USER MOD reduce.3.24.130724 H: found=0, std=0, add=496, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 498 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 Single : A 183 LYS NZ :NH3+ 162:sc= -3.3! (180deg=-4.12!) USER MOD Single : A 193 THR OG1 : rot 32:sc= -0.106 USER MOD Single : A 197 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.000289) USER MOD Single : A 201 TYR OH : rot 180:sc= 0 USER MOD Single : A 210 SER OG : rot 180:sc= -0.954 USER MOD Single : A 226 CYS SG : rot 23:sc= -2.02! USER MOD Single : A 229 THR OG1 : rot 180:sc= 0 USER MOD Single : A 231 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 237 LYS NZ :NH3+ -114:sc= 0.321 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ -163:sc= -0.174 (180deg=-0.868) USER MOD Single : A 240 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 TYR OH : rot 180:sc= 0 USER MOD Single : A 245 HIS :FLIP no HD1:sc= -17.8! C(o=-23!,f=-18!) USER MOD Single : A 246 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 250 SER OG : rot 180:sc= 0 USER MOD Single : A 251 LYS NZ :NH3+ 148:sc= -0.177 (180deg=-1.21!) USER MOD Single : A 252 CYS SG : rot -160:sc= -6.21! USER MOD Single : A 255 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 183 -0.810 8.478 -4.998 1.00 0.00 N ATOM 2 CA LYS A 183 -0.631 7.284 -5.877 1.00 0.00 C ATOM 3 C LYS A 183 -1.025 6.053 -5.070 1.00 0.00 C ATOM 4 O LYS A 183 -1.106 6.114 -3.864 1.00 0.00 O ATOM 5 CB LYS A 183 0.850 7.297 -6.240 1.00 0.00 C ATOM 6 CG LYS A 183 1.401 5.870 -6.461 1.00 0.00 C ATOM 7 CD LYS A 183 1.795 5.734 -7.922 1.00 0.00 C ATOM 8 CE LYS A 183 3.315 5.831 -8.056 1.00 0.00 C ATOM 9 NZ LYS A 183 3.662 4.915 -9.177 1.00 0.00 N ATOM 0 HA LYS A 183 -1.240 7.284 -6.781 1.00 0.00 H new ATOM 0 HB2 LYS A 183 0.997 7.887 -7.145 1.00 0.00 H new ATOM 0 HB3 LYS A 183 1.414 7.785 -5.446 1.00 0.00 H new ATOM 0 HG2 LYS A 183 2.262 5.691 -5.817 1.00 0.00 H new ATOM 0 HG3 LYS A 183 0.648 5.127 -6.200 1.00 0.00 H new ATOM 0 HD2 LYS A 183 1.446 4.780 -8.316 1.00 0.00 H new ATOM 0 HD3 LYS A 183 1.317 6.516 -8.512 1.00 0.00 H new ATOM 0 HE2 LYS A 183 3.628 6.853 -8.270 1.00 0.00 H new ATOM 0 HE3 LYS A 183 3.812 5.532 -7.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 4.612 5.145 -9.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 3.647 3.932 -8.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 2.970 5.028 -9.945 1.00 0.00 H new ATOM 23 N ILE A 184 -1.271 4.939 -5.697 1.00 0.00 N ATOM 24 CA ILE A 184 -1.648 3.747 -4.901 1.00 0.00 C ATOM 25 C ILE A 184 -0.854 2.511 -5.350 1.00 0.00 C ATOM 26 O ILE A 184 0.005 2.591 -6.206 1.00 0.00 O ATOM 27 CB ILE A 184 -3.144 3.547 -5.147 1.00 0.00 C ATOM 28 CG1 ILE A 184 -3.388 3.320 -6.641 1.00 0.00 C ATOM 29 CG2 ILE A 184 -3.913 4.788 -4.689 1.00 0.00 C ATOM 30 CD1 ILE A 184 -4.779 2.719 -6.844 1.00 0.00 C ATOM 0 H ILE A 184 -1.228 4.805 -6.707 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.427 3.887 -3.843 1.00 0.00 H new ATOM 0 HB ILE A 184 -3.489 2.680 -4.584 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -3.305 4.263 -7.181 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.629 2.652 -7.047 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.979 4.642 -4.866 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.741 4.951 -3.625 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -3.568 5.657 -5.249 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.954 2.557 -7.908 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -4.845 1.767 -6.316 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -5.532 3.403 -6.453 1.00 0.00 H new ATOM 42 N PHE A 185 -1.136 1.367 -4.774 1.00 0.00 N ATOM 43 CA PHE A 185 -0.397 0.126 -5.165 1.00 0.00 C ATOM 44 C PHE A 185 -1.302 -1.103 -5.029 1.00 0.00 C ATOM 45 O PHE A 185 -2.074 -1.217 -4.105 1.00 0.00 O ATOM 46 CB PHE A 185 0.813 0.074 -4.208 1.00 0.00 C ATOM 47 CG PHE A 185 1.037 -1.325 -3.647 1.00 0.00 C ATOM 48 CD1 PHE A 185 1.064 -2.434 -4.501 1.00 0.00 C ATOM 49 CD2 PHE A 185 1.214 -1.509 -2.266 1.00 0.00 C ATOM 50 CE1 PHE A 185 1.265 -3.717 -3.978 1.00 0.00 C ATOM 51 CE2 PHE A 185 1.417 -2.793 -1.747 1.00 0.00 C ATOM 52 CZ PHE A 185 1.442 -3.895 -2.603 1.00 0.00 C ATOM 0 H PHE A 185 -1.845 1.239 -4.051 1.00 0.00 H new ATOM 0 HA PHE A 185 -0.074 0.133 -6.206 1.00 0.00 H new ATOM 0 HB2 PHE A 185 1.708 0.400 -4.737 1.00 0.00 H new ATOM 0 HB3 PHE A 185 0.656 0.773 -3.387 1.00 0.00 H new ATOM 0 HD1 PHE A 185 0.930 -2.300 -5.564 1.00 0.00 H new ATOM 0 HD2 PHE A 185 1.193 -0.657 -1.602 1.00 0.00 H new ATOM 0 HE1 PHE A 185 1.283 -4.571 -4.639 1.00 0.00 H new ATOM 0 HE2 PHE A 185 1.554 -2.931 -0.685 1.00 0.00 H new ATOM 0 HZ PHE A 185 1.598 -4.886 -2.203 1.00 0.00 H new ATOM 62 N VAL A 186 -1.200 -2.029 -5.945 1.00 0.00 N ATOM 63 CA VAL A 186 -2.040 -3.256 -5.862 1.00 0.00 C ATOM 64 C VAL A 186 -1.170 -4.466 -5.533 1.00 0.00 C ATOM 65 O VAL A 186 -0.167 -4.716 -6.184 1.00 0.00 O ATOM 66 CB VAL A 186 -2.668 -3.428 -7.244 1.00 0.00 C ATOM 67 CG1 VAL A 186 -3.622 -4.629 -7.220 1.00 0.00 C ATOM 68 CG2 VAL A 186 -3.448 -2.165 -7.616 1.00 0.00 C ATOM 0 H VAL A 186 -0.571 -1.987 -6.747 1.00 0.00 H new ATOM 0 HA VAL A 186 -2.797 -3.171 -5.082 1.00 0.00 H new ATOM 0 HB VAL A 186 -1.883 -3.597 -7.981 1.00 0.00 H new ATOM 0 HG11 VAL A 186 -4.073 -4.755 -8.204 1.00 0.00 H new ATOM 0 HG12 VAL A 186 -3.067 -5.529 -6.957 1.00 0.00 H new ATOM 0 HG13 VAL A 186 -4.405 -4.457 -6.482 1.00 0.00 H new ATOM 0 HG21 VAL A 186 -3.895 -2.291 -8.602 1.00 0.00 H new ATOM 0 HG22 VAL A 186 -4.234 -1.993 -6.881 1.00 0.00 H new ATOM 0 HG23 VAL A 186 -2.771 -1.311 -7.630 1.00 0.00 H new ATOM 78 N GLY A 187 -1.546 -5.219 -4.532 1.00 0.00 N ATOM 79 CA GLY A 187 -0.748 -6.422 -4.155 1.00 0.00 C ATOM 80 C GLY A 187 -1.479 -7.683 -4.612 1.00 0.00 C ATOM 81 O GLY A 187 -1.818 -8.546 -3.826 1.00 0.00 O ATOM 0 H GLY A 187 -2.373 -5.052 -3.959 1.00 0.00 H new ATOM 0 HA2 GLY A 187 0.239 -6.375 -4.614 1.00 0.00 H new ATOM 0 HA3 GLY A 187 -0.597 -6.448 -3.076 1.00 0.00 H new ATOM 148 N THR A 193 -0.603 -6.267 -15.977 1.00 0.00 N ATOM 149 CA THR A 193 -1.531 -5.308 -15.301 1.00 0.00 C ATOM 150 C THR A 193 -2.377 -4.562 -16.352 1.00 0.00 C ATOM 151 O THR A 193 -1.845 -3.811 -17.145 1.00 0.00 O ATOM 152 CB THR A 193 -0.621 -4.336 -14.546 1.00 0.00 C ATOM 153 OG1 THR A 193 0.067 -5.040 -13.522 1.00 0.00 O ATOM 154 CG2 THR A 193 -1.472 -3.228 -13.921 1.00 0.00 C ATOM 0 HA THR A 193 -2.229 -5.809 -14.630 1.00 0.00 H new ATOM 0 HB THR A 193 0.100 -3.896 -15.235 1.00 0.00 H new ATOM 0 HG1 THR A 193 0.229 -5.962 -13.811 1.00 0.00 H new ATOM 0 HG21 THR A 193 -0.827 -2.534 -13.382 1.00 0.00 H new ATOM 0 HG22 THR A 193 -2.006 -2.693 -14.706 1.00 0.00 H new ATOM 0 HG23 THR A 193 -2.190 -3.667 -13.229 1.00 0.00 H new ATOM 162 N PRO A 194 -3.670 -4.812 -16.341 1.00 0.00 N ATOM 163 CA PRO A 194 -4.589 -4.174 -17.321 1.00 0.00 C ATOM 164 C PRO A 194 -4.663 -2.648 -17.150 1.00 0.00 C ATOM 165 O PRO A 194 -5.712 -2.105 -16.898 1.00 0.00 O ATOM 166 CB PRO A 194 -5.938 -4.816 -16.983 1.00 0.00 C ATOM 167 CG PRO A 194 -5.743 -5.798 -15.813 1.00 0.00 C ATOM 168 CD PRO A 194 -4.279 -5.741 -15.361 1.00 0.00 C ATOM 0 HA PRO A 194 -4.266 -4.324 -18.351 1.00 0.00 H new ATOM 0 HB2 PRO A 194 -6.664 -4.049 -16.714 1.00 0.00 H new ATOM 0 HB3 PRO A 194 -6.335 -5.340 -17.853 1.00 0.00 H new ATOM 0 HG2 PRO A 194 -6.404 -5.537 -14.987 1.00 0.00 H new ATOM 0 HG3 PRO A 194 -6.004 -6.810 -16.122 1.00 0.00 H new ATOM 0 HD2 PRO A 194 -4.185 -5.371 -14.340 1.00 0.00 H new ATOM 0 HD3 PRO A 194 -3.808 -6.724 -15.389 1.00 0.00 H new ATOM 176 N GLU A 195 -3.564 -1.961 -17.302 1.00 0.00 N ATOM 177 CA GLU A 195 -3.562 -0.474 -17.164 1.00 0.00 C ATOM 178 C GLU A 195 -4.814 0.135 -17.746 1.00 0.00 C ATOM 179 O GLU A 195 -5.596 0.737 -17.058 1.00 0.00 O ATOM 180 CB GLU A 195 -2.412 0.019 -18.026 1.00 0.00 C ATOM 181 CG GLU A 195 -1.391 0.753 -17.158 1.00 0.00 C ATOM 182 CD GLU A 195 -2.066 1.948 -16.481 1.00 0.00 C ATOM 183 OE1 GLU A 195 -2.593 2.786 -17.193 1.00 0.00 O ATOM 184 OE2 GLU A 195 -2.042 2.005 -15.262 1.00 0.00 O ATOM 0 H GLU A 195 -2.655 -2.371 -17.519 1.00 0.00 H new ATOM 0 HA GLU A 195 -3.487 -0.204 -16.111 1.00 0.00 H new ATOM 0 HB2 GLU A 195 -1.936 -0.823 -18.530 1.00 0.00 H new ATOM 0 HB3 GLU A 195 -2.788 0.685 -18.803 1.00 0.00 H new ATOM 0 HG2 GLU A 195 -0.984 0.077 -16.406 1.00 0.00 H new ATOM 0 HG3 GLU A 195 -0.554 1.092 -17.769 1.00 0.00 H new ATOM 191 N GLU A 196 -4.992 0.023 -19.024 1.00 0.00 N ATOM 192 CA GLU A 196 -6.178 0.650 -19.630 1.00 0.00 C ATOM 193 C GLU A 196 -7.402 0.284 -18.800 1.00 0.00 C ATOM 194 O GLU A 196 -8.240 1.111 -18.492 1.00 0.00 O ATOM 195 CB GLU A 196 -6.270 0.083 -21.047 1.00 0.00 C ATOM 196 CG GLU A 196 -7.623 0.452 -21.659 1.00 0.00 C ATOM 197 CD GLU A 196 -7.667 -0.011 -23.117 1.00 0.00 C ATOM 198 OE1 GLU A 196 -6.936 0.547 -23.918 1.00 0.00 O ATOM 199 OE2 GLU A 196 -8.432 -0.917 -23.406 1.00 0.00 O ATOM 0 H GLU A 196 -4.373 -0.471 -19.667 1.00 0.00 H new ATOM 0 HA GLU A 196 -6.117 1.738 -19.661 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -5.461 0.479 -21.661 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -6.153 -1.000 -21.025 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -8.429 -0.015 -21.094 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -7.777 1.530 -21.604 1.00 0.00 H new ATOM 206 N LYS A 197 -7.479 -0.950 -18.398 1.00 0.00 N ATOM 207 CA LYS A 197 -8.616 -1.382 -17.540 1.00 0.00 C ATOM 208 C LYS A 197 -8.397 -0.799 -16.145 1.00 0.00 C ATOM 209 O LYS A 197 -9.323 -0.522 -15.409 1.00 0.00 O ATOM 210 CB LYS A 197 -8.543 -2.910 -17.514 1.00 0.00 C ATOM 211 CG LYS A 197 -9.866 -3.491 -18.017 1.00 0.00 C ATOM 212 CD LYS A 197 -10.979 -3.160 -17.022 1.00 0.00 C ATOM 213 CE LYS A 197 -12.233 -2.725 -17.783 1.00 0.00 C ATOM 214 NZ LYS A 197 -12.861 -3.994 -18.247 1.00 0.00 N ATOM 0 H LYS A 197 -6.804 -1.680 -18.626 1.00 0.00 H new ATOM 0 HA LYS A 197 -9.589 -1.049 -17.900 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -7.720 -3.256 -18.139 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -8.342 -3.258 -16.501 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -10.106 -3.080 -18.998 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -9.779 -4.571 -18.136 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -11.200 -4.031 -16.404 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -10.655 -2.366 -16.349 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -12.909 -2.162 -17.140 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -11.980 -2.079 -18.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -13.134 -3.901 -19.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -12.182 -4.775 -18.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -13.706 -4.193 -17.674 1.00 0.00 H new ATOM 228 N ILE A 198 -7.157 -0.592 -15.801 1.00 0.00 N ATOM 229 CA ILE A 198 -6.820 -0.004 -14.484 1.00 0.00 C ATOM 230 C ILE A 198 -7.341 1.434 -14.449 1.00 0.00 C ATOM 231 O ILE A 198 -8.127 1.805 -13.603 1.00 0.00 O ATOM 232 CB ILE A 198 -5.275 -0.092 -14.402 1.00 0.00 C ATOM 233 CG1 ILE A 198 -4.907 -0.724 -13.066 1.00 0.00 C ATOM 234 CG2 ILE A 198 -4.616 1.298 -14.477 1.00 0.00 C ATOM 235 CD1 ILE A 198 -5.237 -2.217 -13.098 1.00 0.00 C ATOM 0 H ILE A 198 -6.353 -0.810 -16.389 1.00 0.00 H new ATOM 0 HA ILE A 198 -7.269 -0.513 -13.632 1.00 0.00 H new ATOM 0 HB ILE A 198 -4.919 -0.684 -15.245 1.00 0.00 H new ATOM 0 HG12 ILE A 198 -3.846 -0.580 -12.864 1.00 0.00 H new ATOM 0 HG13 ILE A 198 -5.454 -0.237 -12.259 1.00 0.00 H new ATOM 0 HG21 ILE A 198 -3.533 1.191 -14.416 1.00 0.00 H new ATOM 0 HG22 ILE A 198 -4.881 1.776 -15.420 1.00 0.00 H new ATOM 0 HG23 ILE A 198 -4.967 1.912 -13.648 1.00 0.00 H new ATOM 0 HD11 ILE A 198 -4.973 -2.668 -12.142 1.00 0.00 H new ATOM 0 HD12 ILE A 198 -6.303 -2.350 -13.280 1.00 0.00 H new ATOM 0 HD13 ILE A 198 -4.670 -2.698 -13.895 1.00 0.00 H new ATOM 247 N ARG A 199 -6.926 2.232 -15.389 1.00 0.00 N ATOM 248 CA ARG A 199 -7.411 3.633 -15.448 1.00 0.00 C ATOM 249 C ARG A 199 -8.934 3.615 -15.358 1.00 0.00 C ATOM 250 O ARG A 199 -9.543 4.458 -14.733 1.00 0.00 O ATOM 251 CB ARG A 199 -6.941 4.151 -16.815 1.00 0.00 C ATOM 252 CG ARG A 199 -7.786 5.358 -17.226 1.00 0.00 C ATOM 253 CD ARG A 199 -8.985 4.887 -18.053 1.00 0.00 C ATOM 254 NE ARG A 199 -8.862 5.603 -19.352 1.00 0.00 N ATOM 255 CZ ARG A 199 -9.906 6.183 -19.880 1.00 0.00 C ATOM 256 NH1 ARG A 199 -10.305 7.342 -19.431 1.00 0.00 N ATOM 257 NH2 ARG A 199 -10.551 5.604 -20.854 1.00 0.00 N ATOM 0 H ARG A 199 -6.268 1.971 -16.123 1.00 0.00 H new ATOM 0 HA ARG A 199 -7.039 4.264 -14.641 1.00 0.00 H new ATOM 0 HB2 ARG A 199 -5.889 4.431 -16.767 1.00 0.00 H new ATOM 0 HB3 ARG A 199 -7.027 3.363 -17.563 1.00 0.00 H new ATOM 0 HG2 ARG A 199 -8.130 5.893 -16.340 1.00 0.00 H new ATOM 0 HG3 ARG A 199 -7.183 6.056 -17.806 1.00 0.00 H new ATOM 0 HD2 ARG A 199 -8.967 3.806 -18.195 1.00 0.00 H new ATOM 0 HD3 ARG A 199 -9.925 5.128 -17.557 1.00 0.00 H new ATOM 0 HE ARG A 199 -7.962 5.641 -19.830 1.00 0.00 H new ATOM 0 HH11 ARG A 199 -9.801 7.794 -18.668 1.00 0.00 H new ATOM 0 HH12 ARG A 199 -11.120 7.795 -19.843 1.00 0.00 H new ATOM 0 HH21 ARG A 199 -10.240 4.698 -21.204 1.00 0.00 H new ATOM 0 HH22 ARG A 199 -11.366 6.057 -21.266 1.00 0.00 H new ATOM 271 N GLU A 200 -9.549 2.637 -15.963 1.00 0.00 N ATOM 272 CA GLU A 200 -11.033 2.537 -15.897 1.00 0.00 C ATOM 273 C GLU A 200 -11.470 2.377 -14.463 1.00 0.00 C ATOM 274 O GLU A 200 -12.483 2.910 -14.055 1.00 0.00 O ATOM 275 CB GLU A 200 -11.397 1.306 -16.725 1.00 0.00 C ATOM 276 CG GLU A 200 -11.574 1.710 -18.189 1.00 0.00 C ATOM 277 CD GLU A 200 -13.029 1.491 -18.604 1.00 0.00 C ATOM 278 OE1 GLU A 200 -13.897 2.068 -17.972 1.00 0.00 O ATOM 279 OE2 GLU A 200 -13.250 0.750 -19.548 1.00 0.00 O ATOM 0 H GLU A 200 -9.088 1.903 -16.500 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.528 3.429 -16.282 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -10.615 0.551 -16.637 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -12.316 0.859 -16.346 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.299 2.756 -18.325 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -10.911 1.121 -18.823 1.00 0.00 H new ATOM 286 N TYR A 201 -10.731 1.667 -13.679 1.00 0.00 N ATOM 287 CA TYR A 201 -11.160 1.529 -12.280 1.00 0.00 C ATOM 288 C TYR A 201 -10.532 2.630 -11.435 1.00 0.00 C ATOM 289 O TYR A 201 -11.193 3.555 -11.008 1.00 0.00 O ATOM 290 CB TYR A 201 -10.671 0.162 -11.812 1.00 0.00 C ATOM 291 CG TYR A 201 -11.623 -0.394 -10.782 1.00 0.00 C ATOM 292 CD1 TYR A 201 -12.986 -0.511 -11.075 1.00 0.00 C ATOM 293 CD2 TYR A 201 -11.141 -0.791 -9.529 1.00 0.00 C ATOM 294 CE1 TYR A 201 -13.867 -1.025 -10.115 1.00 0.00 C ATOM 295 CE2 TYR A 201 -12.020 -1.305 -8.570 1.00 0.00 C ATOM 296 CZ TYR A 201 -13.384 -1.421 -8.863 1.00 0.00 C ATOM 297 OH TYR A 201 -14.251 -1.927 -7.917 1.00 0.00 O ATOM 0 H TYR A 201 -9.869 1.187 -13.938 1.00 0.00 H new ATOM 0 HA TYR A 201 -12.243 1.613 -12.185 1.00 0.00 H new ATOM 0 HB2 TYR A 201 -10.599 -0.519 -12.660 1.00 0.00 H new ATOM 0 HB3 TYR A 201 -9.671 0.249 -11.387 1.00 0.00 H new ATOM 0 HD1 TYR A 201 -13.359 -0.205 -12.041 1.00 0.00 H new ATOM 0 HD2 TYR A 201 -10.089 -0.700 -9.303 1.00 0.00 H new ATOM 0 HE1 TYR A 201 -14.919 -1.116 -10.341 1.00 0.00 H new ATOM 0 HE2 TYR A 201 -11.647 -1.612 -7.604 1.00 0.00 H new ATOM 0 HH TYR A 201 -13.752 -2.154 -7.105 1.00 0.00 H new ATOM 307 N PHE A 202 -9.253 2.537 -11.194 1.00 0.00 N ATOM 308 CA PHE A 202 -8.582 3.574 -10.379 1.00 0.00 C ATOM 309 C PHE A 202 -8.766 4.935 -11.043 1.00 0.00 C ATOM 310 O PHE A 202 -9.206 5.888 -10.424 1.00 0.00 O ATOM 311 CB PHE A 202 -7.105 3.162 -10.344 1.00 0.00 C ATOM 312 CG PHE A 202 -6.979 1.795 -9.720 1.00 0.00 C ATOM 313 CD1 PHE A 202 -7.747 1.454 -8.602 1.00 0.00 C ATOM 314 CD2 PHE A 202 -6.099 0.865 -10.276 1.00 0.00 C ATOM 315 CE1 PHE A 202 -7.633 0.175 -8.040 1.00 0.00 C ATOM 316 CE2 PHE A 202 -5.982 -0.412 -9.716 1.00 0.00 C ATOM 317 CZ PHE A 202 -6.751 -0.758 -8.598 1.00 0.00 C ATOM 0 H PHE A 202 -8.649 1.786 -11.528 1.00 0.00 H new ATOM 0 HA PHE A 202 -8.989 3.655 -9.371 1.00 0.00 H new ATOM 0 HB2 PHE A 202 -6.695 3.152 -11.354 1.00 0.00 H new ATOM 0 HB3 PHE A 202 -6.527 3.889 -9.773 1.00 0.00 H new ATOM 0 HD1 PHE A 202 -8.427 2.175 -8.172 1.00 0.00 H new ATOM 0 HD2 PHE A 202 -5.508 1.131 -11.140 1.00 0.00 H new ATOM 0 HE1 PHE A 202 -8.225 -0.091 -7.177 1.00 0.00 H new ATOM 0 HE2 PHE A 202 -5.299 -1.130 -10.146 1.00 0.00 H new ATOM 0 HZ PHE A 202 -6.664 -1.744 -8.166 1.00 0.00 H new ATOM 327 N GLY A 203 -8.476 5.027 -12.308 1.00 0.00 N ATOM 328 CA GLY A 203 -8.681 6.317 -13.009 1.00 0.00 C ATOM 329 C GLY A 203 -10.144 6.711 -12.817 1.00 0.00 C ATOM 330 O GLY A 203 -10.513 7.863 -12.930 1.00 0.00 O ATOM 0 H GLY A 203 -8.108 4.269 -12.882 1.00 0.00 H new ATOM 0 HA2 GLY A 203 -8.020 7.084 -12.604 1.00 0.00 H new ATOM 0 HA3 GLY A 203 -8.445 6.220 -14.069 1.00 0.00 H new ATOM 334 N GLY A 204 -10.974 5.749 -12.505 1.00 0.00 N ATOM 335 CA GLY A 204 -12.414 6.040 -12.277 1.00 0.00 C ATOM 336 C GLY A 204 -12.564 6.793 -10.957 1.00 0.00 C ATOM 337 O GLY A 204 -13.252 7.791 -10.880 1.00 0.00 O ATOM 0 H GLY A 204 -10.711 4.769 -12.399 1.00 0.00 H new ATOM 0 HA2 GLY A 204 -12.813 6.636 -13.098 1.00 0.00 H new ATOM 0 HA3 GLY A 204 -12.986 5.113 -12.249 1.00 0.00 H new ATOM 341 N PHE A 205 -11.914 6.338 -9.914 1.00 0.00 N ATOM 342 CA PHE A 205 -12.027 7.064 -8.616 1.00 0.00 C ATOM 343 C PHE A 205 -11.665 8.526 -8.843 1.00 0.00 C ATOM 344 O PHE A 205 -12.253 9.429 -8.283 1.00 0.00 O ATOM 345 CB PHE A 205 -11.007 6.402 -7.692 1.00 0.00 C ATOM 346 CG PHE A 205 -11.510 5.043 -7.293 1.00 0.00 C ATOM 347 CD1 PHE A 205 -11.275 3.942 -8.122 1.00 0.00 C ATOM 348 CD2 PHE A 205 -12.217 4.884 -6.098 1.00 0.00 C ATOM 349 CE1 PHE A 205 -11.746 2.677 -7.753 1.00 0.00 C ATOM 350 CE2 PHE A 205 -12.689 3.622 -5.726 1.00 0.00 C ATOM 351 CZ PHE A 205 -12.455 2.516 -6.555 1.00 0.00 C ATOM 0 H PHE A 205 -11.320 5.509 -9.906 1.00 0.00 H new ATOM 0 HA PHE A 205 -13.030 7.023 -8.192 1.00 0.00 H new ATOM 0 HB2 PHE A 205 -10.045 6.313 -8.197 1.00 0.00 H new ATOM 0 HB3 PHE A 205 -10.847 7.018 -6.807 1.00 0.00 H new ATOM 0 HD1 PHE A 205 -10.731 4.068 -9.046 1.00 0.00 H new ATOM 0 HD2 PHE A 205 -12.399 5.737 -5.461 1.00 0.00 H new ATOM 0 HE1 PHE A 205 -11.563 1.825 -8.391 1.00 0.00 H new ATOM 0 HE2 PHE A 205 -13.233 3.499 -4.801 1.00 0.00 H new ATOM 0 HZ PHE A 205 -12.821 1.540 -6.271 1.00 0.00 H new ATOM 361 N GLY A 206 -10.697 8.749 -9.680 1.00 0.00 N ATOM 362 CA GLY A 206 -10.262 10.134 -9.991 1.00 0.00 C ATOM 363 C GLY A 206 -9.300 10.060 -11.169 1.00 0.00 C ATOM 364 O GLY A 206 -8.404 9.240 -11.185 1.00 0.00 O ATOM 0 H GLY A 206 -10.180 8.019 -10.170 1.00 0.00 H new ATOM 0 HA2 GLY A 206 -11.121 10.759 -10.236 1.00 0.00 H new ATOM 0 HA3 GLY A 206 -9.775 10.586 -9.127 1.00 0.00 H new ATOM 368 N GLU A 207 -9.481 10.887 -12.163 1.00 0.00 N ATOM 369 CA GLU A 207 -8.570 10.830 -13.341 1.00 0.00 C ATOM 370 C GLU A 207 -7.137 10.590 -12.878 1.00 0.00 C ATOM 371 O GLU A 207 -6.709 11.084 -11.854 1.00 0.00 O ATOM 372 CB GLU A 207 -8.686 12.187 -14.025 1.00 0.00 C ATOM 373 CG GLU A 207 -8.371 13.294 -13.016 1.00 0.00 C ATOM 374 CD GLU A 207 -7.393 14.293 -13.636 1.00 0.00 C ATOM 375 OE1 GLU A 207 -6.816 13.969 -14.662 1.00 0.00 O ATOM 376 OE2 GLU A 207 -7.236 15.365 -13.075 1.00 0.00 O ATOM 0 H GLU A 207 -10.214 11.594 -12.210 1.00 0.00 H new ATOM 0 HA GLU A 207 -8.835 10.019 -14.019 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -7.997 12.242 -14.868 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -9.691 12.320 -14.425 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -9.289 13.803 -12.722 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -7.942 12.863 -12.111 1.00 0.00 H new ATOM 383 N VAL A 208 -6.404 9.818 -13.616 1.00 0.00 N ATOM 384 CA VAL A 208 -5.012 9.520 -13.218 1.00 0.00 C ATOM 385 C VAL A 208 -4.036 10.430 -13.954 1.00 0.00 C ATOM 386 O VAL A 208 -4.223 10.759 -15.109 1.00 0.00 O ATOM 387 CB VAL A 208 -4.808 8.064 -13.643 1.00 0.00 C ATOM 388 CG1 VAL A 208 -3.311 7.763 -13.782 1.00 0.00 C ATOM 389 CG2 VAL A 208 -5.422 7.142 -12.591 1.00 0.00 C ATOM 0 H VAL A 208 -6.712 9.378 -14.483 1.00 0.00 H new ATOM 0 HA VAL A 208 -4.838 9.678 -12.154 1.00 0.00 H new ATOM 0 HB VAL A 208 -5.293 7.898 -14.605 1.00 0.00 H new ATOM 0 HG11 VAL A 208 -3.175 6.725 -14.085 1.00 0.00 H new ATOM 0 HG12 VAL A 208 -2.876 8.420 -14.535 1.00 0.00 H new ATOM 0 HG13 VAL A 208 -2.816 7.930 -12.825 1.00 0.00 H new ATOM 0 HG21 VAL A 208 -5.279 6.103 -12.889 1.00 0.00 H new ATOM 0 HG22 VAL A 208 -4.937 7.313 -11.630 1.00 0.00 H new ATOM 0 HG23 VAL A 208 -6.488 7.351 -12.502 1.00 0.00 H new ATOM 399 N GLU A 209 -2.967 10.790 -13.311 1.00 0.00 N ATOM 400 CA GLU A 209 -1.950 11.621 -13.992 1.00 0.00 C ATOM 401 C GLU A 209 -1.019 10.644 -14.693 1.00 0.00 C ATOM 402 O GLU A 209 -0.735 10.758 -15.869 1.00 0.00 O ATOM 403 CB GLU A 209 -1.224 12.376 -12.876 1.00 0.00 C ATOM 404 CG GLU A 209 -0.062 13.175 -13.470 1.00 0.00 C ATOM 405 CD GLU A 209 -0.609 14.374 -14.246 1.00 0.00 C ATOM 406 OE1 GLU A 209 -0.965 14.194 -15.399 1.00 0.00 O ATOM 407 OE2 GLU A 209 -0.662 15.451 -13.675 1.00 0.00 O ATOM 0 H GLU A 209 -2.755 10.544 -12.344 1.00 0.00 H new ATOM 0 HA GLU A 209 -2.348 12.330 -14.718 1.00 0.00 H new ATOM 0 HB2 GLU A 209 -1.916 13.046 -12.366 1.00 0.00 H new ATOM 0 HB3 GLU A 209 -0.852 11.674 -12.130 1.00 0.00 H new ATOM 0 HG2 GLU A 209 0.602 13.515 -12.676 1.00 0.00 H new ATOM 0 HG3 GLU A 209 0.529 12.540 -14.130 1.00 0.00 H new ATOM 414 N SER A 210 -0.597 9.640 -13.976 1.00 0.00 N ATOM 415 CA SER A 210 0.254 8.594 -14.572 1.00 0.00 C ATOM 416 C SER A 210 0.032 7.315 -13.782 1.00 0.00 C ATOM 417 O SER A 210 -0.581 7.334 -12.735 1.00 0.00 O ATOM 418 CB SER A 210 1.690 9.094 -14.430 1.00 0.00 C ATOM 419 OG SER A 210 1.683 10.507 -14.296 1.00 0.00 O ATOM 0 H SER A 210 -0.813 9.505 -12.988 1.00 0.00 H new ATOM 0 HA SER A 210 0.030 8.393 -15.620 1.00 0.00 H new ATOM 0 HB2 SER A 210 2.162 8.637 -13.560 1.00 0.00 H new ATOM 0 HB3 SER A 210 2.277 8.803 -15.301 1.00 0.00 H new ATOM 0 HG SER A 210 2.603 10.831 -14.203 1.00 0.00 H new ATOM 425 N ILE A 211 0.521 6.208 -14.240 1.00 0.00 N ATOM 426 CA ILE A 211 0.321 4.967 -13.453 1.00 0.00 C ATOM 427 C ILE A 211 1.646 4.258 -13.242 1.00 0.00 C ATOM 428 O ILE A 211 2.700 4.759 -13.579 1.00 0.00 O ATOM 429 CB ILE A 211 -0.610 4.081 -14.257 1.00 0.00 C ATOM 430 CG1 ILE A 211 -0.002 3.809 -15.635 1.00 0.00 C ATOM 431 CG2 ILE A 211 -1.963 4.767 -14.413 1.00 0.00 C ATOM 432 CD1 ILE A 211 0.611 2.410 -15.657 1.00 0.00 C ATOM 0 H ILE A 211 1.043 6.105 -15.110 1.00 0.00 H new ATOM 0 HA ILE A 211 -0.098 5.195 -12.473 1.00 0.00 H new ATOM 0 HB ILE A 211 -0.747 3.134 -13.735 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -0.769 3.893 -16.405 1.00 0.00 H new ATOM 0 HG13 ILE A 211 0.760 4.555 -15.861 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -2.630 4.128 -14.991 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -2.395 4.947 -13.429 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -1.832 5.717 -14.931 1.00 0.00 H new ATOM 0 HD11 ILE A 211 1.044 2.218 -16.639 1.00 0.00 H new ATOM 0 HD12 ILE A 211 1.390 2.342 -14.898 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -0.163 1.670 -15.450 1.00 0.00 H new ATOM 444 N GLU A 212 1.596 3.092 -12.681 1.00 0.00 N ATOM 445 CA GLU A 212 2.848 2.337 -12.435 1.00 0.00 C ATOM 446 C GLU A 212 2.570 0.830 -12.437 1.00 0.00 C ATOM 447 O GLU A 212 1.615 0.363 -11.856 1.00 0.00 O ATOM 448 CB GLU A 212 3.301 2.809 -11.061 1.00 0.00 C ATOM 449 CG GLU A 212 4.413 1.891 -10.552 1.00 0.00 C ATOM 450 CD GLU A 212 5.564 1.887 -11.558 1.00 0.00 C ATOM 451 OE1 GLU A 212 5.613 2.791 -12.376 1.00 0.00 O ATOM 452 OE2 GLU A 212 6.376 0.978 -11.496 1.00 0.00 O ATOM 0 H GLU A 212 0.740 2.626 -12.380 1.00 0.00 H new ATOM 0 HA GLU A 212 3.605 2.508 -13.200 1.00 0.00 H new ATOM 0 HB2 GLU A 212 3.659 3.837 -11.117 1.00 0.00 H new ATOM 0 HB3 GLU A 212 2.461 2.802 -10.366 1.00 0.00 H new ATOM 0 HG2 GLU A 212 4.766 2.233 -9.579 1.00 0.00 H new ATOM 0 HG3 GLU A 212 4.031 0.879 -10.415 1.00 0.00 H new ATOM 459 N LEU A 213 3.392 0.057 -13.082 1.00 0.00 N ATOM 460 CA LEU A 213 3.144 -1.410 -13.098 1.00 0.00 C ATOM 461 C LEU A 213 4.127 -2.128 -12.197 1.00 0.00 C ATOM 462 O LEU A 213 5.056 -1.528 -11.694 1.00 0.00 O ATOM 463 CB LEU A 213 3.362 -1.845 -14.541 1.00 0.00 C ATOM 464 CG LEU A 213 2.120 -1.534 -15.390 1.00 0.00 C ATOM 465 CD1 LEU A 213 0.843 -1.791 -14.582 1.00 0.00 C ATOM 466 CD2 LEU A 213 2.160 -0.067 -15.820 1.00 0.00 C ATOM 0 H LEU A 213 4.216 0.371 -13.594 1.00 0.00 H new ATOM 0 HA LEU A 213 2.142 -1.646 -12.741 1.00 0.00 H new ATOM 0 HB2 LEU A 213 4.230 -1.332 -14.955 1.00 0.00 H new ATOM 0 HB3 LEU A 213 3.576 -2.913 -14.577 1.00 0.00 H new ATOM 0 HG LEU A 213 2.118 -2.181 -16.267 1.00 0.00 H new ATOM 0 HD11 LEU A 213 -0.028 -1.566 -15.197 1.00 0.00 H new ATOM 0 HD12 LEU A 213 0.811 -2.837 -14.275 1.00 0.00 H new ATOM 0 HD13 LEU A 213 0.837 -1.153 -13.698 1.00 0.00 H new ATOM 0 HD21 LEU A 213 1.281 0.159 -16.423 1.00 0.00 H new ATOM 0 HD22 LEU A 213 2.168 0.571 -14.936 1.00 0.00 H new ATOM 0 HD23 LEU A 213 3.060 0.116 -16.408 1.00 0.00 H new ATOM 478 N PRO A 214 3.899 -3.402 -12.013 1.00 0.00 N ATOM 479 CA PRO A 214 4.792 -4.185 -11.161 1.00 0.00 C ATOM 480 C PRO A 214 6.251 -4.002 -11.589 1.00 0.00 C ATOM 481 O PRO A 214 7.146 -3.949 -10.770 1.00 0.00 O ATOM 482 CB PRO A 214 4.309 -5.622 -11.382 1.00 0.00 C ATOM 483 CG PRO A 214 3.125 -5.591 -12.366 1.00 0.00 C ATOM 484 CD PRO A 214 2.752 -4.125 -12.626 1.00 0.00 C ATOM 0 HA PRO A 214 4.764 -3.890 -10.112 1.00 0.00 H new ATOM 0 HB2 PRO A 214 5.117 -6.237 -11.780 1.00 0.00 H new ATOM 0 HB3 PRO A 214 4.004 -6.069 -10.436 1.00 0.00 H new ATOM 0 HG2 PRO A 214 3.394 -6.086 -13.299 1.00 0.00 H new ATOM 0 HG3 PRO A 214 2.274 -6.132 -11.953 1.00 0.00 H new ATOM 0 HD2 PRO A 214 2.656 -3.911 -13.690 1.00 0.00 H new ATOM 0 HD3 PRO A 214 1.804 -3.856 -12.160 1.00 0.00 H new ATOM 662 N PHE A 225 2.720 -6.842 -8.186 1.00 0.00 N ATOM 663 CA PHE A 225 1.811 -5.709 -7.848 1.00 0.00 C ATOM 664 C PHE A 225 1.792 -4.673 -8.966 1.00 0.00 C ATOM 665 O PHE A 225 2.261 -4.905 -10.058 1.00 0.00 O ATOM 666 CB PHE A 225 2.409 -5.080 -6.590 1.00 0.00 C ATOM 667 CG PHE A 225 3.906 -4.945 -6.749 1.00 0.00 C ATOM 668 CD1 PHE A 225 4.734 -6.064 -6.596 1.00 0.00 C ATOM 669 CD2 PHE A 225 4.463 -3.697 -7.049 1.00 0.00 C ATOM 670 CE1 PHE A 225 6.120 -5.933 -6.744 1.00 0.00 C ATOM 671 CE2 PHE A 225 5.848 -3.567 -7.196 1.00 0.00 C ATOM 672 CZ PHE A 225 6.677 -4.684 -7.044 1.00 0.00 C ATOM 0 HA PHE A 225 0.786 -6.053 -7.706 1.00 0.00 H new ATOM 0 HB2 PHE A 225 1.963 -4.101 -6.414 1.00 0.00 H new ATOM 0 HB3 PHE A 225 2.180 -5.696 -5.720 1.00 0.00 H new ATOM 0 HD1 PHE A 225 4.304 -7.027 -6.364 1.00 0.00 H new ATOM 0 HD2 PHE A 225 3.824 -2.834 -7.167 1.00 0.00 H new ATOM 0 HE1 PHE A 225 6.760 -6.795 -6.627 1.00 0.00 H new ATOM 0 HE2 PHE A 225 6.278 -2.604 -7.427 1.00 0.00 H new ATOM 0 HZ PHE A 225 7.746 -4.583 -7.158 1.00 0.00 H new ATOM 682 N CYS A 226 1.261 -3.522 -8.682 1.00 0.00 N ATOM 683 CA CYS A 226 1.217 -2.437 -9.703 1.00 0.00 C ATOM 684 C CYS A 226 0.764 -1.135 -9.025 1.00 0.00 C ATOM 685 O CYS A 226 -0.268 -1.089 -8.387 1.00 0.00 O ATOM 686 CB CYS A 226 0.204 -2.906 -10.763 1.00 0.00 C ATOM 687 SG CYS A 226 -1.501 -2.607 -10.224 1.00 0.00 S ATOM 0 H CYS A 226 0.851 -3.281 -7.780 1.00 0.00 H new ATOM 0 HA CYS A 226 2.186 -2.243 -10.162 1.00 0.00 H new ATOM 0 HB2 CYS A 226 0.388 -2.383 -11.701 1.00 0.00 H new ATOM 0 HB3 CYS A 226 0.345 -3.969 -10.958 1.00 0.00 H new ATOM 0 HG CYS A 226 -1.514 -1.667 -9.326 1.00 0.00 H new ATOM 693 N PHE A 227 1.511 -0.076 -9.141 1.00 0.00 N ATOM 694 CA PHE A 227 1.067 1.187 -8.486 1.00 0.00 C ATOM 695 C PHE A 227 0.411 2.087 -9.521 1.00 0.00 C ATOM 696 O PHE A 227 0.273 1.738 -10.671 1.00 0.00 O ATOM 697 CB PHE A 227 2.321 1.881 -7.934 1.00 0.00 C ATOM 698 CG PHE A 227 2.854 1.188 -6.695 1.00 0.00 C ATOM 699 CD1 PHE A 227 2.999 -0.212 -6.642 1.00 0.00 C ATOM 700 CD2 PHE A 227 3.244 1.972 -5.598 1.00 0.00 C ATOM 701 CE1 PHE A 227 3.532 -0.814 -5.494 1.00 0.00 C ATOM 702 CE2 PHE A 227 3.769 1.365 -4.451 1.00 0.00 C ATOM 703 CZ PHE A 227 3.916 -0.028 -4.399 1.00 0.00 C ATOM 0 H PHE A 227 2.393 -0.026 -9.650 1.00 0.00 H new ATOM 0 HA PHE A 227 0.352 0.981 -7.689 1.00 0.00 H new ATOM 0 HB2 PHE A 227 3.094 1.897 -8.702 1.00 0.00 H new ATOM 0 HB3 PHE A 227 2.086 2.919 -7.697 1.00 0.00 H new ATOM 0 HD1 PHE A 227 2.700 -0.820 -7.483 1.00 0.00 H new ATOM 0 HD2 PHE A 227 3.139 3.046 -5.639 1.00 0.00 H new ATOM 0 HE1 PHE A 227 3.647 -1.887 -5.453 1.00 0.00 H new ATOM 0 HE2 PHE A 227 4.061 1.970 -3.606 1.00 0.00 H new ATOM 0 HZ PHE A 227 4.325 -0.495 -3.515 1.00 0.00 H new ATOM 713 N ILE A 228 0.026 3.250 -9.119 1.00 0.00 N ATOM 714 CA ILE A 228 -0.598 4.204 -10.065 1.00 0.00 C ATOM 715 C ILE A 228 -0.564 5.587 -9.411 1.00 0.00 C ATOM 716 O ILE A 228 -0.870 5.719 -8.242 1.00 0.00 O ATOM 717 CB ILE A 228 -2.040 3.719 -10.239 1.00 0.00 C ATOM 718 CG1 ILE A 228 -2.058 2.567 -11.258 1.00 0.00 C ATOM 719 CG2 ILE A 228 -2.913 4.884 -10.725 1.00 0.00 C ATOM 720 CD1 ILE A 228 -3.395 2.522 -12.002 1.00 0.00 C ATOM 0 H ILE A 228 0.116 3.590 -8.162 1.00 0.00 H new ATOM 0 HA ILE A 228 -0.093 4.262 -11.029 1.00 0.00 H new ATOM 0 HB ILE A 228 -2.436 3.360 -9.289 1.00 0.00 H new ATOM 0 HG12 ILE A 228 -1.244 2.693 -11.971 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -1.889 1.620 -10.746 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -3.940 4.542 -10.850 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -2.886 5.690 -9.991 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -2.534 5.249 -11.679 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -3.386 1.700 -12.718 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -4.204 2.372 -11.287 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -3.548 3.462 -12.532 1.00 0.00 H new ATOM 732 N THR A 229 -0.192 6.621 -10.111 1.00 0.00 N ATOM 733 CA THR A 229 -0.154 7.947 -9.446 1.00 0.00 C ATOM 734 C THR A 229 -1.305 8.803 -9.936 1.00 0.00 C ATOM 735 O THR A 229 -1.645 8.808 -11.102 1.00 0.00 O ATOM 736 CB THR A 229 1.194 8.562 -9.825 1.00 0.00 C ATOM 737 OG1 THR A 229 1.463 9.670 -8.980 1.00 0.00 O ATOM 738 CG2 THR A 229 1.156 9.034 -11.275 1.00 0.00 C ATOM 0 H THR A 229 0.082 6.606 -11.094 1.00 0.00 H new ATOM 0 HA THR A 229 -0.256 7.869 -8.364 1.00 0.00 H new ATOM 0 HB THR A 229 1.976 7.812 -9.708 1.00 0.00 H new ATOM 0 HG1 THR A 229 2.328 10.063 -9.221 1.00 0.00 H new ATOM 0 HG21 THR A 229 2.118 9.471 -11.541 1.00 0.00 H new ATOM 0 HG22 THR A 229 0.950 8.186 -11.928 1.00 0.00 H new ATOM 0 HG23 THR A 229 0.372 9.782 -11.394 1.00 0.00 H new ATOM 746 N PHE A 230 -1.901 9.527 -9.051 1.00 0.00 N ATOM 747 CA PHE A 230 -3.043 10.399 -9.475 1.00 0.00 C ATOM 748 C PHE A 230 -2.572 11.844 -9.644 1.00 0.00 C ATOM 749 O PHE A 230 -1.491 12.100 -10.135 1.00 0.00 O ATOM 750 CB PHE A 230 -4.110 10.304 -8.378 1.00 0.00 C ATOM 751 CG PHE A 230 -4.532 8.868 -8.190 1.00 0.00 C ATOM 752 CD1 PHE A 230 -4.473 7.971 -9.262 1.00 0.00 C ATOM 753 CD2 PHE A 230 -4.993 8.438 -6.940 1.00 0.00 C ATOM 754 CE1 PHE A 230 -4.873 6.642 -9.083 1.00 0.00 C ATOM 755 CE2 PHE A 230 -5.393 7.110 -6.762 1.00 0.00 C ATOM 756 CZ PHE A 230 -5.332 6.211 -7.833 1.00 0.00 C ATOM 0 H PHE A 230 -1.661 9.563 -8.060 1.00 0.00 H new ATOM 0 HA PHE A 230 -3.447 10.074 -10.434 1.00 0.00 H new ATOM 0 HB2 PHE A 230 -3.717 10.701 -7.442 1.00 0.00 H new ATOM 0 HB3 PHE A 230 -4.973 10.913 -8.646 1.00 0.00 H new ATOM 0 HD1 PHE A 230 -4.119 8.304 -10.227 1.00 0.00 H new ATOM 0 HD2 PHE A 230 -5.040 9.132 -6.114 1.00 0.00 H new ATOM 0 HE1 PHE A 230 -4.828 5.949 -9.910 1.00 0.00 H new ATOM 0 HE2 PHE A 230 -5.749 6.778 -5.798 1.00 0.00 H new ATOM 0 HZ PHE A 230 -5.639 5.185 -7.695 1.00 0.00 H new ATOM 766 N LYS A 231 -3.381 12.791 -9.259 1.00 0.00 N ATOM 767 CA LYS A 231 -2.986 14.217 -9.417 1.00 0.00 C ATOM 768 C LYS A 231 -2.787 14.884 -8.053 1.00 0.00 C ATOM 769 O LYS A 231 -1.705 15.324 -7.719 1.00 0.00 O ATOM 770 CB LYS A 231 -4.162 14.851 -10.155 1.00 0.00 C ATOM 771 CG LYS A 231 -3.654 15.591 -11.393 1.00 0.00 C ATOM 772 CD LYS A 231 -2.958 16.885 -10.964 1.00 0.00 C ATOM 773 CE LYS A 231 -3.581 18.071 -11.704 1.00 0.00 C ATOM 774 NZ LYS A 231 -2.444 18.992 -11.980 1.00 0.00 N ATOM 0 H LYS A 231 -4.299 12.638 -8.842 1.00 0.00 H new ATOM 0 HA LYS A 231 -2.043 14.329 -9.952 1.00 0.00 H new ATOM 0 HB2 LYS A 231 -4.878 14.083 -10.447 1.00 0.00 H new ATOM 0 HB3 LYS A 231 -4.687 15.542 -9.496 1.00 0.00 H new ATOM 0 HG2 LYS A 231 -2.961 14.959 -11.948 1.00 0.00 H new ATOM 0 HG3 LYS A 231 -4.485 15.817 -12.061 1.00 0.00 H new ATOM 0 HD2 LYS A 231 -3.056 17.023 -9.887 1.00 0.00 H new ATOM 0 HD3 LYS A 231 -1.892 16.826 -11.182 1.00 0.00 H new ATOM 0 HE2 LYS A 231 -4.063 17.751 -12.628 1.00 0.00 H new ATOM 0 HE3 LYS A 231 -4.345 18.558 -11.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 -2.792 19.831 -12.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 -2.009 19.285 -11.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 -1.736 18.504 -12.565 1.00 0.00 H new ATOM 788 N GLU A 232 -3.827 14.980 -7.271 1.00 0.00 N ATOM 789 CA GLU A 232 -3.697 15.638 -5.938 1.00 0.00 C ATOM 790 C GLU A 232 -3.637 14.599 -4.816 1.00 0.00 C ATOM 791 O GLU A 232 -2.617 14.412 -4.184 1.00 0.00 O ATOM 792 CB GLU A 232 -4.956 16.498 -5.799 1.00 0.00 C ATOM 793 CG GLU A 232 -5.228 17.227 -7.116 1.00 0.00 C ATOM 794 CD GLU A 232 -5.952 18.543 -6.833 1.00 0.00 C ATOM 795 OE1 GLU A 232 -5.312 19.454 -6.334 1.00 0.00 O ATOM 796 OE2 GLU A 232 -7.136 18.620 -7.123 1.00 0.00 O ATOM 0 H GLU A 232 -4.759 14.633 -7.496 1.00 0.00 H new ATOM 0 HA GLU A 232 -2.782 16.225 -5.865 1.00 0.00 H new ATOM 0 HB2 GLU A 232 -5.809 15.872 -5.535 1.00 0.00 H new ATOM 0 HB3 GLU A 232 -4.828 17.220 -4.992 1.00 0.00 H new ATOM 0 HG2 GLU A 232 -4.290 17.421 -7.637 1.00 0.00 H new ATOM 0 HG3 GLU A 232 -5.833 16.601 -7.772 1.00 0.00 H new ATOM 803 N GLU A 233 -4.726 13.929 -4.558 1.00 0.00 N ATOM 804 CA GLU A 233 -4.739 12.912 -3.467 1.00 0.00 C ATOM 805 C GLU A 233 -6.167 12.380 -3.272 1.00 0.00 C ATOM 806 O GLU A 233 -6.379 11.246 -2.892 1.00 0.00 O ATOM 807 CB GLU A 233 -4.285 13.673 -2.217 1.00 0.00 C ATOM 808 CG GLU A 233 -5.002 15.023 -2.145 1.00 0.00 C ATOM 809 CD GLU A 233 -4.620 15.739 -0.848 1.00 0.00 C ATOM 810 OE1 GLU A 233 -4.551 15.077 0.174 1.00 0.00 O ATOM 811 OE2 GLU A 233 -4.403 16.940 -0.898 1.00 0.00 O ATOM 0 H GLU A 233 -5.609 14.041 -5.056 1.00 0.00 H new ATOM 0 HA GLU A 233 -4.098 12.058 -3.684 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -4.502 13.087 -1.324 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -3.206 13.825 -2.244 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -4.731 15.636 -3.004 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -6.081 14.876 -2.187 1.00 0.00 H new ATOM 818 N GLU A 234 -7.139 13.214 -3.526 1.00 0.00 N ATOM 819 CA GLU A 234 -8.571 12.817 -3.360 1.00 0.00 C ATOM 820 C GLU A 234 -8.846 11.370 -3.807 1.00 0.00 C ATOM 821 O GLU A 234 -9.387 10.590 -3.045 1.00 0.00 O ATOM 822 CB GLU A 234 -9.346 13.797 -4.242 1.00 0.00 C ATOM 823 CG GLU A 234 -10.376 14.542 -3.391 1.00 0.00 C ATOM 824 CD GLU A 234 -11.338 13.536 -2.758 1.00 0.00 C ATOM 825 OE1 GLU A 234 -11.207 12.358 -3.048 1.00 0.00 O ATOM 826 OE2 GLU A 234 -12.189 13.960 -1.992 1.00 0.00 O ATOM 0 H GLU A 234 -7.000 14.172 -3.848 1.00 0.00 H new ATOM 0 HA GLU A 234 -8.863 12.853 -2.311 1.00 0.00 H new ATOM 0 HB2 GLU A 234 -8.660 14.506 -4.706 1.00 0.00 H new ATOM 0 HB3 GLU A 234 -9.845 13.261 -5.049 1.00 0.00 H new ATOM 0 HG2 GLU A 234 -9.873 15.119 -2.615 1.00 0.00 H new ATOM 0 HG3 GLU A 234 -10.928 15.251 -4.008 1.00 0.00 H new ATOM 833 N PRO A 235 -8.499 11.051 -5.032 1.00 0.00 N ATOM 834 CA PRO A 235 -8.760 9.689 -5.554 1.00 0.00 C ATOM 835 C PRO A 235 -8.200 8.624 -4.608 1.00 0.00 C ATOM 836 O PRO A 235 -8.808 7.593 -4.395 1.00 0.00 O ATOM 837 CB PRO A 235 -8.044 9.703 -6.907 1.00 0.00 C ATOM 838 CG PRO A 235 -7.416 11.095 -7.116 1.00 0.00 C ATOM 839 CD PRO A 235 -7.824 12.002 -5.944 1.00 0.00 C ATOM 0 HA PRO A 235 -9.819 9.445 -5.645 1.00 0.00 H new ATOM 0 HB2 PRO A 235 -7.274 8.932 -6.936 1.00 0.00 H new ATOM 0 HB3 PRO A 235 -8.747 9.481 -7.710 1.00 0.00 H new ATOM 0 HG2 PRO A 235 -6.330 11.015 -7.171 1.00 0.00 H new ATOM 0 HG3 PRO A 235 -7.753 11.523 -8.060 1.00 0.00 H new ATOM 0 HD2 PRO A 235 -6.961 12.473 -5.474 1.00 0.00 H new ATOM 0 HD3 PRO A 235 -8.491 12.803 -6.262 1.00 0.00 H new ATOM 847 N VAL A 236 -7.067 8.869 -4.017 1.00 0.00 N ATOM 848 CA VAL A 236 -6.503 7.870 -3.065 1.00 0.00 C ATOM 849 C VAL A 236 -7.400 7.796 -1.839 1.00 0.00 C ATOM 850 O VAL A 236 -7.706 6.739 -1.342 1.00 0.00 O ATOM 851 CB VAL A 236 -5.120 8.411 -2.695 1.00 0.00 C ATOM 852 CG1 VAL A 236 -4.741 7.993 -1.270 1.00 0.00 C ATOM 853 CG2 VAL A 236 -4.104 7.839 -3.667 1.00 0.00 C ATOM 0 H VAL A 236 -6.508 9.712 -4.149 1.00 0.00 H new ATOM 0 HA VAL A 236 -6.437 6.867 -3.486 1.00 0.00 H new ATOM 0 HB VAL A 236 -5.134 9.500 -2.747 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -3.755 8.387 -1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -5.474 8.389 -0.567 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -4.724 6.905 -1.202 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -3.111 8.214 -3.418 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -4.108 6.751 -3.599 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -4.362 8.140 -4.682 1.00 0.00 H new ATOM 863 N LYS A 237 -7.827 8.920 -1.356 1.00 0.00 N ATOM 864 CA LYS A 237 -8.715 8.919 -0.162 1.00 0.00 C ATOM 865 C LYS A 237 -9.780 7.863 -0.354 1.00 0.00 C ATOM 866 O LYS A 237 -10.067 7.065 0.520 1.00 0.00 O ATOM 867 CB LYS A 237 -9.379 10.287 -0.140 1.00 0.00 C ATOM 868 CG LYS A 237 -9.155 10.945 1.222 1.00 0.00 C ATOM 869 CD LYS A 237 -10.433 11.662 1.661 1.00 0.00 C ATOM 870 CE LYS A 237 -10.412 13.103 1.148 1.00 0.00 C ATOM 871 NZ LYS A 237 -11.845 13.496 1.046 1.00 0.00 N ATOM 0 H LYS A 237 -7.602 9.841 -1.733 1.00 0.00 H new ATOM 0 HA LYS A 237 -8.168 8.716 0.758 1.00 0.00 H new ATOM 0 HB2 LYS A 237 -8.967 10.915 -0.930 1.00 0.00 H new ATOM 0 HB3 LYS A 237 -10.447 10.187 -0.336 1.00 0.00 H new ATOM 0 HG2 LYS A 237 -8.876 10.192 1.960 1.00 0.00 H new ATOM 0 HG3 LYS A 237 -8.330 11.654 1.163 1.00 0.00 H new ATOM 0 HD2 LYS A 237 -11.307 11.139 1.273 1.00 0.00 H new ATOM 0 HD3 LYS A 237 -10.513 11.653 2.748 1.00 0.00 H new ATOM 0 HE2 LYS A 237 -9.871 13.757 1.831 1.00 0.00 H new ATOM 0 HE3 LYS A 237 -9.914 13.170 0.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 -12.093 13.648 0.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 -12.441 12.740 1.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 -12.003 14.375 1.580 1.00 0.00 H new ATOM 885 N LYS A 238 -10.370 7.860 -1.509 1.00 0.00 N ATOM 886 CA LYS A 238 -11.430 6.865 -1.781 1.00 0.00 C ATOM 887 C LYS A 238 -10.817 5.479 -1.858 1.00 0.00 C ATOM 888 O LYS A 238 -11.177 4.575 -1.131 1.00 0.00 O ATOM 889 CB LYS A 238 -12.014 7.233 -3.140 1.00 0.00 C ATOM 890 CG LYS A 238 -13.535 7.357 -3.030 1.00 0.00 C ATOM 891 CD LYS A 238 -13.953 8.801 -3.316 1.00 0.00 C ATOM 892 CE LYS A 238 -14.213 8.969 -4.814 1.00 0.00 C ATOM 893 NZ LYS A 238 -12.866 9.174 -5.417 1.00 0.00 N ATOM 0 H LYS A 238 -10.164 8.502 -2.274 1.00 0.00 H new ATOM 0 HA LYS A 238 -12.190 6.864 -1.000 1.00 0.00 H new ATOM 0 HB2 LYS A 238 -11.587 8.174 -3.488 1.00 0.00 H new ATOM 0 HB3 LYS A 238 -11.754 6.473 -3.877 1.00 0.00 H new ATOM 0 HG2 LYS A 238 -14.017 6.681 -3.736 1.00 0.00 H new ATOM 0 HG3 LYS A 238 -13.863 7.063 -2.033 1.00 0.00 H new ATOM 0 HD2 LYS A 238 -14.851 9.050 -2.750 1.00 0.00 H new ATOM 0 HD3 LYS A 238 -13.171 9.488 -2.992 1.00 0.00 H new ATOM 0 HE2 LYS A 238 -14.703 8.089 -5.231 1.00 0.00 H new ATOM 0 HE3 LYS A 238 -14.866 9.819 -5.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 238 -12.970 9.577 -6.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 238 -12.316 9.827 -4.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 238 -12.371 8.261 -5.479 1.00 0.00 H new ATOM 907 N ILE A 239 -9.895 5.310 -2.755 1.00 0.00 N ATOM 908 CA ILE A 239 -9.251 3.987 -2.912 1.00 0.00 C ATOM 909 C ILE A 239 -8.814 3.459 -1.540 1.00 0.00 C ATOM 910 O ILE A 239 -9.306 2.458 -1.062 1.00 0.00 O ATOM 911 CB ILE A 239 -8.046 4.237 -3.828 1.00 0.00 C ATOM 912 CG1 ILE A 239 -8.511 4.280 -5.289 1.00 0.00 C ATOM 913 CG2 ILE A 239 -7.025 3.113 -3.660 1.00 0.00 C ATOM 914 CD1 ILE A 239 -9.362 3.047 -5.593 1.00 0.00 C ATOM 0 H ILE A 239 -9.559 6.035 -3.389 1.00 0.00 H new ATOM 0 HA ILE A 239 -9.919 3.237 -3.336 1.00 0.00 H new ATOM 0 HB ILE A 239 -7.587 5.188 -3.560 1.00 0.00 H new ATOM 0 HG12 ILE A 239 -9.088 5.187 -5.471 1.00 0.00 H new ATOM 0 HG13 ILE A 239 -7.649 4.312 -5.955 1.00 0.00 H new ATOM 0 HG21 ILE A 239 -6.172 3.296 -4.313 1.00 0.00 H new ATOM 0 HG22 ILE A 239 -6.688 3.079 -2.624 1.00 0.00 H new ATOM 0 HG23 ILE A 239 -7.486 2.161 -3.923 1.00 0.00 H new ATOM 0 HD11 ILE A 239 -9.691 3.079 -6.632 1.00 0.00 H new ATOM 0 HD12 ILE A 239 -8.770 2.147 -5.428 1.00 0.00 H new ATOM 0 HD13 ILE A 239 -10.232 3.035 -4.937 1.00 0.00 H new ATOM 926 N MET A 240 -7.906 4.133 -0.895 1.00 0.00 N ATOM 927 CA MET A 240 -7.458 3.670 0.449 1.00 0.00 C ATOM 928 C MET A 240 -8.671 3.270 1.295 1.00 0.00 C ATOM 929 O MET A 240 -8.617 2.341 2.077 1.00 0.00 O ATOM 930 CB MET A 240 -6.744 4.871 1.070 1.00 0.00 C ATOM 931 CG MET A 240 -5.631 4.378 1.995 1.00 0.00 C ATOM 932 SD MET A 240 -6.015 4.841 3.702 1.00 0.00 S ATOM 933 CE MET A 240 -4.798 6.171 3.854 1.00 0.00 C ATOM 0 H MET A 240 -7.455 4.982 -1.237 1.00 0.00 H new ATOM 0 HA MET A 240 -6.806 2.799 0.390 1.00 0.00 H new ATOM 0 HB2 MET A 240 -6.327 5.505 0.287 1.00 0.00 H new ATOM 0 HB3 MET A 240 -7.454 5.480 1.630 1.00 0.00 H new ATOM 0 HG2 MET A 240 -5.530 3.296 1.915 1.00 0.00 H new ATOM 0 HG3 MET A 240 -4.676 4.811 1.696 1.00 0.00 H new ATOM 0 HE1 MET A 240 -4.860 6.609 4.850 1.00 0.00 H new ATOM 0 HE2 MET A 240 -3.797 5.768 3.696 1.00 0.00 H new ATOM 0 HE3 MET A 240 -5.003 6.938 3.107 1.00 0.00 H new ATOM 943 N GLU A 241 -9.769 3.964 1.143 1.00 0.00 N ATOM 944 CA GLU A 241 -10.989 3.622 1.937 1.00 0.00 C ATOM 945 C GLU A 241 -11.516 2.237 1.542 1.00 0.00 C ATOM 946 O GLU A 241 -12.416 1.704 2.163 1.00 0.00 O ATOM 947 CB GLU A 241 -12.007 4.706 1.580 1.00 0.00 C ATOM 948 CG GLU A 241 -12.353 5.516 2.832 1.00 0.00 C ATOM 949 CD GLU A 241 -13.467 4.808 3.605 1.00 0.00 C ATOM 950 OE1 GLU A 241 -13.393 3.598 3.737 1.00 0.00 O ATOM 951 OE2 GLU A 241 -14.376 5.488 4.052 1.00 0.00 O ATOM 0 H GLU A 241 -9.875 4.752 0.504 1.00 0.00 H new ATOM 0 HA GLU A 241 -10.786 3.586 3.007 1.00 0.00 H new ATOM 0 HB2 GLU A 241 -11.600 5.362 0.811 1.00 0.00 H new ATOM 0 HB3 GLU A 241 -12.908 4.252 1.168 1.00 0.00 H new ATOM 0 HG2 GLU A 241 -11.471 5.625 3.463 1.00 0.00 H new ATOM 0 HG3 GLU A 241 -12.671 6.520 2.552 1.00 0.00 H new ATOM 958 N LYS A 242 -10.962 1.646 0.518 1.00 0.00 N ATOM 959 CA LYS A 242 -11.422 0.294 0.085 1.00 0.00 C ATOM 960 C LYS A 242 -10.207 -0.573 -0.243 1.00 0.00 C ATOM 961 O LYS A 242 -10.129 -1.181 -1.290 1.00 0.00 O ATOM 962 CB LYS A 242 -12.265 0.540 -1.167 1.00 0.00 C ATOM 963 CG LYS A 242 -13.746 0.365 -0.826 1.00 0.00 C ATOM 964 CD LYS A 242 -14.044 -1.118 -0.597 1.00 0.00 C ATOM 965 CE LYS A 242 -14.216 -1.377 0.900 1.00 0.00 C ATOM 966 NZ LYS A 242 -15.676 -1.604 1.085 1.00 0.00 N ATOM 0 H LYS A 242 -10.207 2.043 -0.040 1.00 0.00 H new ATOM 0 HA LYS A 242 -11.994 -0.224 0.855 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -12.085 1.545 -1.548 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -11.977 -0.156 -1.955 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -13.995 0.939 0.066 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -14.365 0.751 -1.636 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -14.948 -1.405 -1.133 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -13.232 -1.729 -0.992 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -13.638 -2.244 1.220 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -13.870 -0.528 1.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -15.874 -1.789 2.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -16.200 -0.760 0.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -15.975 -2.422 0.517 1.00 0.00 H new ATOM 980 N LYS A 243 -9.260 -0.604 0.655 1.00 0.00 N ATOM 981 CA LYS A 243 -8.005 -1.396 0.452 1.00 0.00 C ATOM 982 C LYS A 243 -8.217 -2.629 -0.440 1.00 0.00 C ATOM 983 O LYS A 243 -7.328 -3.026 -1.166 1.00 0.00 O ATOM 984 CB LYS A 243 -7.590 -1.829 1.859 1.00 0.00 C ATOM 985 CG LYS A 243 -7.086 -0.614 2.641 1.00 0.00 C ATOM 986 CD LYS A 243 -7.521 -0.731 4.103 1.00 0.00 C ATOM 987 CE LYS A 243 -6.820 -1.929 4.748 1.00 0.00 C ATOM 988 NZ LYS A 243 -7.199 -1.866 6.188 1.00 0.00 N ATOM 0 H LYS A 243 -9.302 -0.103 1.542 1.00 0.00 H new ATOM 0 HA LYS A 243 -7.249 -0.799 -0.058 1.00 0.00 H new ATOM 0 HB2 LYS A 243 -8.436 -2.282 2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 243 -6.809 -2.587 1.802 1.00 0.00 H new ATOM 0 HG2 LYS A 243 -6.000 -0.553 2.578 1.00 0.00 H new ATOM 0 HG3 LYS A 243 -7.483 0.303 2.205 1.00 0.00 H new ATOM 0 HD2 LYS A 243 -7.272 0.183 4.642 1.00 0.00 H new ATOM 0 HD3 LYS A 243 -8.602 -0.853 4.163 1.00 0.00 H new ATOM 0 HE2 LYS A 243 -7.143 -2.866 4.295 1.00 0.00 H new ATOM 0 HE3 LYS A 243 -5.739 -1.869 4.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 -6.756 -2.657 6.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 -6.873 -0.966 6.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 -8.233 -1.932 6.278 1.00 0.00 H new ATOM 1002 N TYR A 244 -9.361 -3.254 -0.391 1.00 0.00 N ATOM 1003 CA TYR A 244 -9.565 -4.465 -1.243 1.00 0.00 C ATOM 1004 C TYR A 244 -10.676 -4.203 -2.272 1.00 0.00 C ATOM 1005 O TYR A 244 -11.838 -4.452 -2.016 1.00 0.00 O ATOM 1006 CB TYR A 244 -9.981 -5.559 -0.257 1.00 0.00 C ATOM 1007 CG TYR A 244 -9.435 -6.895 -0.708 1.00 0.00 C ATOM 1008 CD1 TYR A 244 -8.079 -7.010 -1.036 1.00 0.00 C ATOM 1009 CD2 TYR A 244 -10.266 -8.022 -0.774 1.00 0.00 C ATOM 1010 CE1 TYR A 244 -7.555 -8.244 -1.435 1.00 0.00 C ATOM 1011 CE2 TYR A 244 -9.740 -9.257 -1.167 1.00 0.00 C ATOM 1012 CZ TYR A 244 -8.385 -9.368 -1.500 1.00 0.00 C ATOM 1013 OH TYR A 244 -7.866 -10.586 -1.889 1.00 0.00 O ATOM 0 H TYR A 244 -10.154 -2.986 0.192 1.00 0.00 H new ATOM 0 HA TYR A 244 -8.675 -4.741 -1.808 1.00 0.00 H new ATOM 0 HB2 TYR A 244 -9.609 -5.322 0.740 1.00 0.00 H new ATOM 0 HB3 TYR A 244 -11.068 -5.605 -0.189 1.00 0.00 H new ATOM 0 HD1 TYR A 244 -7.436 -6.144 -0.981 1.00 0.00 H new ATOM 0 HD2 TYR A 244 -11.313 -7.937 -0.521 1.00 0.00 H new ATOM 0 HE1 TYR A 244 -6.510 -8.329 -1.693 1.00 0.00 H new ATOM 0 HE2 TYR A 244 -10.380 -10.126 -1.214 1.00 0.00 H new ATOM 0 HH TYR A 244 -8.576 -11.262 -1.880 1.00 0.00 H new ATOM 1023 N HIS A 245 -10.330 -3.701 -3.433 1.00 0.00 N ATOM 1024 CA HIS A 245 -11.378 -3.423 -4.467 1.00 0.00 C ATOM 1025 C HIS A 245 -11.492 -4.589 -5.452 1.00 0.00 C ATOM 1026 O HIS A 245 -11.248 -5.732 -5.121 1.00 0.00 O ATOM 1027 CB HIS A 245 -10.912 -2.175 -5.226 1.00 0.00 C ATOM 1028 CG HIS A 245 -10.254 -1.194 -4.297 1.00 0.00 C ATOM 1029 ND1 HIS A 245 -9.027 -1.193 -3.682 1.00 0.00 N flip ATOM 1030 CD2 HIS A 245 -10.859 -0.004 -3.936 1.00 0.00 C flip ATOM 1031 CE1 HIS A 245 -8.870 -0.020 -2.954 1.00 0.00 C flip ATOM 1032 NE2 HIS A 245 -10.003 0.660 -3.141 1.00 0.00 N flip ATOM 0 H HIS A 245 -9.375 -3.473 -3.709 1.00 0.00 H new ATOM 0 HA HIS A 245 -12.352 -3.283 -3.997 1.00 0.00 H new ATOM 0 HB2 HIS A 245 -10.213 -2.463 -6.011 1.00 0.00 H new ATOM 0 HB3 HIS A 245 -11.764 -1.703 -5.715 1.00 0.00 H new ATOM 0 HD2 HIS A 245 -11.840 0.331 -4.238 1.00 0.00 H new ATOM 0 HE1 HIS A 245 -8.016 0.277 -2.364 1.00 0.00 H new ATOM 0 HE2 HIS A 245 -10.196 1.573 -2.730 1.00 0.00 H new ATOM 1040 N ASN A 246 -11.857 -4.290 -6.671 1.00 0.00 N ATOM 1041 CA ASN A 246 -11.988 -5.352 -7.710 1.00 0.00 C ATOM 1042 C ASN A 246 -11.299 -4.894 -9.001 1.00 0.00 C ATOM 1043 O ASN A 246 -11.421 -3.756 -9.408 1.00 0.00 O ATOM 1044 CB ASN A 246 -13.495 -5.509 -7.929 1.00 0.00 C ATOM 1045 CG ASN A 246 -13.967 -6.832 -7.321 1.00 0.00 C ATOM 1046 OD1 ASN A 246 -14.150 -7.805 -8.024 1.00 0.00 O ATOM 1047 ND2 ASN A 246 -14.173 -6.909 -6.035 1.00 0.00 N ATOM 0 H ASN A 246 -12.072 -3.346 -6.993 1.00 0.00 H new ATOM 0 HA ASN A 246 -11.525 -6.292 -7.411 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -14.028 -4.676 -7.471 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -13.722 -5.485 -8.995 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -14.488 -7.786 -5.621 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -14.019 -6.092 -5.444 1.00 0.00 H new ATOM 1054 N VAL A 247 -10.573 -5.766 -9.648 1.00 0.00 N ATOM 1055 CA VAL A 247 -9.879 -5.367 -10.907 1.00 0.00 C ATOM 1056 C VAL A 247 -9.818 -6.553 -11.877 1.00 0.00 C ATOM 1057 O VAL A 247 -9.336 -7.618 -11.544 1.00 0.00 O ATOM 1058 CB VAL A 247 -8.468 -4.950 -10.470 1.00 0.00 C ATOM 1059 CG1 VAL A 247 -7.524 -4.980 -11.674 1.00 0.00 C ATOM 1060 CG2 VAL A 247 -8.503 -3.530 -9.893 1.00 0.00 C ATOM 0 H VAL A 247 -10.431 -6.734 -9.361 1.00 0.00 H new ATOM 0 HA VAL A 247 -10.397 -4.561 -11.427 1.00 0.00 H new ATOM 0 HB VAL A 247 -8.112 -5.645 -9.709 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -6.523 -4.683 -11.359 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -7.491 -5.989 -12.085 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -7.884 -4.289 -12.436 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -7.499 -3.238 -9.584 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -8.865 -2.837 -10.653 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -9.170 -3.504 -9.031 1.00 0.00 H new ATOM 1070 N GLY A 248 -10.300 -6.374 -13.077 1.00 0.00 N ATOM 1071 CA GLY A 248 -10.266 -7.483 -14.072 1.00 0.00 C ATOM 1072 C GLY A 248 -10.771 -8.777 -13.428 1.00 0.00 C ATOM 1073 O GLY A 248 -10.004 -9.666 -13.116 1.00 0.00 O ATOM 0 H GLY A 248 -10.717 -5.505 -13.412 1.00 0.00 H new ATOM 0 HA2 GLY A 248 -10.884 -7.230 -14.933 1.00 0.00 H new ATOM 0 HA3 GLY A 248 -9.249 -7.622 -14.440 1.00 0.00 H new ATOM 1077 N LEU A 249 -12.057 -8.891 -13.235 1.00 0.00 N ATOM 1078 CA LEU A 249 -12.614 -10.131 -12.619 1.00 0.00 C ATOM 1079 C LEU A 249 -11.733 -10.595 -11.455 1.00 0.00 C ATOM 1080 O LEU A 249 -11.577 -11.775 -11.217 1.00 0.00 O ATOM 1081 CB LEU A 249 -12.604 -11.165 -13.746 1.00 0.00 C ATOM 1082 CG LEU A 249 -14.040 -11.567 -14.086 1.00 0.00 C ATOM 1083 CD1 LEU A 249 -14.517 -10.785 -15.313 1.00 0.00 C ATOM 1084 CD2 LEU A 249 -14.090 -13.066 -14.389 1.00 0.00 C ATOM 0 H LEU A 249 -12.747 -8.180 -13.477 1.00 0.00 H new ATOM 0 HA LEU A 249 -13.613 -9.976 -12.211 1.00 0.00 H new ATOM 0 HB2 LEU A 249 -12.113 -10.753 -14.627 1.00 0.00 H new ATOM 0 HB3 LEU A 249 -12.032 -12.042 -13.443 1.00 0.00 H new ATOM 0 HG LEU A 249 -14.688 -11.342 -13.239 1.00 0.00 H new ATOM 0 HD11 LEU A 249 -15.540 -11.073 -15.553 1.00 0.00 H new ATOM 0 HD12 LEU A 249 -14.482 -9.717 -15.100 1.00 0.00 H new ATOM 0 HD13 LEU A 249 -13.869 -11.008 -16.161 1.00 0.00 H new ATOM 0 HD21 LEU A 249 -15.113 -13.354 -14.632 1.00 0.00 H new ATOM 0 HD22 LEU A 249 -13.440 -13.288 -15.235 1.00 0.00 H new ATOM 0 HD23 LEU A 249 -13.753 -13.625 -13.516 1.00 0.00 H new ATOM 1096 N SER A 250 -11.156 -9.676 -10.729 1.00 0.00 N ATOM 1097 CA SER A 250 -10.288 -10.072 -9.582 1.00 0.00 C ATOM 1098 C SER A 250 -10.398 -9.038 -8.459 1.00 0.00 C ATOM 1099 O SER A 250 -10.907 -7.953 -8.652 1.00 0.00 O ATOM 1100 CB SER A 250 -8.870 -10.095 -10.152 1.00 0.00 C ATOM 1101 OG SER A 250 -8.079 -11.010 -9.405 1.00 0.00 O ATOM 0 H SER A 250 -11.247 -8.671 -10.879 1.00 0.00 H new ATOM 0 HA SER A 250 -10.573 -11.035 -9.158 1.00 0.00 H new ATOM 0 HB2 SER A 250 -8.892 -10.388 -11.202 1.00 0.00 H new ATOM 0 HB3 SER A 250 -8.432 -9.098 -10.109 1.00 0.00 H new ATOM 0 HG SER A 250 -7.169 -11.029 -9.769 1.00 0.00 H new ATOM 1107 N LYS A 251 -9.924 -9.359 -7.286 1.00 0.00 N ATOM 1108 CA LYS A 251 -10.009 -8.378 -6.168 1.00 0.00 C ATOM 1109 C LYS A 251 -8.618 -8.117 -5.581 1.00 0.00 C ATOM 1110 O LYS A 251 -8.429 -8.082 -4.382 1.00 0.00 O ATOM 1111 CB LYS A 251 -10.969 -9.005 -5.145 1.00 0.00 C ATOM 1112 CG LYS A 251 -10.210 -9.924 -4.183 1.00 0.00 C ATOM 1113 CD LYS A 251 -11.195 -10.880 -3.505 1.00 0.00 C ATOM 1114 CE LYS A 251 -11.698 -11.907 -4.523 1.00 0.00 C ATOM 1115 NZ LYS A 251 -10.506 -12.731 -4.863 1.00 0.00 N ATOM 0 H LYS A 251 -9.485 -10.250 -7.055 1.00 0.00 H new ATOM 0 HA LYS A 251 -10.378 -7.405 -6.492 1.00 0.00 H new ATOM 0 HB2 LYS A 251 -11.474 -8.219 -4.583 1.00 0.00 H new ATOM 0 HB3 LYS A 251 -11.742 -9.572 -5.664 1.00 0.00 H new ATOM 0 HG2 LYS A 251 -9.453 -10.490 -4.725 1.00 0.00 H new ATOM 0 HG3 LYS A 251 -9.688 -9.331 -3.432 1.00 0.00 H new ATOM 0 HD2 LYS A 251 -10.710 -11.387 -2.671 1.00 0.00 H new ATOM 0 HD3 LYS A 251 -12.035 -10.321 -3.092 1.00 0.00 H new ATOM 0 HE2 LYS A 251 -12.495 -12.521 -4.103 1.00 0.00 H new ATOM 0 HE3 LYS A 251 -12.105 -11.418 -5.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 251 -10.806 -13.704 -5.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 251 -10.029 -12.325 -5.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 251 -9.849 -12.741 -4.057 1.00 0.00 H new ATOM 1129 N CYS A 252 -7.651 -7.906 -6.429 1.00 0.00 N ATOM 1130 CA CYS A 252 -6.269 -7.615 -5.946 1.00 0.00 C ATOM 1131 C CYS A 252 -6.331 -6.689 -4.731 1.00 0.00 C ATOM 1132 O CYS A 252 -7.324 -6.027 -4.504 1.00 0.00 O ATOM 1133 CB CYS A 252 -5.599 -6.910 -7.121 1.00 0.00 C ATOM 1134 SG CYS A 252 -6.486 -5.374 -7.483 1.00 0.00 S ATOM 0 H CYS A 252 -7.758 -7.922 -7.443 1.00 0.00 H new ATOM 0 HA CYS A 252 -5.728 -8.510 -5.639 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -4.557 -6.694 -6.884 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -5.599 -7.559 -7.997 1.00 0.00 H new ATOM 0 HG CYS A 252 -6.212 -4.990 -8.694 1.00 0.00 H new ATOM 1140 N GLU A 253 -5.284 -6.614 -3.955 1.00 0.00 N ATOM 1141 CA GLU A 253 -5.330 -5.696 -2.778 1.00 0.00 C ATOM 1142 C GLU A 253 -4.869 -4.320 -3.204 1.00 0.00 C ATOM 1143 O GLU A 253 -4.415 -4.127 -4.313 1.00 0.00 O ATOM 1144 CB GLU A 253 -4.406 -6.256 -1.687 1.00 0.00 C ATOM 1145 CG GLU A 253 -3.257 -7.061 -2.294 1.00 0.00 C ATOM 1146 CD GLU A 253 -2.162 -7.258 -1.244 1.00 0.00 C ATOM 1147 OE1 GLU A 253 -1.378 -6.343 -1.055 1.00 0.00 O ATOM 1148 OE2 GLU A 253 -2.126 -8.321 -0.646 1.00 0.00 O ATOM 0 H GLU A 253 -4.416 -7.135 -4.079 1.00 0.00 H new ATOM 0 HA GLU A 253 -6.345 -5.621 -2.389 1.00 0.00 H new ATOM 0 HB2 GLU A 253 -4.004 -5.436 -1.091 1.00 0.00 H new ATOM 0 HB3 GLU A 253 -4.980 -6.890 -1.011 1.00 0.00 H new ATOM 0 HG2 GLU A 253 -3.620 -8.028 -2.642 1.00 0.00 H new ATOM 0 HG3 GLU A 253 -2.853 -6.541 -3.163 1.00 0.00 H new ATOM 1155 N ILE A 254 -5.007 -3.353 -2.352 1.00 0.00 N ATOM 1156 CA ILE A 254 -4.604 -1.980 -2.757 1.00 0.00 C ATOM 1157 C ILE A 254 -4.002 -1.179 -1.596 1.00 0.00 C ATOM 1158 O ILE A 254 -4.701 -0.641 -0.761 1.00 0.00 O ATOM 1159 CB ILE A 254 -5.909 -1.346 -3.264 1.00 0.00 C ATOM 1160 CG1 ILE A 254 -6.022 -1.574 -4.774 1.00 0.00 C ATOM 1161 CG2 ILE A 254 -5.932 0.161 -2.983 1.00 0.00 C ATOM 1162 CD1 ILE A 254 -6.633 -2.951 -5.043 1.00 0.00 C ATOM 0 H ILE A 254 -5.375 -3.447 -1.405 1.00 0.00 H new ATOM 0 HA ILE A 254 -3.818 -1.992 -3.512 1.00 0.00 H new ATOM 0 HB ILE A 254 -6.746 -1.810 -2.743 1.00 0.00 H new ATOM 0 HG12 ILE A 254 -6.640 -0.797 -5.224 1.00 0.00 H new ATOM 0 HG13 ILE A 254 -5.037 -1.506 -5.237 1.00 0.00 H new ATOM 0 HG21 ILE A 254 -6.866 0.586 -3.351 1.00 0.00 H new ATOM 0 HG22 ILE A 254 -5.854 0.332 -1.909 1.00 0.00 H new ATOM 0 HG23 ILE A 254 -5.092 0.638 -3.488 1.00 0.00 H new ATOM 0 HD11 ILE A 254 -6.712 -3.110 -6.118 1.00 0.00 H new ATOM 0 HD12 ILE A 254 -5.998 -3.722 -4.608 1.00 0.00 H new ATOM 0 HD13 ILE A 254 -7.625 -3.003 -4.595 1.00 0.00 H new ATOM 1174 N LYS A 255 -2.707 -1.052 -1.588 1.00 0.00 N ATOM 1175 CA LYS A 255 -2.026 -0.239 -0.546 1.00 0.00 C ATOM 1176 C LYS A 255 -1.673 1.103 -1.178 1.00 0.00 C ATOM 1177 O LYS A 255 -0.802 1.175 -2.017 1.00 0.00 O ATOM 1178 CB LYS A 255 -0.745 -0.996 -0.216 1.00 0.00 C ATOM 1179 CG LYS A 255 -0.786 -1.521 1.211 1.00 0.00 C ATOM 1180 CD LYS A 255 -0.243 -0.452 2.161 1.00 0.00 C ATOM 1181 CE LYS A 255 -1.362 0.524 2.531 1.00 0.00 C ATOM 1182 NZ LYS A 255 -0.695 1.585 3.335 1.00 0.00 N ATOM 0 H LYS A 255 -2.082 -1.483 -2.269 1.00 0.00 H new ATOM 0 HA LYS A 255 -2.634 -0.077 0.344 1.00 0.00 H new ATOM 0 HB2 LYS A 255 -0.617 -1.826 -0.911 1.00 0.00 H new ATOM 0 HB3 LYS A 255 0.115 -0.339 -0.343 1.00 0.00 H new ATOM 0 HG2 LYS A 255 -1.808 -1.782 1.485 1.00 0.00 H new ATOM 0 HG3 LYS A 255 -0.192 -2.431 1.293 1.00 0.00 H new ATOM 0 HD2 LYS A 255 0.157 -0.920 3.061 1.00 0.00 H new ATOM 0 HD3 LYS A 255 0.580 0.085 1.688 1.00 0.00 H new ATOM 0 HE2 LYS A 255 -1.833 0.941 1.641 1.00 0.00 H new ATOM 0 HE3 LYS A 255 -2.145 0.028 3.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 255 -1.398 2.293 3.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 255 -0.261 1.160 4.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 255 0.041 2.044 2.761 1.00 0.00 H new ATOM 1196 N VAL A 256 -2.345 2.157 -0.826 1.00 0.00 N ATOM 1197 CA VAL A 256 -2.026 3.462 -1.467 1.00 0.00 C ATOM 1198 C VAL A 256 -0.509 3.666 -1.551 1.00 0.00 C ATOM 1199 O VAL A 256 0.259 2.942 -0.949 1.00 0.00 O ATOM 1200 CB VAL A 256 -2.682 4.517 -0.597 1.00 0.00 C ATOM 1201 CG1 VAL A 256 -2.300 4.302 0.868 1.00 0.00 C ATOM 1202 CG2 VAL A 256 -2.224 5.897 -1.052 1.00 0.00 C ATOM 0 H VAL A 256 -3.092 2.176 -0.132 1.00 0.00 H new ATOM 0 HA VAL A 256 -2.396 3.514 -2.491 1.00 0.00 H new ATOM 0 HB VAL A 256 -3.765 4.440 -0.692 1.00 0.00 H new ATOM 0 HG11 VAL A 256 -2.776 5.065 1.484 1.00 0.00 H new ATOM 0 HG12 VAL A 256 -2.633 3.315 1.190 1.00 0.00 H new ATOM 0 HG13 VAL A 256 -1.218 4.372 0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 256 -2.693 6.659 -0.430 1.00 0.00 H new ATOM 0 HG22 VAL A 256 -1.140 5.969 -0.960 1.00 0.00 H new ATOM 0 HG23 VAL A 256 -2.511 6.051 -2.092 1.00 0.00 H new ATOM 1212 N ALA A 257 -0.070 4.631 -2.313 1.00 0.00 N ATOM 1213 CA ALA A 257 1.394 4.859 -2.462 1.00 0.00 C ATOM 1214 C ALA A 257 1.712 6.357 -2.517 1.00 0.00 C ATOM 1215 O ALA A 257 0.890 7.164 -2.905 1.00 0.00 O ATOM 1216 CB ALA A 257 1.743 4.195 -3.794 1.00 0.00 C ATOM 0 H ALA A 257 -0.664 5.272 -2.839 1.00 0.00 H new ATOM 0 HA ALA A 257 1.962 4.454 -1.624 1.00 0.00 H new ATOM 0 HB1 ALA A 257 2.809 4.312 -3.991 1.00 0.00 H new ATOM 0 HB2 ALA A 257 1.497 3.134 -3.747 1.00 0.00 H new ATOM 0 HB3 ALA A 257 1.172 4.665 -4.595 1.00 0.00 H new