USER MOD reduce.3.24.130724 H: found=0, std=0, add=496, rem=0, adj=12 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+ -137:sc= -1.94! (180deg=-6.78!) USER MOD Single : A 193 THR OG1 : rot 44:sc= -2.74! USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 TYR OH : rot 180:sc= 0 USER MOD Single : A 210 SER OG : rot 23:sc= 0.682 USER MOD Single : A 226 CYS SG : rot 111:sc= -2.35! USER MOD Single : A 229 THR OG1 : rot 180:sc= -0.0205 USER MOD Single : A 231 LYS NZ :NH3+ -129:sc= 0.211 (180deg=0) USER MOD Single : A 237 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 MET CE :methyl -141:sc= -0.444 (180deg=-2.24!) 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= -16.5! C(o=-19!,f=-17!) USER MOD Single : A 246 ASN : amide:sc= 0.162 X(o=0.16,f=-0.068) USER MOD Single : A 250 SER OG : rot 180:sc= -0.276 USER MOD Single : A 251 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 252 CYS SG : rot 13:sc= -5.44! USER MOD Single : A 255 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 183 -0.695 8.382 -5.086 1.00 0.00 N ATOM 2 CA LYS A 183 -0.468 7.099 -5.808 1.00 0.00 C ATOM 3 C LYS A 183 -0.877 5.959 -4.890 1.00 0.00 C ATOM 4 O LYS A 183 -0.961 6.131 -3.696 1.00 0.00 O ATOM 5 CB LYS A 183 1.030 7.088 -6.092 1.00 0.00 C ATOM 6 CG LYS A 183 1.573 5.646 -6.229 1.00 0.00 C ATOM 7 CD LYS A 183 2.037 5.444 -7.661 1.00 0.00 C ATOM 8 CE LYS A 183 3.552 5.653 -7.741 1.00 0.00 C ATOM 9 NZ LYS A 183 3.837 5.881 -9.187 1.00 0.00 N ATOM 0 HA LYS A 183 -1.041 6.993 -6.729 1.00 0.00 H new ATOM 0 HB2 LYS A 183 1.231 7.642 -7.009 1.00 0.00 H new ATOM 0 HB3 LYS A 183 1.557 7.601 -5.288 1.00 0.00 H new ATOM 0 HG2 LYS A 183 2.399 5.484 -5.536 1.00 0.00 H new ATOM 0 HG3 LYS A 183 0.798 4.923 -5.976 1.00 0.00 H new ATOM 0 HD2 LYS A 183 1.779 4.441 -8.000 1.00 0.00 H new ATOM 0 HD3 LYS A 183 1.527 6.145 -8.322 1.00 0.00 H new ATOM 0 HE2 LYS A 183 3.865 6.506 -7.138 1.00 0.00 H new ATOM 0 HE3 LYS A 183 4.090 4.783 -7.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 4.687 5.348 -9.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 3.028 5.559 -9.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 3.995 6.895 -9.354 1.00 0.00 H new ATOM 23 N ILE A 184 -1.119 4.798 -5.415 1.00 0.00 N ATOM 24 CA ILE A 184 -1.499 3.681 -4.528 1.00 0.00 C ATOM 25 C ILE A 184 -0.783 2.391 -4.968 1.00 0.00 C ATOM 26 O ILE A 184 -0.200 2.334 -6.032 1.00 0.00 O ATOM 27 CB ILE A 184 -3.011 3.528 -4.692 1.00 0.00 C ATOM 28 CG1 ILE A 184 -3.347 3.372 -6.178 1.00 0.00 C ATOM 29 CG2 ILE A 184 -3.718 4.767 -4.139 1.00 0.00 C ATOM 30 CD1 ILE A 184 -3.942 1.985 -6.425 1.00 0.00 C ATOM 0 H ILE A 184 -1.070 4.577 -6.410 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.221 3.870 -3.491 1.00 0.00 H new ATOM 0 HB ILE A 184 -3.347 2.647 -4.145 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.055 4.142 -6.484 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.449 3.506 -6.781 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.796 4.654 -4.258 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.479 4.881 -3.082 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -3.383 5.650 -4.683 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.181 1.875 -7.483 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -3.220 1.222 -6.135 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.850 1.868 -5.834 1.00 0.00 H new ATOM 42 N PHE A 185 -0.838 1.351 -4.174 1.00 0.00 N ATOM 43 CA PHE A 185 -0.174 0.071 -4.580 1.00 0.00 C ATOM 44 C PHE A 185 -1.230 -1.014 -4.773 1.00 0.00 C ATOM 45 O PHE A 185 -2.294 -0.963 -4.197 1.00 0.00 O ATOM 46 CB PHE A 185 0.797 -0.295 -3.437 1.00 0.00 C ATOM 47 CG PHE A 185 0.710 -1.777 -3.084 1.00 0.00 C ATOM 48 CD1 PHE A 185 -0.237 -2.239 -2.153 1.00 0.00 C ATOM 49 CD2 PHE A 185 1.584 -2.689 -3.689 1.00 0.00 C ATOM 50 CE1 PHE A 185 -0.299 -3.605 -1.837 1.00 0.00 C ATOM 51 CE2 PHE A 185 1.515 -4.049 -3.370 1.00 0.00 C ATOM 52 CZ PHE A 185 0.576 -4.506 -2.445 1.00 0.00 C ATOM 0 H PHE A 185 -1.309 1.331 -3.270 1.00 0.00 H new ATOM 0 HA PHE A 185 0.365 0.171 -5.522 1.00 0.00 H new ATOM 0 HB2 PHE A 185 1.817 -0.049 -3.732 1.00 0.00 H new ATOM 0 HB3 PHE A 185 0.567 0.304 -2.556 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -0.916 -1.544 -1.682 1.00 0.00 H new ATOM 0 HD2 PHE A 185 2.314 -2.341 -4.405 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -1.026 -3.960 -1.121 1.00 0.00 H new ATOM 0 HE2 PHE A 185 2.191 -4.747 -3.841 1.00 0.00 H new ATOM 0 HZ PHE A 185 0.526 -5.557 -2.200 1.00 0.00 H new ATOM 62 N VAL A 186 -0.933 -2.001 -5.568 1.00 0.00 N ATOM 63 CA VAL A 186 -1.914 -3.097 -5.778 1.00 0.00 C ATOM 64 C VAL A 186 -1.218 -4.447 -5.699 1.00 0.00 C ATOM 65 O VAL A 186 -0.165 -4.645 -6.272 1.00 0.00 O ATOM 66 CB VAL A 186 -2.458 -2.907 -7.187 1.00 0.00 C ATOM 67 CG1 VAL A 186 -3.511 -3.988 -7.468 1.00 0.00 C ATOM 68 CG2 VAL A 186 -3.098 -1.522 -7.323 1.00 0.00 C ATOM 0 H VAL A 186 -0.056 -2.096 -6.080 1.00 0.00 H new ATOM 0 HA VAL A 186 -2.699 -3.071 -5.022 1.00 0.00 H new ATOM 0 HB VAL A 186 -1.640 -2.989 -7.903 1.00 0.00 H new ATOM 0 HG11 VAL A 186 -3.905 -3.858 -8.476 1.00 0.00 H new ATOM 0 HG12 VAL A 186 -3.053 -4.973 -7.381 1.00 0.00 H new ATOM 0 HG13 VAL A 186 -4.323 -3.901 -6.746 1.00 0.00 H new ATOM 0 HG21 VAL A 186 -3.484 -1.397 -8.335 1.00 0.00 H new ATOM 0 HG22 VAL A 186 -3.916 -1.427 -6.609 1.00 0.00 H new ATOM 0 HG23 VAL A 186 -2.350 -0.754 -7.122 1.00 0.00 H new ATOM 78 N GLY A 187 -1.804 -5.393 -5.028 1.00 0.00 N ATOM 79 CA GLY A 187 -1.168 -6.732 -4.968 1.00 0.00 C ATOM 80 C GLY A 187 -1.835 -7.607 -6.017 1.00 0.00 C ATOM 81 O GLY A 187 -2.087 -8.779 -5.821 1.00 0.00 O ATOM 0 H GLY A 187 -2.686 -5.299 -4.524 1.00 0.00 H new ATOM 0 HA2 GLY A 187 -0.097 -6.656 -5.158 1.00 0.00 H new ATOM 0 HA3 GLY A 187 -1.286 -7.167 -3.976 1.00 0.00 H new ATOM 148 N THR A 193 -0.568 -6.358 -16.403 1.00 0.00 N ATOM 149 CA THR A 193 -1.050 -5.131 -15.701 1.00 0.00 C ATOM 150 C THR A 193 -2.199 -4.494 -16.503 1.00 0.00 C ATOM 151 O THR A 193 -1.965 -3.883 -17.526 1.00 0.00 O ATOM 152 CB THR A 193 0.170 -4.207 -15.668 1.00 0.00 C ATOM 153 OG1 THR A 193 0.629 -3.991 -16.996 1.00 0.00 O ATOM 154 CG2 THR A 193 1.281 -4.857 -14.842 1.00 0.00 C ATOM 0 HA THR A 193 -1.435 -5.333 -14.701 1.00 0.00 H new ATOM 0 HB THR A 193 -0.104 -3.254 -15.216 1.00 0.00 H new ATOM 0 HG1 THR A 193 -0.137 -3.824 -17.584 1.00 0.00 H new ATOM 0 HG21 THR A 193 2.150 -4.199 -14.819 1.00 0.00 H new ATOM 0 HG22 THR A 193 0.927 -5.026 -13.825 1.00 0.00 H new ATOM 0 HG23 THR A 193 1.560 -5.810 -15.293 1.00 0.00 H new ATOM 162 N PRO A 194 -3.412 -4.679 -16.028 1.00 0.00 N ATOM 163 CA PRO A 194 -4.614 -4.139 -16.729 1.00 0.00 C ATOM 164 C PRO A 194 -4.679 -2.599 -16.727 1.00 0.00 C ATOM 165 O PRO A 194 -5.723 -2.034 -16.506 1.00 0.00 O ATOM 166 CB PRO A 194 -5.766 -4.716 -15.898 1.00 0.00 C ATOM 167 CG PRO A 194 -5.181 -5.554 -14.745 1.00 0.00 C ATOM 168 CD PRO A 194 -3.652 -5.443 -14.780 1.00 0.00 C ATOM 0 HA PRO A 194 -4.626 -4.411 -17.784 1.00 0.00 H new ATOM 0 HB2 PRO A 194 -6.385 -3.911 -15.502 1.00 0.00 H new ATOM 0 HB3 PRO A 194 -6.409 -5.334 -16.524 1.00 0.00 H new ATOM 0 HG2 PRO A 194 -5.563 -5.198 -13.788 1.00 0.00 H new ATOM 0 HG3 PRO A 194 -5.486 -6.596 -14.843 1.00 0.00 H new ATOM 0 HD2 PRO A 194 -3.263 -4.922 -13.905 1.00 0.00 H new ATOM 0 HD3 PRO A 194 -3.175 -6.423 -14.806 1.00 0.00 H new ATOM 176 N GLU A 195 -3.589 -1.922 -16.973 1.00 0.00 N ATOM 177 CA GLU A 195 -3.607 -0.419 -16.981 1.00 0.00 C ATOM 178 C GLU A 195 -4.885 0.118 -17.590 1.00 0.00 C ATOM 179 O GLU A 195 -5.667 0.762 -16.938 1.00 0.00 O ATOM 180 CB GLU A 195 -2.476 0.079 -17.897 1.00 0.00 C ATOM 181 CG GLU A 195 -1.736 -1.077 -18.585 1.00 0.00 C ATOM 182 CD GLU A 195 -0.774 -0.515 -19.634 1.00 0.00 C ATOM 183 OE1 GLU A 195 -0.880 0.661 -19.936 1.00 0.00 O ATOM 184 OE2 GLU A 195 0.052 -1.272 -20.117 1.00 0.00 O ATOM 0 H GLU A 195 -2.681 -2.342 -17.170 1.00 0.00 H new ATOM 0 HA GLU A 195 -3.506 -0.084 -15.949 1.00 0.00 H new ATOM 0 HB2 GLU A 195 -2.890 0.745 -18.654 1.00 0.00 H new ATOM 0 HB3 GLU A 195 -1.767 0.664 -17.311 1.00 0.00 H new ATOM 0 HG2 GLU A 195 -1.186 -1.661 -17.847 1.00 0.00 H new ATOM 0 HG3 GLU A 195 -2.451 -1.751 -19.056 1.00 0.00 H new ATOM 191 N GLU A 196 -5.084 -0.093 -18.851 1.00 0.00 N ATOM 192 CA GLU A 196 -6.289 0.475 -19.480 1.00 0.00 C ATOM 193 C GLU A 196 -7.501 0.167 -18.609 1.00 0.00 C ATOM 194 O GLU A 196 -8.330 1.017 -18.345 1.00 0.00 O ATOM 195 CB GLU A 196 -6.403 -0.189 -20.852 1.00 0.00 C ATOM 196 CG GLU A 196 -5.431 0.481 -21.825 1.00 0.00 C ATOM 197 CD GLU A 196 -6.220 1.227 -22.902 1.00 0.00 C ATOM 198 OE1 GLU A 196 -7.269 1.758 -22.578 1.00 0.00 O ATOM 199 OE2 GLU A 196 -5.760 1.257 -24.032 1.00 0.00 O ATOM 0 H GLU A 196 -4.471 -0.628 -19.466 1.00 0.00 H new ATOM 0 HA GLU A 196 -6.234 1.558 -19.587 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -6.179 -1.253 -20.773 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -7.424 -0.105 -21.225 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -4.783 1.174 -21.289 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -4.786 -0.268 -22.285 1.00 0.00 H new ATOM 206 N LYS A 197 -7.583 -1.036 -18.125 1.00 0.00 N ATOM 207 CA LYS A 197 -8.718 -1.392 -17.228 1.00 0.00 C ATOM 208 C LYS A 197 -8.466 -0.736 -15.873 1.00 0.00 C ATOM 209 O LYS A 197 -9.374 -0.434 -15.124 1.00 0.00 O ATOM 210 CB LYS A 197 -8.699 -2.917 -17.121 1.00 0.00 C ATOM 211 CG LYS A 197 -9.898 -3.489 -17.882 1.00 0.00 C ATOM 212 CD LYS A 197 -10.334 -4.807 -17.241 1.00 0.00 C ATOM 213 CE LYS A 197 -10.900 -5.734 -18.319 1.00 0.00 C ATOM 214 NZ LYS A 197 -11.321 -6.961 -17.588 1.00 0.00 N ATOM 0 H LYS A 197 -6.918 -1.787 -18.309 1.00 0.00 H new ATOM 0 HA LYS A 197 -9.687 -1.053 -17.595 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -7.770 -3.311 -17.533 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -8.738 -3.221 -16.075 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -10.723 -2.777 -17.869 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -9.634 -3.651 -18.927 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -9.486 -5.281 -16.746 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -11.086 -4.620 -16.475 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -11.743 -5.273 -18.834 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -10.150 -5.963 -19.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -11.720 -7.646 -18.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -10.497 -7.382 -17.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -12.040 -6.713 -16.879 1.00 0.00 H new ATOM 228 N ILE A 198 -7.219 -0.490 -15.583 1.00 0.00 N ATOM 229 CA ILE A 198 -6.842 0.176 -14.316 1.00 0.00 C ATOM 230 C ILE A 198 -7.392 1.600 -14.350 1.00 0.00 C ATOM 231 O ILE A 198 -8.161 2.004 -13.508 1.00 0.00 O ATOM 232 CB ILE A 198 -5.292 0.128 -14.300 1.00 0.00 C ATOM 233 CG1 ILE A 198 -4.836 -0.431 -12.962 1.00 0.00 C ATOM 234 CG2 ILE A 198 -4.670 1.525 -14.464 1.00 0.00 C ATOM 235 CD1 ILE A 198 -3.351 -0.794 -13.034 1.00 0.00 C ATOM 0 H ILE A 198 -6.433 -0.730 -16.187 1.00 0.00 H new ATOM 0 HA ILE A 198 -7.241 -0.292 -13.416 1.00 0.00 H new ATOM 0 HB ILE A 198 -4.970 -0.496 -15.134 1.00 0.00 H new ATOM 0 HG12 ILE A 198 -5.003 0.303 -12.174 1.00 0.00 H new ATOM 0 HG13 ILE A 198 -5.424 -1.312 -12.706 1.00 0.00 H new ATOM 0 HG21 ILE A 198 -3.583 1.444 -14.447 1.00 0.00 H new ATOM 0 HG22 ILE A 198 -4.987 1.955 -15.414 1.00 0.00 H new ATOM 0 HG23 ILE A 198 -4.999 2.168 -13.647 1.00 0.00 H new ATOM 0 HD11 ILE A 198 -3.027 -1.194 -12.073 1.00 0.00 H new ATOM 0 HD12 ILE A 198 -3.197 -1.544 -13.810 1.00 0.00 H new ATOM 0 HD13 ILE A 198 -2.770 0.097 -13.270 1.00 0.00 H new ATOM 247 N ARG A 199 -7.026 2.347 -15.349 1.00 0.00 N ATOM 248 CA ARG A 199 -7.549 3.728 -15.473 1.00 0.00 C ATOM 249 C ARG A 199 -9.069 3.675 -15.357 1.00 0.00 C ATOM 250 O ARG A 199 -9.692 4.530 -14.763 1.00 0.00 O ATOM 251 CB ARG A 199 -7.120 4.183 -16.874 1.00 0.00 C ATOM 252 CG ARG A 199 -5.964 5.179 -16.757 1.00 0.00 C ATOM 253 CD ARG A 199 -5.699 5.814 -18.124 1.00 0.00 C ATOM 254 NE ARG A 199 -5.274 7.210 -17.826 1.00 0.00 N ATOM 255 CZ ARG A 199 -5.799 8.206 -18.487 1.00 0.00 C ATOM 256 NH1 ARG A 199 -7.088 8.402 -18.456 1.00 0.00 N ATOM 257 NH2 ARG A 199 -5.033 9.006 -19.176 1.00 0.00 N ATOM 0 H ARG A 199 -6.384 2.058 -16.087 1.00 0.00 H new ATOM 0 HA ARG A 199 -7.179 4.409 -14.707 1.00 0.00 H new ATOM 0 HB2 ARG A 199 -6.814 3.323 -17.469 1.00 0.00 H new ATOM 0 HB3 ARG A 199 -7.961 4.645 -17.391 1.00 0.00 H new ATOM 0 HG2 ARG A 199 -6.207 5.951 -16.026 1.00 0.00 H new ATOM 0 HG3 ARG A 199 -5.068 4.672 -16.399 1.00 0.00 H new ATOM 0 HD2 ARG A 199 -4.924 5.273 -18.667 1.00 0.00 H new ATOM 0 HD3 ARG A 199 -6.594 5.798 -18.746 1.00 0.00 H new ATOM 0 HE ARG A 199 -4.573 7.388 -17.106 1.00 0.00 H new ATOM 0 HH11 ARG A 199 -7.686 7.777 -17.915 1.00 0.00 H new ATOM 0 HH12 ARG A 199 -7.498 9.180 -18.972 1.00 0.00 H new ATOM 0 HH21 ARG A 199 -4.025 8.853 -19.198 1.00 0.00 H new ATOM 0 HH22 ARG A 199 -5.442 9.784 -19.693 1.00 0.00 H new ATOM 271 N GLU A 200 -9.665 2.652 -15.908 1.00 0.00 N ATOM 272 CA GLU A 200 -11.145 2.512 -15.819 1.00 0.00 C ATOM 273 C GLU A 200 -11.566 2.420 -14.374 1.00 0.00 C ATOM 274 O GLU A 200 -12.559 2.995 -13.976 1.00 0.00 O ATOM 275 CB GLU A 200 -11.478 1.225 -16.573 1.00 0.00 C ATOM 276 CG GLU A 200 -11.761 1.555 -18.039 1.00 0.00 C ATOM 277 CD GLU A 200 -13.265 1.740 -18.241 1.00 0.00 C ATOM 278 OE1 GLU A 200 -14.020 1.178 -17.465 1.00 0.00 O ATOM 279 OE2 GLU A 200 -13.637 2.441 -19.168 1.00 0.00 O ATOM 0 H GLU A 200 -9.189 1.907 -16.416 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.669 3.366 -16.247 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -10.648 0.523 -16.500 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -12.345 0.741 -16.124 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.231 2.463 -18.327 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.393 0.754 -18.680 1.00 0.00 H new ATOM 286 N TYR A 201 -10.835 1.722 -13.573 1.00 0.00 N ATOM 287 CA TYR A 201 -11.246 1.649 -12.165 1.00 0.00 C ATOM 288 C TYR A 201 -10.575 2.766 -11.382 1.00 0.00 C ATOM 289 O TYR A 201 -11.202 3.731 -10.995 1.00 0.00 O ATOM 290 CB TYR A 201 -10.786 0.287 -11.658 1.00 0.00 C ATOM 291 CG TYR A 201 -11.721 -0.212 -10.582 1.00 0.00 C ATOM 292 CD1 TYR A 201 -13.104 -0.022 -10.699 1.00 0.00 C ATOM 293 CD2 TYR A 201 -11.197 -0.870 -9.464 1.00 0.00 C ATOM 294 CE1 TYR A 201 -13.960 -0.488 -9.693 1.00 0.00 C ATOM 295 CE2 TYR A 201 -12.053 -1.336 -8.462 1.00 0.00 C ATOM 296 CZ TYR A 201 -13.434 -1.146 -8.575 1.00 0.00 C ATOM 297 OH TYR A 201 -14.278 -1.607 -7.584 1.00 0.00 O ATOM 0 H TYR A 201 -9.990 1.210 -13.825 1.00 0.00 H new ATOM 0 HA TYR A 201 -12.324 1.764 -12.048 1.00 0.00 H new ATOM 0 HB2 TYR A 201 -10.756 -0.425 -12.483 1.00 0.00 H new ATOM 0 HB3 TYR A 201 -9.773 0.361 -11.264 1.00 0.00 H new ATOM 0 HD1 TYR A 201 -13.509 0.483 -11.563 1.00 0.00 H new ATOM 0 HD2 TYR A 201 -10.131 -1.018 -9.375 1.00 0.00 H new ATOM 0 HE1 TYR A 201 -15.026 -0.340 -9.780 1.00 0.00 H new ATOM 0 HE2 TYR A 201 -11.647 -1.844 -7.599 1.00 0.00 H new ATOM 0 HH TYR A 201 -13.751 -2.040 -6.881 1.00 0.00 H new ATOM 307 N PHE A 202 -9.297 2.649 -11.155 1.00 0.00 N ATOM 308 CA PHE A 202 -8.592 3.709 -10.407 1.00 0.00 C ATOM 309 C PHE A 202 -8.862 5.051 -11.076 1.00 0.00 C ATOM 310 O PHE A 202 -9.326 5.989 -10.453 1.00 0.00 O ATOM 311 CB PHE A 202 -7.099 3.356 -10.486 1.00 0.00 C ATOM 312 CG PHE A 202 -6.855 1.966 -9.951 1.00 0.00 C ATOM 313 CD1 PHE A 202 -6.676 1.761 -8.577 1.00 0.00 C ATOM 314 CD2 PHE A 202 -6.799 0.880 -10.833 1.00 0.00 C ATOM 315 CE1 PHE A 202 -6.441 0.469 -8.087 1.00 0.00 C ATOM 316 CE2 PHE A 202 -6.563 -0.410 -10.344 1.00 0.00 C ATOM 317 CZ PHE A 202 -6.385 -0.615 -8.971 1.00 0.00 C ATOM 0 H PHE A 202 -8.717 1.866 -11.456 1.00 0.00 H new ATOM 0 HA PHE A 202 -8.922 3.779 -9.370 1.00 0.00 H new ATOM 0 HB2 PHE A 202 -6.759 3.419 -11.520 1.00 0.00 H new ATOM 0 HB3 PHE A 202 -6.518 4.079 -9.914 1.00 0.00 H new ATOM 0 HD1 PHE A 202 -6.719 2.598 -7.896 1.00 0.00 H new ATOM 0 HD2 PHE A 202 -6.938 1.038 -11.892 1.00 0.00 H new ATOM 0 HE1 PHE A 202 -6.303 0.310 -7.028 1.00 0.00 H new ATOM 0 HE2 PHE A 202 -6.518 -1.247 -11.026 1.00 0.00 H new ATOM 0 HZ PHE A 202 -6.204 -1.610 -8.593 1.00 0.00 H new ATOM 327 N GLY A 203 -8.610 5.142 -12.351 1.00 0.00 N ATOM 328 CA GLY A 203 -8.892 6.410 -13.061 1.00 0.00 C ATOM 329 C GLY A 203 -10.360 6.745 -12.826 1.00 0.00 C ATOM 330 O GLY A 203 -10.779 7.883 -12.920 1.00 0.00 O ATOM 0 H GLY A 203 -8.223 4.394 -12.927 1.00 0.00 H new ATOM 0 HA2 GLY A 203 -8.251 7.209 -12.689 1.00 0.00 H new ATOM 0 HA3 GLY A 203 -8.687 6.307 -14.127 1.00 0.00 H new ATOM 334 N GLY A 204 -11.140 5.749 -12.498 1.00 0.00 N ATOM 335 CA GLY A 204 -12.583 5.975 -12.227 1.00 0.00 C ATOM 336 C GLY A 204 -12.723 6.745 -10.916 1.00 0.00 C ATOM 337 O GLY A 204 -13.465 7.704 -10.830 1.00 0.00 O ATOM 0 H GLY A 204 -10.832 4.781 -12.406 1.00 0.00 H new ATOM 0 HA2 GLY A 204 -13.037 6.535 -13.044 1.00 0.00 H new ATOM 0 HA3 GLY A 204 -13.109 5.022 -12.163 1.00 0.00 H new ATOM 341 N PHE A 205 -12.009 6.348 -9.893 1.00 0.00 N ATOM 342 CA PHE A 205 -12.114 7.090 -8.604 1.00 0.00 C ATOM 343 C PHE A 205 -11.767 8.555 -8.848 1.00 0.00 C ATOM 344 O PHE A 205 -12.317 9.455 -8.245 1.00 0.00 O ATOM 345 CB PHE A 205 -11.080 6.447 -7.687 1.00 0.00 C ATOM 346 CG PHE A 205 -11.552 5.074 -7.291 1.00 0.00 C ATOM 347 CD1 PHE A 205 -11.253 3.975 -8.102 1.00 0.00 C ATOM 348 CD2 PHE A 205 -12.282 4.902 -6.113 1.00 0.00 C ATOM 349 CE1 PHE A 205 -11.689 2.696 -7.731 1.00 0.00 C ATOM 350 CE2 PHE A 205 -12.717 3.627 -5.739 1.00 0.00 C ATOM 351 CZ PHE A 205 -12.421 2.522 -6.548 1.00 0.00 C ATOM 0 H PHE A 205 -11.368 5.555 -9.895 1.00 0.00 H new ATOM 0 HA PHE A 205 -13.113 7.048 -8.171 1.00 0.00 H new ATOM 0 HB2 PHE A 205 -10.118 6.381 -8.195 1.00 0.00 H new ATOM 0 HB3 PHE A 205 -10.931 7.063 -6.800 1.00 0.00 H new ATOM 0 HD1 PHE A 205 -10.688 4.111 -9.012 1.00 0.00 H new ATOM 0 HD2 PHE A 205 -12.511 5.754 -5.490 1.00 0.00 H new ATOM 0 HE1 PHE A 205 -11.461 1.845 -8.356 1.00 0.00 H new ATOM 0 HE2 PHE A 205 -13.281 3.494 -4.827 1.00 0.00 H new ATOM 0 HZ PHE A 205 -12.757 1.537 -6.260 1.00 0.00 H new ATOM 361 N GLY A 206 -10.851 8.784 -9.741 1.00 0.00 N ATOM 362 CA GLY A 206 -10.433 10.171 -10.067 1.00 0.00 C ATOM 363 C GLY A 206 -9.430 10.099 -11.214 1.00 0.00 C ATOM 364 O GLY A 206 -8.593 9.220 -11.247 1.00 0.00 O ATOM 0 H GLY A 206 -10.366 8.057 -10.267 1.00 0.00 H new ATOM 0 HA2 GLY A 206 -11.296 10.773 -10.352 1.00 0.00 H new ATOM 0 HA3 GLY A 206 -9.984 10.649 -9.196 1.00 0.00 H new ATOM 368 N GLU A 207 -9.512 10.993 -12.160 1.00 0.00 N ATOM 369 CA GLU A 207 -8.556 10.939 -13.302 1.00 0.00 C ATOM 370 C GLU A 207 -7.157 10.609 -12.795 1.00 0.00 C ATOM 371 O GLU A 207 -6.747 11.042 -11.735 1.00 0.00 O ATOM 372 CB GLU A 207 -8.581 12.327 -13.930 1.00 0.00 C ATOM 373 CG GLU A 207 -8.231 13.375 -12.870 1.00 0.00 C ATOM 374 CD GLU A 207 -7.273 14.406 -13.469 1.00 0.00 C ATOM 375 OE1 GLU A 207 -7.729 15.223 -14.253 1.00 0.00 O ATOM 376 OE2 GLU A 207 -6.102 14.363 -13.133 1.00 0.00 O ATOM 0 H GLU A 207 -10.193 11.752 -12.193 1.00 0.00 H new ATOM 0 HA GLU A 207 -8.830 10.170 -14.025 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -7.870 12.377 -14.755 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -9.567 12.531 -14.347 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -9.137 13.867 -12.517 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -7.772 12.895 -12.006 1.00 0.00 H new ATOM 383 N VAL A 208 -6.428 9.833 -13.536 1.00 0.00 N ATOM 384 CA VAL A 208 -5.065 9.454 -13.102 1.00 0.00 C ATOM 385 C VAL A 208 -4.018 10.275 -13.844 1.00 0.00 C ATOM 386 O VAL A 208 -4.183 10.620 -14.996 1.00 0.00 O ATOM 387 CB VAL A 208 -4.943 7.977 -13.490 1.00 0.00 C ATOM 388 CG1 VAL A 208 -3.464 7.574 -13.578 1.00 0.00 C ATOM 389 CG2 VAL A 208 -5.649 7.123 -12.438 1.00 0.00 C ATOM 0 H VAL A 208 -6.721 9.442 -14.431 1.00 0.00 H new ATOM 0 HA VAL A 208 -4.906 9.628 -12.038 1.00 0.00 H new ATOM 0 HB VAL A 208 -5.407 7.820 -14.464 1.00 0.00 H new ATOM 0 HG11 VAL A 208 -3.389 6.522 -13.854 1.00 0.00 H new ATOM 0 HG12 VAL A 208 -2.965 8.184 -14.331 1.00 0.00 H new ATOM 0 HG13 VAL A 208 -2.986 7.730 -12.611 1.00 0.00 H new ATOM 0 HG21 VAL A 208 -5.566 6.070 -12.708 1.00 0.00 H new ATOM 0 HG22 VAL A 208 -5.184 7.286 -11.466 1.00 0.00 H new ATOM 0 HG23 VAL A 208 -6.701 7.403 -12.389 1.00 0.00 H new ATOM 399 N GLU A 209 -2.921 10.541 -13.207 1.00 0.00 N ATOM 400 CA GLU A 209 -1.841 11.280 -13.896 1.00 0.00 C ATOM 401 C GLU A 209 -0.993 10.227 -14.592 1.00 0.00 C ATOM 402 O GLU A 209 -0.787 10.260 -15.789 1.00 0.00 O ATOM 403 CB GLU A 209 -1.055 11.986 -12.792 1.00 0.00 C ATOM 404 CG GLU A 209 -0.033 12.936 -13.419 1.00 0.00 C ATOM 405 CD GLU A 209 0.545 13.850 -12.338 1.00 0.00 C ATOM 406 OE1 GLU A 209 0.714 13.383 -11.223 1.00 0.00 O ATOM 407 OE2 GLU A 209 0.808 15.002 -12.642 1.00 0.00 O ATOM 0 H GLU A 209 -2.726 10.279 -12.241 1.00 0.00 H new ATOM 0 HA GLU A 209 -2.183 12.011 -14.628 1.00 0.00 H new ATOM 0 HB2 GLU A 209 -1.735 12.541 -12.146 1.00 0.00 H new ATOM 0 HB3 GLU A 209 -0.548 11.252 -12.166 1.00 0.00 H new ATOM 0 HG2 GLU A 209 0.766 12.366 -13.893 1.00 0.00 H new ATOM 0 HG3 GLU A 209 -0.506 13.532 -14.199 1.00 0.00 H new ATOM 414 N SER A 210 -0.552 9.252 -13.848 1.00 0.00 N ATOM 415 CA SER A 210 0.220 8.149 -14.445 1.00 0.00 C ATOM 416 C SER A 210 0.024 6.922 -13.568 1.00 0.00 C ATOM 417 O SER A 210 -0.488 7.023 -12.474 1.00 0.00 O ATOM 418 CB SER A 210 1.676 8.611 -14.443 1.00 0.00 C ATOM 419 OG SER A 210 1.914 9.419 -15.588 1.00 0.00 O ATOM 0 H SER A 210 -0.700 9.179 -12.841 1.00 0.00 H new ATOM 0 HA SER A 210 -0.090 7.897 -15.459 1.00 0.00 H new ATOM 0 HB2 SER A 210 1.889 9.175 -13.535 1.00 0.00 H new ATOM 0 HB3 SER A 210 2.343 7.749 -14.447 1.00 0.00 H new ATOM 0 HG SER A 210 1.066 9.792 -15.907 1.00 0.00 H new ATOM 425 N ILE A 211 0.424 5.774 -14.009 1.00 0.00 N ATOM 426 CA ILE A 211 0.252 4.582 -13.145 1.00 0.00 C ATOM 427 C ILE A 211 1.606 3.940 -12.889 1.00 0.00 C ATOM 428 O ILE A 211 2.639 4.487 -13.221 1.00 0.00 O ATOM 429 CB ILE A 211 -0.647 3.621 -13.907 1.00 0.00 C ATOM 430 CG1 ILE A 211 -0.068 3.369 -15.301 1.00 0.00 C ATOM 431 CG2 ILE A 211 -2.046 4.220 -14.027 1.00 0.00 C ATOM 432 CD1 ILE A 211 -0.609 2.047 -15.846 1.00 0.00 C ATOM 0 H ILE A 211 0.857 5.606 -14.917 1.00 0.00 H new ATOM 0 HA ILE A 211 -0.185 4.845 -12.182 1.00 0.00 H new ATOM 0 HB ILE A 211 -0.705 2.675 -13.369 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -0.334 4.187 -15.970 1.00 0.00 H new ATOM 0 HG13 ILE A 211 1.021 3.337 -15.254 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -2.691 3.532 -14.573 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -2.456 4.389 -13.031 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -1.991 5.168 -14.562 1.00 0.00 H new ATOM 0 HD11 ILE A 211 -0.197 1.867 -16.839 1.00 0.00 H new ATOM 0 HD12 ILE A 211 -0.320 1.234 -15.180 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -1.696 2.097 -15.908 1.00 0.00 H new ATOM 444 N GLU A 212 1.611 2.784 -12.307 1.00 0.00 N ATOM 445 CA GLU A 212 2.902 2.106 -12.035 1.00 0.00 C ATOM 446 C GLU A 212 2.711 0.593 -12.046 1.00 0.00 C ATOM 447 O GLU A 212 1.825 0.063 -11.415 1.00 0.00 O ATOM 448 CB GLU A 212 3.315 2.595 -10.651 1.00 0.00 C ATOM 449 CG GLU A 212 4.589 1.865 -10.216 1.00 0.00 C ATOM 450 CD GLU A 212 5.434 2.784 -9.331 1.00 0.00 C ATOM 451 OE1 GLU A 212 4.992 3.092 -8.237 1.00 0.00 O ATOM 452 OE2 GLU A 212 6.512 3.161 -9.762 1.00 0.00 O ATOM 0 H GLU A 212 0.779 2.277 -12.007 1.00 0.00 H new ATOM 0 HA GLU A 212 3.660 2.330 -12.785 1.00 0.00 H new ATOM 0 HB2 GLU A 212 3.487 3.671 -10.669 1.00 0.00 H new ATOM 0 HB3 GLU A 212 2.514 2.412 -9.934 1.00 0.00 H new ATOM 0 HG2 GLU A 212 4.331 0.957 -9.672 1.00 0.00 H new ATOM 0 HG3 GLU A 212 5.162 1.560 -11.092 1.00 0.00 H new ATOM 459 N LEU A 213 3.531 -0.112 -12.757 1.00 0.00 N ATOM 460 CA LEU A 213 3.375 -1.588 -12.792 1.00 0.00 C ATOM 461 C LEU A 213 4.480 -2.235 -11.982 1.00 0.00 C ATOM 462 O LEU A 213 5.308 -1.545 -11.421 1.00 0.00 O ATOM 463 CB LEU A 213 3.470 -1.942 -14.264 1.00 0.00 C ATOM 464 CG LEU A 213 2.328 -1.250 -15.019 1.00 0.00 C ATOM 465 CD1 LEU A 213 2.131 -1.925 -16.375 1.00 0.00 C ATOM 466 CD2 LEU A 213 1.029 -1.359 -14.203 1.00 0.00 C ATOM 0 H LEU A 213 4.299 0.263 -13.314 1.00 0.00 H new ATOM 0 HA LEU A 213 2.437 -1.937 -12.361 1.00 0.00 H new ATOM 0 HB2 LEU A 213 4.433 -1.626 -14.666 1.00 0.00 H new ATOM 0 HB3 LEU A 213 3.408 -3.022 -14.396 1.00 0.00 H new ATOM 0 HG LEU A 213 2.578 -0.199 -15.166 1.00 0.00 H new ATOM 0 HD11 LEU A 213 1.320 -1.433 -16.912 1.00 0.00 H new ATOM 0 HD12 LEU A 213 3.050 -1.848 -16.957 1.00 0.00 H new ATOM 0 HD13 LEU A 213 1.883 -2.976 -16.226 1.00 0.00 H new ATOM 0 HD21 LEU A 213 0.219 -0.867 -14.741 1.00 0.00 H new ATOM 0 HD22 LEU A 213 0.780 -2.410 -14.054 1.00 0.00 H new ATOM 0 HD23 LEU A 213 1.166 -0.878 -13.235 1.00 0.00 H new ATOM 478 N PRO A 214 4.460 -3.538 -11.899 1.00 0.00 N ATOM 479 CA PRO A 214 5.472 -4.212 -11.100 1.00 0.00 C ATOM 480 C PRO A 214 6.871 -4.006 -11.693 1.00 0.00 C ATOM 481 O PRO A 214 7.050 -3.269 -12.642 1.00 0.00 O ATOM 482 CB PRO A 214 5.038 -5.681 -11.147 1.00 0.00 C ATOM 483 CG PRO A 214 3.748 -5.774 -11.980 1.00 0.00 C ATOM 484 CD PRO A 214 3.454 -4.391 -12.571 1.00 0.00 C ATOM 0 HA PRO A 214 5.542 -3.831 -10.081 1.00 0.00 H new ATOM 0 HB2 PRO A 214 5.822 -6.295 -11.590 1.00 0.00 H new ATOM 0 HB3 PRO A 214 4.868 -6.060 -10.139 1.00 0.00 H new ATOM 0 HG2 PRO A 214 3.862 -6.510 -12.776 1.00 0.00 H new ATOM 0 HG3 PRO A 214 2.917 -6.105 -11.357 1.00 0.00 H new ATOM 0 HD2 PRO A 214 3.570 -4.379 -13.655 1.00 0.00 H new ATOM 0 HD3 PRO A 214 2.436 -4.065 -12.356 1.00 0.00 H new ATOM 662 N PHE A 225 4.305 -6.282 -7.482 1.00 0.00 N ATOM 663 CA PHE A 225 2.909 -5.728 -7.445 1.00 0.00 C ATOM 664 C PHE A 225 2.767 -4.672 -8.534 1.00 0.00 C ATOM 665 O PHE A 225 3.592 -4.553 -9.405 1.00 0.00 O ATOM 666 CB PHE A 225 2.746 -5.071 -6.066 1.00 0.00 C ATOM 667 CG PHE A 225 4.089 -4.601 -5.547 1.00 0.00 C ATOM 668 CD1 PHE A 225 4.926 -3.834 -6.367 1.00 0.00 C ATOM 669 CD2 PHE A 225 4.498 -4.938 -4.250 1.00 0.00 C ATOM 670 CE1 PHE A 225 6.170 -3.403 -5.890 1.00 0.00 C ATOM 671 CE2 PHE A 225 5.742 -4.508 -3.774 1.00 0.00 C ATOM 672 CZ PHE A 225 6.578 -3.740 -4.594 1.00 0.00 C ATOM 0 HA PHE A 225 2.158 -6.501 -7.608 1.00 0.00 H new ATOM 0 HB2 PHE A 225 2.060 -4.227 -6.136 1.00 0.00 H new ATOM 0 HB3 PHE A 225 2.306 -5.782 -5.366 1.00 0.00 H new ATOM 0 HD1 PHE A 225 4.612 -3.575 -7.367 1.00 0.00 H new ATOM 0 HD2 PHE A 225 3.853 -5.530 -3.617 1.00 0.00 H new ATOM 0 HE1 PHE A 225 6.815 -2.810 -6.522 1.00 0.00 H new ATOM 0 HE2 PHE A 225 6.057 -4.768 -2.774 1.00 0.00 H new ATOM 0 HZ PHE A 225 7.538 -3.408 -4.226 1.00 0.00 H new ATOM 682 N CYS A 226 1.742 -3.888 -8.478 1.00 0.00 N ATOM 683 CA CYS A 226 1.570 -2.822 -9.504 1.00 0.00 C ATOM 684 C CYS A 226 0.996 -1.566 -8.818 1.00 0.00 C ATOM 685 O CYS A 226 -0.107 -1.587 -8.307 1.00 0.00 O ATOM 686 CB CYS A 226 0.565 -3.374 -10.525 1.00 0.00 C ATOM 687 SG CYS A 226 -0.706 -4.376 -9.708 1.00 0.00 S ATOM 0 H CYS A 226 1.011 -3.933 -7.769 1.00 0.00 H new ATOM 0 HA CYS A 226 2.509 -2.553 -9.987 1.00 0.00 H new ATOM 0 HB2 CYS A 226 0.095 -2.549 -11.060 1.00 0.00 H new ATOM 0 HB3 CYS A 226 1.089 -3.978 -11.266 1.00 0.00 H new ATOM 0 HG CYS A 226 -1.848 -3.758 -9.765 1.00 0.00 H new ATOM 693 N PHE A 227 1.717 -0.475 -8.803 1.00 0.00 N ATOM 694 CA PHE A 227 1.176 0.763 -8.151 1.00 0.00 C ATOM 695 C PHE A 227 0.465 1.625 -9.195 1.00 0.00 C ATOM 696 O PHE A 227 0.201 1.201 -10.299 1.00 0.00 O ATOM 697 CB PHE A 227 2.386 1.548 -7.619 1.00 0.00 C ATOM 698 CG PHE A 227 2.957 0.928 -6.364 1.00 0.00 C ATOM 699 CD1 PHE A 227 3.351 -0.419 -6.334 1.00 0.00 C ATOM 700 CD2 PHE A 227 3.132 1.733 -5.230 1.00 0.00 C ATOM 701 CE1 PHE A 227 3.918 -0.951 -5.169 1.00 0.00 C ATOM 702 CE2 PHE A 227 3.689 1.194 -4.064 1.00 0.00 C ATOM 703 CZ PHE A 227 4.084 -0.147 -4.035 1.00 0.00 C ATOM 0 H PHE A 227 2.648 -0.384 -9.209 1.00 0.00 H new ATOM 0 HA PHE A 227 0.474 0.507 -7.358 1.00 0.00 H new ATOM 0 HB2 PHE A 227 3.158 1.588 -8.387 1.00 0.00 H new ATOM 0 HB3 PHE A 227 2.089 2.576 -7.412 1.00 0.00 H new ATOM 0 HD1 PHE A 227 3.217 -1.043 -7.206 1.00 0.00 H new ATOM 0 HD2 PHE A 227 2.836 2.771 -5.256 1.00 0.00 H new ATOM 0 HE1 PHE A 227 4.228 -1.985 -5.145 1.00 0.00 H new ATOM 0 HE2 PHE A 227 3.813 1.813 -3.188 1.00 0.00 H new ATOM 0 HZ PHE A 227 4.517 -0.563 -3.137 1.00 0.00 H new ATOM 713 N ILE A 228 0.197 2.849 -8.848 1.00 0.00 N ATOM 714 CA ILE A 228 -0.455 3.802 -9.791 1.00 0.00 C ATOM 715 C ILE A 228 -0.345 5.200 -9.166 1.00 0.00 C ATOM 716 O ILE A 228 -0.512 5.346 -7.971 1.00 0.00 O ATOM 717 CB ILE A 228 -1.923 3.366 -9.884 1.00 0.00 C ATOM 718 CG1 ILE A 228 -2.044 2.203 -10.884 1.00 0.00 C ATOM 719 CG2 ILE A 228 -2.774 4.554 -10.348 1.00 0.00 C ATOM 720 CD1 ILE A 228 -3.431 2.194 -11.534 1.00 0.00 C ATOM 0 H ILE A 228 0.406 3.240 -7.930 1.00 0.00 H new ATOM 0 HA ILE A 228 -0.002 3.815 -10.782 1.00 0.00 H new ATOM 0 HB ILE A 228 -2.277 3.034 -8.908 1.00 0.00 H new ATOM 0 HG12 ILE A 228 -1.277 2.296 -11.653 1.00 0.00 H new ATOM 0 HG13 ILE A 228 -1.870 1.256 -10.372 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -3.818 4.249 -10.416 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -2.680 5.371 -9.632 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -2.429 4.888 -11.327 1.00 0.00 H new ATOM 0 HD11 ILE A 228 -3.497 1.365 -12.238 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -4.193 2.078 -10.763 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -3.591 3.133 -12.064 1.00 0.00 H new ATOM 732 N THR A 229 -0.065 6.230 -9.918 1.00 0.00 N ATOM 733 CA THR A 229 0.044 7.568 -9.275 1.00 0.00 C ATOM 734 C THR A 229 -1.080 8.468 -9.750 1.00 0.00 C ATOM 735 O THR A 229 -1.522 8.391 -10.879 1.00 0.00 O ATOM 736 CB THR A 229 1.408 8.122 -9.694 1.00 0.00 C ATOM 737 OG1 THR A 229 1.726 9.247 -8.886 1.00 0.00 O ATOM 738 CG2 THR A 229 1.369 8.544 -11.162 1.00 0.00 C ATOM 0 H THR A 229 0.090 6.205 -10.926 1.00 0.00 H new ATOM 0 HA THR A 229 -0.038 7.508 -8.190 1.00 0.00 H new ATOM 0 HB THR A 229 2.166 7.350 -9.564 1.00 0.00 H new ATOM 0 HG1 THR A 229 2.600 9.603 -9.151 1.00 0.00 H new ATOM 0 HG21 THR A 229 2.343 8.937 -11.454 1.00 0.00 H new ATOM 0 HG22 THR A 229 1.126 7.681 -11.782 1.00 0.00 H new ATOM 0 HG23 THR A 229 0.611 9.315 -11.299 1.00 0.00 H new ATOM 746 N PHE A 230 -1.554 9.314 -8.892 1.00 0.00 N ATOM 747 CA PHE A 230 -2.672 10.214 -9.311 1.00 0.00 C ATOM 748 C PHE A 230 -2.209 11.669 -9.447 1.00 0.00 C ATOM 749 O PHE A 230 -1.297 11.971 -10.189 1.00 0.00 O ATOM 750 CB PHE A 230 -3.741 10.095 -8.231 1.00 0.00 C ATOM 751 CG PHE A 230 -4.287 8.683 -8.179 1.00 0.00 C ATOM 752 CD1 PHE A 230 -4.208 7.847 -9.304 1.00 0.00 C ATOM 753 CD2 PHE A 230 -4.880 8.210 -7.002 1.00 0.00 C ATOM 754 CE1 PHE A 230 -4.719 6.546 -9.245 1.00 0.00 C ATOM 755 CE2 PHE A 230 -5.390 6.909 -6.946 1.00 0.00 C ATOM 756 CZ PHE A 230 -5.310 6.076 -8.067 1.00 0.00 C ATOM 0 H PHE A 230 -1.229 9.428 -7.932 1.00 0.00 H new ATOM 0 HA PHE A 230 -3.051 9.921 -10.290 1.00 0.00 H new ATOM 0 HB2 PHE A 230 -3.320 10.364 -7.263 1.00 0.00 H new ATOM 0 HB3 PHE A 230 -4.550 10.797 -8.433 1.00 0.00 H new ATOM 0 HD1 PHE A 230 -3.753 8.208 -10.215 1.00 0.00 H new ATOM 0 HD2 PHE A 230 -4.944 8.851 -6.135 1.00 0.00 H new ATOM 0 HE1 PHE A 230 -4.657 5.903 -10.111 1.00 0.00 H new ATOM 0 HE2 PHE A 230 -5.846 6.547 -6.036 1.00 0.00 H new ATOM 0 HZ PHE A 230 -5.704 5.071 -8.023 1.00 0.00 H new ATOM 766 N LYS A 231 -2.859 12.582 -8.766 1.00 0.00 N ATOM 767 CA LYS A 231 -2.485 14.011 -8.895 1.00 0.00 C ATOM 768 C LYS A 231 -3.299 14.854 -7.906 1.00 0.00 C ATOM 769 O LYS A 231 -2.765 15.649 -7.160 1.00 0.00 O ATOM 770 CB LYS A 231 -2.871 14.342 -10.333 1.00 0.00 C ATOM 771 CG LYS A 231 -3.054 15.855 -10.493 1.00 0.00 C ATOM 772 CD LYS A 231 -3.572 16.164 -11.900 1.00 0.00 C ATOM 773 CE LYS A 231 -4.302 17.507 -11.892 1.00 0.00 C ATOM 774 NZ LYS A 231 -5.651 17.216 -12.452 1.00 0.00 N ATOM 0 H LYS A 231 -3.632 12.392 -8.128 1.00 0.00 H new ATOM 0 HA LYS A 231 -1.435 14.211 -8.681 1.00 0.00 H new ATOM 0 HB2 LYS A 231 -2.099 13.987 -11.016 1.00 0.00 H new ATOM 0 HB3 LYS A 231 -3.794 13.826 -10.598 1.00 0.00 H new ATOM 0 HG2 LYS A 231 -3.755 16.228 -9.746 1.00 0.00 H new ATOM 0 HG3 LYS A 231 -2.106 16.366 -10.323 1.00 0.00 H new ATOM 0 HD2 LYS A 231 -2.742 16.194 -12.606 1.00 0.00 H new ATOM 0 HD3 LYS A 231 -4.245 15.374 -12.233 1.00 0.00 H new ATOM 0 HE2 LYS A 231 -4.373 17.912 -10.882 1.00 0.00 H new ATOM 0 HE3 LYS A 231 -3.775 18.246 -12.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 -5.861 17.887 -13.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 -5.670 16.246 -12.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 -6.366 17.312 -11.703 1.00 0.00 H new ATOM 788 N GLU A 232 -4.593 14.677 -7.899 1.00 0.00 N ATOM 789 CA GLU A 232 -5.453 15.458 -6.960 1.00 0.00 C ATOM 790 C GLU A 232 -5.230 14.950 -5.538 1.00 0.00 C ATOM 791 O GLU A 232 -5.422 15.669 -4.578 1.00 0.00 O ATOM 792 CB GLU A 232 -6.899 15.193 -7.396 1.00 0.00 C ATOM 793 CG GLU A 232 -6.983 15.130 -8.922 1.00 0.00 C ATOM 794 CD GLU A 232 -8.417 15.419 -9.369 1.00 0.00 C ATOM 795 OE1 GLU A 232 -9.292 14.645 -9.018 1.00 0.00 O ATOM 796 OE2 GLU A 232 -8.615 16.407 -10.057 1.00 0.00 O ATOM 0 H GLU A 232 -5.093 14.025 -8.503 1.00 0.00 H new ATOM 0 HA GLU A 232 -5.224 16.523 -6.979 1.00 0.00 H new ATOM 0 HB2 GLU A 232 -7.251 14.256 -6.965 1.00 0.00 H new ATOM 0 HB3 GLU A 232 -7.551 15.981 -7.020 1.00 0.00 H new ATOM 0 HG2 GLU A 232 -6.300 15.856 -9.364 1.00 0.00 H new ATOM 0 HG3 GLU A 232 -6.673 14.146 -9.273 1.00 0.00 H new ATOM 803 N GLU A 233 -4.835 13.700 -5.428 1.00 0.00 N ATOM 804 CA GLU A 233 -4.569 13.039 -4.099 1.00 0.00 C ATOM 805 C GLU A 233 -5.893 12.420 -3.588 1.00 0.00 C ATOM 806 O GLU A 233 -5.928 11.450 -2.839 1.00 0.00 O ATOM 807 CB GLU A 233 -4.054 14.155 -3.156 1.00 0.00 C ATOM 808 CG GLU A 233 -5.177 14.668 -2.241 1.00 0.00 C ATOM 809 CD GLU A 233 -4.914 16.131 -1.879 1.00 0.00 C ATOM 810 OE1 GLU A 233 -4.407 16.849 -2.725 1.00 0.00 O ATOM 811 OE2 GLU A 233 -5.226 16.510 -0.762 1.00 0.00 O ATOM 0 H GLU A 233 -4.680 13.089 -6.230 1.00 0.00 H new ATOM 0 HA GLU A 233 -3.832 12.239 -4.160 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -3.233 13.773 -2.550 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -3.657 14.980 -3.747 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -6.140 14.574 -2.743 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -5.228 14.062 -1.336 1.00 0.00 H new ATOM 818 N GLU A 234 -6.987 13.002 -4.011 1.00 0.00 N ATOM 819 CA GLU A 234 -8.335 12.523 -3.601 1.00 0.00 C ATOM 820 C GLU A 234 -8.649 11.111 -4.123 1.00 0.00 C ATOM 821 O GLU A 234 -9.254 10.336 -3.410 1.00 0.00 O ATOM 822 CB GLU A 234 -9.306 13.536 -4.208 1.00 0.00 C ATOM 823 CG GLU A 234 -9.431 14.748 -3.283 1.00 0.00 C ATOM 824 CD GLU A 234 -10.822 15.368 -3.440 1.00 0.00 C ATOM 825 OE1 GLU A 234 -11.780 14.738 -3.025 1.00 0.00 O ATOM 826 OE2 GLU A 234 -10.903 16.463 -3.973 1.00 0.00 O ATOM 0 H GLU A 234 -6.998 13.807 -4.637 1.00 0.00 H new ATOM 0 HA GLU A 234 -8.406 12.452 -2.516 1.00 0.00 H new ATOM 0 HB2 GLU A 234 -8.952 13.851 -5.190 1.00 0.00 H new ATOM 0 HB3 GLU A 234 -10.283 13.075 -4.354 1.00 0.00 H new ATOM 0 HG2 GLU A 234 -9.270 14.447 -2.248 1.00 0.00 H new ATOM 0 HG3 GLU A 234 -8.664 15.484 -3.524 1.00 0.00 H new ATOM 833 N PRO A 235 -8.260 10.794 -5.344 1.00 0.00 N ATOM 834 CA PRO A 235 -8.568 9.451 -5.873 1.00 0.00 C ATOM 835 C PRO A 235 -8.033 8.387 -4.915 1.00 0.00 C ATOM 836 O PRO A 235 -8.553 7.292 -4.842 1.00 0.00 O ATOM 837 CB PRO A 235 -7.869 9.444 -7.233 1.00 0.00 C ATOM 838 CG PRO A 235 -7.196 10.813 -7.444 1.00 0.00 C ATOM 839 CD PRO A 235 -7.506 11.709 -6.236 1.00 0.00 C ATOM 0 HA PRO A 235 -9.631 9.232 -5.973 1.00 0.00 H new ATOM 0 HB2 PRO A 235 -7.127 8.647 -7.273 1.00 0.00 H new ATOM 0 HB3 PRO A 235 -8.589 9.249 -8.028 1.00 0.00 H new ATOM 0 HG2 PRO A 235 -6.119 10.691 -7.556 1.00 0.00 H new ATOM 0 HG3 PRO A 235 -7.561 11.276 -8.361 1.00 0.00 H new ATOM 0 HD2 PRO A 235 -6.597 12.080 -5.762 1.00 0.00 H new ATOM 0 HD3 PRO A 235 -8.098 12.580 -6.518 1.00 0.00 H new ATOM 847 N VAL A 236 -7.033 8.714 -4.138 1.00 0.00 N ATOM 848 CA VAL A 236 -6.529 7.723 -3.149 1.00 0.00 C ATOM 849 C VAL A 236 -7.442 7.769 -1.941 1.00 0.00 C ATOM 850 O VAL A 236 -7.806 6.757 -1.390 1.00 0.00 O ATOM 851 CB VAL A 236 -5.130 8.168 -2.746 1.00 0.00 C ATOM 852 CG1 VAL A 236 -4.736 7.483 -1.436 1.00 0.00 C ATOM 853 CG2 VAL A 236 -4.146 7.761 -3.823 1.00 0.00 C ATOM 0 H VAL A 236 -6.551 9.613 -4.146 1.00 0.00 H new ATOM 0 HA VAL A 236 -6.506 6.712 -3.556 1.00 0.00 H new ATOM 0 HB VAL A 236 -5.117 9.250 -2.618 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -3.734 7.801 -1.146 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -5.444 7.758 -0.654 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -4.748 6.402 -1.573 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -3.143 8.078 -3.538 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -4.164 6.678 -3.942 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -4.422 8.234 -4.765 1.00 0.00 H new ATOM 863 N LYS A 237 -7.826 8.947 -1.534 1.00 0.00 N ATOM 864 CA LYS A 237 -8.743 9.049 -0.362 1.00 0.00 C ATOM 865 C LYS A 237 -9.816 7.985 -0.501 1.00 0.00 C ATOM 866 O LYS A 237 -10.143 7.262 0.424 1.00 0.00 O ATOM 867 CB LYS A 237 -9.402 10.416 -0.471 1.00 0.00 C ATOM 868 CG LYS A 237 -9.212 11.189 0.836 1.00 0.00 C ATOM 869 CD LYS A 237 -7.982 12.090 0.722 1.00 0.00 C ATOM 870 CE LYS A 237 -8.282 13.448 1.363 1.00 0.00 C ATOM 871 NZ LYS A 237 -7.064 13.777 2.154 1.00 0.00 N ATOM 0 H LYS A 237 -7.549 9.834 -1.955 1.00 0.00 H new ATOM 0 HA LYS A 237 -8.219 8.920 0.585 1.00 0.00 H new ATOM 0 HB2 LYS A 237 -8.968 10.974 -1.301 1.00 0.00 H new ATOM 0 HB3 LYS A 237 -10.465 10.302 -0.685 1.00 0.00 H new ATOM 0 HG2 LYS A 237 -10.097 11.789 1.048 1.00 0.00 H new ATOM 0 HG3 LYS A 237 -9.091 10.494 1.667 1.00 0.00 H new ATOM 0 HD2 LYS A 237 -7.129 11.623 1.215 1.00 0.00 H new ATOM 0 HD3 LYS A 237 -7.711 12.222 -0.325 1.00 0.00 H new ATOM 0 HE2 LYS A 237 -8.478 14.207 0.606 1.00 0.00 H new ATOM 0 HE3 LYS A 237 -9.165 13.398 2.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 -7.193 14.696 2.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 -6.906 13.040 2.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 -6.241 13.825 1.520 1.00 0.00 H new ATOM 885 N LYS A 238 -10.354 7.887 -1.678 1.00 0.00 N ATOM 886 CA LYS A 238 -11.406 6.880 -1.924 1.00 0.00 C ATOM 887 C LYS A 238 -10.790 5.493 -1.956 1.00 0.00 C ATOM 888 O LYS A 238 -11.102 4.634 -1.155 1.00 0.00 O ATOM 889 CB LYS A 238 -11.977 7.204 -3.300 1.00 0.00 C ATOM 890 CG LYS A 238 -13.503 7.274 -3.223 1.00 0.00 C ATOM 891 CD LYS A 238 -13.923 8.576 -2.538 1.00 0.00 C ATOM 892 CE LYS A 238 -15.342 8.947 -2.973 1.00 0.00 C ATOM 893 NZ LYS A 238 -15.293 10.414 -3.228 1.00 0.00 N ATOM 0 H LYS A 238 -10.108 8.465 -2.482 1.00 0.00 H new ATOM 0 HA LYS A 238 -12.170 6.900 -1.146 1.00 0.00 H new ATOM 0 HB2 LYS A 238 -11.577 8.154 -3.655 1.00 0.00 H new ATOM 0 HB3 LYS A 238 -11.674 6.442 -4.018 1.00 0.00 H new ATOM 0 HG2 LYS A 238 -13.930 7.224 -4.224 1.00 0.00 H new ATOM 0 HG3 LYS A 238 -13.889 6.419 -2.668 1.00 0.00 H new ATOM 0 HD2 LYS A 238 -13.882 8.459 -1.455 1.00 0.00 H new ATOM 0 HD3 LYS A 238 -13.230 9.376 -2.799 1.00 0.00 H new ATOM 0 HE2 LYS A 238 -15.637 8.400 -3.869 1.00 0.00 H new ATOM 0 HE3 LYS A 238 -16.069 8.705 -2.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 238 -16.231 10.745 -3.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 238 -15.016 10.909 -2.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 238 -14.597 10.613 -3.975 1.00 0.00 H new ATOM 907 N ILE A 239 -9.915 5.273 -2.892 1.00 0.00 N ATOM 908 CA ILE A 239 -9.267 3.945 -3.002 1.00 0.00 C ATOM 909 C ILE A 239 -8.860 3.464 -1.610 1.00 0.00 C ATOM 910 O ILE A 239 -9.385 2.497 -1.097 1.00 0.00 O ATOM 911 CB ILE A 239 -8.042 4.169 -3.891 1.00 0.00 C ATOM 912 CG1 ILE A 239 -8.480 4.199 -5.357 1.00 0.00 C ATOM 913 CG2 ILE A 239 -7.039 3.031 -3.687 1.00 0.00 C ATOM 914 CD1 ILE A 239 -9.060 2.837 -5.744 1.00 0.00 C ATOM 0 H ILE A 239 -9.621 5.959 -3.587 1.00 0.00 H new ATOM 0 HA ILE A 239 -9.924 3.185 -3.424 1.00 0.00 H new ATOM 0 HB ILE A 239 -7.572 5.116 -3.626 1.00 0.00 H new ATOM 0 HG12 ILE A 239 -9.225 4.980 -5.509 1.00 0.00 H new ATOM 0 HG13 ILE A 239 -7.631 4.440 -5.997 1.00 0.00 H new ATOM 0 HG21 ILE A 239 -6.169 3.195 -4.322 1.00 0.00 H new ATOM 0 HG22 ILE A 239 -6.727 3.004 -2.643 1.00 0.00 H new ATOM 0 HG23 ILE A 239 -7.507 2.082 -3.950 1.00 0.00 H new ATOM 0 HD11 ILE A 239 -9.372 2.858 -6.788 1.00 0.00 H new ATOM 0 HD12 ILE A 239 -8.301 2.066 -5.607 1.00 0.00 H new ATOM 0 HD13 ILE A 239 -9.920 2.615 -5.113 1.00 0.00 H new ATOM 926 N MET A 240 -7.942 4.144 -0.984 1.00 0.00 N ATOM 927 CA MET A 240 -7.523 3.735 0.386 1.00 0.00 C ATOM 928 C MET A 240 -8.759 3.388 1.227 1.00 0.00 C ATOM 929 O MET A 240 -8.742 2.464 2.016 1.00 0.00 O ATOM 930 CB MET A 240 -6.805 4.957 0.960 1.00 0.00 C ATOM 931 CG MET A 240 -5.530 4.511 1.675 1.00 0.00 C ATOM 932 SD MET A 240 -5.758 4.658 3.465 1.00 0.00 S ATOM 933 CE MET A 240 -6.107 6.434 3.504 1.00 0.00 C ATOM 0 H MET A 240 -7.464 4.963 -1.360 1.00 0.00 H new ATOM 0 HA MET A 240 -6.881 2.854 0.382 1.00 0.00 H new ATOM 0 HB2 MET A 240 -6.560 5.657 0.161 1.00 0.00 H new ATOM 0 HB3 MET A 240 -7.459 5.483 1.655 1.00 0.00 H new ATOM 0 HG2 MET A 240 -5.294 3.480 1.411 1.00 0.00 H new ATOM 0 HG3 MET A 240 -4.687 5.123 1.354 1.00 0.00 H new ATOM 0 HE1 MET A 240 -5.628 6.880 4.376 1.00 0.00 H new ATOM 0 HE2 MET A 240 -5.720 6.901 2.598 1.00 0.00 H new ATOM 0 HE3 MET A 240 -7.184 6.592 3.561 1.00 0.00 H new ATOM 943 N GLU A 241 -9.834 4.119 1.063 1.00 0.00 N ATOM 944 CA GLU A 241 -11.069 3.823 1.855 1.00 0.00 C ATOM 945 C GLU A 241 -11.613 2.429 1.509 1.00 0.00 C ATOM 946 O GLU A 241 -12.509 1.924 2.155 1.00 0.00 O ATOM 947 CB GLU A 241 -12.072 4.902 1.444 1.00 0.00 C ATOM 948 CG GLU A 241 -13.225 4.935 2.449 1.00 0.00 C ATOM 949 CD GLU A 241 -13.741 6.368 2.590 1.00 0.00 C ATOM 950 OE1 GLU A 241 -13.049 7.168 3.199 1.00 0.00 O ATOM 951 OE2 GLU A 241 -14.817 6.641 2.086 1.00 0.00 O ATOM 0 H GLU A 241 -9.910 4.905 0.418 1.00 0.00 H new ATOM 0 HA GLU A 241 -10.875 3.828 2.928 1.00 0.00 H new ATOM 0 HB2 GLU A 241 -11.581 5.874 1.405 1.00 0.00 H new ATOM 0 HB3 GLU A 241 -12.453 4.697 0.444 1.00 0.00 H new ATOM 0 HG2 GLU A 241 -14.030 4.279 2.117 1.00 0.00 H new ATOM 0 HG3 GLU A 241 -12.889 4.562 3.416 1.00 0.00 H new ATOM 958 N LYS A 242 -11.072 1.804 0.499 1.00 0.00 N ATOM 959 CA LYS A 242 -11.542 0.443 0.109 1.00 0.00 C ATOM 960 C LYS A 242 -10.327 -0.440 -0.184 1.00 0.00 C ATOM 961 O LYS A 242 -10.222 -1.054 -1.226 1.00 0.00 O ATOM 962 CB LYS A 242 -12.384 0.652 -1.152 1.00 0.00 C ATOM 963 CG LYS A 242 -13.791 0.091 -0.928 1.00 0.00 C ATOM 964 CD LYS A 242 -14.644 1.124 -0.189 1.00 0.00 C ATOM 965 CE LYS A 242 -15.708 0.406 0.643 1.00 0.00 C ATOM 966 NZ LYS A 242 -16.879 0.264 -0.267 1.00 0.00 N ATOM 0 H LYS A 242 -10.319 2.180 -0.077 1.00 0.00 H new ATOM 0 HA LYS A 242 -12.122 -0.047 0.891 1.00 0.00 H new ATOM 0 HB2 LYS A 242 -12.439 1.714 -1.393 1.00 0.00 H new ATOM 0 HB3 LYS A 242 -11.915 0.156 -2.001 1.00 0.00 H new ATOM 0 HG2 LYS A 242 -14.251 -0.158 -1.884 1.00 0.00 H new ATOM 0 HG3 LYS A 242 -13.738 -0.832 -0.350 1.00 0.00 H new ATOM 0 HD2 LYS A 242 -14.014 1.736 0.457 1.00 0.00 H new ATOM 0 HD3 LYS A 242 -15.119 1.797 -0.903 1.00 0.00 H new ATOM 0 HE2 LYS A 242 -15.353 -0.567 0.983 1.00 0.00 H new ATOM 0 HE3 LYS A 242 -15.967 0.980 1.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 -17.651 -0.220 0.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 -17.200 1.206 -0.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 -16.605 -0.293 -1.101 1.00 0.00 H new ATOM 980 N LYS A 243 -9.406 -0.471 0.741 1.00 0.00 N ATOM 981 CA LYS A 243 -8.149 -1.274 0.590 1.00 0.00 C ATOM 982 C LYS A 243 -8.321 -2.488 -0.334 1.00 0.00 C ATOM 983 O LYS A 243 -7.415 -2.847 -1.059 1.00 0.00 O ATOM 984 CB LYS A 243 -7.820 -1.739 2.009 1.00 0.00 C ATOM 985 CG LYS A 243 -6.452 -2.425 2.019 1.00 0.00 C ATOM 986 CD LYS A 243 -6.396 -3.438 3.165 1.00 0.00 C ATOM 987 CE LYS A 243 -6.196 -2.699 4.491 1.00 0.00 C ATOM 988 NZ LYS A 243 -6.914 -3.520 5.507 1.00 0.00 N ATOM 0 H LYS A 243 -9.471 0.040 1.621 1.00 0.00 H new ATOM 0 HA LYS A 243 -7.361 -0.675 0.133 1.00 0.00 H new ATOM 0 HB2 LYS A 243 -7.816 -0.888 2.690 1.00 0.00 H new ATOM 0 HB3 LYS A 243 -8.586 -2.428 2.364 1.00 0.00 H new ATOM 0 HG2 LYS A 243 -6.278 -2.927 1.067 1.00 0.00 H new ATOM 0 HG3 LYS A 243 -5.662 -1.683 2.137 1.00 0.00 H new ATOM 0 HD2 LYS A 243 -7.318 -4.019 3.196 1.00 0.00 H new ATOM 0 HD3 LYS A 243 -5.580 -4.142 3.002 1.00 0.00 H new ATOM 0 HE2 LYS A 243 -5.138 -2.607 4.735 1.00 0.00 H new ATOM 0 HE3 LYS A 243 -6.601 -1.688 4.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 -6.821 -3.075 6.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 -7.920 -3.584 5.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 -6.503 -4.475 5.536 1.00 0.00 H new ATOM 1002 N TYR A 244 -9.450 -3.142 -0.315 1.00 0.00 N ATOM 1003 CA TYR A 244 -9.610 -4.335 -1.201 1.00 0.00 C ATOM 1004 C TYR A 244 -10.715 -4.078 -2.233 1.00 0.00 C ATOM 1005 O TYR A 244 -11.889 -4.175 -1.936 1.00 0.00 O ATOM 1006 CB TYR A 244 -9.997 -5.474 -0.256 1.00 0.00 C ATOM 1007 CG TYR A 244 -9.408 -6.773 -0.759 1.00 0.00 C ATOM 1008 CD1 TYR A 244 -8.054 -6.827 -1.109 1.00 0.00 C ATOM 1009 CD2 TYR A 244 -10.201 -7.925 -0.854 1.00 0.00 C ATOM 1010 CE1 TYR A 244 -7.493 -8.028 -1.558 1.00 0.00 C ATOM 1011 CE2 TYR A 244 -9.637 -9.126 -1.297 1.00 0.00 C ATOM 1012 CZ TYR A 244 -8.284 -9.177 -1.651 1.00 0.00 C ATOM 1013 OH TYR A 244 -7.729 -10.362 -2.089 1.00 0.00 O ATOM 0 H TYR A 244 -10.257 -2.910 0.264 1.00 0.00 H new ATOM 0 HA TYR A 244 -8.705 -4.566 -1.763 1.00 0.00 H new ATOM 0 HB2 TYR A 244 -9.634 -5.264 0.750 1.00 0.00 H new ATOM 0 HB3 TYR A 244 -11.082 -5.555 -0.193 1.00 0.00 H new ATOM 0 HD1 TYR A 244 -7.441 -5.941 -1.033 1.00 0.00 H new ATOM 0 HD2 TYR A 244 -11.246 -7.885 -0.585 1.00 0.00 H new ATOM 0 HE1 TYR A 244 -6.449 -8.067 -1.833 1.00 0.00 H new ATOM 0 HE2 TYR A 244 -10.246 -10.015 -1.366 1.00 0.00 H new ATOM 0 HH TYR A 244 -8.415 -11.062 -2.094 1.00 0.00 H new ATOM 1023 N HIS A 245 -10.348 -3.743 -3.445 1.00 0.00 N ATOM 1024 CA HIS A 245 -11.382 -3.471 -4.491 1.00 0.00 C ATOM 1025 C HIS A 245 -11.519 -4.663 -5.442 1.00 0.00 C ATOM 1026 O HIS A 245 -11.159 -5.778 -5.119 1.00 0.00 O ATOM 1027 CB HIS A 245 -10.878 -2.251 -5.270 1.00 0.00 C ATOM 1028 CG HIS A 245 -10.226 -1.261 -4.345 1.00 0.00 C ATOM 1029 ND1 HIS A 245 -9.008 -1.258 -3.709 1.00 0.00 N flip ATOM 1030 CD2 HIS A 245 -10.837 -0.069 -3.996 1.00 0.00 C flip ATOM 1031 CE1 HIS A 245 -8.864 -0.081 -2.981 1.00 0.00 C flip ATOM 1032 NE2 HIS A 245 -9.995 0.598 -3.189 1.00 0.00 N flip ATOM 0 H HIS A 245 -9.381 -3.646 -3.755 1.00 0.00 H new ATOM 0 HA HIS A 245 -12.359 -3.298 -4.040 1.00 0.00 H new ATOM 0 HB2 HIS A 245 -10.165 -2.569 -6.031 1.00 0.00 H new ATOM 0 HB3 HIS A 245 -11.710 -1.777 -5.790 1.00 0.00 H new ATOM 0 HD2 HIS A 245 -11.814 0.264 -4.315 1.00 0.00 H new ATOM 0 HE1 HIS A 245 -8.020 0.219 -2.378 1.00 0.00 H new ATOM 0 HE2 HIS A 245 -10.195 1.513 -2.784 1.00 0.00 H new ATOM 1040 N ASN A 246 -12.034 -4.425 -6.622 1.00 0.00 N ATOM 1041 CA ASN A 246 -12.196 -5.529 -7.613 1.00 0.00 C ATOM 1042 C ASN A 246 -11.821 -5.034 -9.013 1.00 0.00 C ATOM 1043 O ASN A 246 -11.992 -3.875 -9.335 1.00 0.00 O ATOM 1044 CB ASN A 246 -13.678 -5.900 -7.556 1.00 0.00 C ATOM 1045 CG ASN A 246 -13.816 -7.399 -7.284 1.00 0.00 C ATOM 1046 OD1 ASN A 246 -14.660 -7.815 -6.515 1.00 0.00 O ATOM 1047 ND2 ASN A 246 -13.017 -8.236 -7.888 1.00 0.00 N ATOM 0 H ASN A 246 -12.350 -3.509 -6.942 1.00 0.00 H new ATOM 0 HA ASN A 246 -11.555 -6.382 -7.392 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -14.177 -5.330 -6.773 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -14.165 -5.643 -8.497 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -13.102 -9.238 -7.714 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -12.308 -7.889 -8.534 1.00 0.00 H new ATOM 1054 N VAL A 247 -11.312 -5.899 -9.852 1.00 0.00 N ATOM 1055 CA VAL A 247 -10.932 -5.463 -11.227 1.00 0.00 C ATOM 1056 C VAL A 247 -11.229 -6.576 -12.235 1.00 0.00 C ATOM 1057 O VAL A 247 -10.747 -7.685 -12.109 1.00 0.00 O ATOM 1058 CB VAL A 247 -9.430 -5.188 -11.159 1.00 0.00 C ATOM 1059 CG1 VAL A 247 -8.867 -5.078 -12.578 1.00 0.00 C ATOM 1060 CG2 VAL A 247 -9.184 -3.874 -10.412 1.00 0.00 C ATOM 0 H VAL A 247 -11.144 -6.884 -9.645 1.00 0.00 H new ATOM 0 HA VAL A 247 -11.491 -4.584 -11.549 1.00 0.00 H new ATOM 0 HB VAL A 247 -8.936 -6.004 -10.632 1.00 0.00 H new ATOM 0 HG11 VAL A 247 -7.796 -4.882 -12.530 1.00 0.00 H new ATOM 0 HG12 VAL A 247 -9.041 -6.012 -13.112 1.00 0.00 H new ATOM 0 HG13 VAL A 247 -9.362 -4.262 -13.104 1.00 0.00 H new ATOM 0 HG21 VAL A 247 -8.113 -3.678 -10.364 1.00 0.00 H new ATOM 0 HG22 VAL A 247 -9.679 -3.058 -10.939 1.00 0.00 H new ATOM 0 HG23 VAL A 247 -9.585 -3.949 -9.401 1.00 0.00 H new ATOM 1070 N GLY A 248 -12.019 -6.290 -13.232 1.00 0.00 N ATOM 1071 CA GLY A 248 -12.346 -7.334 -14.245 1.00 0.00 C ATOM 1072 C GLY A 248 -12.808 -8.604 -13.531 1.00 0.00 C ATOM 1073 O GLY A 248 -13.967 -8.759 -13.203 1.00 0.00 O ATOM 0 H GLY A 248 -12.452 -5.380 -13.390 1.00 0.00 H new ATOM 0 HA2 GLY A 248 -13.127 -6.975 -14.915 1.00 0.00 H new ATOM 0 HA3 GLY A 248 -11.472 -7.547 -14.860 1.00 0.00 H new ATOM 1077 N LEU A 249 -11.906 -9.514 -13.285 1.00 0.00 N ATOM 1078 CA LEU A 249 -12.290 -10.775 -12.589 1.00 0.00 C ATOM 1079 C LEU A 249 -11.313 -11.063 -11.445 1.00 0.00 C ATOM 1080 O LEU A 249 -11.030 -12.202 -11.129 1.00 0.00 O ATOM 1081 CB LEU A 249 -12.202 -11.860 -13.663 1.00 0.00 C ATOM 1082 CG LEU A 249 -13.355 -12.849 -13.486 1.00 0.00 C ATOM 1083 CD1 LEU A 249 -14.079 -13.035 -14.820 1.00 0.00 C ATOM 1084 CD2 LEU A 249 -12.800 -14.196 -13.017 1.00 0.00 C ATOM 0 H LEU A 249 -10.920 -9.439 -13.536 1.00 0.00 H new ATOM 0 HA LEU A 249 -13.285 -10.721 -12.148 1.00 0.00 H new ATOM 0 HB2 LEU A 249 -12.245 -11.409 -14.655 1.00 0.00 H new ATOM 0 HB3 LEU A 249 -11.248 -12.381 -13.591 1.00 0.00 H new ATOM 0 HG LEU A 249 -14.054 -12.463 -12.745 1.00 0.00 H new ATOM 0 HD11 LEU A 249 -14.901 -13.740 -14.693 1.00 0.00 H new ATOM 0 HD12 LEU A 249 -14.473 -12.076 -15.157 1.00 0.00 H new ATOM 0 HD13 LEU A 249 -13.381 -13.422 -15.562 1.00 0.00 H new ATOM 0 HD21 LEU A 249 -13.620 -14.903 -12.890 1.00 0.00 H new ATOM 0 HD22 LEU A 249 -12.101 -14.580 -13.760 1.00 0.00 H new ATOM 0 HD23 LEU A 249 -12.283 -14.065 -12.066 1.00 0.00 H new ATOM 1096 N SER A 250 -10.798 -10.037 -10.821 1.00 0.00 N ATOM 1097 CA SER A 250 -9.841 -10.247 -9.696 1.00 0.00 C ATOM 1098 C SER A 250 -9.959 -9.092 -8.702 1.00 0.00 C ATOM 1099 O SER A 250 -10.385 -8.008 -9.050 1.00 0.00 O ATOM 1100 CB SER A 250 -8.459 -10.260 -10.349 1.00 0.00 C ATOM 1101 OG SER A 250 -8.420 -11.273 -11.345 1.00 0.00 O ATOM 0 H SER A 250 -10.999 -9.062 -11.042 1.00 0.00 H new ATOM 0 HA SER A 250 -10.033 -11.168 -9.145 1.00 0.00 H new ATOM 0 HB2 SER A 250 -8.245 -9.288 -10.794 1.00 0.00 H new ATOM 0 HB3 SER A 250 -7.691 -10.443 -9.598 1.00 0.00 H new ATOM 0 HG SER A 250 -7.536 -11.283 -11.767 1.00 0.00 H new ATOM 1107 N LYS A 251 -9.595 -9.306 -7.468 1.00 0.00 N ATOM 1108 CA LYS A 251 -9.706 -8.201 -6.476 1.00 0.00 C ATOM 1109 C LYS A 251 -8.341 -7.875 -5.859 1.00 0.00 C ATOM 1110 O LYS A 251 -8.176 -7.879 -4.655 1.00 0.00 O ATOM 1111 CB LYS A 251 -10.701 -8.706 -5.423 1.00 0.00 C ATOM 1112 CG LYS A 251 -9.996 -9.618 -4.418 1.00 0.00 C ATOM 1113 CD LYS A 251 -10.983 -10.669 -3.906 1.00 0.00 C ATOM 1114 CE LYS A 251 -10.330 -12.052 -3.960 1.00 0.00 C ATOM 1115 NZ LYS A 251 -10.671 -12.695 -2.658 1.00 0.00 N ATOM 0 H LYS A 251 -9.230 -10.187 -7.107 1.00 0.00 H new ATOM 0 HA LYS A 251 -10.048 -7.272 -6.933 1.00 0.00 H new ATOM 0 HB2 LYS A 251 -11.151 -7.860 -4.903 1.00 0.00 H new ATOM 0 HB3 LYS A 251 -11.512 -9.248 -5.910 1.00 0.00 H new ATOM 0 HG2 LYS A 251 -9.142 -10.104 -4.889 1.00 0.00 H new ATOM 0 HG3 LYS A 251 -9.609 -9.030 -3.586 1.00 0.00 H new ATOM 0 HD2 LYS A 251 -11.281 -10.436 -2.884 1.00 0.00 H new ATOM 0 HD3 LYS A 251 -11.889 -10.659 -4.513 1.00 0.00 H new ATOM 0 HE2 LYS A 251 -10.710 -12.635 -4.799 1.00 0.00 H new ATOM 0 HE3 LYS A 251 -9.251 -11.973 -4.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 251 -10.256 -13.648 -2.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 251 -10.290 -12.122 -1.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 251 -11.705 -12.763 -2.565 1.00 0.00 H new ATOM 1129 N CYS A 252 -7.371 -7.567 -6.682 1.00 0.00 N ATOM 1130 CA CYS A 252 -6.018 -7.207 -6.160 1.00 0.00 C ATOM 1131 C CYS A 252 -6.158 -6.396 -4.871 1.00 0.00 C ATOM 1132 O CYS A 252 -7.171 -5.769 -4.636 1.00 0.00 O ATOM 1133 CB CYS A 252 -5.403 -6.351 -7.263 1.00 0.00 C ATOM 1134 SG CYS A 252 -6.384 -4.844 -7.467 1.00 0.00 S ATOM 0 H CYS A 252 -7.459 -7.549 -7.698 1.00 0.00 H new ATOM 0 HA CYS A 252 -5.409 -8.080 -5.925 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -4.373 -6.097 -7.011 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -5.374 -6.909 -8.199 1.00 0.00 H new ATOM 0 HG CYS A 252 -7.196 -4.715 -6.460 1.00 0.00 H new ATOM 1140 N GLU A 253 -5.156 -6.381 -4.040 1.00 0.00 N ATOM 1141 CA GLU A 253 -5.276 -5.574 -2.789 1.00 0.00 C ATOM 1142 C GLU A 253 -4.808 -4.164 -3.067 1.00 0.00 C ATOM 1143 O GLU A 253 -4.309 -3.872 -4.132 1.00 0.00 O ATOM 1144 CB GLU A 253 -4.404 -6.220 -1.701 1.00 0.00 C ATOM 1145 CG GLU A 253 -3.209 -6.961 -2.307 1.00 0.00 C ATOM 1146 CD GLU A 253 -3.615 -8.397 -2.646 1.00 0.00 C ATOM 1147 OE1 GLU A 253 -3.634 -9.216 -1.742 1.00 0.00 O ATOM 1148 OE2 GLU A 253 -3.903 -8.653 -3.804 1.00 0.00 O ATOM 0 H GLU A 253 -4.275 -6.880 -4.165 1.00 0.00 H new ATOM 0 HA GLU A 253 -6.311 -5.544 -2.450 1.00 0.00 H new ATOM 0 HB2 GLU A 253 -4.047 -5.452 -1.015 1.00 0.00 H new ATOM 0 HB3 GLU A 253 -5.006 -6.915 -1.116 1.00 0.00 H new ATOM 0 HG2 GLU A 253 -2.867 -6.447 -3.205 1.00 0.00 H new ATOM 0 HG3 GLU A 253 -2.376 -6.964 -1.605 1.00 0.00 H new ATOM 1155 N ILE A 254 -4.980 -3.277 -2.137 1.00 0.00 N ATOM 1156 CA ILE A 254 -4.553 -1.878 -2.403 1.00 0.00 C ATOM 1157 C ILE A 254 -4.033 -1.181 -1.138 1.00 0.00 C ATOM 1158 O ILE A 254 -4.682 -1.137 -0.112 1.00 0.00 O ATOM 1159 CB ILE A 254 -5.809 -1.182 -2.963 1.00 0.00 C ATOM 1160 CG1 ILE A 254 -5.774 -1.237 -4.494 1.00 0.00 C ATOM 1161 CG2 ILE A 254 -5.860 0.287 -2.522 1.00 0.00 C ATOM 1162 CD1 ILE A 254 -6.357 -2.566 -4.978 1.00 0.00 C ATOM 0 H ILE A 254 -5.390 -3.451 -1.219 1.00 0.00 H new ATOM 0 HA ILE A 254 -3.718 -1.839 -3.103 1.00 0.00 H new ATOM 0 HB ILE A 254 -6.691 -1.697 -2.581 1.00 0.00 H new ATOM 0 HG12 ILE A 254 -6.344 -0.406 -4.910 1.00 0.00 H new ATOM 0 HG13 ILE A 254 -4.749 -1.129 -4.848 1.00 0.00 H new ATOM 0 HG21 ILE A 254 -6.755 0.758 -2.929 1.00 0.00 H new ATOM 0 HG22 ILE A 254 -5.885 0.339 -1.434 1.00 0.00 H new ATOM 0 HG23 ILE A 254 -4.976 0.808 -2.890 1.00 0.00 H new ATOM 0 HD11 ILE A 254 -6.330 -2.600 -6.067 1.00 0.00 H new ATOM 0 HD12 ILE A 254 -5.769 -3.390 -4.574 1.00 0.00 H new ATOM 0 HD13 ILE A 254 -7.389 -2.656 -4.638 1.00 0.00 H new ATOM 1174 N LYS A 255 -2.875 -0.597 -1.253 1.00 0.00 N ATOM 1175 CA LYS A 255 -2.265 0.166 -0.125 1.00 0.00 C ATOM 1176 C LYS A 255 -1.681 1.438 -0.724 1.00 0.00 C ATOM 1177 O LYS A 255 -0.686 1.399 -1.411 1.00 0.00 O ATOM 1178 CB LYS A 255 -1.155 -0.721 0.450 1.00 0.00 C ATOM 1179 CG LYS A 255 -1.633 -2.171 0.498 1.00 0.00 C ATOM 1180 CD LYS A 255 -2.894 -2.257 1.338 1.00 0.00 C ATOM 1181 CE LYS A 255 -2.597 -2.997 2.644 1.00 0.00 C ATOM 1182 NZ LYS A 255 -2.391 -1.924 3.655 1.00 0.00 N ATOM 0 H LYS A 255 -2.310 -0.616 -2.102 1.00 0.00 H new ATOM 0 HA LYS A 255 -2.975 0.424 0.661 1.00 0.00 H new ATOM 0 HB2 LYS A 255 -0.258 -0.643 -0.164 1.00 0.00 H new ATOM 0 HB3 LYS A 255 -0.886 -0.382 1.451 1.00 0.00 H new ATOM 0 HG2 LYS A 255 -1.829 -2.535 -0.511 1.00 0.00 H new ATOM 0 HG3 LYS A 255 -0.856 -2.808 0.921 1.00 0.00 H new ATOM 0 HD2 LYS A 255 -3.268 -1.256 1.553 1.00 0.00 H new ATOM 0 HD3 LYS A 255 -3.676 -2.777 0.784 1.00 0.00 H new ATOM 0 HE2 LYS A 255 -3.423 -3.650 2.924 1.00 0.00 H new ATOM 0 HE3 LYS A 255 -1.712 -3.626 2.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 255 -2.182 -2.353 4.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 255 -1.594 -1.322 3.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 255 -3.253 -1.346 3.728 1.00 0.00 H new ATOM 1196 N VAL A 256 -2.325 2.548 -0.523 1.00 0.00 N ATOM 1197 CA VAL A 256 -1.843 3.814 -1.141 1.00 0.00 C ATOM 1198 C VAL A 256 -0.313 3.896 -1.235 1.00 0.00 C ATOM 1199 O VAL A 256 0.414 3.212 -0.542 1.00 0.00 O ATOM 1200 CB VAL A 256 -2.379 4.927 -0.270 1.00 0.00 C ATOM 1201 CG1 VAL A 256 -2.041 4.659 1.198 1.00 0.00 C ATOM 1202 CG2 VAL A 256 -1.743 6.234 -0.726 1.00 0.00 C ATOM 0 H VAL A 256 -3.168 2.636 0.044 1.00 0.00 H new ATOM 0 HA VAL A 256 -2.195 3.881 -2.170 1.00 0.00 H new ATOM 0 HB VAL A 256 -3.464 4.985 -0.362 1.00 0.00 H new ATOM 0 HG11 VAL A 256 -2.432 5.468 1.815 1.00 0.00 H new ATOM 0 HG12 VAL A 256 -2.490 3.716 1.508 1.00 0.00 H new ATOM 0 HG13 VAL A 256 -0.959 4.602 1.318 1.00 0.00 H new ATOM 0 HG21 VAL A 256 -2.115 7.054 -0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 256 -0.660 6.167 -0.624 1.00 0.00 H new ATOM 0 HG23 VAL A 256 -1.998 6.418 -1.769 1.00 0.00 H new ATOM 1212 N ALA A 257 0.168 4.748 -2.103 1.00 0.00 N ATOM 1213 CA ALA A 257 1.632 4.917 -2.291 1.00 0.00 C ATOM 1214 C ALA A 257 1.952 6.394 -2.543 1.00 0.00 C ATOM 1215 O ALA A 257 1.129 7.146 -3.035 1.00 0.00 O ATOM 1216 CB ALA A 257 1.959 4.089 -3.534 1.00 0.00 C ATOM 0 H ALA A 257 -0.407 5.343 -2.699 1.00 0.00 H new ATOM 0 HA ALA A 257 2.207 4.601 -1.421 1.00 0.00 H new ATOM 0 HB1 ALA A 257 3.026 4.158 -3.747 1.00 0.00 H new ATOM 0 HB2 ALA A 257 1.690 3.047 -3.358 1.00 0.00 H new ATOM 0 HB3 ALA A 257 1.394 4.471 -4.384 1.00 0.00 H new