USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=23 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 157 TYR OH : rot 88:sc= 1.3 USER MOD Set 1.2: A 159 ASN : amide:sc= 0.732 K(o=2,f=-2.2) USER MOD Single : A 134 MET CE :methyl 180:sc= -0.189 (180deg=-0.189) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.169 X(o=-0.17,f=-0.062) USER MOD Single : A 143 SER OG : rot 180:sc= -0.0111 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 180:sc= -2.84! USER MOD Single : A 153 ASN : amide:sc= -0.497 K(o=-0.5,f=-3.4!) USER MOD Single : A 154 MET CE :methyl 150:sc= -0.19 (180deg=-1.4!) USER MOD Single : A 155 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.0014) USER MOD Single : A 160 GLN : amide:sc= -1.2 X(o=-1.2,f=-0.91) USER MOD Single : A 162 TYR OH : rot 180:sc= -0.141 USER MOD Single : A 174 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 178 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 179 CYS SG : rot 68:sc= 0.399 USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 66:sc= 0.129 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.0516 K(o=-0.052,f=-1.7!) USER MOD Single : A 187 HIS : no HD1:sc= -0.0687 X(o=-0.069,f=0) USER MOD Single : A 188 THR OG1 : rot 80:sc= 1.12 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 180:sc= -0.0829 USER MOD Single : A 192 THR OG1 : rot 180:sc= 0 USER MOD Single : A 193 THR OG1 : rot -77:sc= 1.24 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 170:sc= 0.0203 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 -174:sc= -0.139 (180deg=-0.159) USER MOD Single : A 206 MET CE :methyl -166:sc= -0.76 (180deg=-1.18) USER MOD Single : A 212 GLN : amide:sc= -0.0865 X(o=-0.086,f=-0.37) USER MOD Single : A 213 MET CE :methyl 138:sc= -3.31 (180deg=-7.88!) USER MOD Single : A 214 CYS SG : rot -35:sc= 0.846 USER MOD Single : A 216 THR OG1 : rot 66:sc= 1.27 USER MOD Single : A 217 GLN : amide:sc= 0 X(o=0,f=-0.0074) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 108 N ALA A 133 14.331 -11.070 -15.767 1.00 0.00 N ATOM 109 CA ALA A 133 15.438 -10.644 -16.615 1.00 0.00 C ATOM 110 C ALA A 133 15.136 -10.911 -18.085 1.00 0.00 C ATOM 111 O ALA A 133 14.052 -11.378 -18.431 1.00 0.00 O ATOM 112 CB ALA A 133 16.721 -11.348 -16.201 1.00 0.00 C ATOM 0 HA ALA A 133 15.569 -9.570 -16.487 1.00 0.00 H new ATOM 0 HB1 ALA A 133 17.539 -11.020 -16.843 1.00 0.00 H new ATOM 0 HB2 ALA A 133 16.952 -11.103 -15.164 1.00 0.00 H new ATOM 0 HB3 ALA A 133 16.592 -12.426 -16.299 1.00 0.00 H new ATOM 118 N MET A 134 16.103 -10.611 -18.947 1.00 0.00 N ATOM 119 CA MET A 134 15.940 -10.819 -20.381 1.00 0.00 C ATOM 120 C MET A 134 17.124 -11.590 -20.956 1.00 0.00 C ATOM 121 O MET A 134 18.254 -11.450 -20.488 1.00 0.00 O ATOM 122 CB MET A 134 15.792 -9.477 -21.099 1.00 0.00 C ATOM 123 CG MET A 134 14.625 -8.643 -20.596 1.00 0.00 C ATOM 124 SD MET A 134 15.117 -7.447 -19.340 1.00 0.00 S ATOM 125 CE MET A 134 13.650 -6.422 -19.256 1.00 0.00 C ATOM 0 H MET A 134 17.007 -10.223 -18.677 1.00 0.00 H new ATOM 0 HA MET A 134 15.036 -11.407 -20.538 1.00 0.00 H new ATOM 0 HB2 MET A 134 16.713 -8.907 -20.979 1.00 0.00 H new ATOM 0 HB3 MET A 134 15.665 -9.658 -22.166 1.00 0.00 H new ATOM 0 HG2 MET A 134 14.171 -8.116 -21.436 1.00 0.00 H new ATOM 0 HG3 MET A 134 13.862 -9.304 -20.184 1.00 0.00 H new ATOM 0 HE1 MET A 134 13.799 -5.633 -18.519 1.00 0.00 H new ATOM 0 HE2 MET A 134 13.461 -5.976 -20.233 1.00 0.00 H new ATOM 0 HE3 MET A 134 12.795 -7.033 -18.965 1.00 0.00 H new ATOM 135 N SER A 135 16.857 -12.403 -21.973 1.00 0.00 N ATOM 136 CA SER A 135 17.901 -13.198 -22.610 1.00 0.00 C ATOM 137 C SER A 135 18.831 -12.315 -23.435 1.00 0.00 C ATOM 138 O SER A 135 18.426 -11.263 -23.932 1.00 0.00 O ATOM 139 CB SER A 135 17.278 -14.276 -23.500 1.00 0.00 C ATOM 140 OG SER A 135 18.030 -15.476 -23.449 1.00 0.00 O ATOM 0 H SER A 135 15.927 -12.529 -22.374 1.00 0.00 H new ATOM 0 HA SER A 135 18.487 -13.678 -21.826 1.00 0.00 H new ATOM 0 HB2 SER A 135 16.255 -14.470 -23.179 1.00 0.00 H new ATOM 0 HB3 SER A 135 17.227 -13.918 -24.528 1.00 0.00 H new ATOM 0 HG SER A 135 17.611 -16.149 -24.024 1.00 0.00 H new ATOM 146 N ARG A 136 20.078 -12.750 -23.577 1.00 0.00 N ATOM 147 CA ARG A 136 21.067 -11.998 -24.342 1.00 0.00 C ATOM 148 C ARG A 136 21.285 -10.615 -23.737 1.00 0.00 C ATOM 149 O ARG A 136 20.845 -9.599 -24.276 1.00 0.00 O ATOM 150 CB ARG A 136 20.623 -11.866 -25.799 1.00 0.00 C ATOM 151 CG ARG A 136 21.194 -12.940 -26.710 1.00 0.00 C ATOM 152 CD ARG A 136 20.376 -13.082 -27.985 1.00 0.00 C ATOM 153 NE ARG A 136 19.295 -14.053 -27.837 1.00 0.00 N ATOM 154 CZ ARG A 136 18.621 -14.564 -28.861 1.00 0.00 C ATOM 155 NH1 ARG A 136 18.915 -14.199 -30.101 1.00 0.00 N ATOM 156 NH2 ARG A 136 17.651 -15.443 -28.645 1.00 0.00 N ATOM 0 H ARG A 136 20.428 -13.619 -23.173 1.00 0.00 H new ATOM 0 HA ARG A 136 22.010 -12.544 -24.305 1.00 0.00 H new ATOM 0 HB2 ARG A 136 19.535 -11.905 -25.843 1.00 0.00 H new ATOM 0 HB3 ARG A 136 20.922 -10.887 -26.174 1.00 0.00 H new ATOM 0 HG2 ARG A 136 22.225 -12.693 -26.963 1.00 0.00 H new ATOM 0 HG3 ARG A 136 21.215 -13.893 -26.182 1.00 0.00 H new ATOM 0 HD2 ARG A 136 19.958 -12.113 -28.257 1.00 0.00 H new ATOM 0 HD3 ARG A 136 21.029 -13.388 -28.802 1.00 0.00 H new ATOM 0 HE ARG A 136 19.044 -14.355 -26.896 1.00 0.00 H new ATOM 0 HH11 ARG A 136 19.661 -13.524 -30.271 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.396 -14.593 -30.885 1.00 0.00 H new ATOM 0 HH21 ARG A 136 17.423 -15.727 -27.692 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.134 -15.835 -29.432 1.00 0.00 H new ATOM 170 N PRO A 137 21.979 -10.572 -22.590 1.00 0.00 N ATOM 171 CA PRO A 137 22.270 -9.319 -21.887 1.00 0.00 C ATOM 172 C PRO A 137 23.273 -8.452 -22.640 1.00 0.00 C ATOM 173 O PRO A 137 23.404 -7.258 -22.366 1.00 0.00 O ATOM 174 CB PRO A 137 22.863 -9.789 -20.556 1.00 0.00 C ATOM 175 CG PRO A 137 23.428 -11.136 -20.848 1.00 0.00 C ATOM 176 CD PRO A 137 22.533 -11.744 -21.891 1.00 0.00 C ATOM 0 HA PRO A 137 21.382 -8.697 -21.778 1.00 0.00 H new ATOM 0 HB2 PRO A 137 23.634 -9.104 -20.202 1.00 0.00 H new ATOM 0 HB3 PRO A 137 22.101 -9.839 -19.779 1.00 0.00 H new ATOM 0 HG2 PRO A 137 24.453 -11.059 -21.211 1.00 0.00 H new ATOM 0 HG3 PRO A 137 23.453 -11.752 -19.949 1.00 0.00 H new ATOM 0 HD2 PRO A 137 23.089 -12.391 -22.570 1.00 0.00 H new ATOM 0 HD3 PRO A 137 21.748 -12.352 -21.442 1.00 0.00 H new ATOM 184 N ILE A 138 23.978 -9.058 -23.589 1.00 0.00 N ATOM 185 CA ILE A 138 24.968 -8.340 -24.382 1.00 0.00 C ATOM 186 C ILE A 138 24.308 -7.274 -25.249 1.00 0.00 C ATOM 187 O ILE A 138 23.265 -7.513 -25.859 1.00 0.00 O ATOM 188 CB ILE A 138 25.768 -9.297 -25.285 1.00 0.00 C ATOM 189 CG1 ILE A 138 26.950 -8.563 -25.922 1.00 0.00 C ATOM 190 CG2 ILE A 138 24.867 -9.892 -26.357 1.00 0.00 C ATOM 191 CD1 ILE A 138 28.020 -8.166 -24.929 1.00 0.00 C ATOM 0 H ILE A 138 23.882 -10.045 -23.828 1.00 0.00 H new ATOM 0 HA ILE A 138 25.650 -7.863 -23.679 1.00 0.00 H new ATOM 0 HB ILE A 138 26.157 -10.111 -24.673 1.00 0.00 H new ATOM 0 HG12 ILE A 138 27.394 -9.200 -26.687 1.00 0.00 H new ATOM 0 HG13 ILE A 138 26.583 -7.669 -26.426 1.00 0.00 H new ATOM 0 HG21 ILE A 138 25.447 -10.566 -26.987 1.00 0.00 H new ATOM 0 HG22 ILE A 138 24.056 -10.445 -25.884 1.00 0.00 H new ATOM 0 HG23 ILE A 138 24.452 -9.091 -26.969 1.00 0.00 H new ATOM 0 HD11 ILE A 138 28.827 -7.650 -25.450 1.00 0.00 H new ATOM 0 HD12 ILE A 138 27.591 -7.503 -24.178 1.00 0.00 H new ATOM 0 HD13 ILE A 138 28.414 -9.058 -24.443 1.00 0.00 H new ATOM 203 N ILE A 139 24.923 -6.097 -25.302 1.00 0.00 N ATOM 204 CA ILE A 139 24.397 -4.995 -26.097 1.00 0.00 C ATOM 205 C ILE A 139 25.355 -4.624 -27.224 1.00 0.00 C ATOM 206 O ILE A 139 26.574 -4.702 -27.068 1.00 0.00 O ATOM 207 CB ILE A 139 24.136 -3.749 -25.230 1.00 0.00 C ATOM 208 CG1 ILE A 139 23.348 -2.705 -26.024 1.00 0.00 C ATOM 209 CG2 ILE A 139 25.449 -3.165 -24.733 1.00 0.00 C ATOM 210 CD1 ILE A 139 22.096 -2.230 -25.320 1.00 0.00 C ATOM 0 H ILE A 139 25.787 -5.882 -24.803 1.00 0.00 H new ATOM 0 HA ILE A 139 23.453 -5.336 -26.522 1.00 0.00 H new ATOM 0 HB ILE A 139 23.542 -4.044 -24.365 1.00 0.00 H new ATOM 0 HG12 ILE A 139 23.992 -1.848 -26.221 1.00 0.00 H new ATOM 0 HG13 ILE A 139 23.074 -3.127 -26.991 1.00 0.00 H new ATOM 0 HG21 ILE A 139 25.248 -2.285 -24.122 1.00 0.00 H new ATOM 0 HG22 ILE A 139 25.975 -3.909 -24.135 1.00 0.00 H new ATOM 0 HG23 ILE A 139 26.067 -2.881 -25.585 1.00 0.00 H new ATOM 0 HD11 ILE A 139 21.588 -1.492 -25.940 1.00 0.00 H new ATOM 0 HD12 ILE A 139 21.432 -3.077 -25.147 1.00 0.00 H new ATOM 0 HD13 ILE A 139 22.365 -1.779 -24.365 1.00 0.00 H new ATOM 222 N HIS A 140 24.796 -4.219 -28.360 1.00 0.00 N ATOM 223 CA HIS A 140 25.601 -3.833 -29.514 1.00 0.00 C ATOM 224 C HIS A 140 26.663 -2.811 -29.118 1.00 0.00 C ATOM 225 O HIS A 140 26.346 -1.667 -28.791 1.00 0.00 O ATOM 226 CB HIS A 140 24.709 -3.259 -30.615 1.00 0.00 C ATOM 227 CG HIS A 140 25.265 -3.444 -31.993 1.00 0.00 C ATOM 228 ND1 HIS A 140 24.958 -2.609 -33.047 1.00 0.00 N ATOM 229 CD2 HIS A 140 26.116 -4.373 -32.487 1.00 0.00 C ATOM 230 CE1 HIS A 140 25.594 -3.019 -34.130 1.00 0.00 C ATOM 231 NE2 HIS A 140 26.304 -4.088 -33.817 1.00 0.00 N ATOM 0 H HIS A 140 23.789 -4.150 -28.506 1.00 0.00 H new ATOM 0 HA HIS A 140 26.103 -4.724 -29.891 1.00 0.00 H new ATOM 0 HB2 HIS A 140 23.729 -3.733 -30.561 1.00 0.00 H new ATOM 0 HB3 HIS A 140 24.559 -2.195 -30.432 1.00 0.00 H new ATOM 0 HD2 HIS A 140 26.564 -5.187 -31.937 1.00 0.00 H new ATOM 0 HE1 HIS A 140 25.542 -2.558 -35.105 1.00 0.00 H new ATOM 0 HE2 HIS A 140 26.896 -4.616 -34.459 1.00 0.00 H new ATOM 239 N PHE A 141 27.923 -3.232 -29.149 1.00 0.00 N ATOM 240 CA PHE A 141 29.031 -2.354 -28.792 1.00 0.00 C ATOM 241 C PHE A 141 29.013 -1.084 -29.637 1.00 0.00 C ATOM 242 O PHE A 141 28.750 0.007 -29.134 1.00 0.00 O ATOM 243 CB PHE A 141 30.365 -3.082 -28.972 1.00 0.00 C ATOM 244 CG PHE A 141 30.394 -4.444 -28.340 1.00 0.00 C ATOM 245 CD1 PHE A 141 30.181 -4.596 -26.979 1.00 0.00 C ATOM 246 CD2 PHE A 141 30.635 -5.573 -29.106 1.00 0.00 C ATOM 247 CE1 PHE A 141 30.208 -5.848 -26.394 1.00 0.00 C ATOM 248 CE2 PHE A 141 30.662 -6.828 -28.527 1.00 0.00 C ATOM 249 CZ PHE A 141 30.450 -6.965 -27.169 1.00 0.00 C ATOM 0 H PHE A 141 28.202 -4.176 -29.418 1.00 0.00 H new ATOM 0 HA PHE A 141 28.917 -2.074 -27.745 1.00 0.00 H new ATOM 0 HB2 PHE A 141 30.576 -3.180 -30.037 1.00 0.00 H new ATOM 0 HB3 PHE A 141 31.162 -2.474 -28.544 1.00 0.00 H new ATOM 0 HD1 PHE A 141 29.992 -3.726 -26.368 1.00 0.00 H new ATOM 0 HD2 PHE A 141 30.804 -5.471 -30.168 1.00 0.00 H new ATOM 0 HE1 PHE A 141 30.040 -5.953 -25.332 1.00 0.00 H new ATOM 0 HE2 PHE A 141 30.849 -7.700 -29.136 1.00 0.00 H new ATOM 0 HZ PHE A 141 30.473 -7.944 -26.714 1.00 0.00 H new ATOM 259 N GLY A 142 29.297 -1.236 -30.928 1.00 0.00 N ATOM 260 CA GLY A 142 29.310 -0.094 -31.823 1.00 0.00 C ATOM 261 C GLY A 142 30.685 0.533 -31.945 1.00 0.00 C ATOM 262 O GLY A 142 30.958 1.265 -32.896 1.00 0.00 O ATOM 0 H GLY A 142 29.518 -2.129 -31.369 1.00 0.00 H new ATOM 0 HA2 GLY A 142 28.968 -0.406 -32.810 1.00 0.00 H new ATOM 0 HA3 GLY A 142 28.604 0.654 -31.462 1.00 0.00 H new ATOM 266 N SER A 143 31.552 0.246 -30.979 1.00 0.00 N ATOM 267 CA SER A 143 32.904 0.791 -30.980 1.00 0.00 C ATOM 268 C SER A 143 33.876 -0.167 -30.298 1.00 0.00 C ATOM 269 O SER A 143 33.808 -0.380 -29.087 1.00 0.00 O ATOM 270 CB SER A 143 32.929 2.149 -30.275 1.00 0.00 C ATOM 271 OG SER A 143 31.621 2.570 -29.932 1.00 0.00 O ATOM 0 H SER A 143 31.342 -0.361 -30.186 1.00 0.00 H new ATOM 0 HA SER A 143 33.217 0.921 -32.016 1.00 0.00 H new ATOM 0 HB2 SER A 143 33.541 2.084 -29.375 1.00 0.00 H new ATOM 0 HB3 SER A 143 33.395 2.891 -30.924 1.00 0.00 H new ATOM 0 HG SER A 143 31.665 3.439 -29.482 1.00 0.00 H new ATOM 277 N ASP A 144 34.779 -0.742 -31.084 1.00 0.00 N ATOM 278 CA ASP A 144 35.767 -1.677 -30.557 1.00 0.00 C ATOM 279 C ASP A 144 36.575 -1.037 -29.432 1.00 0.00 C ATOM 280 O ASP A 144 37.087 -1.729 -28.551 1.00 0.00 O ATOM 281 CB ASP A 144 36.703 -2.145 -31.672 1.00 0.00 C ATOM 282 CG ASP A 144 36.476 -3.596 -32.048 1.00 0.00 C ATOM 283 OD1 ASP A 144 35.409 -3.900 -32.622 1.00 0.00 O ATOM 284 OD2 ASP A 144 37.364 -4.428 -31.769 1.00 0.00 O ATOM 0 H ASP A 144 34.848 -0.577 -32.088 1.00 0.00 H new ATOM 0 HA ASP A 144 35.236 -2.539 -30.153 1.00 0.00 H new ATOM 0 HB2 ASP A 144 36.558 -1.518 -32.552 1.00 0.00 H new ATOM 0 HB3 ASP A 144 37.737 -2.013 -31.354 1.00 0.00 H new ATOM 289 N TYR A 145 36.686 0.286 -29.469 1.00 0.00 N ATOM 290 CA TYR A 145 37.436 1.018 -28.456 1.00 0.00 C ATOM 291 C TYR A 145 36.702 1.002 -27.118 1.00 0.00 C ATOM 292 O TYR A 145 37.277 0.657 -26.087 1.00 0.00 O ATOM 293 CB TYR A 145 37.666 2.462 -28.906 1.00 0.00 C ATOM 294 CG TYR A 145 38.248 2.577 -30.297 1.00 0.00 C ATOM 295 CD1 TYR A 145 39.607 2.394 -30.520 1.00 0.00 C ATOM 296 CD2 TYR A 145 37.438 2.868 -31.388 1.00 0.00 C ATOM 297 CE1 TYR A 145 40.143 2.499 -31.789 1.00 0.00 C ATOM 298 CE2 TYR A 145 37.965 2.973 -32.660 1.00 0.00 C ATOM 299 CZ TYR A 145 39.318 2.788 -32.856 1.00 0.00 C ATOM 300 OH TYR A 145 39.847 2.892 -34.122 1.00 0.00 O ATOM 0 H TYR A 145 36.266 0.873 -30.190 1.00 0.00 H new ATOM 0 HA TYR A 145 38.400 0.526 -28.328 1.00 0.00 H new ATOM 0 HB2 TYR A 145 36.718 3.000 -28.872 1.00 0.00 H new ATOM 0 HB3 TYR A 145 38.336 2.952 -28.199 1.00 0.00 H new ATOM 0 HD1 TYR A 145 40.256 2.166 -29.687 1.00 0.00 H new ATOM 0 HD2 TYR A 145 36.378 3.015 -31.239 1.00 0.00 H new ATOM 0 HE1 TYR A 145 41.202 2.356 -31.945 1.00 0.00 H new ATOM 0 HE2 TYR A 145 37.321 3.199 -33.497 1.00 0.00 H new ATOM 0 HH TYR A 145 39.132 3.099 -34.759 1.00 0.00 H new ATOM 310 N GLU A 146 35.427 1.377 -27.146 1.00 0.00 N ATOM 311 CA GLU A 146 34.613 1.405 -25.936 1.00 0.00 C ATOM 312 C GLU A 146 34.284 -0.009 -25.467 1.00 0.00 C ATOM 313 O GLU A 146 34.127 -0.258 -24.272 1.00 0.00 O ATOM 314 CB GLU A 146 33.321 2.186 -26.182 1.00 0.00 C ATOM 315 CG GLU A 146 33.548 3.654 -26.504 1.00 0.00 C ATOM 316 CD GLU A 146 32.693 4.576 -25.657 1.00 0.00 C ATOM 317 OE1 GLU A 146 31.466 4.622 -25.885 1.00 0.00 O ATOM 318 OE2 GLU A 146 33.251 5.253 -24.768 1.00 0.00 O ATOM 0 H GLU A 146 34.936 1.665 -27.992 1.00 0.00 H new ATOM 0 HA GLU A 146 35.187 1.903 -25.155 1.00 0.00 H new ATOM 0 HB2 GLU A 146 32.777 1.722 -27.005 1.00 0.00 H new ATOM 0 HB3 GLU A 146 32.687 2.110 -25.299 1.00 0.00 H new ATOM 0 HG2 GLU A 146 34.599 3.897 -26.351 1.00 0.00 H new ATOM 0 HG3 GLU A 146 33.330 3.829 -27.558 1.00 0.00 H new ATOM 325 N ASP A 147 34.182 -0.932 -26.418 1.00 0.00 N ATOM 326 CA ASP A 147 33.872 -2.322 -26.104 1.00 0.00 C ATOM 327 C ASP A 147 34.868 -2.886 -25.096 1.00 0.00 C ATOM 328 O ASP A 147 34.521 -3.733 -24.273 1.00 0.00 O ATOM 329 CB ASP A 147 33.882 -3.169 -27.378 1.00 0.00 C ATOM 330 CG ASP A 147 33.789 -4.653 -27.086 1.00 0.00 C ATOM 331 OD1 ASP A 147 33.136 -5.022 -26.088 1.00 0.00 O ATOM 332 OD2 ASP A 147 34.371 -5.447 -27.856 1.00 0.00 O ATOM 0 H ASP A 147 34.309 -0.742 -27.412 1.00 0.00 H new ATOM 0 HA ASP A 147 32.876 -2.356 -25.662 1.00 0.00 H new ATOM 0 HB2 ASP A 147 33.047 -2.874 -28.014 1.00 0.00 H new ATOM 0 HB3 ASP A 147 34.796 -2.968 -27.937 1.00 0.00 H new ATOM 337 N ARG A 148 36.107 -2.411 -25.167 1.00 0.00 N ATOM 338 CA ARG A 148 37.154 -2.870 -24.262 1.00 0.00 C ATOM 339 C ARG A 148 36.806 -2.537 -22.814 1.00 0.00 C ATOM 340 O ARG A 148 36.857 -3.400 -21.938 1.00 0.00 O ATOM 341 CB ARG A 148 38.495 -2.235 -24.634 1.00 0.00 C ATOM 342 CG ARG A 148 39.044 -2.710 -25.970 1.00 0.00 C ATOM 343 CD ARG A 148 39.260 -4.216 -25.979 1.00 0.00 C ATOM 344 NE ARG A 148 40.095 -4.655 -24.864 1.00 0.00 N ATOM 345 CZ ARG A 148 40.246 -5.929 -24.517 1.00 0.00 C ATOM 346 NH1 ARG A 148 39.623 -6.883 -25.195 1.00 0.00 N ATOM 347 NH2 ARG A 148 41.022 -6.250 -23.490 1.00 0.00 N ATOM 0 H ARG A 148 36.410 -1.709 -25.842 1.00 0.00 H new ATOM 0 HA ARG A 148 37.233 -3.953 -24.359 1.00 0.00 H new ATOM 0 HB2 ARG A 148 38.379 -1.152 -24.663 1.00 0.00 H new ATOM 0 HB3 ARG A 148 39.222 -2.457 -23.853 1.00 0.00 H new ATOM 0 HG2 ARG A 148 38.353 -2.435 -26.767 1.00 0.00 H new ATOM 0 HG3 ARG A 148 39.987 -2.205 -26.178 1.00 0.00 H new ATOM 0 HD2 ARG A 148 38.295 -4.721 -25.930 1.00 0.00 H new ATOM 0 HD3 ARG A 148 39.727 -4.510 -26.919 1.00 0.00 H new ATOM 0 HE ARG A 148 40.589 -3.946 -24.322 1.00 0.00 H new ATOM 0 HH11 ARG A 148 39.026 -6.640 -25.985 1.00 0.00 H new ATOM 0 HH12 ARG A 148 39.741 -7.860 -24.926 1.00 0.00 H new ATOM 0 HH21 ARG A 148 41.503 -5.519 -22.966 1.00 0.00 H new ATOM 0 HH22 ARG A 148 41.137 -7.228 -23.224 1.00 0.00 H new ATOM 361 N TYR A 149 36.454 -1.279 -22.571 1.00 0.00 N ATOM 362 CA TYR A 149 36.100 -0.830 -21.229 1.00 0.00 C ATOM 363 C TYR A 149 34.715 -1.333 -20.834 1.00 0.00 C ATOM 364 O TYR A 149 34.443 -1.577 -19.658 1.00 0.00 O ATOM 365 CB TYR A 149 36.142 0.697 -21.152 1.00 0.00 C ATOM 366 CG TYR A 149 36.550 1.223 -19.794 1.00 0.00 C ATOM 367 CD1 TYR A 149 37.847 1.058 -19.325 1.00 0.00 C ATOM 368 CD2 TYR A 149 35.638 1.885 -18.981 1.00 0.00 C ATOM 369 CE1 TYR A 149 38.224 1.537 -18.085 1.00 0.00 C ATOM 370 CE2 TYR A 149 36.007 2.368 -17.741 1.00 0.00 C ATOM 371 CZ TYR A 149 37.301 2.192 -17.297 1.00 0.00 C ATOM 372 OH TYR A 149 37.671 2.670 -16.061 1.00 0.00 O ATOM 0 H TYR A 149 36.406 -0.552 -23.285 1.00 0.00 H new ATOM 0 HA TYR A 149 36.829 -1.242 -20.531 1.00 0.00 H new ATOM 0 HB2 TYR A 149 36.839 1.071 -21.902 1.00 0.00 H new ATOM 0 HB3 TYR A 149 35.158 1.093 -21.405 1.00 0.00 H new ATOM 0 HD1 TYR A 149 38.573 0.547 -19.940 1.00 0.00 H new ATOM 0 HD2 TYR A 149 34.624 2.024 -19.325 1.00 0.00 H new ATOM 0 HE1 TYR A 149 39.236 1.399 -17.735 1.00 0.00 H new ATOM 0 HE2 TYR A 149 35.286 2.881 -17.122 1.00 0.00 H new ATOM 0 HH TYR A 149 36.903 3.106 -15.636 1.00 0.00 H new ATOM 382 N TYR A 150 33.843 -1.485 -21.825 1.00 0.00 N ATOM 383 CA TYR A 150 32.485 -1.957 -21.582 1.00 0.00 C ATOM 384 C TYR A 150 32.495 -3.347 -20.952 1.00 0.00 C ATOM 385 O TYR A 150 31.558 -3.729 -20.251 1.00 0.00 O ATOM 386 CB TYR A 150 31.691 -1.983 -22.889 1.00 0.00 C ATOM 387 CG TYR A 150 30.336 -2.642 -22.761 1.00 0.00 C ATOM 388 CD1 TYR A 150 29.281 -1.989 -22.136 1.00 0.00 C ATOM 389 CD2 TYR A 150 30.111 -3.917 -23.266 1.00 0.00 C ATOM 390 CE1 TYR A 150 28.041 -2.588 -22.017 1.00 0.00 C ATOM 391 CE2 TYR A 150 28.875 -4.522 -23.153 1.00 0.00 C ATOM 392 CZ TYR A 150 27.843 -3.854 -22.526 1.00 0.00 C ATOM 393 OH TYR A 150 26.610 -4.453 -22.410 1.00 0.00 O ATOM 0 H TYR A 150 34.052 -1.288 -22.804 1.00 0.00 H new ATOM 0 HA TYR A 150 32.007 -1.267 -20.887 1.00 0.00 H new ATOM 0 HB2 TYR A 150 31.557 -0.961 -23.243 1.00 0.00 H new ATOM 0 HB3 TYR A 150 32.272 -2.509 -23.647 1.00 0.00 H new ATOM 0 HD1 TYR A 150 29.432 -0.997 -21.737 1.00 0.00 H new ATOM 0 HD2 TYR A 150 30.917 -4.444 -23.755 1.00 0.00 H new ATOM 0 HE1 TYR A 150 27.231 -2.067 -21.528 1.00 0.00 H new ATOM 0 HE2 TYR A 150 28.717 -5.513 -23.553 1.00 0.00 H new ATOM 0 HH TYR A 150 26.638 -5.342 -22.821 1.00 0.00 H new ATOM 403 N ARG A 151 33.562 -4.097 -21.207 1.00 0.00 N ATOM 404 CA ARG A 151 33.696 -5.444 -20.666 1.00 0.00 C ATOM 405 C ARG A 151 33.500 -5.444 -19.152 1.00 0.00 C ATOM 406 O ARG A 151 33.049 -6.433 -18.576 1.00 0.00 O ATOM 407 CB ARG A 151 35.069 -6.022 -21.013 1.00 0.00 C ATOM 408 CG ARG A 151 35.120 -7.541 -20.967 1.00 0.00 C ATOM 409 CD ARG A 151 35.888 -8.109 -22.150 1.00 0.00 C ATOM 410 NE ARG A 151 37.326 -8.145 -21.903 1.00 0.00 N ATOM 411 CZ ARG A 151 37.906 -8.990 -21.057 1.00 0.00 C ATOM 412 NH1 ARG A 151 37.173 -9.865 -20.383 1.00 0.00 N ATOM 413 NH2 ARG A 151 39.222 -8.961 -20.886 1.00 0.00 N ATOM 0 H ARG A 151 34.346 -3.795 -21.785 1.00 0.00 H new ATOM 0 HA ARG A 151 32.923 -6.067 -21.115 1.00 0.00 H new ATOM 0 HB2 ARG A 151 35.353 -5.687 -22.011 1.00 0.00 H new ATOM 0 HB3 ARG A 151 35.808 -5.621 -20.320 1.00 0.00 H new ATOM 0 HG2 ARG A 151 35.591 -7.862 -20.038 1.00 0.00 H new ATOM 0 HG3 ARG A 151 34.106 -7.940 -20.965 1.00 0.00 H new ATOM 0 HD2 ARG A 151 35.532 -9.117 -22.363 1.00 0.00 H new ATOM 0 HD3 ARG A 151 35.687 -7.506 -23.036 1.00 0.00 H new ATOM 0 HE ARG A 151 37.918 -7.485 -22.407 1.00 0.00 H new ATOM 0 HH11 ARG A 151 36.162 -9.891 -20.513 1.00 0.00 H new ATOM 0 HH12 ARG A 151 37.620 -10.513 -19.734 1.00 0.00 H new ATOM 0 HH21 ARG A 151 39.789 -8.290 -21.404 1.00 0.00 H new ATOM 0 HH22 ARG A 151 39.666 -9.610 -20.236 1.00 0.00 H new ATOM 427 N GLU A 152 33.844 -4.328 -18.516 1.00 0.00 N ATOM 428 CA GLU A 152 33.707 -4.201 -17.070 1.00 0.00 C ATOM 429 C GLU A 152 32.335 -3.645 -16.700 1.00 0.00 C ATOM 430 O GLU A 152 31.838 -3.874 -15.599 1.00 0.00 O ATOM 431 CB GLU A 152 34.805 -3.295 -16.510 1.00 0.00 C ATOM 432 CG GLU A 152 36.197 -3.646 -17.006 1.00 0.00 C ATOM 433 CD GLU A 152 37.266 -3.424 -15.954 1.00 0.00 C ATOM 434 OE1 GLU A 152 37.076 -3.884 -14.808 1.00 0.00 O ATOM 435 OE2 GLU A 152 38.293 -2.790 -16.276 1.00 0.00 O ATOM 0 H GLU A 152 34.219 -3.500 -18.979 1.00 0.00 H new ATOM 0 HA GLU A 152 33.807 -5.194 -16.632 1.00 0.00 H new ATOM 0 HB2 GLU A 152 34.583 -2.262 -16.778 1.00 0.00 H new ATOM 0 HB3 GLU A 152 34.791 -3.352 -15.422 1.00 0.00 H new ATOM 0 HG2 GLU A 152 36.214 -4.689 -17.321 1.00 0.00 H new ATOM 0 HG3 GLU A 152 36.428 -3.044 -17.885 1.00 0.00 H new ATOM 442 N ASN A 153 31.730 -2.913 -17.630 1.00 0.00 N ATOM 443 CA ASN A 153 30.416 -2.323 -17.402 1.00 0.00 C ATOM 444 C ASN A 153 29.316 -3.369 -17.554 1.00 0.00 C ATOM 445 O ASN A 153 28.333 -3.364 -16.813 1.00 0.00 O ATOM 446 CB ASN A 153 30.176 -1.168 -18.377 1.00 0.00 C ATOM 447 CG ASN A 153 30.310 0.188 -17.711 1.00 0.00 C ATOM 448 OD1 ASN A 153 29.339 0.936 -17.601 1.00 0.00 O ATOM 449 ND2 ASN A 153 31.518 0.510 -17.264 1.00 0.00 N ATOM 0 H ASN A 153 32.128 -2.714 -18.548 1.00 0.00 H new ATOM 0 HA ASN A 153 30.390 -1.940 -16.382 1.00 0.00 H new ATOM 0 HB2 ASN A 153 30.887 -1.237 -19.200 1.00 0.00 H new ATOM 0 HB3 ASN A 153 29.179 -1.261 -18.808 1.00 0.00 H new ATOM 0 HD21 ASN A 153 31.670 1.409 -16.807 1.00 0.00 H new ATOM 0 HD22 ASN A 153 32.294 -0.142 -17.377 1.00 0.00 H new ATOM 456 N MET A 154 29.489 -4.265 -18.520 1.00 0.00 N ATOM 457 CA MET A 154 28.512 -5.319 -18.769 1.00 0.00 C ATOM 458 C MET A 154 28.260 -6.136 -17.505 1.00 0.00 C ATOM 459 O MET A 154 27.167 -6.666 -17.304 1.00 0.00 O ATOM 460 CB MET A 154 28.993 -6.235 -19.895 1.00 0.00 C ATOM 461 CG MET A 154 30.391 -6.789 -19.672 1.00 0.00 C ATOM 462 SD MET A 154 30.507 -8.550 -20.043 1.00 0.00 S ATOM 463 CE MET A 154 29.624 -8.628 -21.599 1.00 0.00 C ATOM 0 H MET A 154 30.296 -4.282 -19.143 1.00 0.00 H new ATOM 0 HA MET A 154 27.576 -4.848 -19.069 1.00 0.00 H new ATOM 0 HB2 MET A 154 28.295 -7.065 -20.000 1.00 0.00 H new ATOM 0 HB3 MET A 154 28.976 -5.682 -20.834 1.00 0.00 H new ATOM 0 HG2 MET A 154 31.098 -6.243 -20.296 1.00 0.00 H new ATOM 0 HG3 MET A 154 30.684 -6.620 -18.636 1.00 0.00 H new ATOM 0 HE1 MET A 154 30.027 -9.439 -22.206 1.00 0.00 H new ATOM 0 HE2 MET A 154 28.566 -8.808 -21.408 1.00 0.00 H new ATOM 0 HE3 MET A 154 29.741 -7.684 -22.131 1.00 0.00 H new ATOM 473 N HIS A 155 29.278 -6.233 -16.656 1.00 0.00 N ATOM 474 CA HIS A 155 29.166 -6.986 -15.412 1.00 0.00 C ATOM 475 C HIS A 155 28.266 -6.260 -14.417 1.00 0.00 C ATOM 476 O HIS A 155 27.672 -6.880 -13.535 1.00 0.00 O ATOM 477 CB HIS A 155 30.550 -7.207 -14.799 1.00 0.00 C ATOM 478 CG HIS A 155 31.053 -8.610 -14.947 1.00 0.00 C ATOM 479 ND1 HIS A 155 31.767 -9.262 -13.964 1.00 0.00 N ATOM 480 CD2 HIS A 155 30.940 -9.487 -15.972 1.00 0.00 C ATOM 481 CE1 HIS A 155 32.073 -10.478 -14.378 1.00 0.00 C ATOM 482 NE2 HIS A 155 31.583 -10.641 -15.593 1.00 0.00 N ATOM 0 H HIS A 155 30.189 -5.800 -16.807 1.00 0.00 H new ATOM 0 HA HIS A 155 28.719 -7.954 -15.640 1.00 0.00 H new ATOM 0 HB2 HIS A 155 31.259 -6.524 -15.267 1.00 0.00 H new ATOM 0 HB3 HIS A 155 30.514 -6.952 -13.740 1.00 0.00 H new ATOM 0 HD2 HIS A 155 30.438 -9.312 -16.912 1.00 0.00 H new ATOM 0 HE1 HIS A 155 32.630 -11.214 -13.818 1.00 0.00 H new ATOM 0 HE2 HIS A 155 31.668 -11.486 -16.158 1.00 0.00 H new ATOM 490 N ARG A 156 28.172 -4.942 -14.564 1.00 0.00 N ATOM 491 CA ARG A 156 27.346 -4.132 -13.677 1.00 0.00 C ATOM 492 C ARG A 156 26.174 -3.517 -14.436 1.00 0.00 C ATOM 493 O ARG A 156 25.504 -2.612 -13.937 1.00 0.00 O ATOM 494 CB ARG A 156 28.186 -3.027 -13.032 1.00 0.00 C ATOM 495 CG ARG A 156 29.204 -3.544 -12.029 1.00 0.00 C ATOM 496 CD ARG A 156 30.589 -2.978 -12.299 1.00 0.00 C ATOM 497 NE ARG A 156 30.720 -1.602 -11.828 1.00 0.00 N ATOM 498 CZ ARG A 156 31.884 -0.974 -11.707 1.00 0.00 C ATOM 499 NH1 ARG A 156 33.012 -1.595 -12.022 1.00 0.00 N ATOM 500 NH2 ARG A 156 31.922 0.279 -11.271 1.00 0.00 N ATOM 0 H ARG A 156 28.657 -4.413 -15.289 1.00 0.00 H new ATOM 0 HA ARG A 156 26.950 -4.781 -12.896 1.00 0.00 H new ATOM 0 HB2 ARG A 156 28.707 -2.475 -13.814 1.00 0.00 H new ATOM 0 HB3 ARG A 156 27.522 -2.322 -12.532 1.00 0.00 H new ATOM 0 HG2 ARG A 156 28.891 -3.276 -11.020 1.00 0.00 H new ATOM 0 HG3 ARG A 156 29.240 -4.633 -12.073 1.00 0.00 H new ATOM 0 HD2 ARG A 156 31.337 -3.601 -11.809 1.00 0.00 H new ATOM 0 HD3 ARG A 156 30.794 -3.016 -13.369 1.00 0.00 H new ATOM 0 HE ARG A 156 29.871 -1.095 -11.578 1.00 0.00 H new ATOM 0 HH11 ARG A 156 32.987 -2.558 -12.358 1.00 0.00 H new ATOM 0 HH12 ARG A 156 33.904 -1.110 -11.928 1.00 0.00 H new ATOM 0 HH21 ARG A 156 31.056 0.761 -11.028 1.00 0.00 H new ATOM 0 HH22 ARG A 156 32.817 0.760 -11.179 1.00 0.00 H new ATOM 514 N TYR A 157 25.933 -4.013 -15.644 1.00 0.00 N ATOM 515 CA TYR A 157 24.844 -3.510 -16.474 1.00 0.00 C ATOM 516 C TYR A 157 23.529 -3.505 -15.701 1.00 0.00 C ATOM 517 O TYR A 157 23.328 -4.274 -14.760 1.00 0.00 O ATOM 518 CB TYR A 157 24.703 -4.361 -17.737 1.00 0.00 C ATOM 519 CG TYR A 157 23.955 -5.656 -17.515 1.00 0.00 C ATOM 520 CD1 TYR A 157 24.371 -6.565 -16.550 1.00 0.00 C ATOM 521 CD2 TYR A 157 22.832 -5.971 -18.270 1.00 0.00 C ATOM 522 CE1 TYR A 157 23.691 -7.750 -16.344 1.00 0.00 C ATOM 523 CE2 TYR A 157 22.144 -7.152 -18.070 1.00 0.00 C ATOM 524 CZ TYR A 157 22.578 -8.038 -17.106 1.00 0.00 C ATOM 525 OH TYR A 157 21.897 -9.217 -16.904 1.00 0.00 O ATOM 0 H TYR A 157 26.477 -4.763 -16.071 1.00 0.00 H new ATOM 0 HA TYR A 157 25.081 -2.485 -16.759 1.00 0.00 H new ATOM 0 HB2 TYR A 157 24.187 -3.780 -18.501 1.00 0.00 H new ATOM 0 HB3 TYR A 157 25.696 -4.587 -18.125 1.00 0.00 H new ATOM 0 HD1 TYR A 157 25.241 -6.341 -15.950 1.00 0.00 H new ATOM 0 HD2 TYR A 157 22.491 -5.280 -19.027 1.00 0.00 H new ATOM 0 HE1 TYR A 157 24.029 -8.446 -15.591 1.00 0.00 H new ATOM 0 HE2 TYR A 157 21.272 -7.380 -18.665 1.00 0.00 H new ATOM 0 HH TYR A 157 21.221 -9.089 -16.206 1.00 0.00 H new ATOM 535 N PRO A 158 22.609 -2.617 -16.107 1.00 0.00 N ATOM 536 CA PRO A 158 21.295 -2.490 -15.468 1.00 0.00 C ATOM 537 C PRO A 158 20.398 -3.692 -15.742 1.00 0.00 C ATOM 538 O PRO A 158 20.190 -4.074 -16.893 1.00 0.00 O ATOM 539 CB PRO A 158 20.710 -1.229 -16.109 1.00 0.00 C ATOM 540 CG PRO A 158 21.395 -1.122 -17.428 1.00 0.00 C ATOM 541 CD PRO A 158 22.780 -1.670 -17.222 1.00 0.00 C ATOM 0 HA PRO A 158 21.373 -2.436 -14.382 1.00 0.00 H new ATOM 0 HB2 PRO A 158 19.630 -1.311 -16.229 1.00 0.00 H new ATOM 0 HB3 PRO A 158 20.896 -0.349 -15.493 1.00 0.00 H new ATOM 0 HG2 PRO A 158 20.861 -1.688 -18.192 1.00 0.00 H new ATOM 0 HG3 PRO A 158 21.432 -0.086 -17.766 1.00 0.00 H new ATOM 0 HD2 PRO A 158 23.153 -2.167 -18.118 1.00 0.00 H new ATOM 0 HD3 PRO A 158 23.491 -0.882 -16.975 1.00 0.00 H new ATOM 549 N ASN A 159 19.869 -4.285 -14.677 1.00 0.00 N ATOM 550 CA ASN A 159 18.994 -5.445 -14.803 1.00 0.00 C ATOM 551 C ASN A 159 17.597 -5.133 -14.276 1.00 0.00 C ATOM 552 O ASN A 159 16.974 -5.962 -13.614 1.00 0.00 O ATOM 553 CB ASN A 159 19.582 -6.638 -14.047 1.00 0.00 C ATOM 554 CG ASN A 159 19.343 -7.952 -14.765 1.00 0.00 C ATOM 555 OD1 ASN A 159 20.253 -8.770 -14.906 1.00 0.00 O ATOM 556 ND2 ASN A 159 18.115 -8.161 -15.225 1.00 0.00 N ATOM 0 H ASN A 159 20.031 -3.981 -13.717 1.00 0.00 H new ATOM 0 HA ASN A 159 18.916 -5.696 -15.861 1.00 0.00 H new ATOM 0 HB2 ASN A 159 20.654 -6.489 -13.915 1.00 0.00 H new ATOM 0 HB3 ASN A 159 19.142 -6.686 -13.051 1.00 0.00 H new ATOM 0 HD21 ASN A 159 17.895 -9.027 -15.718 1.00 0.00 H new ATOM 0 HD22 ASN A 159 17.391 -7.456 -15.086 1.00 0.00 H new ATOM 563 N GLN A 160 17.113 -3.931 -14.575 1.00 0.00 N ATOM 564 CA GLN A 160 15.790 -3.510 -14.130 1.00 0.00 C ATOM 565 C GLN A 160 15.467 -2.107 -14.635 1.00 0.00 C ATOM 566 O GLN A 160 16.324 -1.224 -14.634 1.00 0.00 O ATOM 567 CB GLN A 160 15.705 -3.547 -12.603 1.00 0.00 C ATOM 568 CG GLN A 160 14.481 -4.280 -12.080 1.00 0.00 C ATOM 569 CD GLN A 160 14.696 -5.777 -11.976 1.00 0.00 C ATOM 570 OE1 GLN A 160 15.177 -6.278 -10.959 1.00 0.00 O ATOM 571 NE2 GLN A 160 14.341 -6.501 -13.031 1.00 0.00 N ATOM 0 H GLN A 160 17.617 -3.233 -15.123 1.00 0.00 H new ATOM 0 HA GLN A 160 15.058 -4.204 -14.544 1.00 0.00 H new ATOM 0 HB2 GLN A 160 16.601 -4.026 -12.209 1.00 0.00 H new ATOM 0 HB3 GLN A 160 15.696 -2.525 -12.223 1.00 0.00 H new ATOM 0 HG2 GLN A 160 14.218 -3.886 -11.098 1.00 0.00 H new ATOM 0 HG3 GLN A 160 13.636 -4.083 -12.739 1.00 0.00 H new ATOM 0 HE21 GLN A 160 13.946 -6.045 -13.853 1.00 0.00 H new ATOM 0 HE22 GLN A 160 14.463 -7.514 -13.019 1.00 0.00 H new ATOM 580 N VAL A 161 14.225 -1.910 -15.066 1.00 0.00 N ATOM 581 CA VAL A 161 13.789 -0.614 -15.573 1.00 0.00 C ATOM 582 C VAL A 161 12.590 -0.093 -14.790 1.00 0.00 C ATOM 583 O VAL A 161 11.976 -0.826 -14.014 1.00 0.00 O ATOM 584 CB VAL A 161 13.419 -0.692 -17.066 1.00 0.00 C ATOM 585 CG1 VAL A 161 14.644 -1.025 -17.904 1.00 0.00 C ATOM 586 CG2 VAL A 161 12.316 -1.716 -17.289 1.00 0.00 C ATOM 0 H VAL A 161 13.503 -2.631 -15.074 1.00 0.00 H new ATOM 0 HA VAL A 161 14.626 0.073 -15.449 1.00 0.00 H new ATOM 0 HB VAL A 161 13.047 0.283 -17.381 1.00 0.00 H new ATOM 0 HG11 VAL A 161 14.362 -1.076 -18.956 1.00 0.00 H new ATOM 0 HG12 VAL A 161 15.400 -0.251 -17.767 1.00 0.00 H new ATOM 0 HG13 VAL A 161 15.049 -1.987 -17.590 1.00 0.00 H new ATOM 0 HG21 VAL A 161 12.067 -1.758 -18.349 1.00 0.00 H new ATOM 0 HG22 VAL A 161 12.657 -2.697 -16.957 1.00 0.00 H new ATOM 0 HG23 VAL A 161 11.432 -1.428 -16.720 1.00 0.00 H new ATOM 596 N TYR A 162 12.262 1.177 -14.998 1.00 0.00 N ATOM 597 CA TYR A 162 11.136 1.798 -14.309 1.00 0.00 C ATOM 598 C TYR A 162 10.051 2.209 -15.300 1.00 0.00 C ATOM 599 O TYR A 162 10.327 2.870 -16.301 1.00 0.00 O ATOM 600 CB TYR A 162 11.607 3.019 -13.516 1.00 0.00 C ATOM 601 CG TYR A 162 12.104 2.684 -12.128 1.00 0.00 C ATOM 602 CD1 TYR A 162 13.236 1.900 -11.945 1.00 0.00 C ATOM 603 CD2 TYR A 162 11.441 3.151 -11.000 1.00 0.00 C ATOM 604 CE1 TYR A 162 13.694 1.591 -10.678 1.00 0.00 C ATOM 605 CE2 TYR A 162 11.893 2.849 -9.730 1.00 0.00 C ATOM 606 CZ TYR A 162 13.019 2.068 -9.574 1.00 0.00 C ATOM 607 OH TYR A 162 13.471 1.763 -8.311 1.00 0.00 O ATOM 0 H TYR A 162 12.759 1.797 -15.638 1.00 0.00 H new ATOM 0 HA TYR A 162 10.715 1.066 -13.620 1.00 0.00 H new ATOM 0 HB2 TYR A 162 12.405 3.515 -14.069 1.00 0.00 H new ATOM 0 HB3 TYR A 162 10.784 3.730 -13.437 1.00 0.00 H new ATOM 0 HD1 TYR A 162 13.767 1.525 -12.807 1.00 0.00 H new ATOM 0 HD2 TYR A 162 10.557 3.760 -11.118 1.00 0.00 H new ATOM 0 HE1 TYR A 162 14.575 0.980 -10.553 1.00 0.00 H new ATOM 0 HE2 TYR A 162 11.367 3.223 -8.864 1.00 0.00 H new ATOM 0 HH TYR A 162 12.884 2.177 -7.645 1.00 0.00 H new ATOM 797 N ASN A 174 6.687 10.262 -24.784 1.00 0.00 N ATOM 798 CA ASN A 174 7.988 10.873 -24.535 1.00 0.00 C ATOM 799 C ASN A 174 8.545 10.436 -23.183 1.00 0.00 C ATOM 800 O ASN A 174 9.758 10.418 -22.976 1.00 0.00 O ATOM 801 CB ASN A 174 7.876 12.398 -24.584 1.00 0.00 C ATOM 802 CG ASN A 174 8.856 13.019 -25.561 1.00 0.00 C ATOM 803 OD1 ASN A 174 9.930 13.480 -25.172 1.00 0.00 O ATOM 804 ND2 ASN A 174 8.489 13.034 -26.837 1.00 0.00 N ATOM 0 HA ASN A 174 8.673 10.540 -25.315 1.00 0.00 H new ATOM 0 HB2 ASN A 174 6.861 12.676 -24.866 1.00 0.00 H new ATOM 0 HB3 ASN A 174 8.053 12.805 -23.588 1.00 0.00 H new ATOM 0 HD21 ASN A 174 9.107 13.439 -27.541 1.00 0.00 H new ATOM 0 HD22 ASN A 174 7.590 12.640 -27.114 1.00 0.00 H new ATOM 811 N PHE A 175 7.650 10.083 -22.267 1.00 0.00 N ATOM 812 CA PHE A 175 8.051 9.645 -20.935 1.00 0.00 C ATOM 813 C PHE A 175 8.976 8.435 -21.016 1.00 0.00 C ATOM 814 O PHE A 175 9.813 8.219 -20.139 1.00 0.00 O ATOM 815 CB PHE A 175 6.818 9.304 -20.095 1.00 0.00 C ATOM 816 CG PHE A 175 7.044 9.442 -18.616 1.00 0.00 C ATOM 817 CD1 PHE A 175 7.432 10.655 -18.071 1.00 0.00 C ATOM 818 CD2 PHE A 175 6.870 8.357 -17.772 1.00 0.00 C ATOM 819 CE1 PHE A 175 7.641 10.785 -16.711 1.00 0.00 C ATOM 820 CE2 PHE A 175 7.076 8.481 -16.411 1.00 0.00 C ATOM 821 CZ PHE A 175 7.463 9.696 -15.880 1.00 0.00 C ATOM 0 H PHE A 175 6.642 10.092 -22.422 1.00 0.00 H new ATOM 0 HA PHE A 175 8.592 10.462 -20.458 1.00 0.00 H new ATOM 0 HB2 PHE A 175 5.995 9.955 -20.391 1.00 0.00 H new ATOM 0 HB3 PHE A 175 6.510 8.281 -20.314 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.573 11.509 -18.717 1.00 0.00 H new ATOM 0 HD2 PHE A 175 6.570 7.404 -18.182 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.943 11.736 -16.299 1.00 0.00 H new ATOM 0 HE2 PHE A 175 6.934 7.629 -15.763 1.00 0.00 H new ATOM 0 HZ PHE A 175 7.626 9.794 -14.817 1.00 0.00 H new ATOM 831 N VAL A 176 8.819 7.647 -22.074 1.00 0.00 N ATOM 832 CA VAL A 176 9.639 6.458 -22.271 1.00 0.00 C ATOM 833 C VAL A 176 11.124 6.803 -22.240 1.00 0.00 C ATOM 834 O VAL A 176 11.921 6.108 -21.610 1.00 0.00 O ATOM 835 CB VAL A 176 9.312 5.765 -23.607 1.00 0.00 C ATOM 836 CG1 VAL A 176 10.183 4.532 -23.797 1.00 0.00 C ATOM 837 CG2 VAL A 176 7.837 5.401 -23.671 1.00 0.00 C ATOM 0 H VAL A 176 8.131 7.811 -22.809 1.00 0.00 H new ATOM 0 HA VAL A 176 9.410 5.777 -21.452 1.00 0.00 H new ATOM 0 HB VAL A 176 9.527 6.460 -24.419 1.00 0.00 H new ATOM 0 HG11 VAL A 176 9.937 4.056 -24.746 1.00 0.00 H new ATOM 0 HG12 VAL A 176 11.233 4.825 -23.799 1.00 0.00 H new ATOM 0 HG13 VAL A 176 10.003 3.831 -22.982 1.00 0.00 H new ATOM 0 HG21 VAL A 176 7.624 4.912 -24.622 1.00 0.00 H new ATOM 0 HG22 VAL A 176 7.593 4.724 -22.852 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.235 6.306 -23.585 1.00 0.00 H new ATOM 847 N HIS A 177 11.489 7.882 -22.925 1.00 0.00 N ATOM 848 CA HIS A 177 12.879 8.322 -22.975 1.00 0.00 C ATOM 849 C HIS A 177 13.370 8.731 -21.590 1.00 0.00 C ATOM 850 O HIS A 177 14.515 8.472 -21.225 1.00 0.00 O ATOM 851 CB HIS A 177 13.031 9.490 -23.949 1.00 0.00 C ATOM 852 CG HIS A 177 12.723 9.130 -25.370 1.00 0.00 C ATOM 853 ND1 HIS A 177 11.771 9.785 -26.123 1.00 0.00 N ATOM 854 CD2 HIS A 177 13.248 8.178 -26.176 1.00 0.00 C ATOM 855 CE1 HIS A 177 11.722 9.250 -27.329 1.00 0.00 C ATOM 856 NE2 HIS A 177 12.609 8.273 -27.388 1.00 0.00 N ATOM 0 H HIS A 177 10.842 8.468 -23.453 1.00 0.00 H new ATOM 0 HA HIS A 177 13.486 7.487 -23.324 1.00 0.00 H new ATOM 0 HB2 HIS A 177 12.372 10.300 -23.637 1.00 0.00 H new ATOM 0 HB3 HIS A 177 14.051 9.869 -23.892 1.00 0.00 H new ATOM 0 HD2 HIS A 177 14.025 7.475 -25.915 1.00 0.00 H new ATOM 0 HE1 HIS A 177 11.068 9.559 -28.131 1.00 0.00 H new ATOM 0 HE2 HIS A 177 12.790 7.685 -28.201 1.00 0.00 H new ATOM 864 N ASN A 178 12.494 9.373 -20.823 1.00 0.00 N ATOM 865 CA ASN A 178 12.839 9.820 -19.478 1.00 0.00 C ATOM 866 C ASN A 178 12.963 8.634 -18.527 1.00 0.00 C ATOM 867 O ASN A 178 13.796 8.637 -17.619 1.00 0.00 O ATOM 868 CB ASN A 178 11.784 10.798 -18.957 1.00 0.00 C ATOM 869 CG ASN A 178 12.045 12.223 -19.408 1.00 0.00 C ATOM 870 OD1 ASN A 178 12.934 12.897 -18.889 1.00 0.00 O ATOM 871 ND2 ASN A 178 11.267 12.688 -20.378 1.00 0.00 N ATOM 0 H ASN A 178 11.541 9.595 -21.110 1.00 0.00 H new ATOM 0 HA ASN A 178 13.803 10.327 -19.526 1.00 0.00 H new ATOM 0 HB2 ASN A 178 10.799 10.485 -19.303 1.00 0.00 H new ATOM 0 HB3 ASN A 178 11.765 10.762 -17.868 1.00 0.00 H new ATOM 0 HD21 ASN A 178 11.394 13.640 -20.722 1.00 0.00 H new ATOM 0 HD22 ASN A 178 10.542 12.093 -20.779 1.00 0.00 H new ATOM 878 N CYS A 179 12.130 7.621 -18.740 1.00 0.00 N ATOM 879 CA CYS A 179 12.146 6.428 -17.903 1.00 0.00 C ATOM 880 C CYS A 179 13.547 5.828 -17.837 1.00 0.00 C ATOM 881 O CYS A 179 13.922 5.206 -16.842 1.00 0.00 O ATOM 882 CB CYS A 179 11.159 5.389 -18.440 1.00 0.00 C ATOM 883 SG CYS A 179 9.411 5.791 -18.122 1.00 0.00 S ATOM 0 H CYS A 179 11.435 7.603 -19.486 1.00 0.00 H new ATOM 0 HA CYS A 179 11.846 6.718 -16.896 1.00 0.00 H new ATOM 0 HB2 CYS A 179 11.307 5.284 -19.515 1.00 0.00 H new ATOM 0 HB3 CYS A 179 11.386 4.422 -17.991 1.00 0.00 H new ATOM 0 HG CYS A 179 9.070 6.829 -18.826 1.00 0.00 H new ATOM 888 N VAL A 180 14.317 6.018 -18.903 1.00 0.00 N ATOM 889 CA VAL A 180 15.678 5.498 -18.967 1.00 0.00 C ATOM 890 C VAL A 180 16.582 6.198 -17.958 1.00 0.00 C ATOM 891 O VAL A 180 17.444 5.572 -17.344 1.00 0.00 O ATOM 892 CB VAL A 180 16.276 5.661 -20.377 1.00 0.00 C ATOM 893 CG1 VAL A 180 17.701 5.132 -20.417 1.00 0.00 C ATOM 894 CG2 VAL A 180 15.408 4.957 -21.408 1.00 0.00 C ATOM 0 H VAL A 180 14.022 6.529 -19.735 1.00 0.00 H new ATOM 0 HA VAL A 180 15.623 4.437 -18.725 1.00 0.00 H new ATOM 0 HB VAL A 180 16.301 6.723 -20.622 1.00 0.00 H new ATOM 0 HG11 VAL A 180 18.107 5.256 -21.421 1.00 0.00 H new ATOM 0 HG12 VAL A 180 18.315 5.686 -19.707 1.00 0.00 H new ATOM 0 HG13 VAL A 180 17.704 4.075 -20.152 1.00 0.00 H new ATOM 0 HG21 VAL A 180 15.845 5.082 -22.398 1.00 0.00 H new ATOM 0 HG22 VAL A 180 15.349 3.895 -21.169 1.00 0.00 H new ATOM 0 HG23 VAL A 180 14.407 5.388 -21.396 1.00 0.00 H new ATOM 904 N ASN A 181 16.378 7.501 -17.794 1.00 0.00 N ATOM 905 CA ASN A 181 17.175 8.287 -16.859 1.00 0.00 C ATOM 906 C ASN A 181 16.866 7.896 -15.417 1.00 0.00 C ATOM 907 O ASN A 181 17.757 7.859 -14.569 1.00 0.00 O ATOM 908 CB ASN A 181 16.911 9.780 -17.062 1.00 0.00 C ATOM 909 CG ASN A 181 18.111 10.634 -16.699 1.00 0.00 C ATOM 910 OD1 ASN A 181 18.297 10.999 -15.538 1.00 0.00 O ATOM 911 ND2 ASN A 181 18.930 10.956 -17.692 1.00 0.00 N ATOM 0 H ASN A 181 15.668 8.035 -18.296 1.00 0.00 H new ATOM 0 HA ASN A 181 18.227 8.081 -17.055 1.00 0.00 H new ATOM 0 HB2 ASN A 181 16.642 9.960 -18.103 1.00 0.00 H new ATOM 0 HB3 ASN A 181 16.057 10.081 -16.455 1.00 0.00 H new ATOM 0 HD21 ASN A 181 19.754 11.529 -17.508 1.00 0.00 H new ATOM 0 HD22 ASN A 181 18.736 10.631 -18.639 1.00 0.00 H new ATOM 918 N ILE A 182 15.597 7.605 -15.148 1.00 0.00 N ATOM 919 CA ILE A 182 15.171 7.216 -13.810 1.00 0.00 C ATOM 920 C ILE A 182 15.847 5.921 -13.373 1.00 0.00 C ATOM 921 O ILE A 182 16.243 5.773 -12.216 1.00 0.00 O ATOM 922 CB ILE A 182 13.643 7.034 -13.736 1.00 0.00 C ATOM 923 CG1 ILE A 182 12.933 8.285 -14.259 1.00 0.00 C ATOM 924 CG2 ILE A 182 13.214 6.732 -12.308 1.00 0.00 C ATOM 925 CD1 ILE A 182 13.241 9.532 -13.461 1.00 0.00 C ATOM 0 H ILE A 182 14.847 7.631 -15.839 1.00 0.00 H new ATOM 0 HA ILE A 182 15.466 8.022 -13.138 1.00 0.00 H new ATOM 0 HB ILE A 182 13.361 6.190 -14.365 1.00 0.00 H new ATOM 0 HG12 ILE A 182 13.220 8.448 -15.298 1.00 0.00 H new ATOM 0 HG13 ILE A 182 11.857 8.113 -14.249 1.00 0.00 H new ATOM 0 HG21 ILE A 182 12.132 6.606 -12.272 1.00 0.00 H new ATOM 0 HG22 ILE A 182 13.697 5.816 -11.969 1.00 0.00 H new ATOM 0 HG23 ILE A 182 13.505 7.558 -11.658 1.00 0.00 H new ATOM 0 HD11 ILE A 182 12.704 10.379 -13.888 1.00 0.00 H new ATOM 0 HD12 ILE A 182 12.929 9.388 -12.427 1.00 0.00 H new ATOM 0 HD13 ILE A 182 14.313 9.729 -13.492 1.00 0.00 H new ATOM 937 N THR A 183 15.979 4.984 -14.306 1.00 0.00 N ATOM 938 CA THR A 183 16.608 3.701 -14.018 1.00 0.00 C ATOM 939 C THR A 183 18.028 3.889 -13.497 1.00 0.00 C ATOM 940 O THR A 183 18.431 3.254 -12.523 1.00 0.00 O ATOM 941 CB THR A 183 16.647 2.801 -15.268 1.00 0.00 C ATOM 942 OG1 THR A 183 15.317 2.565 -15.743 1.00 0.00 O ATOM 943 CG2 THR A 183 17.324 1.475 -14.959 1.00 0.00 C ATOM 0 H THR A 183 15.658 5.090 -15.269 1.00 0.00 H new ATOM 0 HA THR A 183 16.003 3.218 -13.250 1.00 0.00 H new ATOM 0 HB THR A 183 17.222 3.313 -16.040 1.00 0.00 H new ATOM 0 HG1 THR A 183 14.932 3.406 -16.068 1.00 0.00 H new ATOM 0 HG21 THR A 183 17.340 0.857 -15.856 1.00 0.00 H new ATOM 0 HG22 THR A 183 18.346 1.657 -14.626 1.00 0.00 H new ATOM 0 HG23 THR A 183 16.773 0.959 -14.173 1.00 0.00 H new ATOM 951 N ILE A 184 18.782 4.766 -14.152 1.00 0.00 N ATOM 952 CA ILE A 184 20.157 5.039 -13.752 1.00 0.00 C ATOM 953 C ILE A 184 20.207 5.737 -12.398 1.00 0.00 C ATOM 954 O ILE A 184 21.151 5.555 -11.628 1.00 0.00 O ATOM 955 CB ILE A 184 20.883 5.911 -14.794 1.00 0.00 C ATOM 956 CG1 ILE A 184 20.761 5.288 -16.186 1.00 0.00 C ATOM 957 CG2 ILE A 184 22.345 6.085 -14.412 1.00 0.00 C ATOM 958 CD1 ILE A 184 21.438 3.941 -16.307 1.00 0.00 C ATOM 0 H ILE A 184 18.464 5.299 -14.961 1.00 0.00 H new ATOM 0 HA ILE A 184 20.662 4.076 -13.680 1.00 0.00 H new ATOM 0 HB ILE A 184 20.413 6.894 -14.814 1.00 0.00 H new ATOM 0 HG12 ILE A 184 19.705 5.179 -16.435 1.00 0.00 H new ATOM 0 HG13 ILE A 184 21.192 5.969 -16.919 1.00 0.00 H new ATOM 0 HG21 ILE A 184 22.845 6.703 -15.158 1.00 0.00 H new ATOM 0 HG22 ILE A 184 22.411 6.568 -13.437 1.00 0.00 H new ATOM 0 HG23 ILE A 184 22.828 5.109 -14.367 1.00 0.00 H new ATOM 0 HD11 ILE A 184 21.311 3.560 -17.320 1.00 0.00 H new ATOM 0 HD12 ILE A 184 22.501 4.047 -16.090 1.00 0.00 H new ATOM 0 HD13 ILE A 184 20.991 3.244 -15.598 1.00 0.00 H new ATOM 970 N LYS A 185 19.185 6.537 -12.112 1.00 0.00 N ATOM 971 CA LYS A 185 19.110 7.261 -10.849 1.00 0.00 C ATOM 972 C LYS A 185 19.301 6.315 -9.667 1.00 0.00 C ATOM 973 O LYS A 185 20.279 6.423 -8.927 1.00 0.00 O ATOM 974 CB LYS A 185 17.764 7.979 -10.728 1.00 0.00 C ATOM 975 CG LYS A 185 17.730 9.029 -9.631 1.00 0.00 C ATOM 976 CD LYS A 185 16.477 8.907 -8.780 1.00 0.00 C ATOM 977 CE LYS A 185 16.149 10.216 -8.081 1.00 0.00 C ATOM 978 NZ LYS A 185 15.562 9.992 -6.730 1.00 0.00 N ATOM 0 H LYS A 185 18.397 6.700 -12.739 1.00 0.00 H new ATOM 0 HA LYS A 185 19.912 7.999 -10.834 1.00 0.00 H new ATOM 0 HB2 LYS A 185 17.528 8.453 -11.681 1.00 0.00 H new ATOM 0 HB3 LYS A 185 16.984 7.241 -10.537 1.00 0.00 H new ATOM 0 HG2 LYS A 185 18.612 8.924 -8.999 1.00 0.00 H new ATOM 0 HG3 LYS A 185 17.773 10.023 -10.076 1.00 0.00 H new ATOM 0 HD2 LYS A 185 15.637 8.608 -9.408 1.00 0.00 H new ATOM 0 HD3 LYS A 185 16.615 8.121 -8.037 1.00 0.00 H new ATOM 0 HE2 LYS A 185 17.055 10.815 -7.989 1.00 0.00 H new ATOM 0 HE3 LYS A 185 15.449 10.788 -8.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 15.352 10.909 -6.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 14.684 9.442 -6.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 16.239 9.469 -6.140 1.00 0.00 H new ATOM 992 N GLN A 186 18.363 5.390 -9.498 1.00 0.00 N ATOM 993 CA GLN A 186 18.430 4.425 -8.406 1.00 0.00 C ATOM 994 C GLN A 186 19.742 3.649 -8.446 1.00 0.00 C ATOM 995 O GLN A 186 20.218 3.161 -7.420 1.00 0.00 O ATOM 996 CB GLN A 186 17.248 3.457 -8.480 1.00 0.00 C ATOM 997 CG GLN A 186 15.901 4.122 -8.246 1.00 0.00 C ATOM 998 CD GLN A 186 15.604 4.335 -6.774 1.00 0.00 C ATOM 999 OE1 GLN A 186 16.366 3.909 -5.907 1.00 0.00 O ATOM 1000 NE2 GLN A 186 14.490 4.998 -6.485 1.00 0.00 N ATOM 0 H GLN A 186 17.548 5.288 -10.102 1.00 0.00 H new ATOM 0 HA GLN A 186 18.382 4.974 -7.465 1.00 0.00 H new ATOM 0 HB2 GLN A 186 17.242 2.978 -9.459 1.00 0.00 H new ATOM 0 HB3 GLN A 186 17.388 2.669 -7.740 1.00 0.00 H new ATOM 0 HG2 GLN A 186 15.880 5.083 -8.760 1.00 0.00 H new ATOM 0 HG3 GLN A 186 15.115 3.508 -8.686 1.00 0.00 H new ATOM 0 HE21 GLN A 186 13.887 5.334 -7.236 1.00 0.00 H new ATOM 0 HE22 GLN A 186 14.238 5.172 -5.512 1.00 0.00 H new ATOM 1009 N HIS A 187 20.322 3.537 -9.637 1.00 0.00 N ATOM 1010 CA HIS A 187 21.580 2.819 -9.810 1.00 0.00 C ATOM 1011 C HIS A 187 22.741 3.605 -9.208 1.00 0.00 C ATOM 1012 O HIS A 187 23.585 3.047 -8.506 1.00 0.00 O ATOM 1013 CB HIS A 187 21.842 2.557 -11.293 1.00 0.00 C ATOM 1014 CG HIS A 187 22.468 1.223 -11.564 1.00 0.00 C ATOM 1015 ND1 HIS A 187 22.316 0.549 -12.757 1.00 0.00 N ATOM 1016 CD2 HIS A 187 23.253 0.440 -10.788 1.00 0.00 C ATOM 1017 CE1 HIS A 187 22.979 -0.593 -12.702 1.00 0.00 C ATOM 1018 NE2 HIS A 187 23.557 -0.682 -11.518 1.00 0.00 N ATOM 0 H HIS A 187 19.941 3.934 -10.496 1.00 0.00 H new ATOM 0 HA HIS A 187 21.500 1.865 -9.289 1.00 0.00 H new ATOM 0 HB2 HIS A 187 20.900 2.625 -11.837 1.00 0.00 H new ATOM 0 HB3 HIS A 187 22.492 3.340 -11.683 1.00 0.00 H new ATOM 0 HD2 HIS A 187 23.579 0.657 -9.782 1.00 0.00 H new ATOM 0 HE1 HIS A 187 23.038 -1.328 -13.491 1.00 0.00 H new ATOM 0 HE2 HIS A 187 24.136 -1.459 -11.198 1.00 0.00 H new ATOM 1026 N THR A 188 22.779 4.904 -9.488 1.00 0.00 N ATOM 1027 CA THR A 188 23.837 5.766 -8.976 1.00 0.00 C ATOM 1028 C THR A 188 23.916 5.695 -7.455 1.00 0.00 C ATOM 1029 O THR A 188 24.986 5.867 -6.871 1.00 0.00 O ATOM 1030 CB THR A 188 23.622 7.231 -9.400 1.00 0.00 C ATOM 1031 OG1 THR A 188 22.407 7.352 -10.148 1.00 0.00 O ATOM 1032 CG2 THR A 188 24.791 7.730 -10.237 1.00 0.00 C ATOM 0 H THR A 188 22.089 5.382 -10.067 1.00 0.00 H new ATOM 0 HA THR A 188 24.773 5.406 -9.403 1.00 0.00 H new ATOM 0 HB THR A 188 23.555 7.840 -8.499 1.00 0.00 H new ATOM 0 HG1 THR A 188 21.645 7.372 -9.533 1.00 0.00 H new ATOM 0 HG21 THR A 188 24.616 8.767 -10.525 1.00 0.00 H new ATOM 0 HG22 THR A 188 25.710 7.665 -9.654 1.00 0.00 H new ATOM 0 HG23 THR A 188 24.885 7.116 -11.133 1.00 0.00 H new ATOM 1040 N VAL A 189 22.778 5.441 -6.819 1.00 0.00 N ATOM 1041 CA VAL A 189 22.719 5.345 -5.365 1.00 0.00 C ATOM 1042 C VAL A 189 23.667 4.270 -4.846 1.00 0.00 C ATOM 1043 O VAL A 189 24.266 4.416 -3.780 1.00 0.00 O ATOM 1044 CB VAL A 189 21.291 5.033 -4.881 1.00 0.00 C ATOM 1045 CG1 VAL A 189 21.218 5.089 -3.362 1.00 0.00 C ATOM 1046 CG2 VAL A 189 20.293 5.995 -5.507 1.00 0.00 C ATOM 0 H VAL A 189 21.883 5.298 -7.288 1.00 0.00 H new ATOM 0 HA VAL A 189 23.024 6.314 -4.971 1.00 0.00 H new ATOM 0 HB VAL A 189 21.032 4.022 -5.197 1.00 0.00 H new ATOM 0 HG11 VAL A 189 20.201 4.866 -3.038 1.00 0.00 H new ATOM 0 HG12 VAL A 189 21.903 4.355 -2.938 1.00 0.00 H new ATOM 0 HG13 VAL A 189 21.497 6.086 -3.021 1.00 0.00 H new ATOM 0 HG21 VAL A 189 19.289 5.759 -5.153 1.00 0.00 H new ATOM 0 HG22 VAL A 189 20.546 7.017 -5.225 1.00 0.00 H new ATOM 0 HG23 VAL A 189 20.327 5.899 -6.592 1.00 0.00 H new ATOM 1056 N THR A 190 23.800 3.189 -5.608 1.00 0.00 N ATOM 1057 CA THR A 190 24.675 2.088 -5.225 1.00 0.00 C ATOM 1058 C THR A 190 26.140 2.451 -5.436 1.00 0.00 C ATOM 1059 O THR A 190 27.026 1.919 -4.765 1.00 0.00 O ATOM 1060 CB THR A 190 24.354 0.811 -6.025 1.00 0.00 C ATOM 1061 OG1 THR A 190 23.001 0.409 -5.784 1.00 0.00 O ATOM 1062 CG2 THR A 190 25.299 -0.318 -5.645 1.00 0.00 C ATOM 0 H THR A 190 23.313 3.053 -6.494 1.00 0.00 H new ATOM 0 HA THR A 190 24.499 1.899 -4.166 1.00 0.00 H new ATOM 0 HB THR A 190 24.484 1.031 -7.085 1.00 0.00 H new ATOM 0 HG1 THR A 190 22.804 -0.402 -6.297 1.00 0.00 H new ATOM 0 HG21 THR A 190 25.053 -1.209 -6.223 1.00 0.00 H new ATOM 0 HG22 THR A 190 26.326 -0.020 -5.857 1.00 0.00 H new ATOM 0 HG23 THR A 190 25.197 -0.536 -4.582 1.00 0.00 H new ATOM 1070 N THR A 191 26.391 3.361 -6.372 1.00 0.00 N ATOM 1071 CA THR A 191 27.750 3.795 -6.672 1.00 0.00 C ATOM 1072 C THR A 191 28.453 4.304 -5.419 1.00 0.00 C ATOM 1073 O THR A 191 29.680 4.263 -5.322 1.00 0.00 O ATOM 1074 CB THR A 191 27.762 4.904 -7.740 1.00 0.00 C ATOM 1075 OG1 THR A 191 27.011 4.489 -8.886 1.00 0.00 O ATOM 1076 CG2 THR A 191 29.187 5.239 -8.155 1.00 0.00 C ATOM 0 H THR A 191 25.670 3.812 -6.936 1.00 0.00 H new ATOM 0 HA THR A 191 28.283 2.925 -7.056 1.00 0.00 H new ATOM 0 HB THR A 191 27.306 5.796 -7.311 1.00 0.00 H new ATOM 0 HG1 THR A 191 27.022 5.201 -9.560 1.00 0.00 H new ATOM 0 HG21 THR A 191 29.171 6.025 -8.910 1.00 0.00 H new ATOM 0 HG22 THR A 191 29.748 5.583 -7.286 1.00 0.00 H new ATOM 0 HG23 THR A 191 29.665 4.350 -8.567 1.00 0.00 H new ATOM 1084 N THR A 192 27.668 4.785 -4.459 1.00 0.00 N ATOM 1085 CA THR A 192 28.216 5.302 -3.212 1.00 0.00 C ATOM 1086 C THR A 192 28.985 4.223 -2.459 1.00 0.00 C ATOM 1087 O THR A 192 29.957 4.511 -1.760 1.00 0.00 O ATOM 1088 CB THR A 192 27.106 5.858 -2.299 1.00 0.00 C ATOM 1089 OG1 THR A 192 26.335 6.836 -3.005 1.00 0.00 O ATOM 1090 CG2 THR A 192 27.700 6.482 -1.044 1.00 0.00 C ATOM 0 H THR A 192 26.651 4.827 -4.522 1.00 0.00 H new ATOM 0 HA THR A 192 28.897 6.110 -3.478 1.00 0.00 H new ATOM 0 HB THR A 192 26.460 5.031 -2.004 1.00 0.00 H new ATOM 0 HG1 THR A 192 25.631 7.183 -2.418 1.00 0.00 H new ATOM 0 HG21 THR A 192 26.898 6.868 -0.415 1.00 0.00 H new ATOM 0 HG22 THR A 192 28.262 5.728 -0.494 1.00 0.00 H new ATOM 0 HG23 THR A 192 28.366 7.298 -1.324 1.00 0.00 H new ATOM 1098 N THR A 193 28.544 2.977 -2.605 1.00 0.00 N ATOM 1099 CA THR A 193 29.190 1.854 -1.938 1.00 0.00 C ATOM 1100 C THR A 193 30.648 1.726 -2.366 1.00 0.00 C ATOM 1101 O THR A 193 31.523 1.442 -1.548 1.00 0.00 O ATOM 1102 CB THR A 193 28.462 0.529 -2.236 1.00 0.00 C ATOM 1103 OG1 THR A 193 28.620 0.183 -3.616 1.00 0.00 O ATOM 1104 CG2 THR A 193 26.982 0.639 -1.901 1.00 0.00 C ATOM 0 H THR A 193 27.741 2.721 -3.180 1.00 0.00 H new ATOM 0 HA THR A 193 29.144 2.053 -0.867 1.00 0.00 H new ATOM 0 HB THR A 193 28.902 -0.251 -1.614 1.00 0.00 H new ATOM 0 HG1 THR A 193 28.015 0.728 -4.161 1.00 0.00 H new ATOM 0 HG21 THR A 193 26.488 -0.308 -2.119 1.00 0.00 H new ATOM 0 HG22 THR A 193 26.865 0.874 -0.843 1.00 0.00 H new ATOM 0 HG23 THR A 193 26.531 1.430 -2.500 1.00 0.00 H new ATOM 1112 N LYS A 194 30.904 1.939 -3.652 1.00 0.00 N ATOM 1113 CA LYS A 194 32.256 1.849 -4.189 1.00 0.00 C ATOM 1114 C LYS A 194 32.960 3.201 -4.118 1.00 0.00 C ATOM 1115 O LYS A 194 34.175 3.289 -4.292 1.00 0.00 O ATOM 1116 CB LYS A 194 32.221 1.357 -5.638 1.00 0.00 C ATOM 1117 CG LYS A 194 31.533 0.013 -5.806 1.00 0.00 C ATOM 1118 CD LYS A 194 32.394 -0.958 -6.597 1.00 0.00 C ATOM 1119 CE LYS A 194 31.544 -1.972 -7.347 1.00 0.00 C ATOM 1120 NZ LYS A 194 31.497 -3.284 -6.645 1.00 0.00 N ATOM 0 H LYS A 194 30.192 2.176 -4.343 1.00 0.00 H new ATOM 0 HA LYS A 194 32.814 1.135 -3.583 1.00 0.00 H new ATOM 0 HB2 LYS A 194 31.709 2.098 -6.252 1.00 0.00 H new ATOM 0 HB3 LYS A 194 33.242 1.283 -6.013 1.00 0.00 H new ATOM 0 HG2 LYS A 194 31.313 -0.409 -4.826 1.00 0.00 H new ATOM 0 HG3 LYS A 194 30.579 0.152 -6.314 1.00 0.00 H new ATOM 0 HD2 LYS A 194 33.012 -0.405 -7.305 1.00 0.00 H new ATOM 0 HD3 LYS A 194 33.072 -1.479 -5.921 1.00 0.00 H new ATOM 0 HE2 LYS A 194 30.532 -1.584 -7.460 1.00 0.00 H new ATOM 0 HE3 LYS A 194 31.946 -2.111 -8.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 30.908 -3.947 -7.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 32.460 -3.667 -6.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 31.090 -3.156 -5.697 1.00 0.00 H new ATOM 1134 N GLY A 195 32.189 4.252 -3.858 1.00 0.00 N ATOM 1135 CA GLY A 195 32.756 5.584 -3.767 1.00 0.00 C ATOM 1136 C GLY A 195 33.440 6.013 -5.050 1.00 0.00 C ATOM 1137 O GLY A 195 34.451 6.714 -5.018 1.00 0.00 O ATOM 0 H GLY A 195 31.181 4.204 -3.709 1.00 0.00 H new ATOM 0 HA2 GLY A 195 31.967 6.296 -3.525 1.00 0.00 H new ATOM 0 HA3 GLY A 195 33.475 5.614 -2.948 1.00 0.00 H new ATOM 1141 N GLU A 196 32.889 5.588 -6.183 1.00 0.00 N ATOM 1142 CA GLU A 196 33.454 5.931 -7.482 1.00 0.00 C ATOM 1143 C GLU A 196 32.615 7.000 -8.177 1.00 0.00 C ATOM 1144 O GLU A 196 31.509 7.314 -7.741 1.00 0.00 O ATOM 1145 CB GLU A 196 33.548 4.686 -8.367 1.00 0.00 C ATOM 1146 CG GLU A 196 34.954 4.123 -8.479 1.00 0.00 C ATOM 1147 CD GLU A 196 35.255 3.574 -9.860 1.00 0.00 C ATOM 1148 OE1 GLU A 196 34.298 3.371 -10.638 1.00 0.00 O ATOM 1149 OE2 GLU A 196 36.444 3.347 -10.164 1.00 0.00 O ATOM 0 H GLU A 196 32.052 5.006 -6.227 1.00 0.00 H new ATOM 0 HA GLU A 196 34.455 6.329 -7.319 1.00 0.00 H new ATOM 0 HB2 GLU A 196 32.888 3.916 -7.967 1.00 0.00 H new ATOM 0 HB3 GLU A 196 33.184 4.931 -9.365 1.00 0.00 H new ATOM 0 HG2 GLU A 196 35.674 4.905 -8.238 1.00 0.00 H new ATOM 0 HG3 GLU A 196 35.084 3.331 -7.741 1.00 0.00 H new ATOM 1156 N ASN A 197 33.152 7.554 -9.259 1.00 0.00 N ATOM 1157 CA ASN A 197 32.454 8.589 -10.013 1.00 0.00 C ATOM 1158 C ASN A 197 32.096 8.094 -11.411 1.00 0.00 C ATOM 1159 O ASN A 197 32.705 7.156 -11.924 1.00 0.00 O ATOM 1160 CB ASN A 197 33.317 9.848 -10.111 1.00 0.00 C ATOM 1161 CG ASN A 197 33.778 10.341 -8.753 1.00 0.00 C ATOM 1162 OD1 ASN A 197 34.853 9.974 -8.279 1.00 0.00 O ATOM 1163 ND2 ASN A 197 32.963 11.176 -8.119 1.00 0.00 N ATOM 0 H ASN A 197 34.067 7.304 -9.633 1.00 0.00 H new ATOM 0 HA ASN A 197 31.532 8.830 -9.484 1.00 0.00 H new ATOM 0 HB2 ASN A 197 34.187 9.641 -10.734 1.00 0.00 H new ATOM 0 HB3 ASN A 197 32.750 10.636 -10.607 1.00 0.00 H new ATOM 0 HD21 ASN A 197 33.219 11.540 -7.201 1.00 0.00 H new ATOM 0 HD22 ASN A 197 32.081 11.454 -8.550 1.00 0.00 H new ATOM 1170 N PHE A 198 31.103 8.733 -12.022 1.00 0.00 N ATOM 1171 CA PHE A 198 30.663 8.358 -13.361 1.00 0.00 C ATOM 1172 C PHE A 198 30.914 9.490 -14.353 1.00 0.00 C ATOM 1173 O PHE A 198 30.697 10.663 -14.044 1.00 0.00 O ATOM 1174 CB PHE A 198 29.177 7.996 -13.349 1.00 0.00 C ATOM 1175 CG PHE A 198 28.323 8.991 -12.617 1.00 0.00 C ATOM 1176 CD1 PHE A 198 28.142 8.894 -11.247 1.00 0.00 C ATOM 1177 CD2 PHE A 198 27.701 10.025 -13.299 1.00 0.00 C ATOM 1178 CE1 PHE A 198 27.356 9.808 -10.571 1.00 0.00 C ATOM 1179 CE2 PHE A 198 26.914 10.942 -12.629 1.00 0.00 C ATOM 1180 CZ PHE A 198 26.742 10.834 -11.263 1.00 0.00 C ATOM 0 H PHE A 198 30.588 9.512 -11.611 1.00 0.00 H new ATOM 0 HA PHE A 198 31.240 7.488 -13.676 1.00 0.00 H new ATOM 0 HB2 PHE A 198 28.823 7.912 -14.377 1.00 0.00 H new ATOM 0 HB3 PHE A 198 29.054 7.016 -12.889 1.00 0.00 H new ATOM 0 HD1 PHE A 198 28.621 8.095 -10.701 1.00 0.00 H new ATOM 0 HD2 PHE A 198 27.833 10.115 -14.367 1.00 0.00 H new ATOM 0 HE1 PHE A 198 27.222 9.720 -9.503 1.00 0.00 H new ATOM 0 HE2 PHE A 198 26.434 11.742 -13.173 1.00 0.00 H new ATOM 0 HZ PHE A 198 26.129 11.550 -10.737 1.00 0.00 H new ATOM 1190 N THR A 199 31.374 9.131 -15.548 1.00 0.00 N ATOM 1191 CA THR A 199 31.657 10.115 -16.585 1.00 0.00 C ATOM 1192 C THR A 199 30.520 10.190 -17.597 1.00 0.00 C ATOM 1193 O THR A 199 29.736 9.251 -17.734 1.00 0.00 O ATOM 1194 CB THR A 199 32.968 9.789 -17.326 1.00 0.00 C ATOM 1195 OG1 THR A 199 32.917 8.457 -17.848 1.00 0.00 O ATOM 1196 CG2 THR A 199 34.164 9.930 -16.396 1.00 0.00 C ATOM 0 H THR A 199 31.558 8.166 -15.821 1.00 0.00 H new ATOM 0 HA THR A 199 31.760 11.079 -16.086 1.00 0.00 H new ATOM 0 HB THR A 199 33.081 10.496 -18.148 1.00 0.00 H new ATOM 0 HG1 THR A 199 33.677 8.312 -18.450 1.00 0.00 H new ATOM 0 HG21 THR A 199 35.078 9.695 -16.941 1.00 0.00 H new ATOM 0 HG22 THR A 199 34.216 10.953 -16.023 1.00 0.00 H new ATOM 0 HG23 THR A 199 34.055 9.243 -15.557 1.00 0.00 H new ATOM 1204 N GLU A 200 30.436 11.312 -18.305 1.00 0.00 N ATOM 1205 CA GLU A 200 29.393 11.508 -19.305 1.00 0.00 C ATOM 1206 C GLU A 200 29.462 10.429 -20.382 1.00 0.00 C ATOM 1207 O GLU A 200 28.460 10.107 -21.020 1.00 0.00 O ATOM 1208 CB GLU A 200 29.522 12.892 -19.944 1.00 0.00 C ATOM 1209 CG GLU A 200 29.665 14.019 -18.935 1.00 0.00 C ATOM 1210 CD GLU A 200 28.594 13.980 -17.862 1.00 0.00 C ATOM 1211 OE1 GLU A 200 27.414 14.221 -18.192 1.00 0.00 O ATOM 1212 OE2 GLU A 200 28.936 13.708 -16.692 1.00 0.00 O ATOM 0 H GLU A 200 31.077 12.099 -18.205 1.00 0.00 H new ATOM 0 HA GLU A 200 28.427 11.436 -18.805 1.00 0.00 H new ATOM 0 HB2 GLU A 200 30.387 12.897 -20.607 1.00 0.00 H new ATOM 0 HB3 GLU A 200 28.645 13.080 -20.563 1.00 0.00 H new ATOM 0 HG2 GLU A 200 30.647 13.959 -18.466 1.00 0.00 H new ATOM 0 HG3 GLU A 200 29.618 14.976 -19.455 1.00 0.00 H new ATOM 1219 N THR A 201 30.654 9.874 -20.579 1.00 0.00 N ATOM 1220 CA THR A 201 30.857 8.834 -21.579 1.00 0.00 C ATOM 1221 C THR A 201 30.470 7.464 -21.033 1.00 0.00 C ATOM 1222 O THR A 201 29.804 6.681 -21.711 1.00 0.00 O ATOM 1223 CB THR A 201 32.321 8.789 -22.055 1.00 0.00 C ATOM 1224 OG1 THR A 201 32.778 10.112 -22.359 1.00 0.00 O ATOM 1225 CG2 THR A 201 32.464 7.904 -23.284 1.00 0.00 C ATOM 0 H THR A 201 31.494 10.128 -20.059 1.00 0.00 H new ATOM 0 HA THR A 201 30.216 9.080 -22.425 1.00 0.00 H new ATOM 0 HB THR A 201 32.928 8.370 -21.252 1.00 0.00 H new ATOM 0 HG1 THR A 201 33.710 10.075 -22.659 1.00 0.00 H new ATOM 0 HG21 THR A 201 33.507 7.888 -23.602 1.00 0.00 H new ATOM 0 HG22 THR A 201 32.143 6.891 -23.042 1.00 0.00 H new ATOM 0 HG23 THR A 201 31.845 8.298 -24.090 1.00 0.00 H new ATOM 1233 N ASP A 202 30.890 7.182 -19.805 1.00 0.00 N ATOM 1234 CA ASP A 202 30.586 5.906 -19.167 1.00 0.00 C ATOM 1235 C ASP A 202 29.090 5.776 -18.898 1.00 0.00 C ATOM 1236 O ASP A 202 28.487 4.739 -19.174 1.00 0.00 O ATOM 1237 CB ASP A 202 31.366 5.767 -17.859 1.00 0.00 C ATOM 1238 CG ASP A 202 32.810 5.364 -18.086 1.00 0.00 C ATOM 1239 OD1 ASP A 202 33.255 5.382 -19.254 1.00 0.00 O ATOM 1240 OD2 ASP A 202 33.496 5.032 -17.097 1.00 0.00 O ATOM 0 H ASP A 202 31.442 7.820 -19.231 1.00 0.00 H new ATOM 0 HA ASP A 202 30.886 5.108 -19.846 1.00 0.00 H new ATOM 0 HB2 ASP A 202 31.337 6.714 -17.319 1.00 0.00 H new ATOM 0 HB3 ASP A 202 30.880 5.024 -17.227 1.00 0.00 H new ATOM 1245 N VAL A 203 28.497 6.835 -18.356 1.00 0.00 N ATOM 1246 CA VAL A 203 27.072 6.840 -18.049 1.00 0.00 C ATOM 1247 C VAL A 203 26.239 6.587 -19.301 1.00 0.00 C ATOM 1248 O VAL A 203 25.158 6.003 -19.234 1.00 0.00 O ATOM 1249 CB VAL A 203 26.638 8.177 -17.419 1.00 0.00 C ATOM 1250 CG1 VAL A 203 26.831 9.320 -18.403 1.00 0.00 C ATOM 1251 CG2 VAL A 203 25.192 8.101 -16.954 1.00 0.00 C ATOM 0 H VAL A 203 28.982 7.701 -18.120 1.00 0.00 H new ATOM 0 HA VAL A 203 26.900 6.036 -17.333 1.00 0.00 H new ATOM 0 HB VAL A 203 27.266 8.370 -16.549 1.00 0.00 H new ATOM 0 HG11 VAL A 203 26.519 10.256 -17.939 1.00 0.00 H new ATOM 0 HG12 VAL A 203 27.883 9.386 -18.682 1.00 0.00 H new ATOM 0 HG13 VAL A 203 26.230 9.138 -19.294 1.00 0.00 H new ATOM 0 HG21 VAL A 203 24.902 9.054 -16.511 1.00 0.00 H new ATOM 0 HG22 VAL A 203 24.547 7.885 -17.806 1.00 0.00 H new ATOM 0 HG23 VAL A 203 25.090 7.310 -16.211 1.00 0.00 H new ATOM 1261 N LYS A 204 26.751 7.032 -20.445 1.00 0.00 N ATOM 1262 CA LYS A 204 26.056 6.853 -21.714 1.00 0.00 C ATOM 1263 C LYS A 204 26.048 5.385 -22.128 1.00 0.00 C ATOM 1264 O LYS A 204 25.087 4.905 -22.729 1.00 0.00 O ATOM 1265 CB LYS A 204 26.719 7.698 -22.805 1.00 0.00 C ATOM 1266 CG LYS A 204 25.895 7.804 -24.076 1.00 0.00 C ATOM 1267 CD LYS A 204 26.546 7.055 -25.227 1.00 0.00 C ATOM 1268 CE LYS A 204 27.797 7.767 -25.719 1.00 0.00 C ATOM 1269 NZ LYS A 204 27.473 8.857 -26.680 1.00 0.00 N ATOM 0 H LYS A 204 27.644 7.519 -20.518 1.00 0.00 H new ATOM 0 HA LYS A 204 25.025 7.181 -21.584 1.00 0.00 H new ATOM 0 HB2 LYS A 204 26.902 8.700 -22.416 1.00 0.00 H new ATOM 0 HB3 LYS A 204 27.691 7.267 -23.047 1.00 0.00 H new ATOM 0 HG2 LYS A 204 24.897 7.403 -23.898 1.00 0.00 H new ATOM 0 HG3 LYS A 204 25.774 8.853 -24.346 1.00 0.00 H new ATOM 0 HD2 LYS A 204 26.803 6.045 -24.906 1.00 0.00 H new ATOM 0 HD3 LYS A 204 25.835 6.958 -26.047 1.00 0.00 H new ATOM 0 HE2 LYS A 204 28.337 8.182 -24.868 1.00 0.00 H new ATOM 0 HE3 LYS A 204 28.461 7.047 -26.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 28.352 9.318 -26.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 26.980 8.458 -27.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 26.861 9.558 -26.216 1.00 0.00 H new ATOM 1283 N MET A 205 27.125 4.677 -21.802 1.00 0.00 N ATOM 1284 CA MET A 205 27.240 3.263 -22.139 1.00 0.00 C ATOM 1285 C MET A 205 26.146 2.450 -21.453 1.00 0.00 C ATOM 1286 O MET A 205 25.417 1.701 -22.103 1.00 0.00 O ATOM 1287 CB MET A 205 28.616 2.730 -21.734 1.00 0.00 C ATOM 1288 CG MET A 205 29.728 3.135 -22.687 1.00 0.00 C ATOM 1289 SD MET A 205 30.822 1.762 -23.101 1.00 0.00 S ATOM 1290 CE MET A 205 32.403 2.418 -22.574 1.00 0.00 C ATOM 0 H MET A 205 27.930 5.059 -21.305 1.00 0.00 H new ATOM 0 HA MET A 205 27.122 3.162 -23.218 1.00 0.00 H new ATOM 0 HB2 MET A 205 28.856 3.090 -20.734 1.00 0.00 H new ATOM 0 HB3 MET A 205 28.574 1.642 -21.679 1.00 0.00 H new ATOM 0 HG2 MET A 205 29.290 3.534 -23.602 1.00 0.00 H new ATOM 0 HG3 MET A 205 30.313 3.937 -22.237 1.00 0.00 H new ATOM 0 HE1 MET A 205 33.197 1.729 -22.862 1.00 0.00 H new ATOM 0 HE2 MET A 205 32.572 3.385 -23.048 1.00 0.00 H new ATOM 0 HE3 MET A 205 32.403 2.540 -21.491 1.00 0.00 H new ATOM 1300 N MET A 206 26.037 2.605 -20.138 1.00 0.00 N ATOM 1301 CA MET A 206 25.030 1.885 -19.365 1.00 0.00 C ATOM 1302 C MET A 206 23.624 2.276 -19.808 1.00 0.00 C ATOM 1303 O MET A 206 22.730 1.433 -19.880 1.00 0.00 O ATOM 1304 CB MET A 206 25.204 2.168 -17.872 1.00 0.00 C ATOM 1305 CG MET A 206 26.566 1.764 -17.331 1.00 0.00 C ATOM 1306 SD MET A 206 26.708 2.012 -15.551 1.00 0.00 S ATOM 1307 CE MET A 206 26.202 3.724 -15.406 1.00 0.00 C ATOM 0 H MET A 206 26.632 3.222 -19.585 1.00 0.00 H new ATOM 0 HA MET A 206 25.165 0.818 -19.543 1.00 0.00 H new ATOM 0 HB2 MET A 206 25.052 3.232 -17.692 1.00 0.00 H new ATOM 0 HB3 MET A 206 24.430 1.637 -17.317 1.00 0.00 H new ATOM 0 HG2 MET A 206 26.748 0.715 -17.563 1.00 0.00 H new ATOM 0 HG3 MET A 206 27.340 2.342 -17.837 1.00 0.00 H new ATOM 0 HE1 MET A 206 26.470 4.100 -14.419 1.00 0.00 H new ATOM 0 HE2 MET A 206 26.705 4.318 -16.169 1.00 0.00 H new ATOM 0 HE3 MET A 206 25.123 3.797 -15.542 1.00 0.00 H new ATOM 1317 N GLU A 207 23.435 3.558 -20.104 1.00 0.00 N ATOM 1318 CA GLU A 207 22.136 4.058 -20.538 1.00 0.00 C ATOM 1319 C GLU A 207 21.664 3.328 -21.792 1.00 0.00 C ATOM 1320 O GLU A 207 20.464 3.228 -22.050 1.00 0.00 O ATOM 1321 CB GLU A 207 22.209 5.563 -20.808 1.00 0.00 C ATOM 1322 CG GLU A 207 22.015 6.414 -19.565 1.00 0.00 C ATOM 1323 CD GLU A 207 20.639 7.048 -19.501 1.00 0.00 C ATOM 1324 OE1 GLU A 207 20.356 7.937 -20.332 1.00 0.00 O ATOM 1325 OE2 GLU A 207 19.845 6.656 -18.621 1.00 0.00 O ATOM 0 H GLU A 207 24.165 4.269 -20.051 1.00 0.00 H new ATOM 0 HA GLU A 207 21.418 3.873 -19.739 1.00 0.00 H new ATOM 0 HB2 GLU A 207 23.177 5.798 -21.251 1.00 0.00 H new ATOM 0 HB3 GLU A 207 21.449 5.829 -21.543 1.00 0.00 H new ATOM 0 HG2 GLU A 207 22.168 5.797 -18.679 1.00 0.00 H new ATOM 0 HG3 GLU A 207 22.773 7.197 -19.543 1.00 0.00 H new ATOM 1332 N ARG A 208 22.615 2.818 -22.567 1.00 0.00 N ATOM 1333 CA ARG A 208 22.297 2.098 -23.794 1.00 0.00 C ATOM 1334 C ARG A 208 21.594 0.780 -23.485 1.00 0.00 C ATOM 1335 O ARG A 208 20.703 0.353 -24.219 1.00 0.00 O ATOM 1336 CB ARG A 208 23.571 1.832 -24.599 1.00 0.00 C ATOM 1337 CG ARG A 208 23.308 1.453 -26.048 1.00 0.00 C ATOM 1338 CD ARG A 208 24.282 2.143 -26.990 1.00 0.00 C ATOM 1339 NE ARG A 208 24.500 1.373 -28.211 1.00 0.00 N ATOM 1340 CZ ARG A 208 25.242 1.801 -29.227 1.00 0.00 C ATOM 1341 NH1 ARG A 208 25.833 2.986 -29.168 1.00 0.00 N ATOM 1342 NH2 ARG A 208 25.393 1.042 -30.305 1.00 0.00 N ATOM 0 H ARG A 208 23.613 2.890 -22.367 1.00 0.00 H new ATOM 0 HA ARG A 208 21.624 2.719 -24.385 1.00 0.00 H new ATOM 0 HB2 ARG A 208 24.199 2.722 -24.573 1.00 0.00 H new ATOM 0 HB3 ARG A 208 24.133 1.031 -24.119 1.00 0.00 H new ATOM 0 HG2 ARG A 208 23.392 0.372 -26.164 1.00 0.00 H new ATOM 0 HG3 ARG A 208 22.287 1.724 -26.316 1.00 0.00 H new ATOM 0 HD2 ARG A 208 23.899 3.131 -27.248 1.00 0.00 H new ATOM 0 HD3 ARG A 208 25.234 2.293 -26.481 1.00 0.00 H new ATOM 0 HE ARG A 208 24.059 0.457 -28.288 1.00 0.00 H new ATOM 0 HH11 ARG A 208 25.719 3.572 -28.341 1.00 0.00 H new ATOM 0 HH12 ARG A 208 26.402 3.312 -29.949 1.00 0.00 H new ATOM 0 HH21 ARG A 208 24.939 0.130 -30.354 1.00 0.00 H new ATOM 0 HH22 ARG A 208 25.963 1.371 -31.085 1.00 0.00 H new ATOM 1356 N VAL A 209 22.000 0.141 -22.393 1.00 0.00 N ATOM 1357 CA VAL A 209 21.409 -1.128 -21.986 1.00 0.00 C ATOM 1358 C VAL A 209 19.962 -0.943 -21.542 1.00 0.00 C ATOM 1359 O VAL A 209 19.100 -1.769 -21.840 1.00 0.00 O ATOM 1360 CB VAL A 209 22.207 -1.777 -20.839 1.00 0.00 C ATOM 1361 CG1 VAL A 209 21.690 -3.179 -20.555 1.00 0.00 C ATOM 1362 CG2 VAL A 209 23.691 -1.804 -21.172 1.00 0.00 C ATOM 0 H VAL A 209 22.736 0.481 -21.774 1.00 0.00 H new ATOM 0 HA VAL A 209 21.438 -1.784 -22.856 1.00 0.00 H new ATOM 0 HB VAL A 209 22.071 -1.177 -19.939 1.00 0.00 H new ATOM 0 HG11 VAL A 209 22.266 -3.621 -19.742 1.00 0.00 H new ATOM 0 HG12 VAL A 209 20.639 -3.128 -20.270 1.00 0.00 H new ATOM 0 HG13 VAL A 209 21.794 -3.793 -21.449 1.00 0.00 H new ATOM 0 HG21 VAL A 209 24.240 -2.266 -20.351 1.00 0.00 H new ATOM 0 HG22 VAL A 209 23.849 -2.380 -22.084 1.00 0.00 H new ATOM 0 HG23 VAL A 209 24.049 -0.785 -21.320 1.00 0.00 H new ATOM 1372 N VAL A 210 19.703 0.148 -20.828 1.00 0.00 N ATOM 1373 CA VAL A 210 18.359 0.443 -20.344 1.00 0.00 C ATOM 1374 C VAL A 210 17.412 0.743 -21.501 1.00 0.00 C ATOM 1375 O VAL A 210 16.223 0.434 -21.438 1.00 0.00 O ATOM 1376 CB VAL A 210 18.363 1.640 -19.374 1.00 0.00 C ATOM 1377 CG1 VAL A 210 16.987 1.827 -18.752 1.00 0.00 C ATOM 1378 CG2 VAL A 210 19.422 1.450 -18.299 1.00 0.00 C ATOM 0 H VAL A 210 20.405 0.842 -20.572 1.00 0.00 H new ATOM 0 HA VAL A 210 18.011 -0.444 -19.814 1.00 0.00 H new ATOM 0 HB VAL A 210 18.607 2.541 -19.936 1.00 0.00 H new ATOM 0 HG11 VAL A 210 17.009 2.677 -18.070 1.00 0.00 H new ATOM 0 HG12 VAL A 210 16.254 2.011 -19.538 1.00 0.00 H new ATOM 0 HG13 VAL A 210 16.711 0.927 -18.202 1.00 0.00 H new ATOM 0 HG21 VAL A 210 19.411 2.305 -17.622 1.00 0.00 H new ATOM 0 HG22 VAL A 210 19.211 0.540 -17.737 1.00 0.00 H new ATOM 0 HG23 VAL A 210 20.404 1.369 -18.766 1.00 0.00 H new ATOM 1388 N GLU A 211 17.949 1.348 -22.557 1.00 0.00 N ATOM 1389 CA GLU A 211 17.151 1.690 -23.728 1.00 0.00 C ATOM 1390 C GLU A 211 16.565 0.437 -24.372 1.00 0.00 C ATOM 1391 O GLU A 211 15.358 0.348 -24.595 1.00 0.00 O ATOM 1392 CB GLU A 211 18.001 2.451 -24.747 1.00 0.00 C ATOM 1393 CG GLU A 211 17.267 2.759 -26.042 1.00 0.00 C ATOM 1394 CD GLU A 211 18.021 3.739 -26.920 1.00 0.00 C ATOM 1395 OE1 GLU A 211 19.030 3.333 -27.533 1.00 0.00 O ATOM 1396 OE2 GLU A 211 17.600 4.913 -26.995 1.00 0.00 O ATOM 0 H GLU A 211 18.932 1.611 -22.625 1.00 0.00 H new ATOM 0 HA GLU A 211 16.329 2.328 -23.402 1.00 0.00 H new ATOM 0 HB2 GLU A 211 18.339 3.386 -24.300 1.00 0.00 H new ATOM 0 HB3 GLU A 211 18.892 1.865 -24.974 1.00 0.00 H new ATOM 0 HG2 GLU A 211 17.106 1.833 -26.593 1.00 0.00 H new ATOM 0 HG3 GLU A 211 16.283 3.167 -25.810 1.00 0.00 H new ATOM 1403 N GLN A 212 17.429 -0.529 -24.667 1.00 0.00 N ATOM 1404 CA GLN A 212 16.997 -1.777 -25.287 1.00 0.00 C ATOM 1405 C GLN A 212 16.275 -2.663 -24.278 1.00 0.00 C ATOM 1406 O GLN A 212 15.402 -3.450 -24.643 1.00 0.00 O ATOM 1407 CB GLN A 212 18.198 -2.522 -25.871 1.00 0.00 C ATOM 1408 CG GLN A 212 17.882 -3.275 -27.154 1.00 0.00 C ATOM 1409 CD GLN A 212 18.289 -2.508 -28.396 1.00 0.00 C ATOM 1410 OE1 GLN A 212 19.389 -1.959 -28.469 1.00 0.00 O ATOM 1411 NE2 GLN A 212 17.401 -2.465 -29.383 1.00 0.00 N ATOM 0 H GLN A 212 18.431 -0.472 -24.487 1.00 0.00 H new ATOM 0 HA GLN A 212 16.303 -1.534 -26.092 1.00 0.00 H new ATOM 0 HB2 GLN A 212 18.998 -1.808 -26.066 1.00 0.00 H new ATOM 0 HB3 GLN A 212 18.574 -3.227 -25.129 1.00 0.00 H new ATOM 0 HG2 GLN A 212 18.394 -4.237 -27.142 1.00 0.00 H new ATOM 0 HG3 GLN A 212 16.813 -3.484 -27.194 1.00 0.00 H new ATOM 0 HE21 GLN A 212 16.501 -2.934 -29.280 1.00 0.00 H new ATOM 0 HE22 GLN A 212 17.619 -1.963 -30.244 1.00 0.00 H new ATOM 1420 N MET A 213 16.645 -2.531 -23.009 1.00 0.00 N ATOM 1421 CA MET A 213 16.031 -3.320 -21.947 1.00 0.00 C ATOM 1422 C MET A 213 14.535 -3.035 -21.854 1.00 0.00 C ATOM 1423 O MET A 213 13.711 -3.936 -22.014 1.00 0.00 O ATOM 1424 CB MET A 213 16.703 -3.021 -20.606 1.00 0.00 C ATOM 1425 CG MET A 213 16.126 -3.817 -19.446 1.00 0.00 C ATOM 1426 SD MET A 213 17.328 -4.102 -18.133 1.00 0.00 S ATOM 1427 CE MET A 213 17.914 -2.434 -17.842 1.00 0.00 C ATOM 0 H MET A 213 17.367 -1.885 -22.690 1.00 0.00 H new ATOM 0 HA MET A 213 16.168 -4.374 -22.186 1.00 0.00 H new ATOM 0 HB2 MET A 213 17.769 -3.234 -20.688 1.00 0.00 H new ATOM 0 HB3 MET A 213 16.606 -1.957 -20.390 1.00 0.00 H new ATOM 0 HG2 MET A 213 15.267 -3.285 -19.037 1.00 0.00 H new ATOM 0 HG3 MET A 213 15.762 -4.776 -19.814 1.00 0.00 H new ATOM 0 HE1 MET A 213 18.011 -2.264 -16.770 1.00 0.00 H new ATOM 0 HE2 MET A 213 18.885 -2.301 -18.319 1.00 0.00 H new ATOM 0 HE3 MET A 213 17.203 -1.721 -18.260 1.00 0.00 H new ATOM 1437 N CYS A 214 14.192 -1.778 -21.595 1.00 0.00 N ATOM 1438 CA CYS A 214 12.795 -1.375 -21.480 1.00 0.00 C ATOM 1439 C CYS A 214 12.022 -1.725 -22.747 1.00 0.00 C ATOM 1440 O CYS A 214 10.821 -1.994 -22.699 1.00 0.00 O ATOM 1441 CB CYS A 214 12.698 0.128 -21.208 1.00 0.00 C ATOM 1442 SG CYS A 214 13.157 1.171 -22.629 1.00 0.00 S ATOM 0 H CYS A 214 14.862 -1.021 -21.461 1.00 0.00 H new ATOM 0 HA CYS A 214 12.353 -1.918 -20.645 1.00 0.00 H new ATOM 0 HB2 CYS A 214 11.677 0.367 -20.910 1.00 0.00 H new ATOM 0 HB3 CYS A 214 13.343 0.376 -20.365 1.00 0.00 H new ATOM 0 HG CYS A 214 14.112 0.597 -23.298 1.00 0.00 H new ATOM 1447 N ILE A 215 12.718 -1.721 -23.879 1.00 0.00 N ATOM 1448 CA ILE A 215 12.097 -2.040 -25.159 1.00 0.00 C ATOM 1449 C ILE A 215 11.903 -3.544 -25.316 1.00 0.00 C ATOM 1450 O ILE A 215 10.961 -3.995 -25.968 1.00 0.00 O ATOM 1451 CB ILE A 215 12.938 -1.516 -26.338 1.00 0.00 C ATOM 1452 CG1 ILE A 215 12.932 0.014 -26.357 1.00 0.00 C ATOM 1453 CG2 ILE A 215 12.408 -2.069 -27.653 1.00 0.00 C ATOM 1454 CD1 ILE A 215 11.582 0.609 -26.690 1.00 0.00 C ATOM 0 H ILE A 215 13.712 -1.500 -23.936 1.00 0.00 H new ATOM 0 HA ILE A 215 11.124 -1.548 -25.170 1.00 0.00 H new ATOM 0 HB ILE A 215 13.966 -1.855 -26.211 1.00 0.00 H new ATOM 0 HG12 ILE A 215 13.252 0.383 -25.382 1.00 0.00 H new ATOM 0 HG13 ILE A 215 13.664 0.363 -27.086 1.00 0.00 H new ATOM 0 HG21 ILE A 215 13.012 -1.690 -28.477 1.00 0.00 H new ATOM 0 HG22 ILE A 215 12.459 -3.158 -27.637 1.00 0.00 H new ATOM 0 HG23 ILE A 215 11.373 -1.756 -27.788 1.00 0.00 H new ATOM 0 HD11 ILE A 215 11.653 1.697 -26.685 1.00 0.00 H new ATOM 0 HD12 ILE A 215 11.268 0.270 -27.677 1.00 0.00 H new ATOM 0 HD13 ILE A 215 10.851 0.290 -25.948 1.00 0.00 H new ATOM 1466 N THR A 216 12.799 -4.318 -24.712 1.00 0.00 N ATOM 1467 CA THR A 216 12.727 -5.771 -24.783 1.00 0.00 C ATOM 1468 C THR A 216 11.371 -6.278 -24.304 1.00 0.00 C ATOM 1469 O THR A 216 10.805 -7.205 -24.883 1.00 0.00 O ATOM 1470 CB THR A 216 13.836 -6.431 -23.942 1.00 0.00 C ATOM 1471 OG1 THR A 216 15.122 -6.039 -24.434 1.00 0.00 O ATOM 1472 CG2 THR A 216 13.713 -7.947 -23.980 1.00 0.00 C ATOM 0 H THR A 216 13.584 -3.961 -24.167 1.00 0.00 H new ATOM 0 HA THR A 216 12.865 -6.043 -25.829 1.00 0.00 H new ATOM 0 HB THR A 216 13.726 -6.099 -22.910 1.00 0.00 H new ATOM 0 HG1 THR A 216 15.251 -5.079 -24.284 1.00 0.00 H new ATOM 0 HG21 THR A 216 14.506 -8.392 -23.379 1.00 0.00 H new ATOM 0 HG22 THR A 216 12.744 -8.244 -23.578 1.00 0.00 H new ATOM 0 HG23 THR A 216 13.800 -8.293 -25.010 1.00 0.00 H new ATOM 1480 N GLN A 217 10.857 -5.665 -23.243 1.00 0.00 N ATOM 1481 CA GLN A 217 9.567 -6.056 -22.686 1.00 0.00 C ATOM 1482 C GLN A 217 8.464 -5.937 -23.733 1.00 0.00 C ATOM 1483 O GLN A 217 7.586 -6.795 -23.824 1.00 0.00 O ATOM 1484 CB GLN A 217 9.229 -5.190 -21.471 1.00 0.00 C ATOM 1485 CG GLN A 217 10.328 -5.158 -20.422 1.00 0.00 C ATOM 1486 CD GLN A 217 9.851 -4.602 -19.094 1.00 0.00 C ATOM 1487 OE1 GLN A 217 9.181 -3.570 -19.045 1.00 0.00 O ATOM 1488 NE2 GLN A 217 10.196 -5.284 -18.008 1.00 0.00 N ATOM 0 H GLN A 217 11.313 -4.896 -22.752 1.00 0.00 H new ATOM 0 HA GLN A 217 9.635 -7.098 -22.373 1.00 0.00 H new ATOM 0 HB2 GLN A 217 9.028 -4.172 -21.805 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.312 -5.562 -21.014 1.00 0.00 H new ATOM 0 HG2 GLN A 217 10.712 -6.167 -20.272 1.00 0.00 H new ATOM 0 HG3 GLN A 217 11.157 -4.553 -20.788 1.00 0.00 H new ATOM 0 HE21 GLN A 217 10.752 -6.135 -18.095 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.905 -4.957 -17.087 1.00 0.00 H new ATOM 1497 N TYR A 218 8.515 -4.868 -24.520 1.00 0.00 N ATOM 1498 CA TYR A 218 7.519 -4.636 -25.559 1.00 0.00 C ATOM 1499 C TYR A 218 6.136 -4.425 -24.950 1.00 0.00 C ATOM 1500 O TYR A 218 5.123 -4.494 -25.645 1.00 0.00 O ATOM 1501 CB TYR A 218 7.484 -5.813 -26.535 1.00 0.00 C ATOM 1502 CG TYR A 218 7.307 -5.399 -27.978 1.00 0.00 C ATOM 1503 CD1 TYR A 218 8.371 -4.884 -28.709 1.00 0.00 C ATOM 1504 CD2 TYR A 218 6.076 -5.520 -28.611 1.00 0.00 C ATOM 1505 CE1 TYR A 218 8.214 -4.503 -30.028 1.00 0.00 C ATOM 1506 CE2 TYR A 218 5.911 -5.143 -29.929 1.00 0.00 C ATOM 1507 CZ TYR A 218 6.982 -4.635 -30.633 1.00 0.00 C ATOM 1508 OH TYR A 218 6.821 -4.257 -31.947 1.00 0.00 O ATOM 0 H TYR A 218 9.235 -4.149 -24.458 1.00 0.00 H new ATOM 0 HA TYR A 218 7.800 -3.733 -26.100 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.410 -6.381 -26.440 1.00 0.00 H new ATOM 0 HB3 TYR A 218 6.670 -6.482 -26.255 1.00 0.00 H new ATOM 0 HD1 TYR A 218 9.337 -4.780 -28.238 1.00 0.00 H new ATOM 0 HD2 TYR A 218 5.234 -5.916 -28.063 1.00 0.00 H new ATOM 0 HE1 TYR A 218 9.051 -4.104 -30.582 1.00 0.00 H new ATOM 0 HE2 TYR A 218 4.948 -5.246 -30.406 1.00 0.00 H new ATOM 0 HH TYR A 218 5.894 -4.415 -32.222 1.00 0.00 H new