USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 598 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 134 MET CE :methyl 151:sc= -0.349 (180deg=-1.27!) USER MOD Single : A 135 SER OG : rot 180:sc= 0.109 USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 15:sc= -3.44! USER MOD Single : A 153 ASN : amide:sc= 0.342 X(o=0.34,f=0) USER MOD Single : A 154 MET CE :methyl -164:sc= -0.0248 (180deg=-0.476) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 159 ASN : amide:sc= -0.422 X(o=-0.42,f=-0.25) USER MOD Single : A 160 GLN : amide:sc= 0.309 K(o=0.31,f=-0.33) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc= -0.074 K(o=-0.074,f=-0.84) USER MOD Single : A 177 HIS : no HD1:sc=-0.00894 X(o=-0.0089,f=-0.11) USER MOD Single : A 178 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 179 CYS SG : rot 78:sc= 0.103 USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 74:sc= 0.679 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN : amide:sc= -0.0141 K(o=-0.014,f=-1) USER MOD Single : A 187 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot 65:sc= 0.862 USER MOD Single : A 192 THR OG1 : rot -95:sc= 1.24 USER MOD Single : A 193 THR OG1 : rot -77:sc= 1.26 USER MOD Single : A 194 LYS NZ :NH3+ 174:sc=-0.00748 (180deg=-0.0543) USER MOD Single : A 197 ASN : amide:sc= -0.0113 X(o=-0.011,f=0) USER MOD Single : A 199 THR OG1 : rot -170:sc= -0.217 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 206 MET CE :methyl -167:sc= -0.0023 (180deg=-0.249) USER MOD Single : A 212 GLN : amide:sc= -0.308 K(o=-0.31,f=-1.2) USER MOD Single : A 213 MET CE :methyl -170:sc= -1.57 (180deg=-2.18) USER MOD Single : A 214 CYS SG : rot -110:sc= -0.439 USER MOD Single : A 216 THR OG1 : rot 67:sc= 0.264 USER MOD Single : A 217 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 108 N ALA A 133 13.629 -10.214 -13.132 1.00 0.00 N ATOM 109 CA ALA A 133 14.293 -9.670 -14.310 1.00 0.00 C ATOM 110 C ALA A 133 13.520 -10.006 -15.580 1.00 0.00 C ATOM 111 O ALA A 133 12.591 -10.812 -15.558 1.00 0.00 O ATOM 112 CB ALA A 133 15.718 -10.196 -14.402 1.00 0.00 C ATOM 0 HA ALA A 133 14.323 -8.585 -14.211 1.00 0.00 H new ATOM 0 HB1 ALA A 133 16.202 -9.782 -15.286 1.00 0.00 H new ATOM 0 HB2 ALA A 133 16.273 -9.900 -13.512 1.00 0.00 H new ATOM 0 HB3 ALA A 133 15.700 -11.283 -14.474 1.00 0.00 H new ATOM 118 N MET A 134 13.910 -9.381 -16.687 1.00 0.00 N ATOM 119 CA MET A 134 13.253 -9.614 -17.968 1.00 0.00 C ATOM 120 C MET A 134 14.280 -9.848 -19.071 1.00 0.00 C ATOM 121 O MET A 134 15.476 -9.633 -18.874 1.00 0.00 O ATOM 122 CB MET A 134 12.358 -8.427 -18.330 1.00 0.00 C ATOM 123 CG MET A 134 11.327 -8.095 -17.264 1.00 0.00 C ATOM 124 SD MET A 134 11.925 -6.881 -16.073 1.00 0.00 S ATOM 125 CE MET A 134 12.201 -5.469 -17.139 1.00 0.00 C ATOM 0 H MET A 134 14.677 -8.710 -16.722 1.00 0.00 H new ATOM 0 HA MET A 134 12.637 -10.508 -17.875 1.00 0.00 H new ATOM 0 HB2 MET A 134 12.983 -7.551 -18.504 1.00 0.00 H new ATOM 0 HB3 MET A 134 11.844 -8.643 -19.266 1.00 0.00 H new ATOM 0 HG2 MET A 134 10.425 -7.714 -17.743 1.00 0.00 H new ATOM 0 HG3 MET A 134 11.048 -9.008 -16.737 1.00 0.00 H new ATOM 0 HE1 MET A 134 12.066 -4.550 -16.568 1.00 0.00 H new ATOM 0 HE2 MET A 134 13.216 -5.505 -17.535 1.00 0.00 H new ATOM 0 HE3 MET A 134 11.489 -5.491 -17.964 1.00 0.00 H new ATOM 135 N SER A 135 13.805 -10.289 -20.231 1.00 0.00 N ATOM 136 CA SER A 135 14.683 -10.556 -21.364 1.00 0.00 C ATOM 137 C SER A 135 15.389 -9.281 -21.816 1.00 0.00 C ATOM 138 O SER A 135 14.750 -8.332 -22.270 1.00 0.00 O ATOM 139 CB SER A 135 13.885 -11.150 -22.527 1.00 0.00 C ATOM 140 OG SER A 135 12.638 -11.656 -22.083 1.00 0.00 O ATOM 0 H SER A 135 12.817 -10.469 -20.411 1.00 0.00 H new ATOM 0 HA SER A 135 15.437 -11.276 -21.046 1.00 0.00 H new ATOM 0 HB2 SER A 135 13.721 -10.387 -23.288 1.00 0.00 H new ATOM 0 HB3 SER A 135 14.459 -11.949 -22.996 1.00 0.00 H new ATOM 0 HG SER A 135 12.146 -12.028 -22.844 1.00 0.00 H new ATOM 146 N ARG A 136 16.712 -9.268 -21.688 1.00 0.00 N ATOM 147 CA ARG A 136 17.506 -8.110 -22.082 1.00 0.00 C ATOM 148 C ARG A 136 18.810 -8.545 -22.744 1.00 0.00 C ATOM 149 O ARG A 136 19.892 -8.451 -22.164 1.00 0.00 O ATOM 150 CB ARG A 136 17.808 -7.235 -20.864 1.00 0.00 C ATOM 151 CG ARG A 136 18.583 -5.971 -21.200 1.00 0.00 C ATOM 152 CD ARG A 136 17.651 -4.825 -21.560 1.00 0.00 C ATOM 153 NE ARG A 136 16.911 -5.088 -22.792 1.00 0.00 N ATOM 154 CZ ARG A 136 17.434 -4.953 -24.006 1.00 0.00 C ATOM 155 NH1 ARG A 136 18.692 -4.562 -24.150 1.00 0.00 N ATOM 156 NH2 ARG A 136 16.697 -5.211 -25.079 1.00 0.00 N ATOM 0 H ARG A 136 17.256 -10.046 -21.315 1.00 0.00 H new ATOM 0 HA ARG A 136 16.928 -7.532 -22.803 1.00 0.00 H new ATOM 0 HB2 ARG A 136 16.869 -6.959 -20.384 1.00 0.00 H new ATOM 0 HB3 ARG A 136 18.377 -7.818 -20.140 1.00 0.00 H new ATOM 0 HG2 ARG A 136 19.201 -5.685 -20.349 1.00 0.00 H new ATOM 0 HG3 ARG A 136 19.258 -6.168 -22.033 1.00 0.00 H new ATOM 0 HD2 ARG A 136 16.948 -4.659 -20.743 1.00 0.00 H new ATOM 0 HD3 ARG A 136 18.230 -3.909 -21.674 1.00 0.00 H new ATOM 0 HE ARG A 136 15.940 -5.392 -22.716 1.00 0.00 H new ATOM 0 HH11 ARG A 136 19.262 -4.364 -23.328 1.00 0.00 H new ATOM 0 HH12 ARG A 136 19.091 -4.459 -25.083 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.729 -5.513 -24.972 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.099 -5.107 -26.011 1.00 0.00 H new ATOM 170 N PRO A 137 18.707 -9.034 -23.989 1.00 0.00 N ATOM 171 CA PRO A 137 19.867 -9.493 -24.758 1.00 0.00 C ATOM 172 C PRO A 137 20.775 -8.343 -25.180 1.00 0.00 C ATOM 173 O PRO A 137 20.599 -7.207 -24.739 1.00 0.00 O ATOM 174 CB PRO A 137 19.239 -10.157 -25.986 1.00 0.00 C ATOM 175 CG PRO A 137 17.912 -9.497 -26.136 1.00 0.00 C ATOM 176 CD PRO A 137 17.449 -9.176 -24.742 1.00 0.00 C ATOM 0 HA PRO A 137 20.504 -10.159 -24.176 1.00 0.00 H new ATOM 0 HB2 PRO A 137 19.856 -10.012 -26.873 1.00 0.00 H new ATOM 0 HB3 PRO A 137 19.133 -11.232 -25.844 1.00 0.00 H new ATOM 0 HG2 PRO A 137 17.992 -8.592 -26.739 1.00 0.00 H new ATOM 0 HG3 PRO A 137 17.204 -10.154 -26.641 1.00 0.00 H new ATOM 0 HD2 PRO A 137 16.859 -8.260 -24.715 1.00 0.00 H new ATOM 0 HD3 PRO A 137 16.824 -9.970 -24.334 1.00 0.00 H new ATOM 184 N ILE A 138 21.746 -8.645 -26.036 1.00 0.00 N ATOM 185 CA ILE A 138 22.680 -7.635 -26.518 1.00 0.00 C ATOM 186 C ILE A 138 21.940 -6.419 -27.066 1.00 0.00 C ATOM 187 O ILE A 138 21.008 -6.553 -27.859 1.00 0.00 O ATOM 188 CB ILE A 138 23.601 -8.199 -27.615 1.00 0.00 C ATOM 189 CG1 ILE A 138 24.384 -9.403 -27.086 1.00 0.00 C ATOM 190 CG2 ILE A 138 24.552 -7.121 -28.114 1.00 0.00 C ATOM 191 CD1 ILE A 138 23.798 -10.734 -27.502 1.00 0.00 C ATOM 0 H ILE A 138 21.906 -9.580 -26.410 1.00 0.00 H new ATOM 0 HA ILE A 138 23.287 -7.333 -25.665 1.00 0.00 H new ATOM 0 HB ILE A 138 22.985 -8.529 -28.451 1.00 0.00 H new ATOM 0 HG12 ILE A 138 25.413 -9.341 -27.440 1.00 0.00 H new ATOM 0 HG13 ILE A 138 24.418 -9.354 -25.998 1.00 0.00 H new ATOM 0 HG21 ILE A 138 25.197 -7.535 -28.889 1.00 0.00 H new ATOM 0 HG22 ILE A 138 23.978 -6.291 -28.525 1.00 0.00 H new ATOM 0 HG23 ILE A 138 25.164 -6.764 -27.286 1.00 0.00 H new ATOM 0 HD11 ILE A 138 24.403 -11.542 -27.092 1.00 0.00 H new ATOM 0 HD12 ILE A 138 22.779 -10.817 -27.125 1.00 0.00 H new ATOM 0 HD13 ILE A 138 23.789 -10.804 -28.590 1.00 0.00 H new ATOM 203 N ILE A 139 22.364 -5.234 -26.639 1.00 0.00 N ATOM 204 CA ILE A 139 21.743 -3.994 -27.090 1.00 0.00 C ATOM 205 C ILE A 139 22.519 -3.382 -28.252 1.00 0.00 C ATOM 206 O ILE A 139 23.730 -3.567 -28.369 1.00 0.00 O ATOM 207 CB ILE A 139 21.652 -2.964 -25.949 1.00 0.00 C ATOM 208 CG1 ILE A 139 20.788 -1.775 -26.374 1.00 0.00 C ATOM 209 CG2 ILE A 139 23.042 -2.497 -25.545 1.00 0.00 C ATOM 210 CD1 ILE A 139 19.897 -1.250 -25.270 1.00 0.00 C ATOM 0 H ILE A 139 23.134 -5.106 -25.982 1.00 0.00 H new ATOM 0 HA ILE A 139 20.736 -4.247 -27.422 1.00 0.00 H new ATOM 0 HB ILE A 139 21.185 -3.439 -25.087 1.00 0.00 H new ATOM 0 HG12 ILE A 139 21.437 -0.970 -26.720 1.00 0.00 H new ATOM 0 HG13 ILE A 139 20.168 -2.071 -27.220 1.00 0.00 H new ATOM 0 HG21 ILE A 139 22.961 -1.769 -24.738 1.00 0.00 H new ATOM 0 HG22 ILE A 139 23.629 -3.351 -25.206 1.00 0.00 H new ATOM 0 HG23 ILE A 139 23.534 -2.036 -26.401 1.00 0.00 H new ATOM 0 HD11 ILE A 139 19.314 -0.408 -25.643 1.00 0.00 H new ATOM 0 HD12 ILE A 139 19.223 -2.040 -24.939 1.00 0.00 H new ATOM 0 HD13 ILE A 139 20.511 -0.923 -24.431 1.00 0.00 H new ATOM 222 N HIS A 140 21.811 -2.652 -29.108 1.00 0.00 N ATOM 223 CA HIS A 140 22.434 -2.010 -30.261 1.00 0.00 C ATOM 224 C HIS A 140 23.644 -1.184 -29.835 1.00 0.00 C ATOM 225 O HIS A 140 23.501 -0.119 -29.234 1.00 0.00 O ATOM 226 CB HIS A 140 21.422 -1.119 -30.982 1.00 0.00 C ATOM 227 CG HIS A 140 20.532 -1.867 -31.926 1.00 0.00 C ATOM 228 ND1 HIS A 140 20.150 -1.369 -33.155 1.00 0.00 N ATOM 229 CD2 HIS A 140 19.948 -3.083 -31.817 1.00 0.00 C ATOM 230 CE1 HIS A 140 19.369 -2.247 -33.759 1.00 0.00 C ATOM 231 NE2 HIS A 140 19.231 -3.296 -32.969 1.00 0.00 N ATOM 0 H HIS A 140 20.807 -2.490 -29.026 1.00 0.00 H new ATOM 0 HA HIS A 140 22.771 -2.791 -30.943 1.00 0.00 H new ATOM 0 HB2 HIS A 140 20.806 -0.610 -30.241 1.00 0.00 H new ATOM 0 HB3 HIS A 140 21.958 -0.348 -31.535 1.00 0.00 H new ATOM 0 HD2 HIS A 140 20.030 -3.760 -30.980 1.00 0.00 H new ATOM 0 HE1 HIS A 140 18.920 -2.127 -34.734 1.00 0.00 H new ATOM 0 HE2 HIS A 140 18.681 -4.129 -33.180 1.00 0.00 H new ATOM 239 N PHE A 141 24.835 -1.683 -30.150 1.00 0.00 N ATOM 240 CA PHE A 141 26.070 -0.993 -29.799 1.00 0.00 C ATOM 241 C PHE A 141 26.060 0.441 -30.322 1.00 0.00 C ATOM 242 O PHE A 141 25.987 1.395 -29.549 1.00 0.00 O ATOM 243 CB PHE A 141 27.278 -1.744 -30.362 1.00 0.00 C ATOM 244 CG PHE A 141 27.274 -3.212 -30.040 1.00 0.00 C ATOM 245 CD1 PHE A 141 27.413 -3.648 -28.733 1.00 0.00 C ATOM 246 CD2 PHE A 141 27.131 -4.155 -31.045 1.00 0.00 C ATOM 247 CE1 PHE A 141 27.411 -4.997 -28.434 1.00 0.00 C ATOM 248 CE2 PHE A 141 27.128 -5.505 -30.753 1.00 0.00 C ATOM 249 CZ PHE A 141 27.267 -5.927 -29.445 1.00 0.00 C ATOM 0 H PHE A 141 24.970 -2.563 -30.648 1.00 0.00 H new ATOM 0 HA PHE A 141 26.143 -0.965 -28.712 1.00 0.00 H new ATOM 0 HB2 PHE A 141 27.302 -1.618 -31.444 1.00 0.00 H new ATOM 0 HB3 PHE A 141 28.190 -1.296 -29.968 1.00 0.00 H new ATOM 0 HD1 PHE A 141 27.524 -2.925 -27.938 1.00 0.00 H new ATOM 0 HD2 PHE A 141 27.021 -3.831 -32.069 1.00 0.00 H new ATOM 0 HE1 PHE A 141 27.522 -5.324 -27.411 1.00 0.00 H new ATOM 0 HE2 PHE A 141 27.017 -6.230 -31.546 1.00 0.00 H new ATOM 0 HZ PHE A 141 27.263 -6.982 -29.213 1.00 0.00 H new ATOM 259 N GLY A 142 26.133 0.583 -31.642 1.00 0.00 N ATOM 260 CA GLY A 142 26.132 1.902 -32.247 1.00 0.00 C ATOM 261 C GLY A 142 27.515 2.339 -32.689 1.00 0.00 C ATOM 262 O GLY A 142 27.653 3.234 -33.522 1.00 0.00 O ATOM 0 H GLY A 142 26.193 -0.192 -32.303 1.00 0.00 H new ATOM 0 HA2 GLY A 142 25.462 1.903 -33.107 1.00 0.00 H new ATOM 0 HA3 GLY A 142 25.737 2.625 -31.534 1.00 0.00 H new ATOM 266 N SER A 143 28.541 1.708 -32.127 1.00 0.00 N ATOM 267 CA SER A 143 29.920 2.040 -32.464 1.00 0.00 C ATOM 268 C SER A 143 30.834 0.835 -32.264 1.00 0.00 C ATOM 269 O SER A 143 30.787 0.172 -31.227 1.00 0.00 O ATOM 270 CB SER A 143 30.407 3.212 -31.610 1.00 0.00 C ATOM 271 OG SER A 143 31.366 3.988 -32.309 1.00 0.00 O ATOM 0 H SER A 143 28.443 0.964 -31.436 1.00 0.00 H new ATOM 0 HA SER A 143 29.952 2.327 -33.515 1.00 0.00 H new ATOM 0 HB2 SER A 143 29.560 3.839 -31.331 1.00 0.00 H new ATOM 0 HB3 SER A 143 30.843 2.835 -30.685 1.00 0.00 H new ATOM 0 HG SER A 143 31.660 4.732 -31.743 1.00 0.00 H new ATOM 277 N ASP A 144 31.664 0.558 -33.263 1.00 0.00 N ATOM 278 CA ASP A 144 32.591 -0.567 -33.197 1.00 0.00 C ATOM 279 C ASP A 144 33.638 -0.345 -32.110 1.00 0.00 C ATOM 280 O ASP A 144 34.095 -1.294 -31.472 1.00 0.00 O ATOM 281 CB ASP A 144 33.276 -0.770 -34.549 1.00 0.00 C ATOM 282 CG ASP A 144 33.085 -2.174 -35.089 1.00 0.00 C ATOM 283 OD1 ASP A 144 31.926 -2.555 -35.355 1.00 0.00 O ATOM 284 OD2 ASP A 144 34.095 -2.892 -35.245 1.00 0.00 O ATOM 0 H ASP A 144 31.715 1.096 -34.128 1.00 0.00 H new ATOM 0 HA ASP A 144 32.021 -1.462 -32.949 1.00 0.00 H new ATOM 0 HB2 ASP A 144 32.879 -0.051 -35.266 1.00 0.00 H new ATOM 0 HB3 ASP A 144 34.342 -0.564 -34.448 1.00 0.00 H new ATOM 289 N TYR A 145 34.014 0.912 -31.906 1.00 0.00 N ATOM 290 CA TYR A 145 35.010 1.258 -30.899 1.00 0.00 C ATOM 291 C TYR A 145 34.443 1.093 -29.492 1.00 0.00 C ATOM 292 O TYR A 145 35.098 0.543 -28.608 1.00 0.00 O ATOM 293 CB TYR A 145 35.493 2.695 -31.101 1.00 0.00 C ATOM 294 CG TYR A 145 35.939 2.991 -32.515 1.00 0.00 C ATOM 295 CD1 TYR A 145 37.233 2.703 -32.931 1.00 0.00 C ATOM 296 CD2 TYR A 145 35.066 3.557 -33.436 1.00 0.00 C ATOM 297 CE1 TYR A 145 37.645 2.972 -34.222 1.00 0.00 C ATOM 298 CE2 TYR A 145 35.468 3.828 -34.729 1.00 0.00 C ATOM 299 CZ TYR A 145 36.759 3.534 -35.118 1.00 0.00 C ATOM 300 OH TYR A 145 37.165 3.803 -36.405 1.00 0.00 O ATOM 0 H TYR A 145 33.644 1.709 -32.425 1.00 0.00 H new ATOM 0 HA TYR A 145 35.855 0.579 -31.013 1.00 0.00 H new ATOM 0 HB2 TYR A 145 34.690 3.381 -30.831 1.00 0.00 H new ATOM 0 HB3 TYR A 145 36.321 2.890 -30.419 1.00 0.00 H new ATOM 0 HD1 TYR A 145 37.929 2.261 -32.233 1.00 0.00 H new ATOM 0 HD2 TYR A 145 34.055 3.789 -33.135 1.00 0.00 H new ATOM 0 HE1 TYR A 145 38.655 2.744 -34.528 1.00 0.00 H new ATOM 0 HE2 TYR A 145 34.776 4.268 -35.432 1.00 0.00 H new ATOM 0 HH TYR A 145 36.421 4.196 -36.907 1.00 0.00 H new ATOM 310 N GLU A 146 33.220 1.575 -29.295 1.00 0.00 N ATOM 311 CA GLU A 146 32.563 1.482 -27.996 1.00 0.00 C ATOM 312 C GLU A 146 32.148 0.044 -27.698 1.00 0.00 C ATOM 313 O GLU A 146 32.097 -0.372 -26.541 1.00 0.00 O ATOM 314 CB GLU A 146 31.339 2.398 -27.951 1.00 0.00 C ATOM 315 CG GLU A 146 31.685 3.878 -27.974 1.00 0.00 C ATOM 316 CD GLU A 146 30.830 4.691 -27.022 1.00 0.00 C ATOM 317 OE1 GLU A 146 29.589 4.643 -27.151 1.00 0.00 O ATOM 318 OE2 GLU A 146 31.402 5.376 -26.148 1.00 0.00 O ATOM 0 H GLU A 146 32.664 2.033 -30.017 1.00 0.00 H new ATOM 0 HA GLU A 146 33.274 1.802 -27.234 1.00 0.00 H new ATOM 0 HB2 GLU A 146 30.694 2.171 -28.800 1.00 0.00 H new ATOM 0 HB3 GLU A 146 30.766 2.181 -27.049 1.00 0.00 H new ATOM 0 HG2 GLU A 146 32.735 4.006 -27.713 1.00 0.00 H new ATOM 0 HG3 GLU A 146 31.560 4.261 -28.987 1.00 0.00 H new ATOM 325 N ASP A 147 31.851 -0.709 -28.752 1.00 0.00 N ATOM 326 CA ASP A 147 31.439 -2.101 -28.605 1.00 0.00 C ATOM 327 C ASP A 147 32.495 -2.903 -27.851 1.00 0.00 C ATOM 328 O ASP A 147 32.173 -3.845 -27.127 1.00 0.00 O ATOM 329 CB ASP A 147 31.188 -2.728 -29.977 1.00 0.00 C ATOM 330 CG ASP A 147 31.111 -4.241 -29.916 1.00 0.00 C ATOM 331 OD1 ASP A 147 30.217 -4.762 -29.218 1.00 0.00 O ATOM 332 OD2 ASP A 147 31.946 -4.904 -30.567 1.00 0.00 O ATOM 0 H ASP A 147 31.888 -0.379 -29.717 1.00 0.00 H new ATOM 0 HA ASP A 147 30.513 -2.122 -28.030 1.00 0.00 H new ATOM 0 HB2 ASP A 147 30.258 -2.336 -30.388 1.00 0.00 H new ATOM 0 HB3 ASP A 147 31.986 -2.435 -30.659 1.00 0.00 H new ATOM 337 N ARG A 148 33.757 -2.523 -28.026 1.00 0.00 N ATOM 338 CA ARG A 148 34.860 -3.209 -27.364 1.00 0.00 C ATOM 339 C ARG A 148 34.782 -3.029 -25.851 1.00 0.00 C ATOM 340 O ARG A 148 34.846 -4.000 -25.097 1.00 0.00 O ATOM 341 CB ARG A 148 36.200 -2.682 -27.883 1.00 0.00 C ATOM 342 CG ARG A 148 36.534 -3.148 -29.290 1.00 0.00 C ATOM 343 CD ARG A 148 37.248 -2.064 -30.081 1.00 0.00 C ATOM 344 NE ARG A 148 38.666 -1.983 -29.742 1.00 0.00 N ATOM 345 CZ ARG A 148 39.583 -2.821 -30.212 1.00 0.00 C ATOM 346 NH1 ARG A 148 39.232 -3.798 -31.037 1.00 0.00 N ATOM 347 NH2 ARG A 148 40.854 -2.683 -29.857 1.00 0.00 N ATOM 0 H ARG A 148 34.041 -1.744 -28.620 1.00 0.00 H new ATOM 0 HA ARG A 148 34.783 -4.272 -27.590 1.00 0.00 H new ATOM 0 HB2 ARG A 148 36.184 -1.592 -27.865 1.00 0.00 H new ATOM 0 HB3 ARG A 148 36.993 -3.001 -27.206 1.00 0.00 H new ATOM 0 HG2 ARG A 148 37.162 -4.037 -29.240 1.00 0.00 H new ATOM 0 HG3 ARG A 148 35.618 -3.433 -29.807 1.00 0.00 H new ATOM 0 HD2 ARG A 148 37.141 -2.263 -31.147 1.00 0.00 H new ATOM 0 HD3 ARG A 148 36.774 -1.102 -29.887 1.00 0.00 H new ATOM 0 HE ARG A 148 38.969 -1.242 -29.110 1.00 0.00 H new ATOM 0 HH11 ARG A 148 38.256 -3.907 -31.312 1.00 0.00 H new ATOM 0 HH12 ARG A 148 39.938 -4.440 -31.397 1.00 0.00 H new ATOM 0 HH21 ARG A 148 41.128 -1.933 -29.222 1.00 0.00 H new ATOM 0 HH22 ARG A 148 41.557 -3.327 -30.219 1.00 0.00 H new ATOM 361 N TYR A 149 34.644 -1.782 -25.415 1.00 0.00 N ATOM 362 CA TYR A 149 34.561 -1.475 -23.992 1.00 0.00 C ATOM 363 C TYR A 149 33.221 -1.923 -23.416 1.00 0.00 C ATOM 364 O TYR A 149 33.122 -2.263 -22.236 1.00 0.00 O ATOM 365 CB TYR A 149 34.752 0.025 -23.760 1.00 0.00 C ATOM 366 CG TYR A 149 35.384 0.356 -22.427 1.00 0.00 C ATOM 367 CD1 TYR A 149 36.714 0.044 -22.170 1.00 0.00 C ATOM 368 CD2 TYR A 149 34.652 0.979 -21.424 1.00 0.00 C ATOM 369 CE1 TYR A 149 37.295 0.344 -20.954 1.00 0.00 C ATOM 370 CE2 TYR A 149 35.226 1.284 -20.205 1.00 0.00 C ATOM 371 CZ TYR A 149 36.547 0.964 -19.975 1.00 0.00 C ATOM 372 OH TYR A 149 37.122 1.265 -18.761 1.00 0.00 O ATOM 0 H TYR A 149 34.587 -0.967 -26.026 1.00 0.00 H new ATOM 0 HA TYR A 149 35.356 -2.019 -23.482 1.00 0.00 H new ATOM 0 HB2 TYR A 149 35.373 0.431 -24.558 1.00 0.00 H new ATOM 0 HB3 TYR A 149 33.783 0.521 -23.826 1.00 0.00 H new ATOM 0 HD1 TYR A 149 37.303 -0.441 -22.934 1.00 0.00 H new ATOM 0 HD2 TYR A 149 33.616 1.229 -21.600 1.00 0.00 H new ATOM 0 HE1 TYR A 149 38.330 0.095 -20.770 1.00 0.00 H new ATOM 0 HE2 TYR A 149 34.643 1.770 -19.437 1.00 0.00 H new ATOM 0 HH TYR A 149 36.460 1.700 -18.184 1.00 0.00 H new ATOM 382 N TYR A 150 32.193 -1.922 -24.257 1.00 0.00 N ATOM 383 CA TYR A 150 30.858 -2.327 -23.833 1.00 0.00 C ATOM 384 C TYR A 150 30.829 -3.807 -23.464 1.00 0.00 C ATOM 385 O TYR A 150 29.999 -4.243 -22.665 1.00 0.00 O ATOM 386 CB TYR A 150 29.841 -2.045 -24.940 1.00 0.00 C ATOM 387 CG TYR A 150 28.472 -2.625 -24.666 1.00 0.00 C ATOM 388 CD1 TYR A 150 27.704 -2.171 -23.601 1.00 0.00 C ATOM 389 CD2 TYR A 150 27.945 -3.626 -25.473 1.00 0.00 C ATOM 390 CE1 TYR A 150 26.452 -2.698 -23.346 1.00 0.00 C ATOM 391 CE2 TYR A 150 26.694 -4.158 -25.227 1.00 0.00 C ATOM 392 CZ TYR A 150 25.952 -3.691 -24.163 1.00 0.00 C ATOM 393 OH TYR A 150 24.705 -4.218 -23.913 1.00 0.00 O ATOM 0 H TYR A 150 32.258 -1.645 -25.237 1.00 0.00 H new ATOM 0 HA TYR A 150 30.593 -1.746 -22.949 1.00 0.00 H new ATOM 0 HB2 TYR A 150 29.750 -0.967 -25.072 1.00 0.00 H new ATOM 0 HB3 TYR A 150 30.217 -2.451 -25.879 1.00 0.00 H new ATOM 0 HD1 TYR A 150 28.092 -1.392 -22.961 1.00 0.00 H new ATOM 0 HD2 TYR A 150 28.524 -3.995 -26.307 1.00 0.00 H new ATOM 0 HE1 TYR A 150 25.869 -2.335 -22.513 1.00 0.00 H new ATOM 0 HE2 TYR A 150 26.299 -4.935 -25.865 1.00 0.00 H new ATOM 0 HH TYR A 150 24.221 -3.633 -23.293 1.00 0.00 H new ATOM 403 N ARG A 151 31.741 -4.575 -24.051 1.00 0.00 N ATOM 404 CA ARG A 151 31.820 -6.006 -23.786 1.00 0.00 C ATOM 405 C ARG A 151 31.907 -6.277 -22.287 1.00 0.00 C ATOM 406 O ARG A 151 31.409 -7.292 -21.801 1.00 0.00 O ATOM 407 CB ARG A 151 33.033 -6.611 -24.495 1.00 0.00 C ATOM 408 CG ARG A 151 32.718 -7.885 -25.262 1.00 0.00 C ATOM 409 CD ARG A 151 32.148 -7.580 -26.638 1.00 0.00 C ATOM 410 NE ARG A 151 30.961 -8.380 -26.929 1.00 0.00 N ATOM 411 CZ ARG A 151 30.992 -9.692 -27.136 1.00 0.00 C ATOM 412 NH1 ARG A 151 32.143 -10.347 -27.084 1.00 0.00 N ATOM 413 NH2 ARG A 151 29.870 -10.350 -27.395 1.00 0.00 N ATOM 0 H ARG A 151 32.436 -4.230 -24.713 1.00 0.00 H new ATOM 0 HA ARG A 151 30.913 -6.472 -24.170 1.00 0.00 H new ATOM 0 HB2 ARG A 151 33.445 -5.874 -25.185 1.00 0.00 H new ATOM 0 HB3 ARG A 151 33.806 -6.823 -23.757 1.00 0.00 H new ATOM 0 HG2 ARG A 151 33.624 -8.482 -25.366 1.00 0.00 H new ATOM 0 HG3 ARG A 151 32.005 -8.485 -24.696 1.00 0.00 H new ATOM 0 HD2 ARG A 151 31.895 -6.521 -26.699 1.00 0.00 H new ATOM 0 HD3 ARG A 151 32.908 -7.771 -27.396 1.00 0.00 H new ATOM 0 HE ARG A 151 30.059 -7.906 -26.976 1.00 0.00 H new ATOM 0 HH11 ARG A 151 33.008 -9.844 -26.885 1.00 0.00 H new ATOM 0 HH12 ARG A 151 32.164 -11.354 -27.243 1.00 0.00 H new ATOM 0 HH21 ARG A 151 28.983 -9.849 -27.435 1.00 0.00 H new ATOM 0 HH22 ARG A 151 29.895 -11.357 -27.554 1.00 0.00 H new ATOM 427 N GLU A 152 32.542 -5.362 -21.561 1.00 0.00 N ATOM 428 CA GLU A 152 32.694 -5.504 -20.117 1.00 0.00 C ATOM 429 C GLU A 152 31.525 -4.857 -19.381 1.00 0.00 C ATOM 430 O GLU A 152 31.218 -5.216 -18.245 1.00 0.00 O ATOM 431 CB GLU A 152 34.011 -4.877 -19.657 1.00 0.00 C ATOM 432 CG GLU A 152 35.227 -5.394 -20.408 1.00 0.00 C ATOM 433 CD GLU A 152 36.304 -5.922 -19.481 1.00 0.00 C ATOM 434 OE1 GLU A 152 36.037 -6.904 -18.758 1.00 0.00 O ATOM 435 OE2 GLU A 152 37.416 -5.351 -19.478 1.00 0.00 O ATOM 0 H GLU A 152 32.959 -4.516 -21.948 1.00 0.00 H new ATOM 0 HA GLU A 152 32.705 -6.568 -19.881 1.00 0.00 H new ATOM 0 HB2 GLU A 152 33.951 -3.796 -19.780 1.00 0.00 H new ATOM 0 HB3 GLU A 152 34.143 -5.070 -18.592 1.00 0.00 H new ATOM 0 HG2 GLU A 152 34.919 -6.187 -21.089 1.00 0.00 H new ATOM 0 HG3 GLU A 152 35.640 -4.592 -21.019 1.00 0.00 H new ATOM 442 N ASN A 153 30.877 -3.899 -20.036 1.00 0.00 N ATOM 443 CA ASN A 153 29.742 -3.200 -19.444 1.00 0.00 C ATOM 444 C ASN A 153 28.486 -4.065 -19.489 1.00 0.00 C ATOM 445 O ASN A 153 27.650 -4.011 -18.588 1.00 0.00 O ATOM 446 CB ASN A 153 29.492 -1.880 -20.175 1.00 0.00 C ATOM 447 CG ASN A 153 30.438 -0.782 -19.727 1.00 0.00 C ATOM 448 OD1 ASN A 153 30.024 0.190 -19.096 1.00 0.00 O ATOM 449 ND2 ASN A 153 31.717 -0.934 -20.053 1.00 0.00 N ATOM 0 H ASN A 153 31.119 -3.589 -20.977 1.00 0.00 H new ATOM 0 HA ASN A 153 29.980 -2.991 -18.401 1.00 0.00 H new ATOM 0 HB2 ASN A 153 29.603 -2.036 -21.248 1.00 0.00 H new ATOM 0 HB3 ASN A 153 28.464 -1.562 -20.003 1.00 0.00 H new ATOM 0 HD21 ASN A 153 32.400 -0.228 -19.779 1.00 0.00 H new ATOM 0 HD22 ASN A 153 32.015 -1.757 -20.577 1.00 0.00 H new ATOM 456 N MET A 154 28.362 -4.863 -20.545 1.00 0.00 N ATOM 457 CA MET A 154 27.209 -5.742 -20.707 1.00 0.00 C ATOM 458 C MET A 154 27.042 -6.648 -19.492 1.00 0.00 C ATOM 459 O MET A 154 25.925 -7.028 -19.137 1.00 0.00 O ATOM 460 CB MET A 154 27.359 -6.588 -21.972 1.00 0.00 C ATOM 461 CG MET A 154 28.350 -7.731 -21.825 1.00 0.00 C ATOM 462 SD MET A 154 28.970 -8.322 -23.412 1.00 0.00 S ATOM 463 CE MET A 154 27.452 -8.401 -24.360 1.00 0.00 C ATOM 0 H MET A 154 29.045 -4.919 -21.301 1.00 0.00 H new ATOM 0 HA MET A 154 26.319 -5.119 -20.799 1.00 0.00 H new ATOM 0 HB2 MET A 154 26.385 -6.995 -22.244 1.00 0.00 H new ATOM 0 HB3 MET A 154 27.677 -5.946 -22.793 1.00 0.00 H new ATOM 0 HG2 MET A 154 29.189 -7.403 -21.211 1.00 0.00 H new ATOM 0 HG3 MET A 154 27.872 -8.556 -21.296 1.00 0.00 H new ATOM 0 HE1 MET A 154 27.612 -9.006 -25.253 1.00 0.00 H new ATOM 0 HE2 MET A 154 26.667 -8.851 -23.752 1.00 0.00 H new ATOM 0 HE3 MET A 154 27.153 -7.394 -24.653 1.00 0.00 H new ATOM 473 N HIS A 155 28.158 -6.992 -18.857 1.00 0.00 N ATOM 474 CA HIS A 155 28.134 -7.855 -17.681 1.00 0.00 C ATOM 475 C HIS A 155 27.571 -7.111 -16.473 1.00 0.00 C ATOM 476 O HIS A 155 27.041 -7.725 -15.546 1.00 0.00 O ATOM 477 CB HIS A 155 29.541 -8.366 -17.369 1.00 0.00 C ATOM 478 CG HIS A 155 29.746 -9.807 -17.722 1.00 0.00 C ATOM 479 ND1 HIS A 155 29.889 -10.801 -16.777 1.00 0.00 N ATOM 480 CD2 HIS A 155 29.831 -10.420 -18.926 1.00 0.00 C ATOM 481 CE1 HIS A 155 30.054 -11.962 -17.384 1.00 0.00 C ATOM 482 NE2 HIS A 155 30.023 -11.758 -18.689 1.00 0.00 N ATOM 0 H HIS A 155 29.090 -6.687 -19.137 1.00 0.00 H new ATOM 0 HA HIS A 155 27.486 -8.705 -17.897 1.00 0.00 H new ATOM 0 HB2 HIS A 155 30.267 -7.761 -17.911 1.00 0.00 H new ATOM 0 HB3 HIS A 155 29.741 -8.229 -16.306 1.00 0.00 H new ATOM 0 HD2 HIS A 155 29.761 -9.945 -19.893 1.00 0.00 H new ATOM 0 HE1 HIS A 155 30.191 -12.916 -16.897 1.00 0.00 H new ATOM 0 HE2 HIS A 155 30.125 -12.478 -19.404 1.00 0.00 H new ATOM 490 N ARG A 156 27.689 -5.788 -16.491 1.00 0.00 N ATOM 491 CA ARG A 156 27.193 -4.961 -15.397 1.00 0.00 C ATOM 492 C ARG A 156 25.985 -4.141 -15.839 1.00 0.00 C ATOM 493 O ARG A 156 25.570 -3.208 -15.152 1.00 0.00 O ATOM 494 CB ARG A 156 28.297 -4.031 -14.892 1.00 0.00 C ATOM 495 CG ARG A 156 29.180 -4.656 -13.825 1.00 0.00 C ATOM 496 CD ARG A 156 30.483 -3.889 -13.659 1.00 0.00 C ATOM 497 NE ARG A 156 31.474 -4.272 -14.660 1.00 0.00 N ATOM 498 CZ ARG A 156 32.659 -3.685 -14.783 1.00 0.00 C ATOM 499 NH1 ARG A 156 32.998 -2.692 -13.972 1.00 0.00 N ATOM 500 NH2 ARG A 156 33.508 -4.090 -15.719 1.00 0.00 N ATOM 0 H ARG A 156 28.124 -5.265 -17.251 1.00 0.00 H new ATOM 0 HA ARG A 156 26.885 -5.622 -14.587 1.00 0.00 H new ATOM 0 HB2 ARG A 156 28.919 -3.728 -15.735 1.00 0.00 H new ATOM 0 HB3 ARG A 156 27.842 -3.126 -14.490 1.00 0.00 H new ATOM 0 HG2 ARG A 156 28.645 -4.677 -12.875 1.00 0.00 H new ATOM 0 HG3 ARG A 156 29.397 -5.690 -14.091 1.00 0.00 H new ATOM 0 HD2 ARG A 156 30.286 -2.820 -13.734 1.00 0.00 H new ATOM 0 HD3 ARG A 156 30.886 -4.070 -12.662 1.00 0.00 H new ATOM 0 HE ARG A 156 31.244 -5.032 -15.300 1.00 0.00 H new ATOM 0 HH11 ARG A 156 32.348 -2.377 -13.252 1.00 0.00 H new ATOM 0 HH12 ARG A 156 33.909 -2.243 -14.069 1.00 0.00 H new ATOM 0 HH21 ARG A 156 33.251 -4.853 -16.345 1.00 0.00 H new ATOM 0 HH22 ARG A 156 34.418 -3.638 -15.812 1.00 0.00 H new ATOM 514 N TYR A 157 25.424 -4.497 -16.990 1.00 0.00 N ATOM 515 CA TYR A 157 24.266 -3.792 -17.526 1.00 0.00 C ATOM 516 C TYR A 157 23.161 -3.687 -16.479 1.00 0.00 C ATOM 517 O TYR A 157 23.058 -4.502 -15.562 1.00 0.00 O ATOM 518 CB TYR A 157 23.738 -4.508 -18.770 1.00 0.00 C ATOM 519 CG TYR A 157 22.903 -5.730 -18.458 1.00 0.00 C ATOM 520 CD1 TYR A 157 23.421 -6.775 -17.704 1.00 0.00 C ATOM 521 CD2 TYR A 157 21.596 -5.838 -18.917 1.00 0.00 C ATOM 522 CE1 TYR A 157 22.663 -7.893 -17.417 1.00 0.00 C ATOM 523 CE2 TYR A 157 20.830 -6.952 -18.634 1.00 0.00 C ATOM 524 CZ TYR A 157 21.367 -7.977 -17.884 1.00 0.00 C ATOM 525 OH TYR A 157 20.608 -9.088 -17.599 1.00 0.00 O ATOM 0 H TYR A 157 25.753 -5.270 -17.569 1.00 0.00 H new ATOM 0 HA TYR A 157 24.580 -2.785 -17.800 1.00 0.00 H new ATOM 0 HB2 TYR A 157 23.140 -3.809 -19.354 1.00 0.00 H new ATOM 0 HB3 TYR A 157 24.581 -4.804 -19.394 1.00 0.00 H new ATOM 0 HD1 TYR A 157 24.434 -6.712 -17.336 1.00 0.00 H new ATOM 0 HD2 TYR A 157 21.172 -5.037 -19.505 1.00 0.00 H new ATOM 0 HE1 TYR A 157 23.082 -8.697 -16.830 1.00 0.00 H new ATOM 0 HE2 TYR A 157 19.816 -7.020 -18.998 1.00 0.00 H new ATOM 0 HH TYR A 157 19.719 -8.989 -18.000 1.00 0.00 H new ATOM 535 N PRO A 158 22.312 -2.657 -16.618 1.00 0.00 N ATOM 536 CA PRO A 158 21.198 -2.419 -15.695 1.00 0.00 C ATOM 537 C PRO A 158 20.101 -3.469 -15.829 1.00 0.00 C ATOM 538 O PRO A 158 19.630 -3.752 -16.930 1.00 0.00 O ATOM 539 CB PRO A 158 20.676 -1.043 -16.116 1.00 0.00 C ATOM 540 CG PRO A 158 21.071 -0.910 -17.546 1.00 0.00 C ATOM 541 CD PRO A 158 22.375 -1.646 -17.687 1.00 0.00 C ATOM 0 HA PRO A 158 21.514 -2.469 -14.653 1.00 0.00 H new ATOM 0 HB2 PRO A 158 19.595 -0.976 -15.996 1.00 0.00 H new ATOM 0 HB3 PRO A 158 21.114 -0.251 -15.509 1.00 0.00 H new ATOM 0 HG2 PRO A 158 20.311 -1.334 -18.202 1.00 0.00 H new ATOM 0 HG3 PRO A 158 21.183 0.138 -17.824 1.00 0.00 H new ATOM 0 HD2 PRO A 158 22.473 -2.106 -18.670 1.00 0.00 H new ATOM 0 HD3 PRO A 158 23.228 -0.980 -17.561 1.00 0.00 H new ATOM 549 N ASN A 159 19.696 -4.043 -14.700 1.00 0.00 N ATOM 550 CA ASN A 159 18.653 -5.063 -14.692 1.00 0.00 C ATOM 551 C ASN A 159 17.565 -4.719 -13.680 1.00 0.00 C ATOM 552 O ASN A 159 16.906 -5.606 -13.138 1.00 0.00 O ATOM 553 CB ASN A 159 19.253 -6.433 -14.368 1.00 0.00 C ATOM 554 CG ASN A 159 19.505 -6.617 -12.884 1.00 0.00 C ATOM 555 OD1 ASN A 159 20.377 -5.969 -12.306 1.00 0.00 O ATOM 556 ND2 ASN A 159 18.740 -7.506 -12.261 1.00 0.00 N ATOM 0 H ASN A 159 20.074 -3.819 -13.779 1.00 0.00 H new ATOM 0 HA ASN A 159 18.204 -5.097 -15.685 1.00 0.00 H new ATOM 0 HB2 ASN A 159 18.579 -7.214 -14.719 1.00 0.00 H new ATOM 0 HB3 ASN A 159 20.191 -6.554 -14.911 1.00 0.00 H new ATOM 0 HD21 ASN A 159 18.863 -7.674 -11.263 1.00 0.00 H new ATOM 0 HD22 ASN A 159 18.029 -8.020 -12.781 1.00 0.00 H new ATOM 563 N GLN A 160 17.382 -3.427 -13.431 1.00 0.00 N ATOM 564 CA GLN A 160 16.373 -2.966 -12.484 1.00 0.00 C ATOM 565 C GLN A 160 15.841 -1.593 -12.881 1.00 0.00 C ATOM 566 O GLN A 160 16.611 -0.669 -13.141 1.00 0.00 O ATOM 567 CB GLN A 160 16.957 -2.912 -11.071 1.00 0.00 C ATOM 568 CG GLN A 160 16.822 -4.218 -10.306 1.00 0.00 C ATOM 569 CD GLN A 160 15.386 -4.696 -10.217 1.00 0.00 C ATOM 570 OE1 GLN A 160 14.599 -4.189 -9.417 1.00 0.00 O ATOM 571 NE2 GLN A 160 15.036 -5.677 -11.041 1.00 0.00 N ATOM 0 H GLN A 160 17.919 -2.680 -13.872 1.00 0.00 H new ATOM 0 HA GLN A 160 15.545 -3.674 -12.500 1.00 0.00 H new ATOM 0 HB2 GLN A 160 18.012 -2.644 -11.133 1.00 0.00 H new ATOM 0 HB3 GLN A 160 16.460 -2.120 -10.511 1.00 0.00 H new ATOM 0 HG2 GLN A 160 17.426 -4.984 -10.792 1.00 0.00 H new ATOM 0 HG3 GLN A 160 17.221 -4.088 -9.300 1.00 0.00 H new ATOM 0 HE21 GLN A 160 15.721 -6.068 -11.688 1.00 0.00 H new ATOM 0 HE22 GLN A 160 14.083 -6.039 -11.027 1.00 0.00 H new ATOM 580 N VAL A 161 14.518 -1.467 -12.925 1.00 0.00 N ATOM 581 CA VAL A 161 13.883 -0.207 -13.290 1.00 0.00 C ATOM 582 C VAL A 161 12.890 0.237 -12.221 1.00 0.00 C ATOM 583 O VAL A 161 12.086 -0.560 -11.737 1.00 0.00 O ATOM 584 CB VAL A 161 13.151 -0.317 -14.641 1.00 0.00 C ATOM 585 CG1 VAL A 161 14.147 -0.519 -15.772 1.00 0.00 C ATOM 586 CG2 VAL A 161 12.135 -1.448 -14.605 1.00 0.00 C ATOM 0 H VAL A 161 13.866 -2.222 -12.712 1.00 0.00 H new ATOM 0 HA VAL A 161 14.677 0.535 -13.376 1.00 0.00 H new ATOM 0 HB VAL A 161 12.616 0.615 -14.823 1.00 0.00 H new ATOM 0 HG11 VAL A 161 13.612 -0.595 -16.719 1.00 0.00 H new ATOM 0 HG12 VAL A 161 14.832 0.328 -15.809 1.00 0.00 H new ATOM 0 HG13 VAL A 161 14.712 -1.435 -15.600 1.00 0.00 H new ATOM 0 HG21 VAL A 161 11.627 -1.512 -15.567 1.00 0.00 H new ATOM 0 HG22 VAL A 161 12.645 -2.389 -14.401 1.00 0.00 H new ATOM 0 HG23 VAL A 161 11.403 -1.255 -13.821 1.00 0.00 H new ATOM 596 N TYR A 162 12.951 1.513 -11.858 1.00 0.00 N ATOM 597 CA TYR A 162 12.058 2.063 -10.845 1.00 0.00 C ATOM 598 C TYR A 162 11.176 3.160 -11.433 1.00 0.00 C ATOM 599 O TYR A 162 11.652 4.032 -12.161 1.00 0.00 O ATOM 600 CB TYR A 162 12.866 2.618 -9.670 1.00 0.00 C ATOM 601 CG TYR A 162 13.658 1.565 -8.929 1.00 0.00 C ATOM 602 CD1 TYR A 162 14.942 1.221 -9.332 1.00 0.00 C ATOM 603 CD2 TYR A 162 13.122 0.914 -7.825 1.00 0.00 C ATOM 604 CE1 TYR A 162 15.669 0.259 -8.658 1.00 0.00 C ATOM 605 CE2 TYR A 162 13.842 -0.048 -7.144 1.00 0.00 C ATOM 606 CZ TYR A 162 15.115 -0.372 -7.564 1.00 0.00 C ATOM 607 OH TYR A 162 15.835 -1.331 -6.890 1.00 0.00 O ATOM 0 H TYR A 162 13.609 2.186 -12.250 1.00 0.00 H new ATOM 0 HA TYR A 162 11.416 1.258 -10.488 1.00 0.00 H new ATOM 0 HB2 TYR A 162 13.550 3.382 -10.039 1.00 0.00 H new ATOM 0 HB3 TYR A 162 12.187 3.108 -8.972 1.00 0.00 H new ATOM 0 HD1 TYR A 162 15.380 1.714 -10.187 1.00 0.00 H new ATOM 0 HD2 TYR A 162 12.125 1.164 -7.494 1.00 0.00 H new ATOM 0 HE1 TYR A 162 16.666 0.003 -8.986 1.00 0.00 H new ATOM 0 HE2 TYR A 162 13.410 -0.544 -6.287 1.00 0.00 H new ATOM 0 HH TYR A 162 15.302 -1.676 -6.144 1.00 0.00 H new ATOM 797 N ASN A 174 6.358 9.615 -23.641 1.00 0.00 N ATOM 798 CA ASN A 174 7.164 10.443 -22.753 1.00 0.00 C ATOM 799 C ASN A 174 7.499 9.696 -21.466 1.00 0.00 C ATOM 800 O ASN A 174 8.613 9.792 -20.950 1.00 0.00 O ATOM 801 CB ASN A 174 6.426 11.743 -22.424 1.00 0.00 C ATOM 802 CG ASN A 174 6.955 12.924 -23.214 1.00 0.00 C ATOM 803 OD1 ASN A 174 7.502 12.761 -24.305 1.00 0.00 O ATOM 804 ND2 ASN A 174 6.795 14.123 -22.665 1.00 0.00 N ATOM 0 HA ASN A 174 8.096 10.681 -23.266 1.00 0.00 H new ATOM 0 HB2 ASN A 174 5.363 11.617 -22.632 1.00 0.00 H new ATOM 0 HB3 ASN A 174 6.520 11.951 -21.358 1.00 0.00 H new ATOM 0 HD21 ASN A 174 7.131 14.955 -23.150 1.00 0.00 H new ATOM 0 HD22 ASN A 174 6.336 14.212 -21.759 1.00 0.00 H new ATOM 811 N PHE A 175 6.526 8.950 -20.952 1.00 0.00 N ATOM 812 CA PHE A 175 6.716 8.185 -19.725 1.00 0.00 C ATOM 813 C PHE A 175 7.868 7.195 -19.874 1.00 0.00 C ATOM 814 O PHE A 175 8.639 6.977 -18.940 1.00 0.00 O ATOM 815 CB PHE A 175 5.431 7.439 -19.359 1.00 0.00 C ATOM 816 CG PHE A 175 4.742 7.993 -18.145 1.00 0.00 C ATOM 817 CD1 PHE A 175 4.419 9.338 -18.068 1.00 0.00 C ATOM 818 CD2 PHE A 175 4.417 7.168 -17.080 1.00 0.00 C ATOM 819 CE1 PHE A 175 3.785 9.851 -16.952 1.00 0.00 C ATOM 820 CE2 PHE A 175 3.782 7.675 -15.962 1.00 0.00 C ATOM 821 CZ PHE A 175 3.467 9.018 -15.897 1.00 0.00 C ATOM 0 H PHE A 175 5.598 8.859 -21.366 1.00 0.00 H new ATOM 0 HA PHE A 175 6.962 8.884 -18.925 1.00 0.00 H new ATOM 0 HB2 PHE A 175 4.745 7.476 -20.205 1.00 0.00 H new ATOM 0 HB3 PHE A 175 5.667 6.389 -19.186 1.00 0.00 H new ATOM 0 HD1 PHE A 175 4.666 9.994 -18.890 1.00 0.00 H new ATOM 0 HD2 PHE A 175 4.663 6.117 -17.124 1.00 0.00 H new ATOM 0 HE1 PHE A 175 3.539 10.901 -16.905 1.00 0.00 H new ATOM 0 HE2 PHE A 175 3.532 7.021 -15.140 1.00 0.00 H new ATOM 0 HZ PHE A 175 2.973 9.416 -15.023 1.00 0.00 H new ATOM 831 N VAL A 176 7.976 6.597 -21.056 1.00 0.00 N ATOM 832 CA VAL A 176 9.032 5.629 -21.329 1.00 0.00 C ATOM 833 C VAL A 176 10.409 6.233 -21.075 1.00 0.00 C ATOM 834 O VAL A 176 11.219 5.669 -20.338 1.00 0.00 O ATOM 835 CB VAL A 176 8.967 5.122 -22.782 1.00 0.00 C ATOM 836 CG1 VAL A 176 10.060 4.096 -23.039 1.00 0.00 C ATOM 837 CG2 VAL A 176 7.594 4.538 -23.081 1.00 0.00 C ATOM 0 H VAL A 176 7.345 6.766 -21.840 1.00 0.00 H new ATOM 0 HA VAL A 176 8.875 4.790 -20.652 1.00 0.00 H new ATOM 0 HB VAL A 176 9.131 5.967 -23.451 1.00 0.00 H new ATOM 0 HG11 VAL A 176 9.998 3.749 -24.071 1.00 0.00 H new ATOM 0 HG12 VAL A 176 11.035 4.552 -22.867 1.00 0.00 H new ATOM 0 HG13 VAL A 176 9.931 3.250 -22.364 1.00 0.00 H new ATOM 0 HG21 VAL A 176 7.566 4.185 -24.112 1.00 0.00 H new ATOM 0 HG22 VAL A 176 7.398 3.705 -22.406 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.833 5.306 -22.940 1.00 0.00 H new ATOM 847 N HIS A 177 10.668 7.383 -21.689 1.00 0.00 N ATOM 848 CA HIS A 177 11.948 8.064 -21.528 1.00 0.00 C ATOM 849 C HIS A 177 12.127 8.552 -20.093 1.00 0.00 C ATOM 850 O HIS A 177 13.220 8.476 -19.534 1.00 0.00 O ATOM 851 CB HIS A 177 12.046 9.244 -22.495 1.00 0.00 C ATOM 852 CG HIS A 177 12.008 8.841 -23.937 1.00 0.00 C ATOM 853 ND1 HIS A 177 12.590 7.684 -24.411 1.00 0.00 N ATOM 854 CD2 HIS A 177 11.451 9.447 -25.012 1.00 0.00 C ATOM 855 CE1 HIS A 177 12.394 7.597 -25.714 1.00 0.00 C ATOM 856 NE2 HIS A 177 11.705 8.654 -26.104 1.00 0.00 N ATOM 0 H HIS A 177 10.009 7.863 -22.302 1.00 0.00 H new ATOM 0 HA HIS A 177 12.742 7.352 -21.753 1.00 0.00 H new ATOM 0 HB2 HIS A 177 11.226 9.934 -22.297 1.00 0.00 H new ATOM 0 HB3 HIS A 177 12.972 9.786 -22.302 1.00 0.00 H new ATOM 0 HD2 HIS A 177 10.908 10.381 -25.011 1.00 0.00 H new ATOM 0 HE1 HIS A 177 12.739 6.797 -26.352 1.00 0.00 H new ATOM 0 HE2 HIS A 177 11.410 8.850 -27.061 1.00 0.00 H new ATOM 864 N ASN A 178 11.046 9.052 -19.503 1.00 0.00 N ATOM 865 CA ASN A 178 11.084 9.552 -18.134 1.00 0.00 C ATOM 866 C ASN A 178 11.491 8.449 -17.163 1.00 0.00 C ATOM 867 O ASN A 178 12.250 8.683 -16.222 1.00 0.00 O ATOM 868 CB ASN A 178 9.720 10.119 -17.738 1.00 0.00 C ATOM 869 CG ASN A 178 9.825 11.498 -17.116 1.00 0.00 C ATOM 870 OD1 ASN A 178 10.337 11.654 -16.008 1.00 0.00 O ATOM 871 ND2 ASN A 178 9.338 12.507 -17.829 1.00 0.00 N ATOM 0 H ASN A 178 10.133 9.122 -19.952 1.00 0.00 H new ATOM 0 HA ASN A 178 11.828 10.347 -18.085 1.00 0.00 H new ATOM 0 HB2 ASN A 178 9.081 10.169 -18.619 1.00 0.00 H new ATOM 0 HB3 ASN A 178 9.239 9.441 -17.033 1.00 0.00 H new ATOM 0 HD21 ASN A 178 9.380 13.458 -17.462 1.00 0.00 H new ATOM 0 HD22 ASN A 178 8.922 12.331 -18.744 1.00 0.00 H new ATOM 878 N CYS A 179 10.981 7.244 -17.397 1.00 0.00 N ATOM 879 CA CYS A 179 11.290 6.103 -16.544 1.00 0.00 C ATOM 880 C CYS A 179 12.789 5.815 -16.543 1.00 0.00 C ATOM 881 O CYS A 179 13.328 5.277 -15.576 1.00 0.00 O ATOM 882 CB CYS A 179 10.522 4.866 -17.013 1.00 0.00 C ATOM 883 SG CYS A 179 8.775 4.835 -16.498 1.00 0.00 S ATOM 0 H CYS A 179 10.351 7.033 -18.171 1.00 0.00 H new ATOM 0 HA CYS A 179 10.984 6.348 -15.527 1.00 0.00 H new ATOM 0 HB2 CYS A 179 10.570 4.813 -18.101 1.00 0.00 H new ATOM 0 HB3 CYS A 179 11.019 3.976 -16.628 1.00 0.00 H new ATOM 0 HG CYS A 179 8.084 5.631 -17.259 1.00 0.00 H new ATOM 888 N VAL A 180 13.456 6.177 -17.634 1.00 0.00 N ATOM 889 CA VAL A 180 14.892 5.959 -17.759 1.00 0.00 C ATOM 890 C VAL A 180 15.672 6.895 -16.843 1.00 0.00 C ATOM 891 O VAL A 180 16.733 6.539 -16.332 1.00 0.00 O ATOM 892 CB VAL A 180 15.367 6.166 -19.210 1.00 0.00 C ATOM 893 CG1 VAL A 180 16.859 5.892 -19.328 1.00 0.00 C ATOM 894 CG2 VAL A 180 14.577 5.279 -20.160 1.00 0.00 C ATOM 0 H VAL A 180 13.025 6.623 -18.444 1.00 0.00 H new ATOM 0 HA VAL A 180 15.082 4.927 -17.466 1.00 0.00 H new ATOM 0 HB VAL A 180 15.190 7.205 -19.487 1.00 0.00 H new ATOM 0 HG11 VAL A 180 17.176 6.043 -20.360 1.00 0.00 H new ATOM 0 HG12 VAL A 180 17.407 6.573 -18.676 1.00 0.00 H new ATOM 0 HG13 VAL A 180 17.064 4.863 -19.032 1.00 0.00 H new ATOM 0 HG21 VAL A 180 14.925 5.438 -21.181 1.00 0.00 H new ATOM 0 HG22 VAL A 180 14.721 4.234 -19.886 1.00 0.00 H new ATOM 0 HG23 VAL A 180 13.518 5.529 -20.095 1.00 0.00 H new ATOM 904 N ASN A 181 15.138 8.095 -16.639 1.00 0.00 N ATOM 905 CA ASN A 181 15.784 9.084 -15.783 1.00 0.00 C ATOM 906 C ASN A 181 15.684 8.682 -14.315 1.00 0.00 C ATOM 907 O ASN A 181 16.657 8.781 -13.566 1.00 0.00 O ATOM 908 CB ASN A 181 15.150 10.461 -15.991 1.00 0.00 C ATOM 909 CG ASN A 181 16.118 11.593 -15.703 1.00 0.00 C ATOM 910 OD1 ASN A 181 16.361 11.938 -14.546 1.00 0.00 O ATOM 911 ND2 ASN A 181 16.675 12.176 -16.757 1.00 0.00 N ATOM 0 H ASN A 181 14.260 8.406 -17.055 1.00 0.00 H new ATOM 0 HA ASN A 181 16.838 9.131 -16.057 1.00 0.00 H new ATOM 0 HB2 ASN A 181 14.795 10.543 -17.018 1.00 0.00 H new ATOM 0 HB3 ASN A 181 14.279 10.558 -15.344 1.00 0.00 H new ATOM 0 HD21 ASN A 181 17.334 12.943 -16.626 1.00 0.00 H new ATOM 0 HD22 ASN A 181 16.444 11.857 -17.698 1.00 0.00 H new ATOM 918 N ILE A 182 14.503 8.227 -13.911 1.00 0.00 N ATOM 919 CA ILE A 182 14.276 7.808 -12.534 1.00 0.00 C ATOM 920 C ILE A 182 15.193 6.650 -12.154 1.00 0.00 C ATOM 921 O ILE A 182 15.638 6.545 -11.010 1.00 0.00 O ATOM 922 CB ILE A 182 12.813 7.386 -12.307 1.00 0.00 C ATOM 923 CG1 ILE A 182 11.864 8.511 -12.724 1.00 0.00 C ATOM 924 CG2 ILE A 182 12.589 7.010 -10.850 1.00 0.00 C ATOM 925 CD1 ILE A 182 12.013 9.766 -11.893 1.00 0.00 C ATOM 0 H ILE A 182 13.688 8.139 -14.518 1.00 0.00 H new ATOM 0 HA ILE A 182 14.499 8.668 -11.902 1.00 0.00 H new ATOM 0 HB ILE A 182 12.603 6.512 -12.924 1.00 0.00 H new ATOM 0 HG12 ILE A 182 12.041 8.755 -13.771 1.00 0.00 H new ATOM 0 HG13 ILE A 182 10.836 8.155 -12.649 1.00 0.00 H new ATOM 0 HG21 ILE A 182 11.550 6.714 -10.706 1.00 0.00 H new ATOM 0 HG22 ILE A 182 13.243 6.180 -10.584 1.00 0.00 H new ATOM 0 HG23 ILE A 182 12.814 7.867 -10.215 1.00 0.00 H new ATOM 0 HD11 ILE A 182 11.310 10.521 -12.244 1.00 0.00 H new ATOM 0 HD12 ILE A 182 11.807 9.537 -10.848 1.00 0.00 H new ATOM 0 HD13 ILE A 182 13.030 10.146 -11.987 1.00 0.00 H new ATOM 937 N THR A 183 15.472 5.781 -13.121 1.00 0.00 N ATOM 938 CA THR A 183 16.336 4.631 -12.889 1.00 0.00 C ATOM 939 C THR A 183 17.771 5.066 -12.618 1.00 0.00 C ATOM 940 O THR A 183 18.351 4.719 -11.589 1.00 0.00 O ATOM 941 CB THR A 183 16.321 3.666 -14.090 1.00 0.00 C ATOM 942 OG1 THR A 183 14.987 3.211 -14.337 1.00 0.00 O ATOM 943 CG2 THR A 183 17.231 2.473 -13.837 1.00 0.00 C ATOM 0 H THR A 183 15.112 5.852 -14.073 1.00 0.00 H new ATOM 0 HA THR A 183 15.945 4.114 -12.012 1.00 0.00 H new ATOM 0 HB THR A 183 16.688 4.204 -14.964 1.00 0.00 H new ATOM 0 HG1 THR A 183 14.467 3.932 -14.749 1.00 0.00 H new ATOM 0 HG21 THR A 183 17.204 1.806 -14.698 1.00 0.00 H new ATOM 0 HG22 THR A 183 18.252 2.821 -13.679 1.00 0.00 H new ATOM 0 HG23 THR A 183 16.890 1.936 -12.952 1.00 0.00 H new ATOM 951 N ILE A 184 18.338 5.828 -13.547 1.00 0.00 N ATOM 952 CA ILE A 184 19.706 6.313 -13.407 1.00 0.00 C ATOM 953 C ILE A 184 19.849 7.209 -12.182 1.00 0.00 C ATOM 954 O ILE A 184 20.853 7.153 -11.471 1.00 0.00 O ATOM 955 CB ILE A 184 20.157 7.093 -14.656 1.00 0.00 C ATOM 956 CG1 ILE A 184 20.042 6.214 -15.903 1.00 0.00 C ATOM 957 CG2 ILE A 184 21.585 7.590 -14.482 1.00 0.00 C ATOM 958 CD1 ILE A 184 20.896 4.967 -15.844 1.00 0.00 C ATOM 0 H ILE A 184 17.872 6.123 -14.405 1.00 0.00 H new ATOM 0 HA ILE A 184 20.341 5.435 -13.288 1.00 0.00 H new ATOM 0 HB ILE A 184 19.504 7.957 -14.782 1.00 0.00 H new ATOM 0 HG12 ILE A 184 19.000 5.925 -16.039 1.00 0.00 H new ATOM 0 HG13 ILE A 184 20.327 6.799 -16.777 1.00 0.00 H new ATOM 0 HG21 ILE A 184 21.890 8.139 -15.373 1.00 0.00 H new ATOM 0 HG22 ILE A 184 21.638 8.247 -13.614 1.00 0.00 H new ATOM 0 HG23 ILE A 184 22.251 6.740 -14.335 1.00 0.00 H new ATOM 0 HD11 ILE A 184 20.764 4.392 -16.761 1.00 0.00 H new ATOM 0 HD12 ILE A 184 21.944 5.248 -15.739 1.00 0.00 H new ATOM 0 HD13 ILE A 184 20.596 4.361 -14.989 1.00 0.00 H new ATOM 970 N LYS A 185 18.837 8.035 -11.939 1.00 0.00 N ATOM 971 CA LYS A 185 18.846 8.942 -10.797 1.00 0.00 C ATOM 972 C LYS A 185 19.086 8.180 -9.498 1.00 0.00 C ATOM 973 O LYS A 185 20.107 8.369 -8.837 1.00 0.00 O ATOM 974 CB LYS A 185 17.523 9.706 -10.716 1.00 0.00 C ATOM 975 CG LYS A 185 17.548 10.863 -9.732 1.00 0.00 C ATOM 976 CD LYS A 185 16.850 10.503 -8.431 1.00 0.00 C ATOM 977 CE LYS A 185 17.241 11.452 -7.308 1.00 0.00 C ATOM 978 NZ LYS A 185 16.510 12.747 -7.396 1.00 0.00 N ATOM 0 H LYS A 185 17.999 8.095 -12.518 1.00 0.00 H new ATOM 0 HA LYS A 185 19.661 9.653 -10.936 1.00 0.00 H new ATOM 0 HB2 LYS A 185 17.272 10.087 -11.706 1.00 0.00 H new ATOM 0 HB3 LYS A 185 16.730 9.014 -10.431 1.00 0.00 H new ATOM 0 HG2 LYS A 185 18.581 11.145 -9.526 1.00 0.00 H new ATOM 0 HG3 LYS A 185 17.063 11.732 -10.178 1.00 0.00 H new ATOM 0 HD2 LYS A 185 15.770 10.534 -8.576 1.00 0.00 H new ATOM 0 HD3 LYS A 185 17.105 9.481 -8.151 1.00 0.00 H new ATOM 0 HE2 LYS A 185 17.033 10.982 -6.347 1.00 0.00 H new ATOM 0 HE3 LYS A 185 18.314 11.638 -7.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 16.804 13.366 -6.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 16.728 13.208 -8.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 15.487 12.573 -7.334 1.00 0.00 H new ATOM 992 N GLN A 186 18.140 7.318 -9.140 1.00 0.00 N ATOM 993 CA GLN A 186 18.251 6.527 -7.920 1.00 0.00 C ATOM 994 C GLN A 186 19.509 5.665 -7.942 1.00 0.00 C ATOM 995 O GLN A 186 20.047 5.307 -6.894 1.00 0.00 O ATOM 996 CB GLN A 186 17.015 5.642 -7.747 1.00 0.00 C ATOM 997 CG GLN A 186 15.766 6.413 -7.350 1.00 0.00 C ATOM 998 CD GLN A 186 15.784 6.843 -5.896 1.00 0.00 C ATOM 999 OE1 GLN A 186 16.347 6.160 -5.041 1.00 0.00 O ATOM 1000 NE2 GLN A 186 15.164 7.982 -5.608 1.00 0.00 N ATOM 0 H GLN A 186 17.289 7.150 -9.677 1.00 0.00 H new ATOM 0 HA GLN A 186 18.319 7.214 -7.077 1.00 0.00 H new ATOM 0 HB2 GLN A 186 16.824 5.113 -8.680 1.00 0.00 H new ATOM 0 HB3 GLN A 186 17.222 4.887 -6.989 1.00 0.00 H new ATOM 0 HG2 GLN A 186 15.670 7.294 -7.984 1.00 0.00 H new ATOM 0 HG3 GLN A 186 14.888 5.793 -7.531 1.00 0.00 H new ATOM 0 HE21 GLN A 186 14.710 8.517 -6.348 1.00 0.00 H new ATOM 0 HE22 GLN A 186 15.142 8.322 -4.646 1.00 0.00 H new ATOM 1009 N HIS A 187 19.973 5.334 -9.143 1.00 0.00 N ATOM 1010 CA HIS A 187 21.168 4.514 -9.301 1.00 0.00 C ATOM 1011 C HIS A 187 22.339 5.103 -8.521 1.00 0.00 C ATOM 1012 O HIS A 187 23.232 4.379 -8.078 1.00 0.00 O ATOM 1013 CB HIS A 187 21.536 4.391 -10.781 1.00 0.00 C ATOM 1014 CG HIS A 187 22.261 3.124 -11.114 1.00 0.00 C ATOM 1015 ND1 HIS A 187 23.633 3.048 -11.223 1.00 0.00 N ATOM 1016 CD2 HIS A 187 21.796 1.877 -11.362 1.00 0.00 C ATOM 1017 CE1 HIS A 187 23.982 1.810 -11.525 1.00 0.00 C ATOM 1018 NE2 HIS A 187 22.885 1.079 -11.615 1.00 0.00 N ATOM 0 H HIS A 187 19.539 5.621 -10.020 1.00 0.00 H new ATOM 0 HA HIS A 187 20.953 3.522 -8.904 1.00 0.00 H new ATOM 0 HB2 HIS A 187 20.626 4.447 -11.379 1.00 0.00 H new ATOM 0 HB3 HIS A 187 22.157 5.241 -11.064 1.00 0.00 H new ATOM 0 HD2 HIS A 187 20.761 1.567 -11.361 1.00 0.00 H new ATOM 0 HE1 HIS A 187 24.992 1.456 -11.673 1.00 0.00 H new ATOM 0 HE2 HIS A 187 22.852 0.084 -11.836 1.00 0.00 H new ATOM 1026 N THR A 188 22.331 6.422 -8.357 1.00 0.00 N ATOM 1027 CA THR A 188 23.392 7.109 -7.632 1.00 0.00 C ATOM 1028 C THR A 188 23.568 6.529 -6.234 1.00 0.00 C ATOM 1029 O THR A 188 24.666 6.546 -5.677 1.00 0.00 O ATOM 1030 CB THR A 188 23.108 8.619 -7.518 1.00 0.00 C ATOM 1031 OG1 THR A 188 24.257 9.295 -6.995 1.00 0.00 O ATOM 1032 CG2 THR A 188 21.909 8.878 -6.619 1.00 0.00 C ATOM 0 H THR A 188 21.601 7.036 -8.717 1.00 0.00 H new ATOM 0 HA THR A 188 24.310 6.962 -8.201 1.00 0.00 H new ATOM 0 HB THR A 188 22.884 9.000 -8.514 1.00 0.00 H new ATOM 0 HG1 THR A 188 24.069 10.254 -6.927 1.00 0.00 H new ATOM 0 HG21 THR A 188 21.728 9.951 -6.554 1.00 0.00 H new ATOM 0 HG22 THR A 188 21.030 8.386 -7.035 1.00 0.00 H new ATOM 0 HG23 THR A 188 22.109 8.483 -5.623 1.00 0.00 H new ATOM 1040 N VAL A 189 22.479 6.016 -5.670 1.00 0.00 N ATOM 1041 CA VAL A 189 22.513 5.429 -4.336 1.00 0.00 C ATOM 1042 C VAL A 189 23.336 4.146 -4.321 1.00 0.00 C ATOM 1043 O VAL A 189 24.211 3.966 -3.474 1.00 0.00 O ATOM 1044 CB VAL A 189 21.094 5.122 -3.821 1.00 0.00 C ATOM 1045 CG1 VAL A 189 21.151 4.516 -2.427 1.00 0.00 C ATOM 1046 CG2 VAL A 189 20.240 6.381 -3.829 1.00 0.00 C ATOM 0 H VAL A 189 21.562 5.995 -6.117 1.00 0.00 H new ATOM 0 HA VAL A 189 22.979 6.164 -3.679 1.00 0.00 H new ATOM 0 HB VAL A 189 20.634 4.394 -4.489 1.00 0.00 H new ATOM 0 HG11 VAL A 189 20.139 4.306 -2.080 1.00 0.00 H new ATOM 0 HG12 VAL A 189 21.724 3.589 -2.456 1.00 0.00 H new ATOM 0 HG13 VAL A 189 21.630 5.218 -1.744 1.00 0.00 H new ATOM 0 HG21 VAL A 189 19.241 6.145 -3.462 1.00 0.00 H new ATOM 0 HG22 VAL A 189 20.695 7.133 -3.185 1.00 0.00 H new ATOM 0 HG23 VAL A 189 20.171 6.768 -4.846 1.00 0.00 H new ATOM 1056 N THR A 190 23.050 3.255 -5.265 1.00 0.00 N ATOM 1057 CA THR A 190 23.763 1.987 -5.362 1.00 0.00 C ATOM 1058 C THR A 190 25.210 2.202 -5.788 1.00 0.00 C ATOM 1059 O THR A 190 26.087 1.394 -5.478 1.00 0.00 O ATOM 1060 CB THR A 190 23.081 1.034 -6.361 1.00 0.00 C ATOM 1061 OG1 THR A 190 21.738 0.765 -5.943 1.00 0.00 O ATOM 1062 CG2 THR A 190 23.853 -0.272 -6.475 1.00 0.00 C ATOM 0 H THR A 190 22.329 3.388 -5.974 1.00 0.00 H new ATOM 0 HA THR A 190 23.743 1.536 -4.370 1.00 0.00 H new ATOM 0 HB THR A 190 23.067 1.517 -7.338 1.00 0.00 H new ATOM 0 HG1 THR A 190 21.311 0.160 -6.584 1.00 0.00 H new ATOM 0 HG21 THR A 190 23.353 -0.929 -7.186 1.00 0.00 H new ATOM 0 HG22 THR A 190 24.866 -0.067 -6.821 1.00 0.00 H new ATOM 0 HG23 THR A 190 23.894 -0.757 -5.500 1.00 0.00 H new ATOM 1070 N THR A 191 25.456 3.296 -6.502 1.00 0.00 N ATOM 1071 CA THR A 191 26.798 3.617 -6.972 1.00 0.00 C ATOM 1072 C THR A 191 27.788 3.670 -5.813 1.00 0.00 C ATOM 1073 O THR A 191 28.988 3.461 -5.998 1.00 0.00 O ATOM 1074 CB THR A 191 26.825 4.964 -7.717 1.00 0.00 C ATOM 1075 OG1 THR A 191 25.931 4.924 -8.835 1.00 0.00 O ATOM 1076 CG2 THR A 191 28.232 5.288 -8.199 1.00 0.00 C ATOM 0 H THR A 191 24.743 3.975 -6.768 1.00 0.00 H new ATOM 0 HA THR A 191 27.090 2.824 -7.660 1.00 0.00 H new ATOM 0 HB THR A 191 26.506 5.743 -7.024 1.00 0.00 H new ATOM 0 HG1 THR A 191 25.010 4.828 -8.514 1.00 0.00 H new ATOM 0 HG21 THR A 191 28.226 6.244 -8.722 1.00 0.00 H new ATOM 0 HG22 THR A 191 28.905 5.347 -7.344 1.00 0.00 H new ATOM 0 HG23 THR A 191 28.574 4.506 -8.877 1.00 0.00 H new ATOM 1084 N THR A 192 27.279 3.950 -4.618 1.00 0.00 N ATOM 1085 CA THR A 192 28.118 4.031 -3.429 1.00 0.00 C ATOM 1086 C THR A 192 28.671 2.661 -3.052 1.00 0.00 C ATOM 1087 O THR A 192 29.800 2.546 -2.573 1.00 0.00 O ATOM 1088 CB THR A 192 27.341 4.606 -2.230 1.00 0.00 C ATOM 1089 OG1 THR A 192 26.301 3.701 -1.841 1.00 0.00 O ATOM 1090 CG2 THR A 192 26.738 5.959 -2.574 1.00 0.00 C ATOM 0 H THR A 192 26.289 4.125 -4.448 1.00 0.00 H new ATOM 0 HA THR A 192 28.944 4.700 -3.671 1.00 0.00 H new ATOM 0 HB THR A 192 28.039 4.736 -1.403 1.00 0.00 H new ATOM 0 HG1 THR A 192 25.462 3.960 -2.276 1.00 0.00 H new ATOM 0 HG21 THR A 192 26.194 6.345 -1.712 1.00 0.00 H new ATOM 0 HG22 THR A 192 27.533 6.654 -2.842 1.00 0.00 H new ATOM 0 HG23 THR A 192 26.053 5.849 -3.415 1.00 0.00 H new ATOM 1098 N THR A 193 27.870 1.623 -3.273 1.00 0.00 N ATOM 1099 CA THR A 193 28.279 0.261 -2.956 1.00 0.00 C ATOM 1100 C THR A 193 29.436 -0.186 -3.843 1.00 0.00 C ATOM 1101 O THR A 193 30.227 -1.049 -3.461 1.00 0.00 O ATOM 1102 CB THR A 193 27.111 -0.729 -3.120 1.00 0.00 C ATOM 1103 OG1 THR A 193 26.810 -0.907 -4.508 1.00 0.00 O ATOM 1104 CG2 THR A 193 25.873 -0.231 -2.388 1.00 0.00 C ATOM 0 H THR A 193 26.934 1.700 -3.671 1.00 0.00 H new ATOM 0 HA THR A 193 28.601 0.262 -1.915 1.00 0.00 H new ATOM 0 HB THR A 193 27.410 -1.684 -2.688 1.00 0.00 H new ATOM 0 HG1 THR A 193 26.313 -0.129 -4.837 1.00 0.00 H new ATOM 0 HG21 THR A 193 25.061 -0.946 -2.518 1.00 0.00 H new ATOM 0 HG22 THR A 193 26.096 -0.124 -1.326 1.00 0.00 H new ATOM 0 HG23 THR A 193 25.574 0.735 -2.795 1.00 0.00 H new ATOM 1112 N LYS A 194 29.531 0.408 -5.027 1.00 0.00 N ATOM 1113 CA LYS A 194 30.594 0.073 -5.969 1.00 0.00 C ATOM 1114 C LYS A 194 31.839 0.913 -5.704 1.00 0.00 C ATOM 1115 O LYS A 194 32.917 0.622 -6.222 1.00 0.00 O ATOM 1116 CB LYS A 194 30.116 0.289 -7.406 1.00 0.00 C ATOM 1117 CG LYS A 194 29.281 -0.859 -7.948 1.00 0.00 C ATOM 1118 CD LYS A 194 29.045 -0.720 -9.443 1.00 0.00 C ATOM 1119 CE LYS A 194 30.190 -1.319 -10.246 1.00 0.00 C ATOM 1120 NZ LYS A 194 30.034 -1.068 -11.705 1.00 0.00 N ATOM 0 H LYS A 194 28.885 1.124 -5.358 1.00 0.00 H new ATOM 0 HA LYS A 194 30.850 -0.978 -5.832 1.00 0.00 H new ATOM 0 HB2 LYS A 194 29.530 1.207 -7.451 1.00 0.00 H new ATOM 0 HB3 LYS A 194 30.983 0.433 -8.051 1.00 0.00 H new ATOM 0 HG2 LYS A 194 29.785 -1.804 -7.745 1.00 0.00 H new ATOM 0 HG3 LYS A 194 28.323 -0.890 -7.429 1.00 0.00 H new ATOM 0 HD2 LYS A 194 28.112 -1.215 -9.713 1.00 0.00 H new ATOM 0 HD3 LYS A 194 28.932 0.334 -9.698 1.00 0.00 H new ATOM 0 HE2 LYS A 194 31.134 -0.896 -9.904 1.00 0.00 H new ATOM 0 HE3 LYS A 194 30.238 -2.393 -10.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 30.882 -1.401 -12.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 29.199 -1.578 -12.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 29.912 -0.049 -11.871 1.00 0.00 H new ATOM 1134 N GLY A 195 31.684 1.956 -4.894 1.00 0.00 N ATOM 1135 CA GLY A 195 32.804 2.821 -4.575 1.00 0.00 C ATOM 1136 C GLY A 195 33.451 3.413 -5.811 1.00 0.00 C ATOM 1137 O GLY A 195 34.616 3.807 -5.781 1.00 0.00 O ATOM 0 H GLY A 195 30.802 2.217 -4.453 1.00 0.00 H new ATOM 0 HA2 GLY A 195 32.463 3.627 -3.926 1.00 0.00 H new ATOM 0 HA3 GLY A 195 33.548 2.255 -4.015 1.00 0.00 H new ATOM 1141 N GLU A 196 32.693 3.474 -6.902 1.00 0.00 N ATOM 1142 CA GLU A 196 33.201 4.020 -8.155 1.00 0.00 C ATOM 1143 C GLU A 196 32.314 5.158 -8.652 1.00 0.00 C ATOM 1144 O GLU A 196 31.312 5.496 -8.025 1.00 0.00 O ATOM 1145 CB GLU A 196 33.286 2.922 -9.218 1.00 0.00 C ATOM 1146 CG GLU A 196 34.653 2.265 -9.308 1.00 0.00 C ATOM 1147 CD GLU A 196 35.427 2.696 -10.538 1.00 0.00 C ATOM 1148 OE1 GLU A 196 36.004 3.803 -10.520 1.00 0.00 O ATOM 1149 OE2 GLU A 196 35.456 1.924 -11.520 1.00 0.00 O ATOM 0 H GLU A 196 31.726 3.152 -6.943 1.00 0.00 H new ATOM 0 HA GLU A 196 34.200 4.416 -7.971 1.00 0.00 H new ATOM 0 HB2 GLU A 196 32.539 2.159 -9.000 1.00 0.00 H new ATOM 0 HB3 GLU A 196 33.032 3.348 -10.189 1.00 0.00 H new ATOM 0 HG2 GLU A 196 35.229 2.510 -8.416 1.00 0.00 H new ATOM 0 HG3 GLU A 196 34.531 1.182 -9.321 1.00 0.00 H new ATOM 1156 N ASN A 197 32.693 5.744 -9.783 1.00 0.00 N ATOM 1157 CA ASN A 197 31.933 6.845 -10.364 1.00 0.00 C ATOM 1158 C ASN A 197 31.518 6.523 -11.797 1.00 0.00 C ATOM 1159 O ASN A 197 32.003 5.561 -12.393 1.00 0.00 O ATOM 1160 CB ASN A 197 32.760 8.132 -10.338 1.00 0.00 C ATOM 1161 CG ASN A 197 32.987 8.645 -8.929 1.00 0.00 C ATOM 1162 OD1 ASN A 197 34.125 8.769 -8.477 1.00 0.00 O ATOM 1163 ND2 ASN A 197 31.900 8.945 -8.226 1.00 0.00 N ATOM 0 H ASN A 197 33.521 5.475 -10.315 1.00 0.00 H new ATOM 0 HA ASN A 197 31.032 6.987 -9.767 1.00 0.00 H new ATOM 0 HB2 ASN A 197 33.723 7.952 -10.816 1.00 0.00 H new ATOM 0 HB3 ASN A 197 32.253 8.899 -10.924 1.00 0.00 H new ATOM 0 HD21 ASN A 197 31.990 9.294 -7.272 1.00 0.00 H new ATOM 0 HD22 ASN A 197 30.976 8.827 -8.641 1.00 0.00 H new ATOM 1170 N PHE A 198 30.619 7.334 -12.343 1.00 0.00 N ATOM 1171 CA PHE A 198 30.138 7.136 -13.705 1.00 0.00 C ATOM 1172 C PHE A 198 30.565 8.292 -14.606 1.00 0.00 C ATOM 1173 O PHE A 198 30.453 9.460 -14.233 1.00 0.00 O ATOM 1174 CB PHE A 198 28.614 7.002 -13.716 1.00 0.00 C ATOM 1175 CG PHE A 198 27.914 8.058 -12.910 1.00 0.00 C ATOM 1176 CD1 PHE A 198 27.538 9.258 -13.492 1.00 0.00 C ATOM 1177 CD2 PHE A 198 27.631 7.850 -11.569 1.00 0.00 C ATOM 1178 CE1 PHE A 198 26.893 10.231 -12.753 1.00 0.00 C ATOM 1179 CE2 PHE A 198 26.986 8.820 -10.825 1.00 0.00 C ATOM 1180 CZ PHE A 198 26.617 10.012 -11.417 1.00 0.00 C ATOM 0 H PHE A 198 30.208 8.135 -11.863 1.00 0.00 H new ATOM 0 HA PHE A 198 30.579 6.216 -14.089 1.00 0.00 H new ATOM 0 HB2 PHE A 198 28.261 7.049 -14.746 1.00 0.00 H new ATOM 0 HB3 PHE A 198 28.341 6.020 -13.329 1.00 0.00 H new ATOM 0 HD1 PHE A 198 27.752 9.435 -14.536 1.00 0.00 H new ATOM 0 HD2 PHE A 198 27.918 6.920 -11.101 1.00 0.00 H new ATOM 0 HE1 PHE A 198 26.605 11.162 -13.219 1.00 0.00 H new ATOM 0 HE2 PHE A 198 26.771 8.646 -9.781 1.00 0.00 H new ATOM 0 HZ PHE A 198 26.114 10.771 -10.837 1.00 0.00 H new ATOM 1190 N THR A 199 31.056 7.957 -15.795 1.00 0.00 N ATOM 1191 CA THR A 199 31.502 8.964 -16.749 1.00 0.00 C ATOM 1192 C THR A 199 30.399 9.304 -17.746 1.00 0.00 C ATOM 1193 O THR A 199 29.455 8.536 -17.925 1.00 0.00 O ATOM 1194 CB THR A 199 32.749 8.494 -17.522 1.00 0.00 C ATOM 1195 OG1 THR A 199 32.499 7.221 -18.127 1.00 0.00 O ATOM 1196 CG2 THR A 199 33.952 8.394 -16.597 1.00 0.00 C ATOM 0 H THR A 199 31.155 6.995 -16.120 1.00 0.00 H new ATOM 0 HA THR A 199 31.755 9.854 -16.173 1.00 0.00 H new ATOM 0 HB THR A 199 32.967 9.228 -18.298 1.00 0.00 H new ATOM 0 HG1 THR A 199 33.337 6.857 -18.482 1.00 0.00 H new ATOM 0 HG21 THR A 199 34.821 8.060 -17.165 1.00 0.00 H new ATOM 0 HG22 THR A 199 34.157 9.371 -16.160 1.00 0.00 H new ATOM 0 HG23 THR A 199 33.741 7.678 -15.802 1.00 0.00 H new ATOM 1204 N GLU A 200 30.527 10.459 -18.391 1.00 0.00 N ATOM 1205 CA GLU A 200 29.539 10.899 -19.370 1.00 0.00 C ATOM 1206 C GLU A 200 29.403 9.884 -20.500 1.00 0.00 C ATOM 1207 O GLU A 200 28.357 9.789 -21.144 1.00 0.00 O ATOM 1208 CB GLU A 200 29.928 12.265 -19.940 1.00 0.00 C ATOM 1209 CG GLU A 200 31.247 12.256 -20.694 1.00 0.00 C ATOM 1210 CD GLU A 200 31.556 13.591 -21.345 1.00 0.00 C ATOM 1211 OE1 GLU A 200 31.101 13.815 -22.486 1.00 0.00 O ATOM 1212 OE2 GLU A 200 32.252 14.412 -20.712 1.00 0.00 O ATOM 0 H GLU A 200 31.303 11.106 -18.254 1.00 0.00 H new ATOM 0 HA GLU A 200 28.577 10.984 -18.865 1.00 0.00 H new ATOM 0 HB2 GLU A 200 29.139 12.608 -20.609 1.00 0.00 H new ATOM 0 HB3 GLU A 200 29.990 12.985 -19.124 1.00 0.00 H new ATOM 0 HG2 GLU A 200 32.052 11.996 -20.007 1.00 0.00 H new ATOM 0 HG3 GLU A 200 31.218 11.481 -21.460 1.00 0.00 H new ATOM 1219 N THR A 201 30.469 9.125 -20.738 1.00 0.00 N ATOM 1220 CA THR A 201 30.470 8.117 -21.791 1.00 0.00 C ATOM 1221 C THR A 201 29.833 6.819 -21.310 1.00 0.00 C ATOM 1222 O THR A 201 29.028 6.213 -22.018 1.00 0.00 O ATOM 1223 CB THR A 201 31.899 7.822 -22.284 1.00 0.00 C ATOM 1224 OG1 THR A 201 32.631 9.045 -22.424 1.00 0.00 O ATOM 1225 CG2 THR A 201 31.871 7.087 -23.615 1.00 0.00 C ATOM 0 H THR A 201 31.343 9.190 -20.215 1.00 0.00 H new ATOM 0 HA THR A 201 29.885 8.522 -22.617 1.00 0.00 H new ATOM 0 HB THR A 201 32.390 7.187 -21.547 1.00 0.00 H new ATOM 0 HG1 THR A 201 33.539 8.849 -22.736 1.00 0.00 H new ATOM 0 HG21 THR A 201 32.892 6.890 -23.943 1.00 0.00 H new ATOM 0 HG22 THR A 201 31.338 6.143 -23.498 1.00 0.00 H new ATOM 0 HG23 THR A 201 31.363 7.701 -24.359 1.00 0.00 H new ATOM 1233 N ASP A 202 30.197 6.397 -20.105 1.00 0.00 N ATOM 1234 CA ASP A 202 29.658 5.170 -19.529 1.00 0.00 C ATOM 1235 C ASP A 202 28.164 5.309 -19.254 1.00 0.00 C ATOM 1236 O ASP A 202 27.380 4.411 -19.563 1.00 0.00 O ATOM 1237 CB ASP A 202 30.397 4.822 -18.235 1.00 0.00 C ATOM 1238 CG ASP A 202 31.814 4.346 -18.488 1.00 0.00 C ATOM 1239 OD1 ASP A 202 32.476 4.904 -19.387 1.00 0.00 O ATOM 1240 OD2 ASP A 202 32.261 3.416 -17.785 1.00 0.00 O ATOM 0 H ASP A 202 30.863 6.886 -19.507 1.00 0.00 H new ATOM 0 HA ASP A 202 29.803 4.365 -20.250 1.00 0.00 H new ATOM 0 HB2 ASP A 202 30.421 5.698 -17.587 1.00 0.00 H new ATOM 0 HB3 ASP A 202 29.846 4.047 -17.702 1.00 0.00 H new ATOM 1245 N VAL A 203 27.777 6.439 -18.672 1.00 0.00 N ATOM 1246 CA VAL A 203 26.377 6.695 -18.356 1.00 0.00 C ATOM 1247 C VAL A 203 25.516 6.675 -19.614 1.00 0.00 C ATOM 1248 O VAL A 203 24.359 6.255 -19.582 1.00 0.00 O ATOM 1249 CB VAL A 203 26.200 8.052 -17.648 1.00 0.00 C ATOM 1250 CG1 VAL A 203 26.686 9.186 -18.539 1.00 0.00 C ATOM 1251 CG2 VAL A 203 24.747 8.261 -17.252 1.00 0.00 C ATOM 0 H VAL A 203 28.413 7.192 -18.410 1.00 0.00 H new ATOM 0 HA VAL A 203 26.054 5.899 -17.686 1.00 0.00 H new ATOM 0 HB VAL A 203 26.803 8.050 -16.740 1.00 0.00 H new ATOM 0 HG11 VAL A 203 26.553 10.137 -18.023 1.00 0.00 H new ATOM 0 HG12 VAL A 203 27.742 9.042 -18.768 1.00 0.00 H new ATOM 0 HG13 VAL A 203 26.111 9.193 -19.465 1.00 0.00 H new ATOM 0 HG21 VAL A 203 24.641 9.224 -16.753 1.00 0.00 H new ATOM 0 HG22 VAL A 203 24.121 8.243 -18.144 1.00 0.00 H new ATOM 0 HG23 VAL A 203 24.436 7.466 -16.575 1.00 0.00 H new ATOM 1261 N LYS A 204 26.089 7.131 -20.723 1.00 0.00 N ATOM 1262 CA LYS A 204 25.377 7.164 -21.995 1.00 0.00 C ATOM 1263 C LYS A 204 25.020 5.754 -22.456 1.00 0.00 C ATOM 1264 O LYS A 204 23.901 5.501 -22.900 1.00 0.00 O ATOM 1265 CB LYS A 204 26.225 7.861 -23.060 1.00 0.00 C ATOM 1266 CG LYS A 204 25.501 8.990 -23.772 1.00 0.00 C ATOM 1267 CD LYS A 204 25.472 10.254 -22.928 1.00 0.00 C ATOM 1268 CE LYS A 204 24.075 10.538 -22.398 1.00 0.00 C ATOM 1269 NZ LYS A 204 23.883 11.981 -22.087 1.00 0.00 N ATOM 0 H LYS A 204 27.045 7.483 -20.766 1.00 0.00 H new ATOM 0 HA LYS A 204 24.453 7.725 -21.851 1.00 0.00 H new ATOM 0 HB2 LYS A 204 27.127 8.257 -22.593 1.00 0.00 H new ATOM 0 HB3 LYS A 204 26.545 7.124 -23.797 1.00 0.00 H new ATOM 0 HG2 LYS A 204 25.993 9.197 -24.722 1.00 0.00 H new ATOM 0 HG3 LYS A 204 24.481 8.682 -24.002 1.00 0.00 H new ATOM 0 HD2 LYS A 204 26.165 10.151 -22.093 1.00 0.00 H new ATOM 0 HD3 LYS A 204 25.815 11.099 -23.525 1.00 0.00 H new ATOM 0 HE2 LYS A 204 23.336 10.224 -23.135 1.00 0.00 H new ATOM 0 HE3 LYS A 204 23.900 9.946 -21.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 22.919 12.134 -21.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 24.571 12.275 -21.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 24.025 12.544 -22.950 1.00 0.00 H new ATOM 1283 N MET A 205 25.979 4.840 -22.345 1.00 0.00 N ATOM 1284 CA MET A 205 25.764 3.455 -22.748 1.00 0.00 C ATOM 1285 C MET A 205 24.663 2.810 -21.913 1.00 0.00 C ATOM 1286 O MET A 205 23.765 2.162 -22.448 1.00 0.00 O ATOM 1287 CB MET A 205 27.061 2.655 -22.610 1.00 0.00 C ATOM 1288 CG MET A 205 28.229 3.254 -23.376 1.00 0.00 C ATOM 1289 SD MET A 205 28.993 2.078 -24.509 1.00 0.00 S ATOM 1290 CE MET A 205 30.729 2.375 -24.187 1.00 0.00 C ATOM 0 H MET A 205 26.911 5.033 -21.980 1.00 0.00 H new ATOM 0 HA MET A 205 25.452 3.451 -23.792 1.00 0.00 H new ATOM 0 HB2 MET A 205 27.326 2.587 -21.555 1.00 0.00 H new ATOM 0 HB3 MET A 205 26.890 1.638 -22.962 1.00 0.00 H new ATOM 0 HG2 MET A 205 27.883 4.122 -23.938 1.00 0.00 H new ATOM 0 HG3 MET A 205 28.978 3.610 -22.669 1.00 0.00 H new ATOM 0 HE1 MET A 205 31.333 1.720 -24.815 1.00 0.00 H new ATOM 0 HE2 MET A 205 30.968 3.414 -24.412 1.00 0.00 H new ATOM 0 HE3 MET A 205 30.944 2.172 -23.138 1.00 0.00 H new ATOM 1300 N MET A 206 24.740 2.993 -20.599 1.00 0.00 N ATOM 1301 CA MET A 206 23.748 2.429 -19.690 1.00 0.00 C ATOM 1302 C MET A 206 22.359 2.982 -19.990 1.00 0.00 C ATOM 1303 O MET A 206 21.365 2.260 -19.918 1.00 0.00 O ATOM 1304 CB MET A 206 24.126 2.729 -18.238 1.00 0.00 C ATOM 1305 CG MET A 206 25.309 1.916 -17.738 1.00 0.00 C ATOM 1306 SD MET A 206 25.364 1.804 -15.939 1.00 0.00 S ATOM 1307 CE MET A 206 25.316 3.537 -15.490 1.00 0.00 C ATOM 0 H MET A 206 25.478 3.527 -20.140 1.00 0.00 H new ATOM 0 HA MET A 206 23.730 1.349 -19.838 1.00 0.00 H new ATOM 0 HB2 MET A 206 24.359 3.790 -18.143 1.00 0.00 H new ATOM 0 HB3 MET A 206 23.265 2.533 -17.599 1.00 0.00 H new ATOM 0 HG2 MET A 206 25.259 0.912 -18.159 1.00 0.00 H new ATOM 0 HG3 MET A 206 26.233 2.367 -18.099 1.00 0.00 H new ATOM 0 HE1 MET A 206 25.574 3.647 -14.437 1.00 0.00 H new ATOM 0 HE2 MET A 206 26.031 4.090 -16.098 1.00 0.00 H new ATOM 0 HE3 MET A 206 24.314 3.930 -15.661 1.00 0.00 H new ATOM 1317 N GLU A 207 22.298 4.266 -20.328 1.00 0.00 N ATOM 1318 CA GLU A 207 21.029 4.915 -20.637 1.00 0.00 C ATOM 1319 C GLU A 207 20.295 4.171 -21.750 1.00 0.00 C ATOM 1320 O GLU A 207 19.066 4.186 -21.815 1.00 0.00 O ATOM 1321 CB GLU A 207 21.262 6.370 -21.049 1.00 0.00 C ATOM 1322 CG GLU A 207 21.661 7.273 -19.895 1.00 0.00 C ATOM 1323 CD GLU A 207 20.629 8.346 -19.609 1.00 0.00 C ATOM 1324 OE1 GLU A 207 19.716 8.088 -18.796 1.00 0.00 O ATOM 1325 OE2 GLU A 207 20.732 9.442 -20.198 1.00 0.00 O ATOM 0 H GLU A 207 23.112 4.877 -20.395 1.00 0.00 H new ATOM 0 HA GLU A 207 20.411 4.894 -19.739 1.00 0.00 H new ATOM 0 HB2 GLU A 207 22.041 6.403 -21.811 1.00 0.00 H new ATOM 0 HB3 GLU A 207 20.352 6.759 -21.506 1.00 0.00 H new ATOM 0 HG2 GLU A 207 21.808 6.669 -19.000 1.00 0.00 H new ATOM 0 HG3 GLU A 207 22.617 7.745 -20.122 1.00 0.00 H new ATOM 1332 N ARG A 208 21.059 3.521 -22.623 1.00 0.00 N ATOM 1333 CA ARG A 208 20.482 2.773 -23.733 1.00 0.00 C ATOM 1334 C ARG A 208 19.825 1.487 -23.240 1.00 0.00 C ATOM 1335 O ARG A 208 18.696 1.171 -23.615 1.00 0.00 O ATOM 1336 CB ARG A 208 21.560 2.443 -24.768 1.00 0.00 C ATOM 1337 CG ARG A 208 21.186 2.844 -26.185 1.00 0.00 C ATOM 1338 CD ARG A 208 21.853 1.944 -27.213 1.00 0.00 C ATOM 1339 NE ARG A 208 20.914 1.489 -28.235 1.00 0.00 N ATOM 1340 CZ ARG A 208 20.410 2.281 -29.174 1.00 0.00 C ATOM 1341 NH1 ARG A 208 20.753 3.561 -29.222 1.00 0.00 N ATOM 1342 NH2 ARG A 208 19.560 1.793 -30.069 1.00 0.00 N ATOM 0 H ARG A 208 22.078 3.498 -22.583 1.00 0.00 H new ATOM 0 HA ARG A 208 19.718 3.395 -24.199 1.00 0.00 H new ATOM 0 HB2 ARG A 208 22.486 2.946 -24.489 1.00 0.00 H new ATOM 0 HB3 ARG A 208 21.760 1.372 -24.743 1.00 0.00 H new ATOM 0 HG2 ARG A 208 20.104 2.795 -26.305 1.00 0.00 H new ATOM 0 HG3 ARG A 208 21.479 3.879 -26.361 1.00 0.00 H new ATOM 0 HD2 ARG A 208 22.673 2.483 -27.688 1.00 0.00 H new ATOM 0 HD3 ARG A 208 22.288 1.080 -26.710 1.00 0.00 H new ATOM 0 HE ARG A 208 20.630 0.509 -28.227 1.00 0.00 H new ATOM 0 HH11 ARG A 208 21.406 3.940 -28.536 1.00 0.00 H new ATOM 0 HH12 ARG A 208 20.364 4.166 -29.945 1.00 0.00 H new ATOM 0 HH21 ARG A 208 19.294 0.809 -30.036 1.00 0.00 H new ATOM 0 HH22 ARG A 208 19.173 2.402 -30.790 1.00 0.00 H new ATOM 1356 N VAL A 209 20.540 0.750 -22.396 1.00 0.00 N ATOM 1357 CA VAL A 209 20.027 -0.501 -21.851 1.00 0.00 C ATOM 1358 C VAL A 209 18.795 -0.260 -20.985 1.00 0.00 C ATOM 1359 O VAL A 209 17.882 -1.083 -20.943 1.00 0.00 O ATOM 1360 CB VAL A 209 21.095 -1.228 -21.013 1.00 0.00 C ATOM 1361 CG1 VAL A 209 20.564 -2.563 -20.512 1.00 0.00 C ATOM 1362 CG2 VAL A 209 22.368 -1.421 -21.823 1.00 0.00 C ATOM 0 H VAL A 209 21.476 0.998 -22.075 1.00 0.00 H new ATOM 0 HA VAL A 209 19.754 -1.127 -22.700 1.00 0.00 H new ATOM 0 HB VAL A 209 21.333 -0.611 -20.147 1.00 0.00 H new ATOM 0 HG11 VAL A 209 21.333 -3.062 -19.922 1.00 0.00 H new ATOM 0 HG12 VAL A 209 19.683 -2.395 -19.892 1.00 0.00 H new ATOM 0 HG13 VAL A 209 20.295 -3.190 -21.362 1.00 0.00 H new ATOM 0 HG21 VAL A 209 23.112 -1.936 -21.215 1.00 0.00 H new ATOM 0 HG22 VAL A 209 22.149 -2.016 -22.709 1.00 0.00 H new ATOM 0 HG23 VAL A 209 22.757 -0.449 -22.126 1.00 0.00 H new ATOM 1372 N VAL A 210 18.777 0.877 -20.296 1.00 0.00 N ATOM 1373 CA VAL A 210 17.657 1.229 -19.432 1.00 0.00 C ATOM 1374 C VAL A 210 16.397 1.497 -20.248 1.00 0.00 C ATOM 1375 O VAL A 210 15.290 1.166 -19.824 1.00 0.00 O ATOM 1376 CB VAL A 210 17.975 2.471 -18.578 1.00 0.00 C ATOM 1377 CG1 VAL A 210 16.792 2.827 -17.692 1.00 0.00 C ATOM 1378 CG2 VAL A 210 19.225 2.237 -17.744 1.00 0.00 C ATOM 0 H VAL A 210 19.525 1.570 -20.320 1.00 0.00 H new ATOM 0 HA VAL A 210 17.486 0.378 -18.773 1.00 0.00 H new ATOM 0 HB VAL A 210 18.163 3.312 -19.246 1.00 0.00 H new ATOM 0 HG11 VAL A 210 17.035 3.707 -17.096 1.00 0.00 H new ATOM 0 HG12 VAL A 210 15.922 3.039 -18.314 1.00 0.00 H new ATOM 0 HG13 VAL A 210 16.569 1.991 -17.030 1.00 0.00 H new ATOM 0 HG21 VAL A 210 19.435 3.124 -17.147 1.00 0.00 H new ATOM 0 HG22 VAL A 210 19.068 1.384 -17.084 1.00 0.00 H new ATOM 0 HG23 VAL A 210 20.069 2.035 -18.403 1.00 0.00 H new ATOM 1388 N GLU A 211 16.574 2.097 -21.421 1.00 0.00 N ATOM 1389 CA GLU A 211 15.450 2.409 -22.296 1.00 0.00 C ATOM 1390 C GLU A 211 14.748 1.135 -22.756 1.00 0.00 C ATOM 1391 O GLU A 211 13.544 0.973 -22.562 1.00 0.00 O ATOM 1392 CB GLU A 211 15.927 3.209 -23.510 1.00 0.00 C ATOM 1393 CG GLU A 211 14.819 3.534 -24.498 1.00 0.00 C ATOM 1394 CD GLU A 211 15.089 4.805 -25.280 1.00 0.00 C ATOM 1395 OE1 GLU A 211 15.388 5.839 -24.648 1.00 0.00 O ATOM 1396 OE2 GLU A 211 15.003 4.764 -26.526 1.00 0.00 O ATOM 0 H GLU A 211 17.484 2.376 -21.787 1.00 0.00 H new ATOM 0 HA GLU A 211 14.738 3.011 -21.730 1.00 0.00 H new ATOM 0 HB2 GLU A 211 16.380 4.139 -23.167 1.00 0.00 H new ATOM 0 HB3 GLU A 211 16.706 2.645 -24.023 1.00 0.00 H new ATOM 0 HG2 GLU A 211 14.701 2.702 -25.193 1.00 0.00 H new ATOM 0 HG3 GLU A 211 13.876 3.636 -23.960 1.00 0.00 H new ATOM 1403 N GLN A 212 15.511 0.234 -23.367 1.00 0.00 N ATOM 1404 CA GLN A 212 14.962 -1.025 -23.856 1.00 0.00 C ATOM 1405 C GLN A 212 14.213 -1.759 -22.749 1.00 0.00 C ATOM 1406 O GLN A 212 13.146 -2.326 -22.979 1.00 0.00 O ATOM 1407 CB GLN A 212 16.080 -1.913 -24.407 1.00 0.00 C ATOM 1408 CG GLN A 212 16.383 -1.667 -25.876 1.00 0.00 C ATOM 1409 CD GLN A 212 15.192 -1.945 -26.773 1.00 0.00 C ATOM 1410 OE1 GLN A 212 14.283 -2.688 -26.403 1.00 0.00 O ATOM 1411 NE2 GLN A 212 15.192 -1.347 -27.958 1.00 0.00 N ATOM 0 H GLN A 212 16.510 0.353 -23.535 1.00 0.00 H new ATOM 0 HA GLN A 212 14.258 -0.799 -24.657 1.00 0.00 H new ATOM 0 HB2 GLN A 212 16.986 -1.746 -23.825 1.00 0.00 H new ATOM 0 HB3 GLN A 212 15.803 -2.958 -24.272 1.00 0.00 H new ATOM 0 HG2 GLN A 212 16.700 -0.633 -26.009 1.00 0.00 H new ATOM 0 HG3 GLN A 212 17.218 -2.298 -26.181 1.00 0.00 H new ATOM 0 HE21 GLN A 212 15.967 -0.739 -28.222 1.00 0.00 H new ATOM 0 HE22 GLN A 212 14.417 -1.495 -28.604 1.00 0.00 H new ATOM 1420 N MET A 213 14.781 -1.745 -21.547 1.00 0.00 N ATOM 1421 CA MET A 213 14.166 -2.409 -20.403 1.00 0.00 C ATOM 1422 C MET A 213 12.719 -1.957 -20.226 1.00 0.00 C ATOM 1423 O MET A 213 11.831 -2.771 -19.973 1.00 0.00 O ATOM 1424 CB MET A 213 14.962 -2.120 -19.130 1.00 0.00 C ATOM 1425 CG MET A 213 15.720 -3.327 -18.600 1.00 0.00 C ATOM 1426 SD MET A 213 16.131 -3.176 -16.851 1.00 0.00 S ATOM 1427 CE MET A 213 17.289 -1.810 -16.892 1.00 0.00 C ATOM 0 H MET A 213 15.666 -1.281 -21.340 1.00 0.00 H new ATOM 0 HA MET A 213 14.173 -3.483 -20.591 1.00 0.00 H new ATOM 0 HB2 MET A 213 15.670 -1.315 -19.329 1.00 0.00 H new ATOM 0 HB3 MET A 213 14.280 -1.762 -18.359 1.00 0.00 H new ATOM 0 HG2 MET A 213 15.119 -4.224 -18.752 1.00 0.00 H new ATOM 0 HG3 MET A 213 16.637 -3.456 -19.175 1.00 0.00 H new ATOM 0 HE1 MET A 213 17.768 -1.710 -15.918 1.00 0.00 H new ATOM 0 HE2 MET A 213 18.047 -1.999 -17.652 1.00 0.00 H new ATOM 0 HE3 MET A 213 16.757 -0.889 -17.131 1.00 0.00 H new ATOM 1437 N CYS A 214 12.490 -0.655 -20.360 1.00 0.00 N ATOM 1438 CA CYS A 214 11.152 -0.094 -20.213 1.00 0.00 C ATOM 1439 C CYS A 214 10.227 -0.600 -21.316 1.00 0.00 C ATOM 1440 O CYS A 214 9.024 -0.760 -21.106 1.00 0.00 O ATOM 1441 CB CYS A 214 11.211 1.434 -20.243 1.00 0.00 C ATOM 1442 SG CYS A 214 10.052 2.246 -19.096 1.00 0.00 S ATOM 0 H CYS A 214 13.214 0.032 -20.570 1.00 0.00 H new ATOM 0 HA CYS A 214 10.753 -0.416 -19.251 1.00 0.00 H new ATOM 0 HB2 CYS A 214 12.226 1.752 -20.003 1.00 0.00 H new ATOM 0 HB3 CYS A 214 11.001 1.775 -21.257 1.00 0.00 H new ATOM 0 HG CYS A 214 9.110 2.831 -19.774 1.00 0.00 H new ATOM 1447 N ILE A 215 10.797 -0.851 -22.490 1.00 0.00 N ATOM 1448 CA ILE A 215 10.024 -1.341 -23.625 1.00 0.00 C ATOM 1449 C ILE A 215 9.706 -2.824 -23.475 1.00 0.00 C ATOM 1450 O ILE A 215 8.614 -3.276 -23.822 1.00 0.00 O ATOM 1451 CB ILE A 215 10.772 -1.119 -24.953 1.00 0.00 C ATOM 1452 CG1 ILE A 215 11.218 0.340 -25.075 1.00 0.00 C ATOM 1453 CG2 ILE A 215 9.889 -1.508 -26.129 1.00 0.00 C ATOM 1454 CD1 ILE A 215 12.089 0.606 -26.282 1.00 0.00 C ATOM 0 H ILE A 215 11.791 -0.723 -22.680 1.00 0.00 H new ATOM 0 HA ILE A 215 9.094 -0.773 -23.642 1.00 0.00 H new ATOM 0 HB ILE A 215 11.659 -1.753 -24.964 1.00 0.00 H new ATOM 0 HG12 ILE A 215 10.336 0.978 -25.126 1.00 0.00 H new ATOM 0 HG13 ILE A 215 11.763 0.621 -24.174 1.00 0.00 H new ATOM 0 HG21 ILE A 215 10.431 -1.346 -27.061 1.00 0.00 H new ATOM 0 HG22 ILE A 215 9.616 -2.560 -26.047 1.00 0.00 H new ATOM 0 HG23 ILE A 215 8.986 -0.897 -26.124 1.00 0.00 H new ATOM 0 HD11 ILE A 215 12.367 1.660 -26.305 1.00 0.00 H new ATOM 0 HD12 ILE A 215 12.989 -0.006 -26.223 1.00 0.00 H new ATOM 0 HD13 ILE A 215 11.539 0.356 -27.190 1.00 0.00 H new ATOM 1466 N THR A 216 10.668 -3.580 -22.953 1.00 0.00 N ATOM 1467 CA THR A 216 10.491 -5.013 -22.756 1.00 0.00 C ATOM 1468 C THR A 216 9.247 -5.305 -21.925 1.00 0.00 C ATOM 1469 O THR A 216 8.530 -6.272 -22.183 1.00 0.00 O ATOM 1470 CB THR A 216 11.716 -5.640 -22.064 1.00 0.00 C ATOM 1471 OG1 THR A 216 12.895 -5.395 -22.837 1.00 0.00 O ATOM 1472 CG2 THR A 216 11.526 -7.139 -21.881 1.00 0.00 C ATOM 0 H THR A 216 11.577 -3.223 -22.659 1.00 0.00 H new ATOM 0 HA THR A 216 10.375 -5.456 -23.745 1.00 0.00 H new ATOM 0 HB THR A 216 11.825 -5.180 -21.082 1.00 0.00 H new ATOM 0 HG1 THR A 216 13.097 -4.436 -22.830 1.00 0.00 H new ATOM 0 HG21 THR A 216 12.404 -7.560 -21.390 1.00 0.00 H new ATOM 0 HG22 THR A 216 10.644 -7.322 -21.267 1.00 0.00 H new ATOM 0 HG23 THR A 216 11.394 -7.611 -22.855 1.00 0.00 H new ATOM 1480 N GLN A 217 8.996 -4.463 -20.928 1.00 0.00 N ATOM 1481 CA GLN A 217 7.838 -4.631 -20.059 1.00 0.00 C ATOM 1482 C GLN A 217 6.544 -4.608 -20.866 1.00 0.00 C ATOM 1483 O GLN A 217 5.666 -5.449 -20.674 1.00 0.00 O ATOM 1484 CB GLN A 217 7.808 -3.533 -18.994 1.00 0.00 C ATOM 1485 CG GLN A 217 7.054 -3.927 -17.735 1.00 0.00 C ATOM 1486 CD GLN A 217 6.305 -2.764 -17.114 1.00 0.00 C ATOM 1487 OE1 GLN A 217 5.108 -2.590 -17.342 1.00 0.00 O ATOM 1488 NE2 GLN A 217 7.009 -1.960 -16.326 1.00 0.00 N ATOM 0 H GLN A 217 9.579 -3.657 -20.702 1.00 0.00 H new ATOM 0 HA GLN A 217 7.922 -5.601 -19.568 1.00 0.00 H new ATOM 0 HB2 GLN A 217 8.831 -3.269 -18.727 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.349 -2.640 -19.418 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.348 -4.723 -17.973 1.00 0.00 H new ATOM 0 HG3 GLN A 217 7.757 -4.332 -17.007 1.00 0.00 H new ATOM 0 HE21 GLN A 217 8.000 -2.143 -16.165 1.00 0.00 H new ATOM 0 HE22 GLN A 217 6.559 -1.160 -15.881 1.00 0.00 H new ATOM 1497 N TYR A 218 6.433 -3.640 -21.769 1.00 0.00 N ATOM 1498 CA TYR A 218 5.245 -3.506 -22.604 1.00 0.00 C ATOM 1499 C TYR A 218 5.297 -4.471 -23.784 1.00 0.00 C ATOM 1500 O TYR A 218 6.059 -4.272 -24.730 1.00 0.00 O ATOM 1501 CB TYR A 218 5.113 -2.069 -23.111 1.00 0.00 C ATOM 1502 CG TYR A 218 5.229 -1.029 -22.020 1.00 0.00 C ATOM 1503 CD1 TYR A 218 4.383 -1.051 -20.918 1.00 0.00 C ATOM 1504 CD2 TYR A 218 6.185 -0.023 -22.092 1.00 0.00 C ATOM 1505 CE1 TYR A 218 4.486 -0.102 -19.920 1.00 0.00 C ATOM 1506 CE2 TYR A 218 6.296 0.929 -21.097 1.00 0.00 C ATOM 1507 CZ TYR A 218 5.443 0.886 -20.013 1.00 0.00 C ATOM 1508 OH TYR A 218 5.549 1.832 -19.020 1.00 0.00 O ATOM 0 H TYR A 218 7.151 -2.937 -21.941 1.00 0.00 H new ATOM 0 HA TYR A 218 4.374 -3.751 -21.996 1.00 0.00 H new ATOM 0 HB2 TYR A 218 5.883 -1.885 -23.860 1.00 0.00 H new ATOM 0 HB3 TYR A 218 4.150 -1.955 -23.609 1.00 0.00 H new ATOM 0 HD1 TYR A 218 3.632 -1.823 -20.841 1.00 0.00 H new ATOM 0 HD2 TYR A 218 6.853 0.015 -22.940 1.00 0.00 H new ATOM 0 HE1 TYR A 218 3.820 -0.134 -19.071 1.00 0.00 H new ATOM 0 HE2 TYR A 218 7.046 1.703 -21.167 1.00 0.00 H new ATOM 0 HH TYR A 218 6.273 2.455 -19.238 1.00 0.00 H new