.00 H new ATOM 0 HA THR A 190 24.043 2.605 -4.853 1.00 0.00 H new ATOM 0 HB THR A 190 23.683 1.645 -7.719 1.00 0.00 H new ATOM 0 HG1 THR A 190 21.862 0.510 -6.773 1.00 0.00 H new ATOM 0 HG21 THR A 190 23.972 -0.614 -6.771 1.00 0.00 H new ATOM 0 HG22 THR A 190 25.422 0.390 -6.534 1.00 0.00 H new ATOM 0 HG23 THR A 190 24.307 0.103 -5.177 1.00 0.00 H new ATOM 1070 N THR A 191 25.859 3.787 -7.274 1.00 0.00 N ATOM 1071 CA THR A 191 27.221 4.049 -7.721 1.00 0.00 C ATOM 1072 C THR A 191 28.110 4.473 -6.557 1.00 0.00 C ATOM 1073 O THR A 191 29.326 4.282 -6.589 1.00 0.00 O ATOM 1074 CB THR A 191 27.256 5.145 -8.804 1.00 0.00 C ATOM 1075 OG1 THR A 191 26.175 4.959 -9.724 1.00 0.00 O ATOM 1076 CG2 THR A 191 28.579 5.120 -9.555 1.00 0.00 C ATOM 0 H THR A 191 25.143 4.317 -7.771 1.00 0.00 H new ATOM 0 HA THR A 191 27.599 3.118 -8.144 1.00 0.00 H new ATOM 0 HB THR A 191 27.152 6.113 -8.314 1.00 0.00 H new ATOM 0 HG1 THR A 191 26.293 5.556 -10.492 1.00 0.00 H new ATOM 0 HG21 THR A 191 28.581 5.902 -10.314 1.00 0.00 H new ATOM 0 HG22 THR A 191 29.398 5.291 -8.856 1.00 0.00 H new ATOM 0 HG23 THR A 191 28.707 4.149 -10.034 1.00 0.00 H new ATOM 1084 N THR A 192 27.495 5.049 -5.528 1.00 0.00 N ATOM 1085 CA THR A 192 28.231 5.499 -4.354 1.00 0.00 C ATOM 1086 C THR A 192 29.068 4.371 -3.763 1.00 0.00 C ATOM 1087 O THR A 192 30.096 4.612 -3.129 1.00 0.00 O ATOM 1088 CB THR A 192 27.280 6.041 -3.269 1.00 0.00 C ATOM 1089 OG1 THR A 192 26.165 6.700 -3.880 1.00 0.00 O ATOM 1090 CG2 THR A 192 28.006 7.009 -2.348 1.00 0.00 C ATOM 0 H THR A 192 26.489 5.214 -5.485 1.00 0.00 H new ATOM 0 HA THR A 192 28.891 6.302 -4.683 1.00 0.00 H new ATOM 0 HB THR A 192 26.923 5.199 -2.676 1.00 0.00 H new ATOM 0 HG1 THR A 192 25.412 6.076 -3.947 1.00 0.00 H new ATOM 0 HG21 THR A 192 27.315 7.378 -1.591 1.00 0.00 H new ATOM 0 HG22 THR A 192 28.836 6.496 -1.862 1.00 0.00 H new ATOM 0 HG23 THR A 192 28.388 7.848 -2.930 1.00 0.00 H new ATOM 1098 N THR A 193 28.623 3.136 -3.975 1.00 0.00 N ATOM 1099 CA THR A 193 29.331 1.970 -3.462 1.00 0.00 C ATOM 1100 C THR A 193 30.781 1.957 -3.932 1.00 0.00 C ATOM 1101 O THR A 193 31.665 1.452 -3.239 1.00 0.00 O ATOM 1102 CB THR A 193 28.649 0.661 -3.902 1.00 0.00 C ATOM 1103 OG1 THR A 193 29.253 -0.454 -3.237 1.00 0.00 O ATOM 1104 CG2 THR A 193 28.753 0.476 -5.409 1.00 0.00 C ATOM 0 H THR A 193 27.775 2.918 -4.499 1.00 0.00 H new ATOM 0 HA THR A 193 29.305 2.037 -2.374 1.00 0.00 H new ATOM 0 HB THR A 193 27.595 0.718 -3.631 1.00 0.00 H new ATOM 0 HG1 THR A 193 28.813 -1.282 -3.521 1.00 0.00 H new ATOM 0 HG21 THR A 193 28.264 -0.455 -5.696 1.00 0.00 H new ATOM 0 HG22 THR A 193 28.266 1.311 -5.913 1.00 0.00 H new ATOM 0 HG23 THR A 193 29.803 0.439 -5.699 1.00 0.00 H new ATOM 1112 N LYS A 194 31.020 2.516 -5.114 1.00 0.00 N ATOM 1113 CA LYS A 194 32.364 2.571 -5.676 1.00 0.00 C ATOM 1114 C LYS A 194 32.946 3.976 -5.559 1.00 0.00 C ATOM 1115 O LYS A 194 34.144 4.180 -5.750 1.00 0.00 O ATOM 1116 CB LYS A 194 32.343 2.137 -7.144 1.00 0.00 C ATOM 1117 CG LYS A 194 33.123 0.862 -7.412 1.00 0.00 C ATOM 1118 CD LYS A 194 34.622 1.097 -7.326 1.00 0.00 C ATOM 1119 CE LYS A 194 35.172 0.689 -5.968 1.00 0.00 C ATOM 1120 NZ LYS A 194 36.528 0.082 -6.078 1.00 0.00 N ATOM 0 H LYS A 194 30.300 2.937 -5.701 1.00 0.00 H new ATOM 0 HA LYS A 194 32.996 1.887 -5.110 1.00 0.00 H new ATOM 0 HB2 LYS A 194 31.309 1.993 -7.457 1.00 0.00 H new ATOM 0 HB3 LYS A 194 32.753 2.939 -7.757 1.00 0.00 H new ATOM 0 HG2 LYS A 194 32.832 0.098 -6.691 1.00 0.00 H new ATOM 0 HG3 LYS A 194 32.870 0.480 -8.401 1.00 0.00 H new ATOM 0 HD2 LYS A 194 35.126 0.531 -8.109 1.00 0.00 H new ATOM 0 HD3 LYS A 194 34.837 2.150 -7.506 1.00 0.00 H new ATOM 0 HE2 LYS A 194 35.217 1.562 -5.317 1.00 0.00 H new ATOM 0 HE3 LYS A 194 34.492 -0.023 -5.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 36.868 -0.182 -5.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 36.481 -0.766 -6.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 37.183 0.770 -6.501 1.00 0.00 H new ATOM 1134 N GLY A 195 32.089 4.942 -5.242 1.00 0.00 N ATOM 1135 CA GLY A 195 32.538 6.315 -5.103 1.00 0.00 C ATOM 1136 C GLY A 195 33.080 6.882 -6.400 1.00 0.00 C ATOM 1137 O GLY A 195 33.946 7.757 -6.388 1.00 0.00 O ATOM 0 H GLY A 195 31.092 4.798 -5.079 1.00 0.00 H new ATOM 0 HA2 GLY A 195 31.708 6.932 -4.759 1.00 0.00 H new ATOM 0 HA3 GLY A 195 33.312 6.365 -4.337 1.00 0.00 H new ATOM 1141 N GLU A 196 32.571 6.382 -7.521 1.00 0.00 N ATOM 1142 CA GLU A 196 33.013 6.843 -8.832 1.00 0.00 C ATOM 1143 C GLU A 196 31.903 7.615 -9.540 1.00 0.00 C ATOM 1144 O GLU A 196 30.778 7.693 -9.050 1.00 0.00 O ATOM 1145 CB GLU A 196 33.453 5.657 -9.693 1.00 0.00 C ATOM 1146 CG GLU A 196 34.883 5.213 -9.433 1.00 0.00 C ATOM 1147 CD GLU A 196 35.298 4.043 -10.304 1.00 0.00 C ATOM 1148 OE1 GLU A 196 35.119 4.129 -11.537 1.00 0.00 O ATOM 1149 OE2 GLU A 196 35.802 3.042 -9.753 1.00 0.00 O ATOM 0 H GLU A 196 31.853 5.658 -7.548 1.00 0.00 H new ATOM 0 HA GLU A 196 33.861 7.512 -8.686 1.00 0.00 H new ATOM 0 HB2 GLU A 196 32.782 4.818 -9.510 1.00 0.00 H new ATOM 0 HB3 GLU A 196 33.350 5.924 -10.745 1.00 0.00 H new ATOM 0 HG2 GLU A 196 35.558 6.051 -9.611 1.00 0.00 H new ATOM 0 HG3 GLU A 196 34.988 4.936 -8.384 1.00 0.00 H new ATOM 1156 N ASN A 197 32.231 8.184 -10.695 1.00 0.00 N ATOM 1157 CA ASN A 197 31.262 8.951 -11.471 1.00 0.00 C ATOM 1158 C ASN A 197 30.996 8.287 -12.818 1.00 0.00 C ATOM 1159 O ASN A 197 31.728 7.390 -13.236 1.00 0.00 O ATOM 1160 CB ASN A 197 31.766 10.380 -11.685 1.00 0.00 C ATOM 1161 CG ASN A 197 32.134 11.065 -10.383 1.00 0.00 C ATOM 1162 OD1 ASN A 197 33.306 11.336 -10.121 1.00 0.00 O ATOM 1163 ND2 ASN A 197 31.131 11.347 -9.559 1.00 0.00 N ATOM 0 H ASN A 197 33.159 8.129 -11.114 1.00 0.00 H new ATOM 0 HA ASN A 197 30.328 8.982 -10.911 1.00 0.00 H new ATOM 0 HB2 ASN A 197 32.636 10.361 -12.341 1.00 0.00 H new ATOM 0 HB3 ASN A 197 30.997 10.961 -12.193 1.00 0.00 H new ATOM 0 HD21 ASN A 197 31.317 11.807 -8.668 1.00 0.00 H new ATOM 0 HD22 ASN A 197 30.175 11.104 -9.818 1.00 0.00 H new ATOM 1170 N PHE A 198 29.942 8.734 -13.494 1.00 0.00 N ATOM 1171 CA PHE A 198 29.578 8.183 -14.794 1.00 0.00 C ATOM 1172 C PHE A 198 29.799 9.210 -15.901 1.00 0.00 C ATOM 1173 O PHE A 198 29.376 10.361 -15.790 1.00 0.00 O ATOM 1174 CB PHE A 198 28.117 7.730 -14.788 1.00 0.00 C ATOM 1175 CG PHE A 198 27.173 8.755 -14.227 1.00 0.00 C ATOM 1176 CD1 PHE A 198 26.601 9.712 -15.048 1.00 0.00 C ATOM 1177 CD2 PHE A 198 26.859 8.761 -12.877 1.00 0.00 C ATOM 1178 CE1 PHE A 198 25.732 10.657 -14.535 1.00 0.00 C ATOM 1179 CE2 PHE A 198 25.990 9.702 -12.358 1.00 0.00 C ATOM 1180 CZ PHE A 198 25.427 10.652 -13.188 1.00 0.00 C ATOM 0 H PHE A 198 29.325 9.476 -13.163 1.00 0.00 H new ATOM 0 HA PHE A 198 30.218 7.322 -14.988 1.00 0.00 H new ATOM 0 HB2 PHE A 198 27.815 7.490 -15.808 1.00 0.00 H new ATOM 0 HB3 PHE A 198 28.032 6.812 -14.206 1.00 0.00 H new ATOM 0 HD1 PHE A 198 26.837 9.720 -16.102 1.00 0.00 H new ATOM 0 HD2 PHE A 198 27.298 8.022 -12.223 1.00 0.00 H new ATOM 0 HE1 PHE A 198 25.292 11.398 -15.186 1.00 0.00 H new ATOM 0 HE2 PHE A 198 25.751 9.695 -11.305 1.00 0.00 H new ATOM 0 HZ PHE A 198 24.749 11.390 -12.784 1.00 0.00 H new ATOM 1190 N THR A 199 30.466 8.785 -16.970 1.00 0.00 N ATOM 1191 CA THR A 199 30.745 9.666 -18.096 1.00 0.00 C ATOM 1192 C THR A 199 29.530 9.796 -19.008 1.00 0.00 C ATOM 1193 O THR A 199 28.594 9.002 -18.924 1.00 0.00 O ATOM 1194 CB THR A 199 31.941 9.158 -18.924 1.00 0.00 C ATOM 1195 OG1 THR A 199 31.750 7.781 -19.266 1.00 0.00 O ATOM 1196 CG2 THR A 199 33.241 9.318 -18.150 1.00 0.00 C ATOM 0 H THR A 199 30.823 7.836 -17.079 1.00 0.00 H new ATOM 0 HA THR A 199 30.989 10.643 -17.679 1.00 0.00 H new ATOM 0 HB THR A 199 32.003 9.753 -19.835 1.00 0.00 H new ATOM 0 HG1 THR A 199 32.513 7.466 -19.794 1.00 0.00 H new ATOM 0 HG21 THR A 199 34.071 8.953 -18.754 1.00 0.00 H new ATOM 0 HG22 THR A 199 33.398 10.371 -17.916 1.00 0.00 H new ATOM 0 HG23 THR A 199 33.186 8.745 -17.224 1.00 0.00 H new ATOM 1204 N GLU A 200 29.553 10.802 -19.877 1.00 0.00 N ATOM 1205 CA GLU A 200 28.451 11.034 -20.804 1.00 0.00 C ATOM 1206 C GLU A 200 28.292 9.859 -21.765 1.00 0.00 C ATOM 1207 O GLU A 200 27.194 9.582 -22.249 1.00 0.00 O ATOM 1208 CB GLU A 200 28.683 12.325 -21.592 1.00 0.00 C ATOM 1209 CG GLU A 200 30.062 12.413 -22.223 1.00 0.00 C ATOM 1210 CD GLU A 200 30.050 13.143 -23.552 1.00 0.00 C ATOM 1211 OE1 GLU A 200 29.372 12.664 -24.485 1.00 0.00 O ATOM 1212 OE2 GLU A 200 30.718 14.193 -23.660 1.00 0.00 O ATOM 0 H GLU A 200 30.321 11.468 -19.958 1.00 0.00 H new ATOM 0 HA GLU A 200 27.534 11.131 -20.223 1.00 0.00 H new ATOM 0 HB2 GLU A 200 27.929 12.403 -22.375 1.00 0.00 H new ATOM 0 HB3 GLU A 200 28.542 13.177 -20.927 1.00 0.00 H new ATOM 0 HG2 GLU A 200 30.739 12.924 -21.538 1.00 0.00 H new ATOM 0 HG3 GLU A 200 30.456 11.407 -22.369 1.00 0.00 H new ATOM 1219 N THR A 201 29.397 9.172 -22.038 1.00 0.00 N ATOM 1220 CA THR A 201 29.381 8.029 -22.942 1.00 0.00 C ATOM 1221 C THR A 201 28.850 6.782 -22.244 1.00 0.00 C ATOM 1222 O THR A 201 28.031 6.050 -22.799 1.00 0.00 O ATOM 1223 CB THR A 201 30.788 7.732 -23.496 1.00 0.00 C ATOM 1224 OG1 THR A 201 31.365 8.928 -24.033 1.00 0.00 O ATOM 1225 CG2 THR A 201 30.729 6.662 -24.576 1.00 0.00 C ATOM 0 H THR A 201 30.314 9.387 -21.646 1.00 0.00 H new ATOM 0 HA THR A 201 28.719 8.289 -23.768 1.00 0.00 H new ATOM 0 HB THR A 201 31.408 7.366 -22.677 1.00 0.00 H new ATOM 0 HG1 THR A 201 32.260 8.732 -24.382 1.00 0.00 H new ATOM 0 HG21 THR A 201 31.734 6.469 -24.952 1.00 0.00 H new ATOM 0 HG22 THR A 201 30.316 5.744 -24.157 1.00 0.00 H new ATOM 0 HG23 THR A 201 30.095 7.005 -25.394 1.00 0.00 H new ATOM 1233 N ASP A 202 29.320 6.548 -21.024 1.00 0.00 N ATOM 1234 CA ASP A 202 28.890 5.390 -20.248 1.00 0.00 C ATOM 1235 C ASP A 202 27.410 5.493 -19.892 1.00 0.00 C ATOM 1236 O ASP A 202 26.662 4.523 -20.015 1.00 0.00 O ATOM 1237 CB ASP A 202 29.726 5.264 -18.974 1.00 0.00 C ATOM 1238 CG ASP A 202 29.400 4.008 -18.189 1.00 0.00 C ATOM 1239 OD1 ASP A 202 28.952 3.021 -18.809 1.00 0.00 O ATOM 1240 OD2 ASP A 202 29.591 4.013 -16.955 1.00 0.00 O ATOM 0 H ASP A 202 29.999 7.144 -20.551 1.00 0.00 H new ATOM 0 HA ASP A 202 29.037 4.500 -20.859 1.00 0.00 H new ATOM 0 HB2 ASP A 202 30.784 5.261 -19.236 1.00 0.00 H new ATOM 0 HB3 ASP A 202 29.556 6.137 -18.344 1.00 0.00 H new ATOM 1245 N VAL A 203 26.994 6.676 -19.450 1.00 0.00 N ATOM 1246 CA VAL A 203 25.604 6.906 -19.076 1.00 0.00 C ATOM 1247 C VAL A 203 24.680 6.766 -20.281 1.00 0.00 C ATOM 1248 O VAL A 203 23.531 6.343 -20.151 1.00 0.00 O ATOM 1249 CB VAL A 203 25.413 8.304 -18.457 1.00 0.00 C ATOM 1250 CG1 VAL A 203 25.740 9.387 -19.474 1.00 0.00 C ATOM 1251 CG2 VAL A 203 23.995 8.464 -17.931 1.00 0.00 C ATOM 0 H VAL A 203 27.600 7.489 -19.342 1.00 0.00 H new ATOM 0 HA VAL A 203 25.347 6.150 -18.334 1.00 0.00 H new ATOM 0 HB VAL A 203 26.101 8.408 -17.618 1.00 0.00 H new ATOM 0 HG11 VAL A 203 25.599 10.368 -19.019 1.00 0.00 H new ATOM 0 HG12 VAL A 203 26.776 9.282 -19.797 1.00 0.00 H new ATOM 0 HG13 VAL A 203 25.079 9.289 -20.335 1.00 0.00 H new ATOM 0 HG21 VAL A 203 23.878 9.457 -17.497 1.00 0.00 H new ATOM 0 HG22 VAL A 203 23.287 8.340 -18.750 1.00 0.00 H new ATOM 0 HG23 VAL A 203 23.803 7.710 -17.168 1.00 0.00 H new ATOM 1261 N LYS A 204 25.190 7.122 -21.455 1.00 0.00 N ATOM 1262 CA LYS A 204 24.413 7.035 -22.685 1.00 0.00 C ATOM 1263 C LYS A 204 24.150 5.580 -23.061 1.00 0.00 C ATOM 1264 O LYS A 204 23.034 5.216 -23.430 1.00 0.00 O ATOM 1265 CB LYS A 204 25.146 7.743 -23.827 1.00 0.00 C ATOM 1266 CG LYS A 204 24.843 9.229 -23.915 1.00 0.00 C ATOM 1267 CD LYS A 204 23.735 9.514 -24.914 1.00 0.00 C ATOM 1268 CE LYS A 204 24.295 9.957 -26.257 1.00 0.00 C ATOM 1269 NZ LYS A 204 23.232 10.488 -27.154 1.00 0.00 N ATOM 0 H LYS A 204 26.139 7.474 -21.580 1.00 0.00 H new ATOM 0 HA LYS A 204 23.455 7.527 -22.515 1.00 0.00 H new ATOM 0 HB2 LYS A 204 26.220 7.607 -23.698 1.00 0.00 H new ATOM 0 HB3 LYS A 204 24.875 7.269 -24.770 1.00 0.00 H new ATOM 0 HG2 LYS A 204 24.553 9.601 -22.932 1.00 0.00 H new ATOM 0 HG3 LYS A 204 25.744 9.768 -24.206 1.00 0.00 H new ATOM 0 HD2 LYS A 204 23.127 8.620 -25.049 1.00 0.00 H new ATOM 0 HD3 LYS A 204 23.078 10.289 -24.519 1.00 0.00 H new ATOM 0 HE2 LYS A 204 25.053 10.724 -26.099 1.00 0.00 H new ATOM 0 HE3 LYS A 204 24.790 9.114 -26.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 23.655 10.779 -28.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 22.521 9.748 -27.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 22.777 11.308 -26.705 1.00 0.00 H new ATOM 1283 N MET A 205 25.185 4.752 -22.963 1.00 0.00 N ATOM 1284 CA MET A 205 25.064 3.336 -23.290 1.00 0.00 C ATOM 1285 C MET A 205 24.099 2.638 -22.336 1.00 0.00 C ATOM 1286 O MET A 205 23.287 1.813 -22.755 1.00 0.00 O ATOM 1287 CB MET A 205 26.435 2.659 -23.233 1.00 0.00 C ATOM 1288 CG MET A 205 27.337 3.014 -24.403 1.00 0.00 C ATOM 1289 SD MET A 205 28.329 1.616 -24.965 1.00 0.00 S ATOM 1290 CE MET A 205 29.938 2.060 -24.316 1.00 0.00 C ATOM 0 H MET A 205 26.116 5.037 -22.660 1.00 0.00 H new ATOM 0 HA MET A 205 24.668 3.255 -24.302 1.00 0.00 H new ATOM 0 HB2 MET A 205 26.931 2.940 -22.304 1.00 0.00 H new ATOM 0 HB3 MET A 205 26.297 1.578 -23.206 1.00 0.00 H new ATOM 0 HG2 MET A 205 26.727 3.377 -25.230 1.00 0.00 H new ATOM 0 HG3 MET A 205 27.998 3.830 -24.112 1.00 0.00 H new ATOM 0 HE1 MET A 205 30.663 1.290 -24.582 1.00 0.00 H new ATOM 0 HE2 MET A 205 30.251 3.014 -24.740 1.00 0.00 H new ATOM 0 HE3 MET A 205 29.882 2.146 -23.231 1.00 0.00 H new ATOM 1300 N MET A 206 24.194 2.975 -21.054 1.00 0.00 N ATOM 1301 CA MET A 206 23.328 2.381 -20.042 1.00 0.00 C ATOM 1302 C MET A 206 21.865 2.716 -20.314 1.00 0.00 C ATOM 1303 O MET A 206 20.982 1.881 -20.123 1.00 0.00 O ATOM 1304 CB MET A 206 23.726 2.870 -18.649 1.00 0.00 C ATOM 1305 CG MET A 206 24.924 2.138 -18.066 1.00 0.00 C ATOM 1306 SD MET A 206 24.989 2.233 -16.267 1.00 0.00 S ATOM 1307 CE MET A 206 25.142 4.001 -16.027 1.00 0.00 C ATOM 0 H MET A 206 24.861 3.656 -20.691 1.00 0.00 H new ATOM 0 HA MET A 206 23.448 1.299 -20.086 1.00 0.00 H new ATOM 0 HB2 MET A 206 23.950 3.936 -18.698 1.00 0.00 H new ATOM 0 HB3 MET A 206 22.877 2.753 -17.976 1.00 0.00 H new ATOM 0 HG2 MET A 206 24.888 1.092 -18.369 1.00 0.00 H new ATOM 0 HG3 MET A 206 25.839 2.559 -18.481 1.00 0.00 H new ATOM 0 HE1 MET A 206 25.301 4.212 -14.970 1.00 0.00 H new ATOM 0 HE2 MET A 206 25.989 4.374 -16.603 1.00 0.00 H new ATOM 0 HE3 MET A 206 24.230 4.494 -16.362 1.00 0.00 H new ATOM 1317 N GLU A 207 21.617 3.944 -20.759 1.00 0.00 N ATOM 1318 CA GLU A 207 20.260 4.389 -21.055 1.00 0.00 C ATOM 1319 C GLU A 207 19.695 3.646 -22.262 1.00 0.00 C ATOM 1320 O GLU A 207 18.481 3.489 -22.395 1.00 0.00 O ATOM 1321 CB GLU A 207 20.240 5.897 -21.315 1.00 0.00 C ATOM 1322 CG GLU A 207 20.479 6.733 -20.069 1.00 0.00 C ATOM 1323 CD GLU A 207 19.292 7.608 -19.717 1.00 0.00 C ATOM 1324 OE1 GLU A 207 18.229 7.053 -19.367 1.00 0.00 O ATOM 1325 OE2 GLU A 207 19.426 8.847 -19.791 1.00 0.00 O ATOM 0 H GLU A 207 22.337 4.648 -20.922 1.00 0.00 H new ATOM 0 HA GLU A 207 19.635 4.168 -20.189 1.00 0.00 H new ATOM 0 HB2 GLU A 207 21.001 6.139 -22.056 1.00 0.00 H new ATOM 0 HB3 GLU A 207 19.277 6.170 -21.746 1.00 0.00 H new ATOM 0 HG2 GLU A 207 20.700 6.073 -19.230 1.00 0.00 H new ATOM 0 HG3 GLU A 207 21.357 7.361 -20.221 1.00 0.00 H new ATOM 1332 N ARG A 208 20.584 3.191 -23.139 1.00 0.00 N ATOM 1333 CA ARG A 208 20.175 2.466 -24.335 1.00 0.00 C ATOM 1334 C ARG A 208 19.434 1.183 -23.968 1.00 0.00 C ATOM 1335 O ARG A 208 18.449 0.817 -24.608 1.00 0.00 O ATOM 1336 CB ARG A 208 21.394 2.134 -25.198 1.00 0.00 C ATOM 1337 CG ARG A 208 21.252 2.570 -26.647 1.00 0.00 C ATOM 1338 CD ARG A 208 21.984 1.626 -27.588 1.00 0.00 C ATOM 1339 NE ARG A 208 21.159 1.244 -28.731 1.00 0.00 N ATOM 1340 CZ ARG A 208 20.863 2.066 -29.731 1.00 0.00 C ATOM 1341 NH1 ARG A 208 21.322 3.310 -29.730 1.00 0.00 N ATOM 1342 NH2 ARG A 208 20.106 1.644 -30.736 1.00 0.00 N ATOM 0 H ARG A 208 21.592 3.312 -23.043 1.00 0.00 H new ATOM 0 HA ARG A 208 19.499 3.105 -24.903 1.00 0.00 H new ATOM 0 HB2 ARG A 208 22.274 2.613 -24.768 1.00 0.00 H new ATOM 0 HB3 ARG A 208 21.569 1.059 -25.167 1.00 0.00 H new ATOM 0 HG2 ARG A 208 20.196 2.606 -26.915 1.00 0.00 H new ATOM 0 HG3 ARG A 208 21.645 3.580 -26.764 1.00 0.00 H new ATOM 0 HD2 ARG A 208 22.897 2.104 -27.943 1.00 0.00 H new ATOM 0 HD3 ARG A 208 22.284 0.731 -27.043 1.00 0.00 H new ATOM 0 HE ARG A 208 20.790 0.294 -28.763 1.00 0.00 H new ATOM 0 HH11 ARG A 208 21.904 3.638 -28.960 1.00 0.00 H new ATOM 0 HH12 ARG A 208 21.093 3.939 -30.500 1.00 0.00 H new ATOM 0 HH21 ARG A 208 19.751 0.688 -30.741 1.00 0.00 H new ATOM 0 HH22 ARG A 208 19.879 2.276 -31.504 1.00 0.00 H new ATOM 1356 N VAL A 209 19.916 0.504 -22.932 1.00 0.00 N ATOM 1357 CA VAL A 209 19.300 -0.737 -22.478 1.00 0.00 C ATOM 1358 C VAL A 209 17.961 -0.471 -21.801 1.00 0.00 C ATOM 1359 O VAL A 209 16.968 -1.144 -22.078 1.00 0.00 O ATOM 1360 CB VAL A 209 20.217 -1.493 -21.498 1.00 0.00 C ATOM 1361 CG1 VAL A 209 19.553 -2.780 -21.030 1.00 0.00 C ATOM 1362 CG2 VAL A 209 21.563 -1.783 -22.144 1.00 0.00 C ATOM 0 H VAL A 209 20.731 0.793 -22.391 1.00 0.00 H new ATOM 0 HA VAL A 209 19.140 -1.353 -23.363 1.00 0.00 H new ATOM 0 HB VAL A 209 20.387 -0.862 -20.626 1.00 0.00 H new ATOM 0 HG11 VAL A 209 20.215 -3.301 -20.338 1.00 0.00 H new ATOM 0 HG12 VAL A 209 18.616 -2.544 -20.526 1.00 0.00 H new ATOM 0 HG13 VAL A 209 19.351 -3.419 -21.890 1.00 0.00 H new ATOM 0 HG21 VAL A 209 22.198 -2.317 -21.437 1.00 0.00 H new ATOM 0 HG22 VAL A 209 21.415 -2.395 -23.034 1.00 0.00 H new ATOM 0 HG23 VAL A 209 22.042 -0.845 -22.424 1.00 0.00 H new ATOM 1372 N VAL A 210 17.940 0.517 -20.911 1.00 0.00 N ATOM 1373 CA VAL A 210 16.721 0.875 -20.195 1.00 0.00 C ATOM 1374 C VAL A 210 15.586 1.188 -21.164 1.00 0.00 C ATOM 1375 O VAL A 210 14.421 0.913 -20.878 1.00 0.00 O ATOM 1376 CB VAL A 210 16.947 2.090 -19.276 1.00 0.00 C ATOM 1377 CG1 VAL A 210 15.663 2.452 -18.545 1.00 0.00 C ATOM 1378 CG2 VAL A 210 18.071 1.811 -18.291 1.00 0.00 C ATOM 0 H VAL A 210 18.753 1.083 -20.669 1.00 0.00 H new ATOM 0 HA VAL A 210 16.447 0.014 -19.586 1.00 0.00 H new ATOM 0 HB VAL A 210 17.238 2.941 -19.892 1.00 0.00 H new ATOM 0 HG11 VAL A 210 15.842 3.313 -17.900 1.00 0.00 H new ATOM 0 HG12 VAL A 210 14.888 2.697 -19.271 1.00 0.00 H new ATOM 0 HG13 VAL A 210 15.338 1.606 -17.939 1.00 0.00 H new ATOM 0 HG21 VAL A 210 18.217 2.680 -17.650 1.00 0.00 H new ATOM 0 HG22 VAL A 210 17.812 0.947 -17.678 1.00 0.00 H new ATOM 0 HG23 VAL A 210 18.991 1.605 -18.838 1.00 0.00 H new ATOM 1388 N GLU A 211 15.935 1.763 -22.310 1.00 0.00 N ATOM 1389 CA GLU A 211 14.944 2.113 -23.321 1.00 0.00 C ATOM 1390 C GLU A 211 14.100 0.899 -23.698 1.00 0.00 C ATOM 1391 O GLU A 211 12.874 0.925 -23.586 1.00 0.00 O ATOM 1392 CB GLU A 211 15.631 2.677 -24.567 1.00 0.00 C ATOM 1393 CG GLU A 211 14.663 3.078 -25.667 1.00 0.00 C ATOM 1394 CD GLU A 211 15.293 4.003 -26.690 1.00 0.00 C ATOM 1395 OE1 GLU A 211 16.253 3.575 -27.364 1.00 0.00 O ATOM 1396 OE2 GLU A 211 14.826 5.154 -26.816 1.00 0.00 O ATOM 0 H GLU A 211 16.896 1.996 -22.562 1.00 0.00 H new ATOM 0 HA GLU A 211 14.287 2.875 -22.901 1.00 0.00 H new ATOM 0 HB2 GLU A 211 16.224 3.546 -24.282 1.00 0.00 H new ATOM 0 HB3 GLU A 211 16.324 1.932 -24.958 1.00 0.00 H new ATOM 0 HG2 GLU A 211 14.298 2.182 -26.169 1.00 0.00 H new ATOM 0 HG3 GLU A 211 13.797 3.569 -25.223 1.00 0.00 H new ATOM 1403 N GLN A 212 14.765 -0.161 -24.146 1.00 0.00 N ATOM 1404 CA GLN A 212 14.075 -1.384 -24.541 1.00 0.00 C ATOM 1405 C GLN A 212 13.575 -2.146 -23.318 1.00 0.00 C ATOM 1406 O GLN A 212 12.574 -2.859 -23.386 1.00 0.00 O ATOM 1407 CB GLN A 212 15.005 -2.274 -25.367 1.00 0.00 C ATOM 1408 CG GLN A 212 14.475 -2.582 -26.758 1.00 0.00 C ATOM 1409 CD GLN A 212 14.166 -1.330 -27.554 1.00 0.00 C ATOM 1410 OE1 GLN A 212 13.030 -1.115 -27.979 1.00 0.00 O ATOM 1411 NE2 GLN A 212 15.177 -0.495 -27.762 1.00 0.00 N ATOM 0 H GLN A 212 15.780 -0.198 -24.245 1.00 0.00 H new ATOM 0 HA GLN A 212 13.214 -1.106 -25.149 1.00 0.00 H new ATOM 0 HB2 GLN A 212 15.976 -1.786 -25.457 1.00 0.00 H new ATOM 0 HB3 GLN A 212 15.167 -3.210 -24.833 1.00 0.00 H new ATOM 0 HG2 GLN A 212 15.209 -3.180 -27.298 1.00 0.00 H new ATOM 0 HG3 GLN A 212 13.572 -3.186 -26.673 1.00 0.00 H new ATOM 0 HE21 GLN A 212 16.102 -0.712 -27.392 1.00 0.00 H new ATOM 0 HE22 GLN A 212 15.028 0.364 -28.292 1.00 0.00 H new ATOM 1420 N MET A 213 14.279 -1.990 -22.201 1.00 0.00 N ATOM 1421 CA MET A 213 13.905 -2.664 -20.963 1.00 0.00 C ATOM 1422 C MET A 213 12.433 -2.430 -20.640 1.00 0.00 C ATOM 1423 O MET A 213 11.670 -3.378 -20.452 1.00 0.00 O ATOM 1424 CB MET A 213 14.777 -2.171 -19.806 1.00 0.00 C ATOM 1425 CG MET A 213 14.845 -3.144 -18.640 1.00 0.00 C ATOM 1426 SD MET A 213 16.523 -3.715 -18.309 1.00 0.00 S ATOM 1427 CE MET A 213 17.338 -2.167 -17.926 1.00 0.00 C ATOM 0 H MET A 213 15.110 -1.404 -22.128 1.00 0.00 H new ATOM 0 HA MET A 213 14.064 -3.734 -21.099 1.00 0.00 H new ATOM 0 HB2 MET A 213 15.786 -1.987 -20.175 1.00 0.00 H new ATOM 0 HB3 MET A 213 14.389 -1.217 -19.450 1.00 0.00 H new ATOM 0 HG2 MET A 213 14.446 -2.663 -17.747 1.00 0.00 H new ATOM 0 HG3 MET A 213 14.208 -4.003 -18.851 1.00 0.00 H new ATOM 0 HE1 MET A 213 18.288 -2.369 -17.431 1.00 0.00 H new ATOM 0 HE2 MET A 213 17.520 -1.614 -18.847 1.00 0.00 H new ATOM 0 HE3 MET A 213 16.703 -1.575 -17.266 1.00 0.00 H new ATOM 1437 N CYS A 214 12.039 -1.163 -20.577 1.00 0.00 N ATOM 1438 CA CYS A 214 10.659 -0.804 -20.276 1.00 0.00 C ATOM 1439 C CYS A 214 9.717 -1.299 -21.370 1.00 0.00 C ATOM 1440 O CYS A 214 8.549 -1.591 -21.113 1.00 0.00 O ATOM 1441 CB CYS A 214 10.526 0.712 -20.121 1.00 0.00 C ATOM 1442 SG CYS A 214 10.576 1.628 -21.695 1.00 0.00 S ATOM 0 H CYS A 214 12.657 -0.366 -20.731 1.00 0.00 H new ATOM 0 HA CYS A 214 10.382 -1.284 -19.337 1.00 0.00 H new ATOM 0 HB2 CYS A 214 9.587 0.934 -19.614 1.00 0.00 H new ATOM 0 HB3 CYS A 214 11.329 1.072 -19.478 1.00 0.00 H new ATOM 0 HG CYS A 214 11.533 1.160 -22.439 1.00 0.00 H new ATOM 1447 N ILE A 215 10.235 -1.391 -22.591 1.00 0.00 N ATOM 1448 CA ILE A 215 9.441 -1.852 -23.723 1.00 0.00 C ATOM 1449 C ILE A 215 9.190 -3.354 -23.644 1.00 0.00 C ATOM 1450 O ILE A 215 8.159 -3.849 -24.101 1.00 0.00 O ATOM 1451 CB ILE A 215 10.130 -1.528 -25.062 1.00 0.00 C ATOM 1452 CG1 ILE A 215 10.279 -0.015 -25.231 1.00 0.00 C ATOM 1453 CG2 ILE A 215 9.341 -2.120 -26.220 1.00 0.00 C ATOM 1454 CD1 ILE A 215 8.958 0.712 -25.359 1.00 0.00 C ATOM 0 H ILE A 215 11.200 -1.153 -22.821 1.00 0.00 H new ATOM 0 HA ILE A 215 8.488 -1.324 -23.676 1.00 0.00 H new ATOM 0 HB ILE A 215 11.125 -1.974 -25.059 1.00 0.00 H new ATOM 0 HG12 ILE A 215 10.824 0.386 -24.376 1.00 0.00 H new ATOM 0 HG13 ILE A 215 10.882 0.186 -26.116 1.00 0.00 H new ATOM 0 HG21 ILE A 215 9.840 -1.883 -27.159 1.00 0.00 H new ATOM 0 HG22 ILE A 215 9.281 -3.202 -26.104 1.00 0.00 H new ATOM 0 HG23 ILE A 215 8.335 -1.700 -26.227 1.00 0.00 H new ATOM 0 HD11 ILE A 215 9.140 1.780 -25.476 1.00 0.00 H new ATOM 0 HD12 ILE A 215 8.420 0.338 -26.230 1.00 0.00 H new ATOM 0 HD13 ILE A 215 8.361 0.542 -24.463 1.00 0.00 H new ATOM 1466 N THR A 216 10.140 -4.077 -23.058 1.00 0.00 N ATOM 1467 CA THR A 216 10.023 -5.523 -22.918 1.00 0.00 C ATOM 1468 C THR A 216 8.720 -5.904 -22.223 1.00 0.00 C ATOM 1469 O THR A 216 8.100 -6.913 -22.558 1.00 0.00 O ATOM 1470 CB THR A 216 11.206 -6.108 -22.123 1.00 0.00 C ATOM 1471 OG1 THR A 216 12.437 -5.819 -22.794 1.00 0.00 O ATOM 1472 CG2 THR A 216 11.054 -7.613 -21.956 1.00 0.00 C ATOM 0 H THR A 216 10.999 -3.684 -22.673 1.00 0.00 H new ATOM 0 HA THR A 216 10.030 -5.940 -23.925 1.00 0.00 H new ATOM 0 HB THR A 216 11.215 -5.648 -21.135 1.00 0.00 H new ATOM 0 HG1 THR A 216 12.545 -4.848 -22.876 1.00 0.00 H new ATOM 0 HG21 THR A 216 11.901 -8.004 -21.392 1.00 0.00 H new ATOM 0 HG22 THR A 216 10.130 -7.828 -21.419 1.00 0.00 H new ATOM 0 HG23 THR A 216 11.022 -8.087 -22.937 1.00 0.00 H new ATOM 1480 N GLN A 217 8.312 -5.091 -21.254 1.00 0.00 N ATOM 1481 CA GLN A 217 7.082 -5.344 -20.512 1.00 0.00 C ATOM 1482 C GLN A 217 5.900 -5.516 -21.461 1.00 0.00 C ATOM 1483 O GLN A 217 4.949 -6.236 -21.158 1.00 0.00 O ATOM 1484 CB GLN A 217 6.806 -4.199 -19.536 1.00 0.00 C ATOM 1485 CG GLN A 217 7.517 -4.353 -18.202 1.00 0.00 C ATOM 1486 CD GLN A 217 6.584 -4.794 -17.091 1.00 0.00 C ATOM 1487 OE1 GLN A 217 5.606 -5.502 -17.330 1.00 0.00 O ATOM 1488 NE2 GLN A 217 6.883 -4.377 -15.866 1.00 0.00 N ATOM 0 H GLN A 217 8.815 -4.252 -20.964 1.00 0.00 H new ATOM 0 HA GLN A 217 7.210 -6.269 -19.949 1.00 0.00 H new ATOM 0 HB2 GLN A 217 7.112 -3.259 -19.995 1.00 0.00 H new ATOM 0 HB3 GLN A 217 5.732 -4.133 -19.361 1.00 0.00 H new ATOM 0 HG2 GLN A 217 8.322 -5.081 -18.306 1.00 0.00 H new ATOM 0 HG3 GLN A 217 7.978 -3.404 -17.929 1.00 0.00 H new ATOM 0 HE21 GLN A 217 7.704 -3.791 -15.713 1.00 0.00 H new ATOM 0 HE22 GLN A 217 6.292 -4.643 -15.078 1.00 0.00 H new ATOM 1497 N TYR A 218 5.967 -4.850 -22.608 1.00 0.00 N ATOM 1498 CA TYR A 218 4.901 -4.928 -23.600 1.00 0.00 C ATOM 1499 C TYR A 218 5.376 -5.654 -24.855 1.00 0.00 C ATOM 1500 O TYR A 218 6.168 -5.121 -25.631 1.00 0.00 O ATOM 1501 CB TYR A 218 4.412 -3.525 -23.964 1.00 0.00 C ATOM 1502 CG TYR A 218 4.181 -2.634 -22.764 1.00 0.00 C ATOM 1503 CD1 TYR A 218 3.045 -2.776 -21.977 1.00 0.00 C ATOM 1504 CD2 TYR A 218 5.098 -1.649 -22.418 1.00 0.00 C ATOM 1505 CE1 TYR A 218 2.829 -1.964 -20.880 1.00 0.00 C ATOM 1506 CE2 TYR A 218 4.891 -0.834 -21.322 1.00 0.00 C ATOM 1507 CZ TYR A 218 3.755 -0.995 -20.557 1.00 0.00 C ATOM 1508 OH TYR A 218 3.545 -0.184 -19.466 1.00 0.00 O ATOM 0 H TYR A 218 6.748 -4.250 -22.874 1.00 0.00 H new ATOM 0 HA TYR A 218 4.076 -5.493 -23.166 1.00 0.00 H new ATOM 0 HB2 TYR A 218 5.143 -3.054 -24.621 1.00 0.00 H new ATOM 0 HB3 TYR A 218 3.483 -3.608 -24.529 1.00 0.00 H new ATOM 0 HD1 TYR A 218 2.318 -3.534 -22.227 1.00 0.00 H new ATOM 0 HD2 TYR A 218 5.988 -1.518 -23.016 1.00 0.00 H new ATOM 0 HE1 TYR A 218 1.940 -2.088 -20.279 1.00 0.00 H new ATOM 0 HE2 TYR A 218 5.615 -0.075 -21.066 1.00 0.00 H new ATOM 0 HH TYR A 218 4.292 0.444 -19.377 1.00 0.00 H new