USER MOD reduce.3.24.130724 H: found=0, std=0, add=749, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 750 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 215 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 218 THR OG1 : rot -126:sc= 1.43 USER MOD Set 2.1: A 191 HIS :FLIP no HE2:sc= -3.26 F(o=-6.1,f=-4) USER MOD Set 2.2: A 201 HIS : no HD1:sc= -0.77 K(o=-4,f=-5.9!) USER MOD Set 3.1: A 157 MET CE :methyl -155:sc= -1.06 (180deg=-1.06) USER MOD Set 3.2: A 186 HIS : no HD1:sc= -1.28 K(o=-2.3,f=-3.4) USER MOD Single : A 141 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 ASN : amide:sc= -0.465 X(o=-0.46,f=-0.054) USER MOD Single : A 147 THR OG1 : rot 67:sc= 0.12 USER MOD Single : A 149 LYS NZ :NH3+ 165:sc= -0.554 (180deg=-0.817) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN : amide:sc= -2.69! C(o=-2.7!,f=-4.6!) USER MOD Single : A 156 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 GLN : amide:sc= -0.901 K(o=-0.9,f=-4!) USER MOD Single : A 170 ASN : amide:sc= -1.58! C(o=-1.6!,f=-4.4!) USER MOD Single : A 172 ASN : amide:sc= 0.0389 K(o=0.039,f=-2.6!) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 ASN : amide:sc= -0.093 X(o=-0.093,f=0) USER MOD Single : A 175 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 177 LYS NZ :NH3+ 138:sc= 0.77 (180deg=-0.00716) USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 182 MET CE :methyl -137:sc= -0.815 (180deg=-2.49) USER MOD Single : A 183 THR OG1 : rot 180:sc= 0 USER MOD Single : A 184 SER OG : rot 180:sc= 0 USER MOD Single : A 185 TYR OH : rot 180:sc= 0 USER MOD Single : A 188 MET CE :methyl -106:sc= -0.545 (180deg=-1.45) USER MOD Single : A 196 TYR OH : rot 180:sc= 0 USER MOD Single : A 199 MET CE :methyl -177:sc= -1.52 (180deg=-1.55) USER MOD Single : A 202 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 205 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 206 THR OG1 : rot -78:sc= -0.773 USER MOD Single : A 208 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 213 ASN : amide:sc= -1.76 K(o=-1.8,f=-4!) USER MOD Single : A 214 LYS NZ :NH3+ -123:sc= -0.0141 (180deg=-0.586) USER MOD Single : A 216 SER OG : rot 180:sc=-0.00977 USER MOD Single : A 217 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 223 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 226 SER OG : rot -36:sc= 0.439 USER MOD ----------------------------------------------------------------- ATOM 143 N ASP A 139 10.342 -3.496 11.147 1.00 0.00 N ATOM 144 CA ASP A 139 11.129 -3.633 9.927 1.00 0.00 C ATOM 145 C ASP A 139 10.230 -3.931 8.731 1.00 0.00 C ATOM 146 O ASP A 139 9.972 -5.091 8.409 1.00 0.00 O ATOM 147 CB ASP A 139 12.170 -4.742 10.087 1.00 0.00 C ATOM 148 CG ASP A 139 13.022 -4.562 11.329 1.00 0.00 C ATOM 149 OD1 ASP A 139 12.456 -4.558 12.442 1.00 0.00 O ATOM 150 OD2 ASP A 139 14.255 -4.425 11.187 1.00 0.00 O ATOM 0 HA ASP A 139 11.642 -2.688 9.747 1.00 0.00 H new ATOM 0 HB2 ASP A 139 11.665 -5.707 10.133 1.00 0.00 H new ATOM 0 HB3 ASP A 139 12.814 -4.761 9.208 1.00 0.00 H new ATOM 155 N LEU A 140 9.755 -2.876 8.077 1.00 0.00 N ATOM 156 CA LEU A 140 8.884 -3.025 6.917 1.00 0.00 C ATOM 157 C LEU A 140 9.537 -3.902 5.854 1.00 0.00 C ATOM 158 O LEU A 140 9.018 -4.963 5.505 1.00 0.00 O ATOM 159 CB LEU A 140 8.549 -1.654 6.328 1.00 0.00 C ATOM 160 CG LEU A 140 7.717 -0.726 7.215 1.00 0.00 C ATOM 161 CD1 LEU A 140 7.856 0.717 6.757 1.00 0.00 C ATOM 162 CD2 LEU A 140 6.256 -1.151 7.209 1.00 0.00 C ATOM 0 H LEU A 140 9.958 -1.909 8.330 1.00 0.00 H new ATOM 0 HA LEU A 140 7.964 -3.508 7.244 1.00 0.00 H new ATOM 0 HB2 LEU A 140 9.483 -1.148 6.083 1.00 0.00 H new ATOM 0 HB3 LEU A 140 8.013 -1.805 5.391 1.00 0.00 H new ATOM 0 HG LEU A 140 8.092 -0.799 8.236 1.00 0.00 H new ATOM 0 HD11 LEU A 140 7.257 1.362 7.400 1.00 0.00 H new ATOM 0 HD12 LEU A 140 8.902 1.018 6.814 1.00 0.00 H new ATOM 0 HD13 LEU A 140 7.509 0.807 5.728 1.00 0.00 H new ATOM 0 HD21 LEU A 140 5.679 -0.480 7.845 1.00 0.00 H new ATOM 0 HD22 LEU A 140 5.869 -1.108 6.191 1.00 0.00 H new ATOM 0 HD23 LEU A 140 6.172 -2.170 7.587 1.00 0.00 H new ATOM 174 N HIS A 141 10.679 -3.453 5.344 1.00 0.00 N ATOM 175 CA HIS A 141 11.406 -4.199 4.322 1.00 0.00 C ATOM 176 C HIS A 141 11.332 -5.699 4.589 1.00 0.00 C ATOM 177 O HIS A 141 10.980 -6.479 3.705 1.00 0.00 O ATOM 178 CB HIS A 141 12.866 -3.749 4.273 1.00 0.00 C ATOM 179 CG HIS A 141 13.637 -4.339 3.133 1.00 0.00 C ATOM 180 ND1 HIS A 141 14.975 -4.662 3.216 1.00 0.00 N ATOM 181 CD2 HIS A 141 13.250 -4.667 1.878 1.00 0.00 C ATOM 182 CE1 HIS A 141 15.378 -5.161 2.061 1.00 0.00 C ATOM 183 NE2 HIS A 141 14.350 -5.175 1.232 1.00 0.00 N ATOM 0 H HIS A 141 11.121 -2.577 5.621 1.00 0.00 H new ATOM 0 HA HIS A 141 10.939 -3.996 3.358 1.00 0.00 H new ATOM 0 HB2 HIS A 141 12.900 -2.662 4.200 1.00 0.00 H new ATOM 0 HB3 HIS A 141 13.353 -4.021 5.209 1.00 0.00 H new ATOM 0 HD2 HIS A 141 12.260 -4.551 1.462 1.00 0.00 H new ATOM 0 HE1 HIS A 141 16.378 -5.500 1.833 1.00 0.00 H new ATOM 0 HE2 HIS A 141 14.370 -5.509 0.268 1.00 0.00 H new ATOM 192 N GLU A 142 11.667 -6.095 5.813 1.00 0.00 N ATOM 193 CA GLU A 142 11.640 -7.502 6.195 1.00 0.00 C ATOM 194 C GLU A 142 10.284 -8.126 5.878 1.00 0.00 C ATOM 195 O GLU A 142 10.188 -9.057 5.080 1.00 0.00 O ATOM 196 CB GLU A 142 11.949 -7.655 7.685 1.00 0.00 C ATOM 197 CG GLU A 142 13.435 -7.729 7.995 1.00 0.00 C ATOM 198 CD GLU A 142 13.994 -9.130 7.839 1.00 0.00 C ATOM 199 OE1 GLU A 142 13.324 -10.089 8.276 1.00 0.00 O ATOM 200 OE2 GLU A 142 15.103 -9.267 7.280 1.00 0.00 O ATOM 0 H GLU A 142 11.960 -5.461 6.557 1.00 0.00 H new ATOM 0 HA GLU A 142 12.404 -8.023 5.618 1.00 0.00 H new ATOM 0 HB2 GLU A 142 11.515 -6.814 8.225 1.00 0.00 H new ATOM 0 HB3 GLU A 142 11.464 -8.557 8.057 1.00 0.00 H new ATOM 0 HG2 GLU A 142 13.975 -7.051 7.334 1.00 0.00 H new ATOM 0 HG3 GLU A 142 13.607 -7.384 9.015 1.00 0.00 H new ATOM 207 N PHE A 143 9.238 -7.605 6.512 1.00 0.00 N ATOM 208 CA PHE A 143 7.887 -8.111 6.300 1.00 0.00 C ATOM 209 C PHE A 143 7.569 -8.207 4.810 1.00 0.00 C ATOM 210 O PHE A 143 7.165 -9.261 4.317 1.00 0.00 O ATOM 211 CB PHE A 143 6.866 -7.205 6.993 1.00 0.00 C ATOM 212 CG PHE A 143 5.440 -7.585 6.712 1.00 0.00 C ATOM 213 CD1 PHE A 143 4.795 -8.530 7.494 1.00 0.00 C ATOM 214 CD2 PHE A 143 4.745 -6.997 5.668 1.00 0.00 C ATOM 215 CE1 PHE A 143 3.483 -8.882 7.237 1.00 0.00 C ATOM 216 CE2 PHE A 143 3.433 -7.344 5.407 1.00 0.00 C ATOM 217 CZ PHE A 143 2.801 -8.287 6.193 1.00 0.00 C ATOM 0 H PHE A 143 9.300 -6.833 7.176 1.00 0.00 H new ATOM 0 HA PHE A 143 7.829 -9.110 6.731 1.00 0.00 H new ATOM 0 HB2 PHE A 143 7.037 -7.235 8.069 1.00 0.00 H new ATOM 0 HB3 PHE A 143 7.029 -6.176 6.673 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.323 -8.996 8.313 1.00 0.00 H new ATOM 0 HD2 PHE A 143 5.234 -6.258 5.050 1.00 0.00 H new ATOM 0 HE1 PHE A 143 2.992 -9.622 7.852 1.00 0.00 H new ATOM 0 HE2 PHE A 143 2.903 -6.878 4.589 1.00 0.00 H new ATOM 0 HZ PHE A 143 1.775 -8.559 5.992 1.00 0.00 H new ATOM 227 N LEU A 144 7.754 -7.100 4.100 1.00 0.00 N ATOM 228 CA LEU A 144 7.488 -7.058 2.666 1.00 0.00 C ATOM 229 C LEU A 144 8.078 -8.278 1.966 1.00 0.00 C ATOM 230 O LEU A 144 7.380 -8.992 1.246 1.00 0.00 O ATOM 231 CB LEU A 144 8.064 -5.778 2.057 1.00 0.00 C ATOM 232 CG LEU A 144 7.326 -4.482 2.397 1.00 0.00 C ATOM 233 CD1 LEU A 144 8.215 -3.277 2.134 1.00 0.00 C ATOM 234 CD2 LEU A 144 6.035 -4.379 1.599 1.00 0.00 C ATOM 0 H LEU A 144 8.087 -6.220 4.493 1.00 0.00 H new ATOM 0 HA LEU A 144 6.408 -7.067 2.522 1.00 0.00 H new ATOM 0 HB2 LEU A 144 9.100 -5.679 2.382 1.00 0.00 H new ATOM 0 HB3 LEU A 144 8.079 -5.890 0.973 1.00 0.00 H new ATOM 0 HG LEU A 144 7.074 -4.497 3.457 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.673 -2.364 2.382 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.112 -3.345 2.750 1.00 0.00 H new ATOM 0 HD13 LEU A 144 8.498 -3.257 1.082 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.523 -3.451 1.854 1.00 0.00 H new ATOM 0 HD22 LEU A 144 6.264 -4.386 0.533 1.00 0.00 H new ATOM 0 HD23 LEU A 144 5.391 -5.226 1.838 1.00 0.00 H new ATOM 246 N VAL A 145 9.368 -8.512 2.184 1.00 0.00 N ATOM 247 CA VAL A 145 10.052 -9.647 1.577 1.00 0.00 C ATOM 248 C VAL A 145 9.394 -10.963 1.976 1.00 0.00 C ATOM 249 O VAL A 145 9.062 -11.786 1.125 1.00 0.00 O ATOM 250 CB VAL A 145 11.539 -9.687 1.979 1.00 0.00 C ATOM 251 CG1 VAL A 145 12.226 -10.896 1.363 1.00 0.00 C ATOM 252 CG2 VAL A 145 12.236 -8.400 1.567 1.00 0.00 C ATOM 0 H VAL A 145 9.960 -7.930 2.777 1.00 0.00 H new ATOM 0 HA VAL A 145 9.978 -9.520 0.497 1.00 0.00 H new ATOM 0 HB VAL A 145 11.603 -9.777 3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 145 13.275 -10.908 1.658 1.00 0.00 H new ATOM 0 HG12 VAL A 145 11.741 -11.807 1.712 1.00 0.00 H new ATOM 0 HG13 VAL A 145 12.155 -10.841 0.277 1.00 0.00 H new ATOM 0 HG21 VAL A 145 13.285 -8.445 1.858 1.00 0.00 H new ATOM 0 HG22 VAL A 145 12.165 -8.277 0.486 1.00 0.00 H new ATOM 0 HG23 VAL A 145 11.758 -7.554 2.061 1.00 0.00 H new ATOM 262 N ASN A 146 9.207 -11.154 3.278 1.00 0.00 N ATOM 263 CA ASN A 146 8.588 -12.370 3.791 1.00 0.00 C ATOM 264 C ASN A 146 7.290 -12.675 3.049 1.00 0.00 C ATOM 265 O ASN A 146 7.026 -13.819 2.679 1.00 0.00 O ATOM 266 CB ASN A 146 8.312 -12.234 5.290 1.00 0.00 C ATOM 267 CG ASN A 146 7.339 -13.281 5.796 1.00 0.00 C ATOM 268 OD1 ASN A 146 7.743 -14.348 6.258 1.00 0.00 O ATOM 269 ND2 ASN A 146 6.048 -12.979 5.712 1.00 0.00 N ATOM 0 H ASN A 146 9.475 -10.482 3.997 1.00 0.00 H new ATOM 0 HA ASN A 146 9.281 -13.196 3.629 1.00 0.00 H new ATOM 0 HB2 ASN A 146 9.250 -12.319 5.839 1.00 0.00 H new ATOM 0 HB3 ASN A 146 7.912 -11.241 5.494 1.00 0.00 H new ATOM 0 HD21 ASN A 146 5.346 -13.644 6.038 1.00 0.00 H new ATOM 0 HD22 ASN A 146 5.758 -12.082 5.322 1.00 0.00 H new ATOM 276 N THR A 147 6.481 -11.641 2.835 1.00 0.00 N ATOM 277 CA THR A 147 5.211 -11.797 2.138 1.00 0.00 C ATOM 278 C THR A 147 5.423 -12.286 0.709 1.00 0.00 C ATOM 279 O THR A 147 4.733 -13.194 0.243 1.00 0.00 O ATOM 280 CB THR A 147 4.422 -10.475 2.103 1.00 0.00 C ATOM 281 OG1 THR A 147 4.204 -10.000 3.437 1.00 0.00 O ATOM 282 CG2 THR A 147 3.086 -10.659 1.400 1.00 0.00 C ATOM 0 H THR A 147 6.683 -10.687 3.135 1.00 0.00 H new ATOM 0 HA THR A 147 4.637 -12.540 2.692 1.00 0.00 H new ATOM 0 HB THR A 147 5.008 -9.743 1.547 1.00 0.00 H new ATOM 0 HG1 THR A 147 5.062 -9.749 3.839 1.00 0.00 H new ATOM 0 HG21 THR A 147 2.548 -9.711 1.388 1.00 0.00 H new ATOM 0 HG22 THR A 147 3.256 -10.992 0.376 1.00 0.00 H new ATOM 0 HG23 THR A 147 2.495 -11.405 1.931 1.00 0.00 H new ATOM 290 N LEU A 148 6.383 -11.680 0.019 1.00 0.00 N ATOM 291 CA LEU A 148 6.687 -12.054 -1.358 1.00 0.00 C ATOM 292 C LEU A 148 7.041 -13.535 -1.454 1.00 0.00 C ATOM 293 O LEU A 148 6.660 -14.215 -2.407 1.00 0.00 O ATOM 294 CB LEU A 148 7.842 -11.206 -1.894 1.00 0.00 C ATOM 295 CG LEU A 148 7.529 -9.731 -2.148 1.00 0.00 C ATOM 296 CD1 LEU A 148 8.814 -8.930 -2.291 1.00 0.00 C ATOM 297 CD2 LEU A 148 6.661 -9.575 -3.388 1.00 0.00 C ATOM 0 H LEU A 148 6.964 -10.928 0.390 1.00 0.00 H new ATOM 0 HA LEU A 148 5.799 -11.871 -1.963 1.00 0.00 H new ATOM 0 HB2 LEU A 148 8.669 -11.265 -1.186 1.00 0.00 H new ATOM 0 HB3 LEU A 148 8.189 -11.649 -2.827 1.00 0.00 H new ATOM 0 HG LEU A 148 6.977 -9.344 -1.292 1.00 0.00 H new ATOM 0 HD11 LEU A 148 8.572 -7.883 -2.471 1.00 0.00 H new ATOM 0 HD12 LEU A 148 9.399 -9.015 -1.375 1.00 0.00 H new ATOM 0 HD13 LEU A 148 9.393 -9.318 -3.129 1.00 0.00 H new ATOM 0 HD21 LEU A 148 6.449 -8.519 -3.553 1.00 0.00 H new ATOM 0 HD22 LEU A 148 7.187 -9.979 -4.253 1.00 0.00 H new ATOM 0 HD23 LEU A 148 5.725 -10.116 -3.247 1.00 0.00 H new ATOM 309 N LYS A 149 7.771 -14.029 -0.460 1.00 0.00 N ATOM 310 CA LYS A 149 8.175 -15.430 -0.429 1.00 0.00 C ATOM 311 C LYS A 149 6.972 -16.337 -0.187 1.00 0.00 C ATOM 312 O LYS A 149 6.596 -17.130 -1.050 1.00 0.00 O ATOM 313 CB LYS A 149 9.225 -15.655 0.661 1.00 0.00 C ATOM 314 CG LYS A 149 10.506 -14.870 0.442 1.00 0.00 C ATOM 315 CD LYS A 149 11.615 -15.342 1.368 1.00 0.00 C ATOM 316 CE LYS A 149 11.564 -14.626 2.709 1.00 0.00 C ATOM 317 NZ LYS A 149 10.676 -15.326 3.678 1.00 0.00 N ATOM 0 H LYS A 149 8.095 -13.479 0.336 1.00 0.00 H new ATOM 0 HA LYS A 149 8.607 -15.680 -1.398 1.00 0.00 H new ATOM 0 HB2 LYS A 149 8.800 -15.379 1.626 1.00 0.00 H new ATOM 0 HB3 LYS A 149 9.464 -16.717 0.710 1.00 0.00 H new ATOM 0 HG2 LYS A 149 10.826 -14.976 -0.594 1.00 0.00 H new ATOM 0 HG3 LYS A 149 10.317 -13.810 0.610 1.00 0.00 H new ATOM 0 HD2 LYS A 149 11.527 -16.417 1.525 1.00 0.00 H new ATOM 0 HD3 LYS A 149 12.582 -15.167 0.897 1.00 0.00 H new ATOM 0 HE2 LYS A 149 12.570 -14.557 3.123 1.00 0.00 H new ATOM 0 HE3 LYS A 149 11.209 -13.606 2.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 10.858 -14.968 4.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 9.682 -15.152 3.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 10.867 -16.348 3.648 1.00 0.00 H new ATOM 331 N LYS A 150 6.372 -16.214 0.992 1.00 0.00 N ATOM 332 CA LYS A 150 5.211 -17.020 1.347 1.00 0.00 C ATOM 333 C LYS A 150 4.112 -16.883 0.299 1.00 0.00 C ATOM 334 O LYS A 150 3.616 -17.879 -0.228 1.00 0.00 O ATOM 335 CB LYS A 150 4.676 -16.604 2.719 1.00 0.00 C ATOM 336 CG LYS A 150 5.510 -17.119 3.880 1.00 0.00 C ATOM 337 CD LYS A 150 5.204 -18.576 4.184 1.00 0.00 C ATOM 338 CE LYS A 150 3.863 -18.728 4.884 1.00 0.00 C ATOM 339 NZ LYS A 150 3.466 -20.158 5.018 1.00 0.00 N ATOM 0 H LYS A 150 6.671 -15.563 1.718 1.00 0.00 H new ATOM 0 HA LYS A 150 5.523 -18.064 1.386 1.00 0.00 H new ATOM 0 HB2 LYS A 150 4.633 -15.516 2.768 1.00 0.00 H new ATOM 0 HB3 LYS A 150 3.654 -16.968 2.827 1.00 0.00 H new ATOM 0 HG2 LYS A 150 6.569 -17.010 3.645 1.00 0.00 H new ATOM 0 HG3 LYS A 150 5.316 -16.513 4.765 1.00 0.00 H new ATOM 0 HD2 LYS A 150 5.199 -19.149 3.257 1.00 0.00 H new ATOM 0 HD3 LYS A 150 5.993 -18.992 4.811 1.00 0.00 H new ATOM 0 HE2 LYS A 150 3.915 -18.271 5.872 1.00 0.00 H new ATOM 0 HE3 LYS A 150 3.098 -18.190 4.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 2.547 -20.219 5.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 3.391 -20.587 4.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 4.183 -20.667 5.574 1.00 0.00 H new ATOM 353 N ASN A 151 3.737 -15.644 -0.001 1.00 0.00 N ATOM 354 CA ASN A 151 2.697 -15.377 -0.988 1.00 0.00 C ATOM 355 C ASN A 151 3.249 -14.559 -2.152 1.00 0.00 C ATOM 356 O ASN A 151 3.104 -13.337 -2.208 1.00 0.00 O ATOM 357 CB ASN A 151 1.526 -14.637 -0.339 1.00 0.00 C ATOM 358 CG ASN A 151 0.243 -14.773 -1.136 1.00 0.00 C ATOM 359 OD1 ASN A 151 0.266 -14.825 -2.366 1.00 0.00 O ATOM 360 ND2 ASN A 151 -0.884 -14.830 -0.436 1.00 0.00 N ATOM 0 H ASN A 151 4.138 -14.809 0.425 1.00 0.00 H new ATOM 0 HA ASN A 151 2.344 -16.333 -1.374 1.00 0.00 H new ATOM 0 HB2 ASN A 151 1.368 -15.024 0.668 1.00 0.00 H new ATOM 0 HB3 ASN A 151 1.778 -13.581 -0.238 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -1.779 -14.921 -0.917 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -0.855 -14.783 0.583 1.00 0.00 H new ATOM 367 N PRO A 152 3.896 -15.246 -3.104 1.00 0.00 N ATOM 368 CA PRO A 152 4.482 -14.603 -4.285 1.00 0.00 C ATOM 369 C PRO A 152 3.420 -14.081 -5.246 1.00 0.00 C ATOM 370 O PRO A 152 3.543 -12.980 -5.783 1.00 0.00 O ATOM 371 CB PRO A 152 5.287 -15.729 -4.938 1.00 0.00 C ATOM 372 CG PRO A 152 4.621 -16.983 -4.488 1.00 0.00 C ATOM 373 CD PRO A 152 4.107 -16.703 -3.103 1.00 0.00 C ATOM 0 HA PRO A 152 5.080 -13.731 -4.021 1.00 0.00 H new ATOM 0 HB2 PRO A 152 5.277 -15.644 -6.025 1.00 0.00 H new ATOM 0 HB3 PRO A 152 6.331 -15.701 -4.626 1.00 0.00 H new ATOM 0 HG2 PRO A 152 3.806 -17.255 -5.159 1.00 0.00 H new ATOM 0 HG3 PRO A 152 5.322 -17.817 -4.483 1.00 0.00 H new ATOM 0 HD2 PRO A 152 3.182 -17.243 -2.901 1.00 0.00 H new ATOM 0 HD3 PRO A 152 4.825 -17.004 -2.340 1.00 0.00 H new ATOM 381 N ARG A 153 2.377 -14.877 -5.459 1.00 0.00 N ATOM 382 CA ARG A 153 1.294 -14.494 -6.357 1.00 0.00 C ATOM 383 C ARG A 153 0.801 -13.084 -6.044 1.00 0.00 C ATOM 384 O ARG A 153 0.413 -12.338 -6.942 1.00 0.00 O ATOM 385 CB ARG A 153 0.136 -15.487 -6.246 1.00 0.00 C ATOM 386 CG ARG A 153 -0.801 -15.466 -7.442 1.00 0.00 C ATOM 387 CD ARG A 153 -0.220 -16.232 -8.619 1.00 0.00 C ATOM 388 NE ARG A 153 -0.420 -17.673 -8.487 1.00 0.00 N ATOM 389 CZ ARG A 153 -1.615 -18.253 -8.505 1.00 0.00 C ATOM 390 NH1 ARG A 153 -2.710 -17.520 -8.650 1.00 0.00 N ATOM 391 NH2 ARG A 153 -1.716 -19.570 -8.379 1.00 0.00 N ATOM 0 H ARG A 153 2.259 -15.791 -5.022 1.00 0.00 H new ATOM 0 HA ARG A 153 1.679 -14.508 -7.377 1.00 0.00 H new ATOM 0 HB2 ARG A 153 0.541 -16.492 -6.130 1.00 0.00 H new ATOM 0 HB3 ARG A 153 -0.435 -15.267 -5.344 1.00 0.00 H new ATOM 0 HG2 ARG A 153 -1.760 -15.901 -7.161 1.00 0.00 H new ATOM 0 HG3 ARG A 153 -0.993 -14.434 -7.737 1.00 0.00 H new ATOM 0 HD2 ARG A 153 -0.684 -15.885 -9.542 1.00 0.00 H new ATOM 0 HD3 ARG A 153 0.846 -16.020 -8.699 1.00 0.00 H new ATOM 0 HE ARG A 153 0.402 -18.266 -8.375 1.00 0.00 H new ATOM 0 HH11 ARG A 153 -2.637 -16.507 -8.748 1.00 0.00 H new ATOM 0 HH12 ARG A 153 -3.626 -17.969 -8.663 1.00 0.00 H new ATOM 0 HH21 ARG A 153 -0.876 -20.138 -8.268 1.00 0.00 H new ATOM 0 HH22 ARG A 153 -2.634 -20.015 -8.393 1.00 0.00 H new ATOM 405 N ASP A 154 0.819 -12.727 -4.764 1.00 0.00 N ATOM 406 CA ASP A 154 0.375 -11.407 -4.332 1.00 0.00 C ATOM 407 C ASP A 154 1.189 -10.310 -5.011 1.00 0.00 C ATOM 408 O ASP A 154 0.656 -9.260 -5.370 1.00 0.00 O ATOM 409 CB ASP A 154 0.490 -11.279 -2.812 1.00 0.00 C ATOM 410 CG ASP A 154 -0.773 -11.717 -2.097 1.00 0.00 C ATOM 411 OD1 ASP A 154 -1.872 -11.507 -2.651 1.00 0.00 O ATOM 412 OD2 ASP A 154 -0.663 -12.268 -0.982 1.00 0.00 O ATOM 0 H ASP A 154 1.136 -13.334 -4.008 1.00 0.00 H new ATOM 0 HA ASP A 154 -0.670 -11.290 -4.621 1.00 0.00 H new ATOM 0 HB2 ASP A 154 1.329 -11.880 -2.462 1.00 0.00 H new ATOM 0 HB3 ASP A 154 0.710 -10.243 -2.553 1.00 0.00 H new ATOM 417 N ARG A 155 2.483 -10.561 -5.182 1.00 0.00 N ATOM 418 CA ARG A 155 3.371 -9.594 -5.816 1.00 0.00 C ATOM 419 C ARG A 155 2.640 -8.817 -6.907 1.00 0.00 C ATOM 420 O ARG A 155 2.914 -7.639 -7.133 1.00 0.00 O ATOM 421 CB ARG A 155 4.590 -10.302 -6.409 1.00 0.00 C ATOM 422 CG ARG A 155 4.306 -11.004 -7.727 1.00 0.00 C ATOM 423 CD ARG A 155 5.530 -11.748 -8.237 1.00 0.00 C ATOM 424 NE ARG A 155 5.250 -12.481 -9.470 1.00 0.00 N ATOM 425 CZ ARG A 155 6.192 -12.876 -10.319 1.00 0.00 C ATOM 426 NH1 ARG A 155 7.467 -12.610 -10.071 1.00 0.00 N ATOM 427 NH2 ARG A 155 5.859 -13.538 -11.420 1.00 0.00 N ATOM 0 H ARG A 155 2.939 -11.425 -4.890 1.00 0.00 H new ATOM 0 HA ARG A 155 3.703 -8.890 -5.053 1.00 0.00 H new ATOM 0 HB2 ARG A 155 5.385 -9.572 -6.560 1.00 0.00 H new ATOM 0 HB3 ARG A 155 4.960 -11.033 -5.690 1.00 0.00 H new ATOM 0 HG2 ARG A 155 3.481 -11.705 -7.597 1.00 0.00 H new ATOM 0 HG3 ARG A 155 3.988 -10.272 -8.469 1.00 0.00 H new ATOM 0 HD2 ARG A 155 6.339 -11.038 -8.413 1.00 0.00 H new ATOM 0 HD3 ARG A 155 5.876 -12.443 -7.472 1.00 0.00 H new ATOM 0 HE ARG A 155 4.279 -12.701 -9.690 1.00 0.00 H new ATOM 0 HH11 ARG A 155 7.727 -12.101 -9.226 1.00 0.00 H new ATOM 0 HH12 ARG A 155 8.188 -12.915 -10.725 1.00 0.00 H new ATOM 0 HH21 ARG A 155 4.879 -13.744 -11.615 1.00 0.00 H new ATOM 0 HH22 ARG A 155 6.583 -13.841 -12.072 1.00 0.00 H new ATOM 441 N MET A 156 1.709 -9.486 -7.579 1.00 0.00 N ATOM 442 CA MET A 156 0.938 -8.858 -8.646 1.00 0.00 C ATOM 443 C MET A 156 0.308 -7.554 -8.166 1.00 0.00 C ATOM 444 O MET A 156 0.602 -6.481 -8.694 1.00 0.00 O ATOM 445 CB MET A 156 -0.151 -9.810 -9.146 1.00 0.00 C ATOM 446 CG MET A 156 0.391 -11.000 -9.920 1.00 0.00 C ATOM 447 SD MET A 156 -0.903 -11.922 -10.772 1.00 0.00 S ATOM 448 CE MET A 156 -0.340 -11.808 -12.468 1.00 0.00 C ATOM 0 H MET A 156 1.470 -10.462 -7.404 1.00 0.00 H new ATOM 0 HA MET A 156 1.618 -8.632 -9.467 1.00 0.00 H new ATOM 0 HB2 MET A 156 -0.725 -10.173 -8.293 1.00 0.00 H new ATOM 0 HB3 MET A 156 -0.841 -9.257 -9.783 1.00 0.00 H new ATOM 0 HG2 MET A 156 1.123 -10.652 -10.648 1.00 0.00 H new ATOM 0 HG3 MET A 156 0.915 -11.666 -9.235 1.00 0.00 H new ATOM 0 HE1 MET A 156 -1.039 -12.333 -13.119 1.00 0.00 H new ATOM 0 HE2 MET A 156 -0.285 -10.760 -12.763 1.00 0.00 H new ATOM 0 HE3 MET A 156 0.647 -12.262 -12.555 1.00 0.00 H new ATOM 458 N MET A 157 -0.558 -7.654 -7.163 1.00 0.00 N ATOM 459 CA MET A 157 -1.228 -6.481 -6.613 1.00 0.00 C ATOM 460 C MET A 157 -0.214 -5.490 -6.051 1.00 0.00 C ATOM 461 O MET A 157 -0.230 -4.307 -6.395 1.00 0.00 O ATOM 462 CB MET A 157 -2.213 -6.897 -5.518 1.00 0.00 C ATOM 463 CG MET A 157 -2.864 -5.721 -4.808 1.00 0.00 C ATOM 464 SD MET A 157 -1.919 -5.164 -3.377 1.00 0.00 S ATOM 465 CE MET A 157 -3.237 -4.644 -2.282 1.00 0.00 C ATOM 0 H MET A 157 -0.812 -8.534 -6.715 1.00 0.00 H new ATOM 0 HA MET A 157 -1.776 -5.995 -7.420 1.00 0.00 H new ATOM 0 HB2 MET A 157 -2.991 -7.521 -5.958 1.00 0.00 H new ATOM 0 HB3 MET A 157 -1.690 -7.510 -4.784 1.00 0.00 H new ATOM 0 HG2 MET A 157 -2.975 -4.894 -5.510 1.00 0.00 H new ATOM 0 HG3 MET A 157 -3.867 -6.004 -4.488 1.00 0.00 H new ATOM 0 HE1 MET A 157 -2.857 -3.897 -1.585 1.00 0.00 H new ATOM 0 HE2 MET A 157 -4.049 -4.213 -2.868 1.00 0.00 H new ATOM 0 HE3 MET A 157 -3.609 -5.504 -1.726 1.00 0.00 H new ATOM 475 N LEU A 158 0.667 -5.978 -5.185 1.00 0.00 N ATOM 476 CA LEU A 158 1.689 -5.135 -4.575 1.00 0.00 C ATOM 477 C LEU A 158 2.335 -4.224 -5.615 1.00 0.00 C ATOM 478 O LEU A 158 2.346 -3.002 -5.464 1.00 0.00 O ATOM 479 CB LEU A 158 2.757 -5.999 -3.903 1.00 0.00 C ATOM 480 CG LEU A 158 2.394 -6.570 -2.532 1.00 0.00 C ATOM 481 CD1 LEU A 158 3.321 -7.720 -2.169 1.00 0.00 C ATOM 482 CD2 LEU A 158 2.450 -5.482 -1.469 1.00 0.00 C ATOM 0 H LEU A 158 0.694 -6.954 -4.889 1.00 0.00 H new ATOM 0 HA LEU A 158 1.208 -4.512 -3.821 1.00 0.00 H new ATOM 0 HB2 LEU A 158 2.996 -6.829 -4.568 1.00 0.00 H new ATOM 0 HB3 LEU A 158 3.664 -5.404 -3.798 1.00 0.00 H new ATOM 0 HG LEU A 158 1.375 -6.953 -2.578 1.00 0.00 H new ATOM 0 HD11 LEU A 158 3.047 -8.113 -1.190 1.00 0.00 H new ATOM 0 HD12 LEU A 158 3.231 -8.509 -2.915 1.00 0.00 H new ATOM 0 HD13 LEU A 158 4.350 -7.363 -2.141 1.00 0.00 H new ATOM 0 HD21 LEU A 158 2.189 -5.907 -0.500 1.00 0.00 H new ATOM 0 HD22 LEU A 158 3.458 -5.068 -1.424 1.00 0.00 H new ATOM 0 HD23 LEU A 158 1.744 -4.691 -1.721 1.00 0.00 H new ATOM 494 N LEU A 159 2.871 -4.827 -6.670 1.00 0.00 N ATOM 495 CA LEU A 159 3.518 -4.071 -7.737 1.00 0.00 C ATOM 496 C LEU A 159 2.586 -2.994 -8.283 1.00 0.00 C ATOM 497 O LEU A 159 2.899 -1.804 -8.236 1.00 0.00 O ATOM 498 CB LEU A 159 3.948 -5.010 -8.865 1.00 0.00 C ATOM 499 CG LEU A 159 5.082 -5.981 -8.536 1.00 0.00 C ATOM 500 CD1 LEU A 159 5.180 -7.067 -9.596 1.00 0.00 C ATOM 501 CD2 LEU A 159 6.403 -5.235 -8.409 1.00 0.00 C ATOM 0 H LEU A 159 2.871 -5.837 -6.810 1.00 0.00 H new ATOM 0 HA LEU A 159 4.401 -3.585 -7.321 1.00 0.00 H new ATOM 0 HB2 LEU A 159 3.080 -5.590 -9.178 1.00 0.00 H new ATOM 0 HB3 LEU A 159 4.252 -4.404 -9.719 1.00 0.00 H new ATOM 0 HG LEU A 159 4.862 -6.455 -7.580 1.00 0.00 H new ATOM 0 HD11 LEU A 159 5.993 -7.748 -9.345 1.00 0.00 H new ATOM 0 HD12 LEU A 159 4.242 -7.621 -9.638 1.00 0.00 H new ATOM 0 HD13 LEU A 159 5.376 -6.611 -10.567 1.00 0.00 H new ATOM 0 HD21 LEU A 159 7.199 -5.942 -8.175 1.00 0.00 H new ATOM 0 HD22 LEU A 159 6.629 -4.733 -9.350 1.00 0.00 H new ATOM 0 HD23 LEU A 159 6.328 -4.496 -7.612 1.00 0.00 H new ATOM 513 N LYS A 160 1.437 -3.419 -8.798 1.00 0.00 N ATOM 514 CA LYS A 160 0.456 -2.492 -9.350 1.00 0.00 C ATOM 515 C LYS A 160 0.376 -1.221 -8.511 1.00 0.00 C ATOM 516 O LYS A 160 0.502 -0.112 -9.031 1.00 0.00 O ATOM 517 CB LYS A 160 -0.920 -3.156 -9.421 1.00 0.00 C ATOM 518 CG LYS A 160 -2.013 -2.238 -9.942 1.00 0.00 C ATOM 519 CD LYS A 160 -2.004 -2.165 -11.460 1.00 0.00 C ATOM 520 CE LYS A 160 -2.989 -1.127 -11.974 1.00 0.00 C ATOM 521 NZ LYS A 160 -4.366 -1.681 -12.093 1.00 0.00 N ATOM 0 H LYS A 160 1.162 -4.400 -8.845 1.00 0.00 H new ATOM 0 HA LYS A 160 0.775 -2.222 -10.357 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -0.858 -4.034 -10.064 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -1.196 -3.508 -8.427 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -2.984 -2.596 -9.600 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -1.878 -1.239 -9.528 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -1.001 -1.919 -11.807 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -2.254 -3.142 -11.874 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -2.999 -0.271 -11.300 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -2.659 -0.763 -12.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -5.008 -0.943 -12.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -4.362 -2.482 -12.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -4.692 -2.005 -11.160 1.00 0.00 H new ATOM 535 N LEU A 161 0.169 -1.389 -7.209 1.00 0.00 N ATOM 536 CA LEU A 161 0.073 -0.255 -6.297 1.00 0.00 C ATOM 537 C LEU A 161 1.339 0.595 -6.351 1.00 0.00 C ATOM 538 O LEU A 161 1.274 1.809 -6.537 1.00 0.00 O ATOM 539 CB LEU A 161 -0.166 -0.744 -4.867 1.00 0.00 C ATOM 540 CG LEU A 161 -1.583 -1.224 -4.550 1.00 0.00 C ATOM 541 CD1 LEU A 161 -1.638 -1.843 -3.162 1.00 0.00 C ATOM 542 CD2 LEU A 161 -2.572 -0.073 -4.663 1.00 0.00 C ATOM 0 H LEU A 161 0.064 -2.300 -6.762 1.00 0.00 H new ATOM 0 HA LEU A 161 -0.770 0.361 -6.609 1.00 0.00 H new ATOM 0 HB2 LEU A 161 0.527 -1.560 -4.663 1.00 0.00 H new ATOM 0 HB3 LEU A 161 0.084 0.065 -4.181 1.00 0.00 H new ATOM 0 HG LEU A 161 -1.860 -1.988 -5.277 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -2.654 -2.179 -2.953 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -0.958 -2.693 -3.116 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -1.342 -1.101 -2.421 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -3.576 -0.432 -4.434 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.298 0.712 -3.959 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -2.552 0.326 -5.677 1.00 0.00 H new ATOM 554 N GLU A 162 2.488 -0.053 -6.188 1.00 0.00 N ATOM 555 CA GLU A 162 3.769 0.644 -6.220 1.00 0.00 C ATOM 556 C GLU A 162 3.892 1.497 -7.479 1.00 0.00 C ATOM 557 O GLU A 162 4.420 2.608 -7.438 1.00 0.00 O ATOM 558 CB GLU A 162 4.922 -0.359 -6.155 1.00 0.00 C ATOM 559 CG GLU A 162 6.282 0.259 -6.434 1.00 0.00 C ATOM 560 CD GLU A 162 7.346 -0.781 -6.729 1.00 0.00 C ATOM 561 OE1 GLU A 162 7.856 -1.395 -5.768 1.00 0.00 O ATOM 562 OE2 GLU A 162 7.668 -0.980 -7.918 1.00 0.00 O ATOM 0 H GLU A 162 2.558 -1.059 -6.033 1.00 0.00 H new ATOM 0 HA GLU A 162 3.819 1.300 -5.351 1.00 0.00 H new ATOM 0 HB2 GLU A 162 4.937 -0.819 -5.167 1.00 0.00 H new ATOM 0 HB3 GLU A 162 4.740 -1.157 -6.875 1.00 0.00 H new ATOM 0 HG2 GLU A 162 6.200 0.940 -7.281 1.00 0.00 H new ATOM 0 HG3 GLU A 162 6.590 0.854 -5.574 1.00 0.00 H new ATOM 569 N GLN A 163 3.402 0.969 -8.596 1.00 0.00 N ATOM 570 CA GLN A 163 3.459 1.681 -9.867 1.00 0.00 C ATOM 571 C GLN A 163 2.649 2.973 -9.803 1.00 0.00 C ATOM 572 O GLN A 163 3.151 4.047 -10.133 1.00 0.00 O ATOM 573 CB GLN A 163 2.936 0.793 -10.997 1.00 0.00 C ATOM 574 CG GLN A 163 3.969 -0.190 -11.525 1.00 0.00 C ATOM 575 CD GLN A 163 3.348 -1.306 -12.341 1.00 0.00 C ATOM 576 OE1 GLN A 163 2.332 -1.883 -11.953 1.00 0.00 O ATOM 577 NE2 GLN A 163 3.957 -1.617 -13.479 1.00 0.00 N ATOM 0 H GLN A 163 2.961 0.051 -8.646 1.00 0.00 H new ATOM 0 HA GLN A 163 4.500 1.935 -10.067 1.00 0.00 H new ATOM 0 HB2 GLN A 163 2.068 0.239 -10.640 1.00 0.00 H new ATOM 0 HB3 GLN A 163 2.596 1.425 -11.817 1.00 0.00 H new ATOM 0 HG2 GLN A 163 4.693 0.345 -12.140 1.00 0.00 H new ATOM 0 HG3 GLN A 163 4.518 -0.620 -10.687 1.00 0.00 H new ATOM 0 HE21 GLN A 163 4.797 -1.113 -13.762 1.00 0.00 H new ATOM 0 HE22 GLN A 163 3.585 -2.360 -14.070 1.00 0.00 H new ATOM 586 N GLU A 164 1.395 2.859 -9.378 1.00 0.00 N ATOM 587 CA GLU A 164 0.517 4.018 -9.273 1.00 0.00 C ATOM 588 C GLU A 164 1.072 5.033 -8.277 1.00 0.00 C ATOM 589 O GLU A 164 0.957 6.242 -8.478 1.00 0.00 O ATOM 590 CB GLU A 164 -0.888 3.585 -8.848 1.00 0.00 C ATOM 591 CG GLU A 164 -1.798 3.240 -10.015 1.00 0.00 C ATOM 592 CD GLU A 164 -2.436 4.466 -10.639 1.00 0.00 C ATOM 593 OE1 GLU A 164 -2.823 5.383 -9.885 1.00 0.00 O ATOM 594 OE2 GLU A 164 -2.547 4.508 -11.882 1.00 0.00 O ATOM 0 H GLU A 164 0.965 1.977 -9.101 1.00 0.00 H new ATOM 0 HA GLU A 164 0.462 4.490 -10.254 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -0.809 2.719 -8.191 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -1.345 4.385 -8.266 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -1.224 2.708 -10.774 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -2.580 2.562 -9.673 1.00 0.00 H new ATOM 601 N ILE A 165 1.672 4.531 -7.203 1.00 0.00 N ATOM 602 CA ILE A 165 2.245 5.393 -6.177 1.00 0.00 C ATOM 603 C ILE A 165 3.458 6.149 -6.707 1.00 0.00 C ATOM 604 O ILE A 165 3.464 7.379 -6.759 1.00 0.00 O ATOM 605 CB ILE A 165 2.660 4.587 -4.932 1.00 0.00 C ATOM 606 CG1 ILE A 165 1.423 4.048 -4.211 1.00 0.00 C ATOM 607 CG2 ILE A 165 3.492 5.449 -3.995 1.00 0.00 C ATOM 608 CD1 ILE A 165 1.705 3.569 -2.804 1.00 0.00 C ATOM 0 H ILE A 165 1.774 3.533 -7.021 1.00 0.00 H new ATOM 0 HA ILE A 165 1.470 6.107 -5.897 1.00 0.00 H new ATOM 0 HB ILE A 165 3.269 3.741 -5.252 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.664 4.830 -4.175 1.00 0.00 H new ATOM 0 HG13 ILE A 165 1.005 3.224 -4.790 1.00 0.00 H new ATOM 0 HG21 ILE A 165 3.777 4.865 -3.120 1.00 0.00 H new ATOM 0 HG22 ILE A 165 4.389 5.788 -4.513 1.00 0.00 H new ATOM 0 HG23 ILE A 165 2.907 6.313 -3.679 1.00 0.00 H new ATOM 0 HD11 ILE A 165 0.783 3.201 -2.353 1.00 0.00 H new ATOM 0 HD12 ILE A 165 2.441 2.765 -2.834 1.00 0.00 H new ATOM 0 HD13 ILE A 165 2.094 4.395 -2.209 1.00 0.00 H new ATOM 620 N LEU A 166 4.485 5.404 -7.103 1.00 0.00 N ATOM 621 CA LEU A 166 5.706 6.003 -7.632 1.00 0.00 C ATOM 622 C LEU A 166 5.383 7.038 -8.706 1.00 0.00 C ATOM 623 O LEU A 166 5.939 8.136 -8.709 1.00 0.00 O ATOM 624 CB LEU A 166 6.620 4.921 -8.209 1.00 0.00 C ATOM 625 CG LEU A 166 7.336 4.034 -7.190 1.00 0.00 C ATOM 626 CD1 LEU A 166 8.305 3.093 -7.889 1.00 0.00 C ATOM 627 CD2 LEU A 166 8.066 4.886 -6.162 1.00 0.00 C ATOM 0 H LEU A 166 4.496 4.385 -7.068 1.00 0.00 H new ATOM 0 HA LEU A 166 6.220 6.505 -6.812 1.00 0.00 H new ATOM 0 HB2 LEU A 166 6.026 4.282 -8.863 1.00 0.00 H new ATOM 0 HB3 LEU A 166 7.372 5.404 -8.833 1.00 0.00 H new ATOM 0 HG LEU A 166 6.589 3.433 -6.671 1.00 0.00 H new ATOM 0 HD11 LEU A 166 8.805 2.470 -7.148 1.00 0.00 H new ATOM 0 HD12 LEU A 166 7.757 2.459 -8.586 1.00 0.00 H new ATOM 0 HD13 LEU A 166 9.048 3.675 -8.434 1.00 0.00 H new ATOM 0 HD21 LEU A 166 8.570 4.238 -5.445 1.00 0.00 H new ATOM 0 HD22 LEU A 166 8.803 5.512 -6.665 1.00 0.00 H new ATOM 0 HD23 LEU A 166 7.349 5.519 -5.639 1.00 0.00 H new ATOM 639 N GLU A 167 4.480 6.680 -9.613 1.00 0.00 N ATOM 640 CA GLU A 167 4.083 7.578 -10.691 1.00 0.00 C ATOM 641 C GLU A 167 3.317 8.779 -10.143 1.00 0.00 C ATOM 642 O GLU A 167 3.417 9.887 -10.671 1.00 0.00 O ATOM 643 CB GLU A 167 3.223 6.834 -11.715 1.00 0.00 C ATOM 644 CG GLU A 167 4.019 5.909 -12.620 1.00 0.00 C ATOM 645 CD GLU A 167 3.149 5.201 -13.640 1.00 0.00 C ATOM 646 OE1 GLU A 167 2.026 4.790 -13.278 1.00 0.00 O ATOM 647 OE2 GLU A 167 3.590 5.057 -14.799 1.00 0.00 O ATOM 0 H GLU A 167 4.010 5.775 -9.623 1.00 0.00 H new ATOM 0 HA GLU A 167 4.987 7.938 -11.181 1.00 0.00 H new ATOM 0 HB2 GLU A 167 2.468 6.251 -11.188 1.00 0.00 H new ATOM 0 HB3 GLU A 167 2.693 7.562 -12.329 1.00 0.00 H new ATOM 0 HG2 GLU A 167 4.785 6.485 -13.139 1.00 0.00 H new ATOM 0 HG3 GLU A 167 4.536 5.167 -12.011 1.00 0.00 H new ATOM 654 N PHE A 168 2.550 8.550 -9.082 1.00 0.00 N ATOM 655 CA PHE A 168 1.765 9.611 -8.463 1.00 0.00 C ATOM 656 C PHE A 168 2.671 10.631 -7.780 1.00 0.00 C ATOM 657 O PHE A 168 2.374 11.826 -7.759 1.00 0.00 O ATOM 658 CB PHE A 168 0.784 9.023 -7.446 1.00 0.00 C ATOM 659 CG PHE A 168 0.237 10.038 -6.484 1.00 0.00 C ATOM 660 CD1 PHE A 168 -0.791 10.886 -6.861 1.00 0.00 C ATOM 661 CD2 PHE A 168 0.752 10.144 -5.202 1.00 0.00 C ATOM 662 CE1 PHE A 168 -1.297 11.822 -5.978 1.00 0.00 C ATOM 663 CE2 PHE A 168 0.250 11.076 -4.314 1.00 0.00 C ATOM 664 CZ PHE A 168 -0.775 11.917 -4.703 1.00 0.00 C ATOM 0 H PHE A 168 2.456 7.639 -8.633 1.00 0.00 H new ATOM 0 HA PHE A 168 1.204 10.117 -9.248 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -0.044 8.557 -7.980 1.00 0.00 H new ATOM 0 HB3 PHE A 168 1.285 8.235 -6.884 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -1.203 10.815 -7.857 1.00 0.00 H new ATOM 0 HD2 PHE A 168 1.555 9.491 -4.893 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -2.099 12.477 -6.285 1.00 0.00 H new ATOM 0 HE2 PHE A 168 0.658 11.147 -3.317 1.00 0.00 H new ATOM 0 HZ PHE A 168 -1.167 12.648 -4.011 1.00 0.00 H new ATOM 674 N ILE A 169 3.778 10.151 -7.222 1.00 0.00 N ATOM 675 CA ILE A 169 4.728 11.020 -6.540 1.00 0.00 C ATOM 676 C ILE A 169 5.481 11.899 -7.532 1.00 0.00 C ATOM 677 O ILE A 169 5.609 13.106 -7.335 1.00 0.00 O ATOM 678 CB ILE A 169 5.745 10.206 -5.717 1.00 0.00 C ATOM 679 CG1 ILE A 169 5.021 9.328 -4.695 1.00 0.00 C ATOM 680 CG2 ILE A 169 6.728 11.136 -5.022 1.00 0.00 C ATOM 681 CD1 ILE A 169 5.883 8.220 -4.132 1.00 0.00 C ATOM 0 H ILE A 169 4.038 9.165 -7.229 1.00 0.00 H new ATOM 0 HA ILE A 169 4.149 11.652 -5.866 1.00 0.00 H new ATOM 0 HB ILE A 169 6.303 9.558 -6.394 1.00 0.00 H new ATOM 0 HG12 ILE A 169 4.667 9.954 -3.876 1.00 0.00 H new ATOM 0 HG13 ILE A 169 4.140 8.889 -5.164 1.00 0.00 H new ATOM 0 HG21 ILE A 169 7.440 10.547 -4.444 1.00 0.00 H new ATOM 0 HG22 ILE A 169 7.263 11.723 -5.768 1.00 0.00 H new ATOM 0 HG23 ILE A 169 6.186 11.806 -4.355 1.00 0.00 H new ATOM 0 HD11 ILE A 169 5.305 7.638 -3.414 1.00 0.00 H new ATOM 0 HD12 ILE A 169 6.216 7.571 -4.942 1.00 0.00 H new ATOM 0 HD13 ILE A 169 6.751 8.652 -3.634 1.00 0.00 H new ATOM 693 N ASN A 170 5.976 11.284 -8.602 1.00 0.00 N ATOM 694 CA ASN A 170 6.715 12.011 -9.627 1.00 0.00 C ATOM 695 C ASN A 170 5.846 13.093 -10.261 1.00 0.00 C ATOM 696 O ASN A 170 6.282 14.231 -10.435 1.00 0.00 O ATOM 697 CB ASN A 170 7.215 11.047 -10.705 1.00 0.00 C ATOM 698 CG ASN A 170 7.997 11.754 -11.796 1.00 0.00 C ATOM 699 OD1 ASN A 170 7.637 12.851 -12.221 1.00 0.00 O ATOM 700 ND2 ASN A 170 9.073 11.125 -12.254 1.00 0.00 N ATOM 0 H ASN A 170 5.878 10.285 -8.781 1.00 0.00 H new ATOM 0 HA ASN A 170 7.571 12.490 -9.151 1.00 0.00 H new ATOM 0 HB2 ASN A 170 7.846 10.287 -10.244 1.00 0.00 H new ATOM 0 HB3 ASN A 170 6.364 10.530 -11.149 1.00 0.00 H new ATOM 0 HD21 ASN A 170 9.639 11.551 -12.988 1.00 0.00 H new ATOM 0 HD22 ASN A 170 9.334 10.216 -11.872 1.00 0.00 H new ATOM 707 N ASP A 171 4.615 12.730 -10.603 1.00 0.00 N ATOM 708 CA ASP A 171 3.683 13.669 -11.216 1.00 0.00 C ATOM 709 C ASP A 171 3.353 14.810 -10.258 1.00 0.00 C ATOM 710 O ASP A 171 3.118 14.589 -9.071 1.00 0.00 O ATOM 711 CB ASP A 171 2.399 12.949 -11.632 1.00 0.00 C ATOM 712 CG ASP A 171 1.502 13.817 -12.494 1.00 0.00 C ATOM 713 OD1 ASP A 171 2.034 14.545 -13.357 1.00 0.00 O ATOM 714 OD2 ASP A 171 0.269 13.767 -12.304 1.00 0.00 O ATOM 0 H ASP A 171 4.239 11.792 -10.466 1.00 0.00 H new ATOM 0 HA ASP A 171 4.159 14.088 -12.103 1.00 0.00 H new ATOM 0 HB2 ASP A 171 2.655 12.041 -12.178 1.00 0.00 H new ATOM 0 HB3 ASP A 171 1.853 12.641 -10.740 1.00 0.00 H new ATOM 719 N ASN A 172 3.339 16.031 -10.783 1.00 0.00 N ATOM 720 CA ASN A 172 3.040 17.207 -9.974 1.00 0.00 C ATOM 721 C ASN A 172 1.559 17.566 -10.062 1.00 0.00 C ATOM 722 O ASN A 172 0.931 17.901 -9.059 1.00 0.00 O ATOM 723 CB ASN A 172 3.891 18.395 -10.429 1.00 0.00 C ATOM 724 CG ASN A 172 3.672 18.738 -11.890 1.00 0.00 C ATOM 725 OD1 ASN A 172 4.027 17.965 -12.780 1.00 0.00 O ATOM 726 ND2 ASN A 172 3.086 19.902 -12.143 1.00 0.00 N ATOM 0 H ASN A 172 3.531 16.232 -11.764 1.00 0.00 H new ATOM 0 HA ASN A 172 3.279 16.973 -8.936 1.00 0.00 H new ATOM 0 HB2 ASN A 172 3.654 19.264 -9.815 1.00 0.00 H new ATOM 0 HB3 ASN A 172 4.944 18.167 -10.266 1.00 0.00 H new ATOM 0 HD21 ASN A 172 2.913 20.187 -13.107 1.00 0.00 H new ATOM 0 HD22 ASN A 172 2.808 20.511 -11.373 1.00 0.00 H new ATOM 733 N ASN A 173 1.009 17.492 -11.270 1.00 0.00 N ATOM 734 CA ASN A 173 -0.398 17.808 -11.490 1.00 0.00 C ATOM 735 C ASN A 173 -1.266 17.230 -10.376 1.00 0.00 C ATOM 736 O ASN A 173 -2.172 17.893 -9.874 1.00 0.00 O ATOM 737 CB ASN A 173 -0.858 17.267 -12.844 1.00 0.00 C ATOM 738 CG ASN A 173 -2.100 17.971 -13.357 1.00 0.00 C ATOM 739 OD1 ASN A 173 -2.044 19.131 -13.767 1.00 0.00 O ATOM 740 ND2 ASN A 173 -3.228 17.271 -13.336 1.00 0.00 N ATOM 0 H ASN A 173 1.516 17.216 -12.111 1.00 0.00 H new ATOM 0 HA ASN A 173 -0.506 18.893 -11.485 1.00 0.00 H new ATOM 0 HB2 ASN A 173 -0.053 17.381 -13.570 1.00 0.00 H new ATOM 0 HB3 ASN A 173 -1.059 16.199 -12.756 1.00 0.00 H new ATOM 0 HD21 ASN A 173 -4.096 17.692 -13.668 1.00 0.00 H new ATOM 0 HD22 ASN A 173 -3.227 16.312 -12.987 1.00 0.00 H new ATOM 747 N ASN A 174 -0.980 15.989 -9.995 1.00 0.00 N ATOM 748 CA ASN A 174 -1.735 15.321 -8.941 1.00 0.00 C ATOM 749 C ASN A 174 -1.151 15.641 -7.568 1.00 0.00 C ATOM 750 O ASN A 174 0.064 15.755 -7.411 1.00 0.00 O ATOM 751 CB ASN A 174 -1.736 13.808 -9.167 1.00 0.00 C ATOM 752 CG ASN A 174 -2.870 13.359 -10.068 1.00 0.00 C ATOM 753 OD1 ASN A 174 -3.709 12.549 -9.673 1.00 0.00 O ATOM 754 ND2 ASN A 174 -2.900 13.885 -11.287 1.00 0.00 N ATOM 0 H ASN A 174 -0.232 15.426 -10.400 1.00 0.00 H new ATOM 0 HA ASN A 174 -2.761 15.687 -8.974 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -0.785 13.509 -9.608 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -1.816 13.300 -8.206 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -3.639 13.621 -11.938 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -2.184 14.553 -11.572 1.00 0.00 H new ATOM 761 N GLN A 175 -2.026 15.782 -6.577 1.00 0.00 N ATOM 762 CA GLN A 175 -1.597 16.089 -5.218 1.00 0.00 C ATOM 763 C GLN A 175 -2.243 15.138 -4.216 1.00 0.00 C ATOM 764 O GLN A 175 -1.638 14.781 -3.204 1.00 0.00 O ATOM 765 CB GLN A 175 -1.946 17.536 -4.864 1.00 0.00 C ATOM 766 CG GLN A 175 -0.876 18.536 -5.270 1.00 0.00 C ATOM 767 CD GLN A 175 -1.323 19.974 -5.089 1.00 0.00 C ATOM 768 OE1 GLN A 175 -2.448 20.238 -4.663 1.00 0.00 O ATOM 769 NE2 GLN A 175 -0.442 20.913 -5.413 1.00 0.00 N ATOM 0 H GLN A 175 -3.035 15.689 -6.690 1.00 0.00 H new ATOM 0 HA GLN A 175 -0.516 15.961 -5.168 1.00 0.00 H new ATOM 0 HB2 GLN A 175 -2.885 17.804 -5.349 1.00 0.00 H new ATOM 0 HB3 GLN A 175 -2.111 17.609 -3.789 1.00 0.00 H new ATOM 0 HG2 GLN A 175 0.023 18.361 -4.678 1.00 0.00 H new ATOM 0 HG3 GLN A 175 -0.607 18.371 -6.313 1.00 0.00 H new ATOM 0 HE21 GLN A 175 0.479 20.649 -5.762 1.00 0.00 H new ATOM 0 HE22 GLN A 175 -0.687 21.898 -5.313 1.00 0.00 H new ATOM 778 N PHE A 176 -3.475 14.731 -4.503 1.00 0.00 N ATOM 779 CA PHE A 176 -4.204 13.822 -3.626 1.00 0.00 C ATOM 780 C PHE A 176 -4.643 12.572 -4.383 1.00 0.00 C ATOM 781 O PHE A 176 -5.005 12.638 -5.558 1.00 0.00 O ATOM 782 CB PHE A 176 -5.424 14.525 -3.028 1.00 0.00 C ATOM 783 CG PHE A 176 -5.136 15.226 -1.731 1.00 0.00 C ATOM 784 CD1 PHE A 176 -5.216 14.544 -0.528 1.00 0.00 C ATOM 785 CD2 PHE A 176 -4.786 16.567 -1.716 1.00 0.00 C ATOM 786 CE1 PHE A 176 -4.952 15.186 0.668 1.00 0.00 C ATOM 787 CE2 PHE A 176 -4.520 17.213 -0.524 1.00 0.00 C ATOM 788 CZ PHE A 176 -4.604 16.523 0.669 1.00 0.00 C ATOM 0 H PHE A 176 -3.990 15.016 -5.336 1.00 0.00 H new ATOM 0 HA PHE A 176 -3.536 13.521 -2.819 1.00 0.00 H new ATOM 0 HB2 PHE A 176 -5.804 15.250 -3.747 1.00 0.00 H new ATOM 0 HB3 PHE A 176 -6.214 13.791 -2.868 1.00 0.00 H new ATOM 0 HD1 PHE A 176 -5.488 13.499 -0.524 1.00 0.00 H new ATOM 0 HD2 PHE A 176 -4.721 17.113 -2.646 1.00 0.00 H new ATOM 0 HE1 PHE A 176 -5.018 14.643 1.599 1.00 0.00 H new ATOM 0 HE2 PHE A 176 -4.246 18.258 -0.525 1.00 0.00 H new ATOM 0 HZ PHE A 176 -4.398 17.028 1.601 1.00 0.00 H new ATOM 798 N LYS A 177 -4.608 11.432 -3.701 1.00 0.00 N ATOM 799 CA LYS A 177 -5.002 10.165 -4.306 1.00 0.00 C ATOM 800 C LYS A 177 -5.892 9.364 -3.360 1.00 0.00 C ATOM 801 O LYS A 177 -5.621 9.275 -2.163 1.00 0.00 O ATOM 802 CB LYS A 177 -3.764 9.346 -4.676 1.00 0.00 C ATOM 803 CG LYS A 177 -4.089 7.971 -5.235 1.00 0.00 C ATOM 804 CD LYS A 177 -4.552 8.052 -6.680 1.00 0.00 C ATOM 805 CE LYS A 177 -4.370 6.724 -7.398 1.00 0.00 C ATOM 806 NZ LYS A 177 -5.075 6.702 -8.710 1.00 0.00 N ATOM 0 H LYS A 177 -4.311 11.360 -2.728 1.00 0.00 H new ATOM 0 HA LYS A 177 -5.568 10.384 -5.211 1.00 0.00 H new ATOM 0 HB2 LYS A 177 -3.179 9.899 -5.411 1.00 0.00 H new ATOM 0 HB3 LYS A 177 -3.137 9.231 -3.792 1.00 0.00 H new ATOM 0 HG2 LYS A 177 -3.208 7.333 -5.170 1.00 0.00 H new ATOM 0 HG3 LYS A 177 -4.866 7.505 -4.629 1.00 0.00 H new ATOM 0 HD2 LYS A 177 -5.602 8.343 -6.711 1.00 0.00 H new ATOM 0 HD3 LYS A 177 -3.991 8.828 -7.200 1.00 0.00 H new ATOM 0 HE2 LYS A 177 -3.307 6.538 -7.553 1.00 0.00 H new ATOM 0 HE3 LYS A 177 -4.746 5.917 -6.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 -4.468 6.248 -9.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 -5.962 6.167 -8.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 -5.288 7.676 -9.006 1.00 0.00 H new ATOM 820 N LYS A 178 -6.954 8.781 -3.906 1.00 0.00 N ATOM 821 CA LYS A 178 -7.882 7.985 -3.112 1.00 0.00 C ATOM 822 C LYS A 178 -8.102 6.615 -3.745 1.00 0.00 C ATOM 823 O LYS A 178 -8.776 6.494 -4.769 1.00 0.00 O ATOM 824 CB LYS A 178 -9.220 8.714 -2.971 1.00 0.00 C ATOM 825 CG LYS A 178 -10.344 7.829 -2.462 1.00 0.00 C ATOM 826 CD LYS A 178 -11.702 8.479 -2.666 1.00 0.00 C ATOM 827 CE LYS A 178 -12.835 7.503 -2.391 1.00 0.00 C ATOM 828 NZ LYS A 178 -14.166 8.168 -2.445 1.00 0.00 N ATOM 0 H LYS A 178 -7.193 8.845 -4.895 1.00 0.00 H new ATOM 0 HA LYS A 178 -7.446 7.843 -2.123 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -9.095 9.556 -2.290 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -9.503 9.126 -3.939 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -10.317 6.871 -2.981 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -10.194 7.622 -1.402 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -11.796 9.342 -2.007 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -11.779 8.849 -3.688 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -12.803 6.695 -3.122 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -12.695 7.051 -1.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -14.911 7.469 -2.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -14.206 8.923 -1.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -14.311 8.577 -3.390 1.00 0.00 H new ATOM 842 N PHE A 179 -7.531 5.585 -3.129 1.00 0.00 N ATOM 843 CA PHE A 179 -7.666 4.223 -3.633 1.00 0.00 C ATOM 844 C PHE A 179 -9.091 3.712 -3.445 1.00 0.00 C ATOM 845 O PHE A 179 -9.765 4.022 -2.462 1.00 0.00 O ATOM 846 CB PHE A 179 -6.681 3.293 -2.920 1.00 0.00 C ATOM 847 CG PHE A 179 -5.256 3.485 -3.353 1.00 0.00 C ATOM 848 CD1 PHE A 179 -4.896 3.333 -4.683 1.00 0.00 C ATOM 849 CD2 PHE A 179 -4.276 3.816 -2.431 1.00 0.00 C ATOM 850 CE1 PHE A 179 -3.585 3.508 -5.084 1.00 0.00 C ATOM 851 CE2 PHE A 179 -2.963 3.993 -2.827 1.00 0.00 C ATOM 852 CZ PHE A 179 -2.618 3.839 -4.155 1.00 0.00 C ATOM 0 H PHE A 179 -6.971 5.667 -2.281 1.00 0.00 H new ATOM 0 HA PHE A 179 -7.440 4.233 -4.699 1.00 0.00 H new ATOM 0 HB2 PHE A 179 -6.751 3.458 -1.845 1.00 0.00 H new ATOM 0 HB3 PHE A 179 -6.972 2.259 -3.104 1.00 0.00 H new ATOM 0 HD1 PHE A 179 -5.648 3.075 -5.414 1.00 0.00 H new ATOM 0 HD2 PHE A 179 -4.541 3.937 -1.391 1.00 0.00 H new ATOM 0 HE1 PHE A 179 -3.317 3.386 -6.123 1.00 0.00 H new ATOM 0 HE2 PHE A 179 -2.209 4.251 -2.099 1.00 0.00 H new ATOM 0 HZ PHE A 179 -1.593 3.977 -4.467 1.00 0.00 H new ATOM 862 N PRO A 180 -9.564 2.909 -4.410 1.00 0.00 N ATOM 863 CA PRO A 180 -10.913 2.338 -4.375 1.00 0.00 C ATOM 864 C PRO A 180 -11.067 1.282 -3.286 1.00 0.00 C ATOM 865 O PRO A 180 -10.084 0.852 -2.683 1.00 0.00 O ATOM 866 CB PRO A 180 -11.067 1.705 -5.760 1.00 0.00 C ATOM 867 CG PRO A 180 -9.674 1.411 -6.198 1.00 0.00 C ATOM 868 CD PRO A 180 -8.816 2.498 -5.610 1.00 0.00 C ATOM 0 HA PRO A 180 -11.668 3.091 -4.150 1.00 0.00 H new ATOM 0 HB2 PRO A 180 -11.668 0.797 -5.716 1.00 0.00 H new ATOM 0 HB3 PRO A 180 -11.565 2.384 -6.452 1.00 0.00 H new ATOM 0 HG2 PRO A 180 -9.354 0.429 -5.848 1.00 0.00 H new ATOM 0 HG3 PRO A 180 -9.601 1.401 -7.285 1.00 0.00 H new ATOM 0 HD2 PRO A 180 -7.821 2.132 -5.358 1.00 0.00 H new ATOM 0 HD3 PRO A 180 -8.684 3.327 -6.305 1.00 0.00 H new ATOM 876 N GLN A 181 -12.306 0.869 -3.040 1.00 0.00 N ATOM 877 CA GLN A 181 -12.588 -0.137 -2.023 1.00 0.00 C ATOM 878 C GLN A 181 -11.540 -1.245 -2.048 1.00 0.00 C ATOM 879 O GLN A 181 -10.901 -1.485 -3.073 1.00 0.00 O ATOM 880 CB GLN A 181 -13.981 -0.732 -2.235 1.00 0.00 C ATOM 881 CG GLN A 181 -15.106 0.166 -1.747 1.00 0.00 C ATOM 882 CD GLN A 181 -16.474 -0.465 -1.922 1.00 0.00 C ATOM 883 OE1 GLN A 181 -16.588 -1.646 -2.250 1.00 0.00 O ATOM 884 NE2 GLN A 181 -17.521 0.322 -1.704 1.00 0.00 N ATOM 0 H GLN A 181 -13.130 1.215 -3.531 1.00 0.00 H new ATOM 0 HA GLN A 181 -12.553 0.349 -1.048 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -14.123 -0.934 -3.297 1.00 0.00 H new ATOM 0 HB3 GLN A 181 -14.041 -1.689 -1.717 1.00 0.00 H new ATOM 0 HG2 GLN A 181 -14.949 0.398 -0.694 1.00 0.00 H new ATOM 0 HG3 GLN A 181 -15.074 1.110 -2.290 1.00 0.00 H new ATOM 0 HE21 GLN A 181 -17.380 1.295 -1.434 1.00 0.00 H new ATOM 0 HE22 GLN A 181 -18.466 -0.047 -1.807 1.00 0.00 H new ATOM 893 N MET A 182 -11.369 -1.917 -0.915 1.00 0.00 N ATOM 894 CA MET A 182 -10.398 -3.001 -0.808 1.00 0.00 C ATOM 895 C MET A 182 -10.775 -3.960 0.316 1.00 0.00 C ATOM 896 O MET A 182 -11.601 -3.637 1.171 1.00 0.00 O ATOM 897 CB MET A 182 -8.997 -2.437 -0.565 1.00 0.00 C ATOM 898 CG MET A 182 -8.227 -2.151 -1.845 1.00 0.00 C ATOM 899 SD MET A 182 -6.500 -1.735 -1.537 1.00 0.00 S ATOM 900 CE MET A 182 -6.550 0.049 -1.682 1.00 0.00 C ATOM 0 H MET A 182 -11.890 -1.731 -0.058 1.00 0.00 H new ATOM 0 HA MET A 182 -10.402 -3.553 -1.748 1.00 0.00 H new ATOM 0 HB2 MET A 182 -9.080 -1.517 0.013 1.00 0.00 H new ATOM 0 HB3 MET A 182 -8.430 -3.144 0.041 1.00 0.00 H new ATOM 0 HG2 MET A 182 -8.276 -3.023 -2.497 1.00 0.00 H new ATOM 0 HG3 MET A 182 -8.706 -1.329 -2.377 1.00 0.00 H new ATOM 0 HE1 MET A 182 -5.688 0.392 -2.255 1.00 0.00 H new ATOM 0 HE2 MET A 182 -7.466 0.347 -2.192 1.00 0.00 H new ATOM 0 HE3 MET A 182 -6.526 0.496 -0.688 1.00 0.00 H new ATOM 910 N THR A 183 -10.165 -5.141 0.311 1.00 0.00 N ATOM 911 CA THR A 183 -10.438 -6.147 1.329 1.00 0.00 C ATOM 912 C THR A 183 -9.459 -6.032 2.492 1.00 0.00 C ATOM 913 O THR A 183 -8.342 -5.540 2.330 1.00 0.00 O ATOM 914 CB THR A 183 -10.360 -7.571 0.747 1.00 0.00 C ATOM 915 OG1 THR A 183 -10.918 -8.510 1.674 1.00 0.00 O ATOM 916 CG2 THR A 183 -8.920 -7.951 0.437 1.00 0.00 C ATOM 0 H THR A 183 -9.478 -5.424 -0.388 1.00 0.00 H new ATOM 0 HA THR A 183 -11.450 -5.965 1.690 1.00 0.00 H new ATOM 0 HB THR A 183 -10.932 -7.593 -0.181 1.00 0.00 H new ATOM 0 HG1 THR A 183 -10.866 -9.413 1.296 1.00 0.00 H new ATOM 0 HG21 THR A 183 -8.890 -8.961 0.027 1.00 0.00 H new ATOM 0 HG22 THR A 183 -8.508 -7.252 -0.290 1.00 0.00 H new ATOM 0 HG23 THR A 183 -8.329 -7.913 1.352 1.00 0.00 H new ATOM 924 N SER A 184 -9.884 -6.488 3.666 1.00 0.00 N ATOM 925 CA SER A 184 -9.046 -6.433 4.857 1.00 0.00 C ATOM 926 C SER A 184 -7.591 -6.734 4.512 1.00 0.00 C ATOM 927 O SER A 184 -6.701 -5.918 4.755 1.00 0.00 O ATOM 928 CB SER A 184 -9.548 -7.426 5.907 1.00 0.00 C ATOM 929 OG SER A 184 -10.825 -7.051 6.395 1.00 0.00 O ATOM 0 H SER A 184 -10.805 -6.900 3.817 1.00 0.00 H new ATOM 0 HA SER A 184 -9.104 -5.424 5.265 1.00 0.00 H new ATOM 0 HB2 SER A 184 -9.600 -8.424 5.472 1.00 0.00 H new ATOM 0 HB3 SER A 184 -8.839 -7.475 6.734 1.00 0.00 H new ATOM 0 HG SER A 184 -11.124 -7.702 7.063 1.00 0.00 H new ATOM 935 N TYR A 185 -7.356 -7.912 3.943 1.00 0.00 N ATOM 936 CA TYR A 185 -6.009 -8.323 3.566 1.00 0.00 C ATOM 937 C TYR A 185 -5.256 -7.176 2.899 1.00 0.00 C ATOM 938 O TYR A 185 -4.139 -6.838 3.294 1.00 0.00 O ATOM 939 CB TYR A 185 -6.066 -9.527 2.623 1.00 0.00 C ATOM 940 CG TYR A 185 -4.867 -10.441 2.736 1.00 0.00 C ATOM 941 CD1 TYR A 185 -4.626 -11.163 3.898 1.00 0.00 C ATOM 942 CD2 TYR A 185 -3.974 -10.582 1.680 1.00 0.00 C ATOM 943 CE1 TYR A 185 -3.531 -11.999 4.006 1.00 0.00 C ATOM 944 CE2 TYR A 185 -2.878 -11.417 1.779 1.00 0.00 C ATOM 945 CZ TYR A 185 -2.661 -12.123 2.944 1.00 0.00 C ATOM 946 OH TYR A 185 -1.569 -12.955 3.046 1.00 0.00 O ATOM 0 H TYR A 185 -8.081 -8.598 3.733 1.00 0.00 H new ATOM 0 HA TYR A 185 -5.475 -8.605 4.473 1.00 0.00 H new ATOM 0 HB2 TYR A 185 -6.970 -10.099 2.832 1.00 0.00 H new ATOM 0 HB3 TYR A 185 -6.145 -9.170 1.596 1.00 0.00 H new ATOM 0 HD1 TYR A 185 -5.306 -11.069 4.732 1.00 0.00 H new ATOM 0 HD2 TYR A 185 -4.140 -10.030 0.767 1.00 0.00 H new ATOM 0 HE1 TYR A 185 -3.358 -12.552 4.917 1.00 0.00 H new ATOM 0 HE2 TYR A 185 -2.195 -11.517 0.949 1.00 0.00 H new ATOM 0 HH TYR A 185 -1.059 -12.929 2.210 1.00 0.00 H new ATOM 956 N HIS A 186 -5.875 -6.580 1.885 1.00 0.00 N ATOM 957 CA HIS A 186 -5.265 -5.470 1.163 1.00 0.00 C ATOM 958 C HIS A 186 -4.979 -4.302 2.102 1.00 0.00 C ATOM 959 O HIS A 186 -3.836 -3.864 2.233 1.00 0.00 O ATOM 960 CB HIS A 186 -6.177 -5.012 0.024 1.00 0.00 C ATOM 961 CG HIS A 186 -6.192 -5.947 -1.145 1.00 0.00 C ATOM 962 ND1 HIS A 186 -6.331 -5.521 -2.449 1.00 0.00 N ATOM 963 CD2 HIS A 186 -6.082 -7.295 -1.202 1.00 0.00 C ATOM 964 CE1 HIS A 186 -6.308 -6.566 -3.257 1.00 0.00 C ATOM 965 NE2 HIS A 186 -6.158 -7.655 -2.525 1.00 0.00 N ATOM 0 H HIS A 186 -6.799 -6.847 1.545 1.00 0.00 H new ATOM 0 HA HIS A 186 -4.320 -5.817 0.745 1.00 0.00 H new ATOM 0 HB2 HIS A 186 -7.193 -4.903 0.404 1.00 0.00 H new ATOM 0 HB3 HIS A 186 -5.856 -4.027 -0.314 1.00 0.00 H new ATOM 0 HD2 HIS A 186 -5.958 -7.963 -0.363 1.00 0.00 H new ATOM 0 HE1 HIS A 186 -6.397 -6.535 -4.333 1.00 0.00 H new ATOM 0 HE2 HIS A 186 -6.107 -8.608 -2.884 1.00 0.00 H new ATOM 974 N ARG A 187 -6.024 -3.803 2.754 1.00 0.00 N ATOM 975 CA ARG A 187 -5.885 -2.686 3.679 1.00 0.00 C ATOM 976 C ARG A 187 -4.550 -2.751 4.414 1.00 0.00 C ATOM 977 O ARG A 187 -3.842 -1.751 4.526 1.00 0.00 O ATOM 978 CB ARG A 187 -7.035 -2.685 4.688 1.00 0.00 C ATOM 979 CG ARG A 187 -7.081 -1.441 5.560 1.00 0.00 C ATOM 980 CD ARG A 187 -8.384 -1.354 6.339 1.00 0.00 C ATOM 981 NE ARG A 187 -8.246 -0.545 7.547 1.00 0.00 N ATOM 982 CZ ARG A 187 -8.159 0.781 7.538 1.00 0.00 C ATOM 983 NH1 ARG A 187 -8.195 1.443 6.390 1.00 0.00 N ATOM 984 NH2 ARG A 187 -8.035 1.447 8.679 1.00 0.00 N ATOM 0 H ARG A 187 -6.976 -4.155 2.658 1.00 0.00 H new ATOM 0 HA ARG A 187 -5.917 -1.763 3.101 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -7.979 -2.776 4.150 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -6.946 -3.563 5.327 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -6.241 -1.451 6.254 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -6.969 -0.554 4.936 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -9.159 -0.926 5.703 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -8.712 -2.357 6.610 1.00 0.00 H new ATOM 0 HE ARG A 187 -8.215 -1.024 8.447 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -8.290 0.935 5.511 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -8.128 2.461 6.386 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -8.006 0.941 9.564 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -7.968 2.465 8.671 1.00 0.00 H new ATOM 998 N MET A 188 -4.212 -3.936 4.914 1.00 0.00 N ATOM 999 CA MET A 188 -2.961 -4.132 5.637 1.00 0.00 C ATOM 1000 C MET A 188 -1.764 -3.982 4.704 1.00 0.00 C ATOM 1001 O MET A 188 -0.885 -3.150 4.934 1.00 0.00 O ATOM 1002 CB MET A 188 -2.939 -5.512 6.297 1.00 0.00 C ATOM 1003 CG MET A 188 -1.612 -5.849 6.956 1.00 0.00 C ATOM 1004 SD MET A 188 -1.307 -7.625 7.034 1.00 0.00 S ATOM 1005 CE MET A 188 -1.026 -7.997 5.305 1.00 0.00 C ATOM 0 H MET A 188 -4.787 -4.774 4.831 1.00 0.00 H new ATOM 0 HA MET A 188 -2.894 -3.367 6.410 1.00 0.00 H new ATOM 0 HB2 MET A 188 -3.730 -5.560 7.046 1.00 0.00 H new ATOM 0 HB3 MET A 188 -3.165 -6.269 5.546 1.00 0.00 H new ATOM 0 HG2 MET A 188 -0.804 -5.369 6.403 1.00 0.00 H new ATOM 0 HG3 MET A 188 -1.597 -5.437 7.965 1.00 0.00 H new ATOM 0 HE1 MET A 188 -1.894 -8.516 4.899 1.00 0.00 H new ATOM 0 HE2 MET A 188 -0.867 -7.070 4.754 1.00 0.00 H new ATOM 0 HE3 MET A 188 -0.145 -8.632 5.208 1.00 0.00 H new ATOM 1015 N LEU A 189 -1.736 -4.792 3.651 1.00 0.00 N ATOM 1016 CA LEU A 189 -0.646 -4.749 2.683 1.00 0.00 C ATOM 1017 C LEU A 189 -0.309 -3.310 2.305 1.00 0.00 C ATOM 1018 O LEU A 189 0.854 -2.906 2.334 1.00 0.00 O ATOM 1019 CB LEU A 189 -1.019 -5.543 1.430 1.00 0.00 C ATOM 1020 CG LEU A 189 -1.299 -7.032 1.638 1.00 0.00 C ATOM 1021 CD1 LEU A 189 -1.867 -7.651 0.370 1.00 0.00 C ATOM 1022 CD2 LEU A 189 -0.032 -7.758 2.066 1.00 0.00 C ATOM 0 H LEU A 189 -2.455 -5.486 3.446 1.00 0.00 H new ATOM 0 HA LEU A 189 0.233 -5.200 3.143 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -1.903 -5.086 0.984 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -0.210 -5.443 0.707 1.00 0.00 H new ATOM 0 HG LEU A 189 -2.039 -7.135 2.431 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -2.060 -8.711 0.537 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -2.798 -7.150 0.106 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -1.150 -7.537 -0.443 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -0.250 -8.816 2.209 1.00 0.00 H new ATOM 0 HD22 LEU A 189 0.730 -7.646 1.295 1.00 0.00 H new ATOM 0 HD23 LEU A 189 0.333 -7.333 3.001 1.00 0.00 H new ATOM 1034 N LEU A 190 -1.333 -2.542 1.952 1.00 0.00 N ATOM 1035 CA LEU A 190 -1.146 -1.146 1.570 1.00 0.00 C ATOM 1036 C LEU A 190 -0.523 -0.348 2.711 1.00 0.00 C ATOM 1037 O LEU A 190 0.491 0.327 2.530 1.00 0.00 O ATOM 1038 CB LEU A 190 -2.484 -0.523 1.169 1.00 0.00 C ATOM 1039 CG LEU A 190 -2.474 0.985 0.918 1.00 0.00 C ATOM 1040 CD1 LEU A 190 -1.624 1.318 -0.298 1.00 0.00 C ATOM 1041 CD2 LEU A 190 -3.893 1.505 0.737 1.00 0.00 C ATOM 0 H LEU A 190 -2.301 -2.861 1.922 1.00 0.00 H new ATOM 0 HA LEU A 190 -0.468 -1.116 0.717 1.00 0.00 H new ATOM 0 HB2 LEU A 190 -2.836 -1.019 0.265 1.00 0.00 H new ATOM 0 HB3 LEU A 190 -3.211 -0.736 1.953 1.00 0.00 H new ATOM 0 HG LEU A 190 -2.036 1.476 1.787 1.00 0.00 H new ATOM 0 HD11 LEU A 190 -1.629 2.396 -0.461 1.00 0.00 H new ATOM 0 HD12 LEU A 190 -0.601 0.981 -0.130 1.00 0.00 H new ATOM 0 HD13 LEU A 190 -2.032 0.816 -1.176 1.00 0.00 H new ATOM 0 HD21 LEU A 190 -3.867 2.580 0.559 1.00 0.00 H new ATOM 0 HD22 LEU A 190 -4.357 1.008 -0.115 1.00 0.00 H new ATOM 0 HD23 LEU A 190 -4.473 1.300 1.637 1.00 0.00 H new ATOM 1053 N HIS A 191 -1.135 -0.432 3.889 1.00 0.00 N ATOM 1054 CA HIS A 191 -0.638 0.280 5.061 1.00 0.00 C ATOM 1055 C HIS A 191 0.876 0.135 5.183 1.00 0.00 C ATOM 1056 O HIS A 191 1.570 1.076 5.567 1.00 0.00 O ATOM 1057 CB HIS A 191 -1.316 -0.243 6.327 1.00 0.00 C ATOM 1058 CG HIS A 191 -2.725 0.236 6.494 1.00 0.00 C ATOM 1059 ND1 HIS A 191 -3.806 -0.366 7.044 1.00 0.00 N flip ATOM 1060 CD2 HIS A 191 -3.154 1.475 6.066 1.00 0.00 C flip ATOM 1061 CE1 HIS A 191 -4.857 0.512 6.940 1.00 0.00 C flip ATOM 1062 NE2 HIS A 191 -4.438 1.615 6.347 1.00 0.00 N flip ATOM 0 H HIS A 191 -1.975 -0.986 4.057 1.00 0.00 H new ATOM 0 HA HIS A 191 -0.876 1.337 4.941 1.00 0.00 H new ATOM 0 HB2 HIS A 191 -1.311 -1.333 6.308 1.00 0.00 H new ATOM 0 HB3 HIS A 191 -0.732 0.063 7.195 1.00 0.00 H new ATOM 0 HD1 HIS A 191 -3.834 -1.298 7.458 1.00 0.00 H new ATOM 0 HD2 HIS A 191 -2.537 2.215 5.578 1.00 0.00 H new ATOM 0 HE1 HIS A 191 -5.863 0.330 7.287 1.00 0.00 H new ATOM 1071 N ARG A 192 1.381 -1.050 4.855 1.00 0.00 N ATOM 1072 CA ARG A 192 2.812 -1.318 4.931 1.00 0.00 C ATOM 1073 C ARG A 192 3.565 -0.563 3.839 1.00 0.00 C ATOM 1074 O ARG A 192 4.544 0.131 4.112 1.00 0.00 O ATOM 1075 CB ARG A 192 3.078 -2.819 4.804 1.00 0.00 C ATOM 1076 CG ARG A 192 2.739 -3.606 6.059 1.00 0.00 C ATOM 1077 CD ARG A 192 3.699 -3.286 7.194 1.00 0.00 C ATOM 1078 NE ARG A 192 3.257 -2.135 7.976 1.00 0.00 N ATOM 1079 CZ ARG A 192 2.141 -2.121 8.697 1.00 0.00 C ATOM 1080 NH1 ARG A 192 1.359 -3.191 8.735 1.00 0.00 N ATOM 1081 NH2 ARG A 192 1.806 -1.036 9.383 1.00 0.00 N ATOM 0 H ARG A 192 0.820 -1.839 4.534 1.00 0.00 H new ATOM 0 HA ARG A 192 3.170 -0.973 5.901 1.00 0.00 H new ATOM 0 HB2 ARG A 192 2.497 -3.213 3.970 1.00 0.00 H new ATOM 0 HB3 ARG A 192 4.129 -2.974 4.561 1.00 0.00 H new ATOM 0 HG2 ARG A 192 1.719 -3.378 6.368 1.00 0.00 H new ATOM 0 HG3 ARG A 192 2.775 -4.673 5.841 1.00 0.00 H new ATOM 0 HD2 ARG A 192 3.791 -4.154 7.847 1.00 0.00 H new ATOM 0 HD3 ARG A 192 4.690 -3.088 6.786 1.00 0.00 H new ATOM 0 HE ARG A 192 3.837 -1.296 7.968 1.00 0.00 H new ATOM 0 HH11 ARG A 192 1.614 -4.028 8.210 1.00 0.00 H new ATOM 0 HH12 ARG A 192 0.503 -3.178 9.289 1.00 0.00 H new ATOM 0 HH21 ARG A 192 2.405 -0.211 9.357 1.00 0.00 H new ATOM 0 HH22 ARG A 192 0.949 -1.027 9.936 1.00 0.00 H new ATOM 1095 N VAL A 193 3.101 -0.704 2.601 1.00 0.00 N ATOM 1096 CA VAL A 193 3.730 -0.036 1.469 1.00 0.00 C ATOM 1097 C VAL A 193 3.756 1.476 1.668 1.00 0.00 C ATOM 1098 O VAL A 193 4.800 2.112 1.530 1.00 0.00 O ATOM 1099 CB VAL A 193 2.999 -0.356 0.151 1.00 0.00 C ATOM 1100 CG1 VAL A 193 3.558 0.483 -0.988 1.00 0.00 C ATOM 1101 CG2 VAL A 193 3.101 -1.839 -0.168 1.00 0.00 C ATOM 0 H VAL A 193 2.292 -1.275 2.357 1.00 0.00 H new ATOM 0 HA VAL A 193 4.752 -0.410 1.409 1.00 0.00 H new ATOM 0 HB VAL A 193 1.945 -0.105 0.271 1.00 0.00 H new ATOM 0 HG11 VAL A 193 3.029 0.243 -1.910 1.00 0.00 H new ATOM 0 HG12 VAL A 193 3.427 1.541 -0.759 1.00 0.00 H new ATOM 0 HG13 VAL A 193 4.619 0.268 -1.112 1.00 0.00 H new ATOM 0 HG21 VAL A 193 2.579 -2.047 -1.102 1.00 0.00 H new ATOM 0 HG22 VAL A 193 4.150 -2.118 -0.268 1.00 0.00 H new ATOM 0 HG23 VAL A 193 2.647 -2.416 0.637 1.00 0.00 H new ATOM 1111 N ALA A 194 2.600 2.044 1.995 1.00 0.00 N ATOM 1112 CA ALA A 194 2.491 3.481 2.216 1.00 0.00 C ATOM 1113 C ALA A 194 3.490 3.952 3.268 1.00 0.00 C ATOM 1114 O ALA A 194 4.286 4.857 3.020 1.00 0.00 O ATOM 1115 CB ALA A 194 1.074 3.844 2.633 1.00 0.00 C ATOM 0 H ALA A 194 1.726 1.531 2.113 1.00 0.00 H new ATOM 0 HA ALA A 194 2.724 3.987 1.279 1.00 0.00 H new ATOM 0 HB1 ALA A 194 1.007 4.920 2.795 1.00 0.00 H new ATOM 0 HB2 ALA A 194 0.377 3.551 1.848 1.00 0.00 H new ATOM 0 HB3 ALA A 194 0.821 3.322 3.556 1.00 0.00 H new ATOM 1121 N ALA A 195 3.443 3.331 4.442 1.00 0.00 N ATOM 1122 CA ALA A 195 4.345 3.687 5.531 1.00 0.00 C ATOM 1123 C ALA A 195 5.798 3.663 5.069 1.00 0.00 C ATOM 1124 O ALA A 195 6.611 4.479 5.504 1.00 0.00 O ATOM 1125 CB ALA A 195 4.148 2.744 6.708 1.00 0.00 C ATOM 0 H ALA A 195 2.790 2.579 4.663 1.00 0.00 H new ATOM 0 HA ALA A 195 4.109 4.702 5.849 1.00 0.00 H new ATOM 0 HB1 ALA A 195 4.828 3.021 7.514 1.00 0.00 H new ATOM 0 HB2 ALA A 195 3.119 2.813 7.061 1.00 0.00 H new ATOM 0 HB3 ALA A 195 4.356 1.721 6.394 1.00 0.00 H new ATOM 1131 N TYR A 196 6.119 2.724 4.186 1.00 0.00 N ATOM 1132 CA TYR A 196 7.475 2.593 3.668 1.00 0.00 C ATOM 1133 C TYR A 196 7.873 3.827 2.865 1.00 0.00 C ATOM 1134 O TYR A 196 8.951 4.389 3.061 1.00 0.00 O ATOM 1135 CB TYR A 196 7.591 1.343 2.794 1.00 0.00 C ATOM 1136 CG TYR A 196 9.017 0.903 2.552 1.00 0.00 C ATOM 1137 CD1 TYR A 196 9.818 1.555 1.623 1.00 0.00 C ATOM 1138 CD2 TYR A 196 9.565 -0.164 3.254 1.00 0.00 C ATOM 1139 CE1 TYR A 196 11.121 1.157 1.398 1.00 0.00 C ATOM 1140 CE2 TYR A 196 10.867 -0.569 3.037 1.00 0.00 C ATOM 1141 CZ TYR A 196 11.642 0.094 2.107 1.00 0.00 C ATOM 1142 OH TYR A 196 12.940 -0.305 1.887 1.00 0.00 O ATOM 0 H TYR A 196 5.458 2.042 3.814 1.00 0.00 H new ATOM 0 HA TYR A 196 8.153 2.500 4.516 1.00 0.00 H new ATOM 0 HB2 TYR A 196 7.043 0.528 3.267 1.00 0.00 H new ATOM 0 HB3 TYR A 196 7.111 1.535 1.834 1.00 0.00 H new ATOM 0 HD1 TYR A 196 9.414 2.388 1.067 1.00 0.00 H new ATOM 0 HD2 TYR A 196 8.962 -0.686 3.982 1.00 0.00 H new ATOM 0 HE1 TYR A 196 11.729 1.675 0.671 1.00 0.00 H new ATOM 0 HE2 TYR A 196 11.277 -1.400 3.592 1.00 0.00 H new ATOM 0 HH TYR A 196 13.151 -1.066 2.467 1.00 0.00 H new ATOM 1152 N PHE A 197 6.995 4.244 1.959 1.00 0.00 N ATOM 1153 CA PHE A 197 7.253 5.412 1.125 1.00 0.00 C ATOM 1154 C PHE A 197 7.214 6.692 1.954 1.00 0.00 C ATOM 1155 O PHE A 197 7.733 7.728 1.541 1.00 0.00 O ATOM 1156 CB PHE A 197 6.227 5.493 -0.007 1.00 0.00 C ATOM 1157 CG PHE A 197 6.626 4.725 -1.235 1.00 0.00 C ATOM 1158 CD1 PHE A 197 7.781 5.051 -1.927 1.00 0.00 C ATOM 1159 CD2 PHE A 197 5.847 3.676 -1.696 1.00 0.00 C ATOM 1160 CE1 PHE A 197 8.152 4.346 -3.057 1.00 0.00 C ATOM 1161 CE2 PHE A 197 6.213 2.967 -2.824 1.00 0.00 C ATOM 1162 CZ PHE A 197 7.366 3.303 -3.506 1.00 0.00 C ATOM 0 H PHE A 197 6.098 3.790 1.784 1.00 0.00 H new ATOM 0 HA PHE A 197 8.250 5.308 0.696 1.00 0.00 H new ATOM 0 HB2 PHE A 197 5.270 5.115 0.353 1.00 0.00 H new ATOM 0 HB3 PHE A 197 6.076 6.539 -0.275 1.00 0.00 H new ATOM 0 HD1 PHE A 197 8.399 5.866 -1.580 1.00 0.00 H new ATOM 0 HD2 PHE A 197 4.944 3.410 -1.168 1.00 0.00 H new ATOM 0 HE1 PHE A 197 9.055 4.610 -3.588 1.00 0.00 H new ATOM 0 HE2 PHE A 197 5.598 2.151 -3.172 1.00 0.00 H new ATOM 0 HZ PHE A 197 7.652 2.751 -4.389 1.00 0.00 H new ATOM 1172 N GLY A 198 6.594 6.612 3.128 1.00 0.00 N ATOM 1173 CA GLY A 198 6.498 7.770 3.996 1.00 0.00 C ATOM 1174 C GLY A 198 5.307 8.647 3.664 1.00 0.00 C ATOM 1175 O GLY A 198 5.401 9.873 3.702 1.00 0.00 O ATOM 0 H GLY A 198 6.157 5.766 3.493 1.00 0.00 H new ATOM 0 HA2 GLY A 198 6.424 7.439 5.032 1.00 0.00 H new ATOM 0 HA3 GLY A 198 7.412 8.358 3.914 1.00 0.00 H new ATOM 1179 N MET A 199 4.184 8.017 3.336 1.00 0.00 N ATOM 1180 CA MET A 199 2.969 8.749 2.995 1.00 0.00 C ATOM 1181 C MET A 199 2.061 8.891 4.212 1.00 0.00 C ATOM 1182 O MET A 199 2.338 8.334 5.274 1.00 0.00 O ATOM 1183 CB MET A 199 2.221 8.039 1.865 1.00 0.00 C ATOM 1184 CG MET A 199 3.056 7.849 0.609 1.00 0.00 C ATOM 1185 SD MET A 199 3.014 9.288 -0.477 1.00 0.00 S ATOM 1186 CE MET A 199 2.875 8.499 -2.079 1.00 0.00 C ATOM 0 H MET A 199 4.090 7.002 3.299 1.00 0.00 H new ATOM 0 HA MET A 199 3.256 9.746 2.660 1.00 0.00 H new ATOM 0 HB2 MET A 199 1.885 7.064 2.219 1.00 0.00 H new ATOM 0 HB3 MET A 199 1.328 8.612 1.615 1.00 0.00 H new ATOM 0 HG2 MET A 199 4.088 7.642 0.891 1.00 0.00 H new ATOM 0 HG3 MET A 199 2.693 6.977 0.065 1.00 0.00 H new ATOM 0 HE1 MET A 199 2.891 9.258 -2.861 1.00 0.00 H new ATOM 0 HE2 MET A 199 3.711 7.814 -2.221 1.00 0.00 H new ATOM 0 HE3 MET A 199 1.938 7.944 -2.131 1.00 0.00 H new ATOM 1196 N ASP A 200 0.975 9.640 4.049 1.00 0.00 N ATOM 1197 CA ASP A 200 0.025 9.855 5.135 1.00 0.00 C ATOM 1198 C ASP A 200 -1.389 9.483 4.701 1.00 0.00 C ATOM 1199 O ASP A 200 -2.078 10.271 4.053 1.00 0.00 O ATOM 1200 CB ASP A 200 0.064 11.314 5.594 1.00 0.00 C ATOM 1201 CG ASP A 200 1.210 11.590 6.547 1.00 0.00 C ATOM 1202 OD1 ASP A 200 1.095 11.224 7.735 1.00 0.00 O ATOM 1203 OD2 ASP A 200 2.222 12.174 6.105 1.00 0.00 O ATOM 0 H ASP A 200 0.731 10.108 3.176 1.00 0.00 H new ATOM 0 HA ASP A 200 0.311 9.213 5.968 1.00 0.00 H new ATOM 0 HB2 ASP A 200 0.155 11.964 4.723 1.00 0.00 H new ATOM 0 HB3 ASP A 200 -0.878 11.564 6.081 1.00 0.00 H new ATOM 1208 N HIS A 201 -1.815 8.277 5.061 1.00 0.00 N ATOM 1209 CA HIS A 201 -3.147 7.799 4.708 1.00 0.00 C ATOM 1210 C HIS A 201 -4.156 8.151 5.797 1.00 0.00 C ATOM 1211 O HIS A 201 -3.799 8.293 6.965 1.00 0.00 O ATOM 1212 CB HIS A 201 -3.128 6.287 4.483 1.00 0.00 C ATOM 1213 CG HIS A 201 -3.400 5.494 5.724 1.00 0.00 C ATOM 1214 ND1 HIS A 201 -4.669 5.282 6.219 1.00 0.00 N ATOM 1215 CD2 HIS A 201 -2.557 4.858 6.571 1.00 0.00 C ATOM 1216 CE1 HIS A 201 -4.595 4.552 7.317 1.00 0.00 C ATOM 1217 NE2 HIS A 201 -3.324 4.280 7.552 1.00 0.00 N ATOM 0 H HIS A 201 -1.257 7.612 5.597 1.00 0.00 H new ATOM 0 HA HIS A 201 -3.449 8.291 3.784 1.00 0.00 H new ATOM 0 HB2 HIS A 201 -3.871 6.031 3.728 1.00 0.00 H new ATOM 0 HB3 HIS A 201 -2.155 5.999 4.084 1.00 0.00 H new ATOM 0 HD2 HIS A 201 -1.481 4.814 6.490 1.00 0.00 H new ATOM 0 HE1 HIS A 201 -5.432 4.232 7.920 1.00 0.00 H new ATOM 0 HE2 HIS A 201 -2.970 3.730 8.335 1.00 0.00 H new ATOM 1226 N ASN A 202 -5.419 8.291 5.405 1.00 0.00 N ATOM 1227 CA ASN A 202 -6.479 8.627 6.347 1.00 0.00 C ATOM 1228 C ASN A 202 -7.768 7.886 6.004 1.00 0.00 C ATOM 1229 O ASN A 202 -8.025 7.572 4.841 1.00 0.00 O ATOM 1230 CB ASN A 202 -6.730 10.137 6.347 1.00 0.00 C ATOM 1231 CG ASN A 202 -5.772 10.882 7.257 1.00 0.00 C ATOM 1232 OD1 ASN A 202 -4.679 11.268 6.843 1.00 0.00 O ATOM 1233 ND2 ASN A 202 -6.180 11.087 8.504 1.00 0.00 N ATOM 0 H ASN A 202 -5.732 8.177 4.441 1.00 0.00 H new ATOM 0 HA ASN A 202 -6.158 8.318 7.342 1.00 0.00 H new ATOM 0 HB2 ASN A 202 -6.633 10.519 5.331 1.00 0.00 H new ATOM 0 HB3 ASN A 202 -7.754 10.332 6.664 1.00 0.00 H new ATOM 0 HD21 ASN A 202 -5.579 11.582 9.162 1.00 0.00 H new ATOM 0 HD22 ASN A 202 -7.095 10.749 8.803 1.00 0.00 H new ATOM 1240 N VAL A 203 -8.575 7.610 7.023 1.00 0.00 N ATOM 1241 CA VAL A 203 -9.838 6.908 6.829 1.00 0.00 C ATOM 1242 C VAL A 203 -10.970 7.885 6.531 1.00 0.00 C ATOM 1243 O VAL A 203 -10.922 9.048 6.932 1.00 0.00 O ATOM 1244 CB VAL A 203 -10.210 6.071 8.068 1.00 0.00 C ATOM 1245 CG1 VAL A 203 -9.215 4.938 8.265 1.00 0.00 C ATOM 1246 CG2 VAL A 203 -10.279 6.953 9.305 1.00 0.00 C ATOM 0 H VAL A 203 -8.377 7.862 7.991 1.00 0.00 H new ATOM 0 HA VAL A 203 -9.703 6.242 5.976 1.00 0.00 H new ATOM 0 HB VAL A 203 -11.195 5.633 7.907 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -9.494 4.358 9.145 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -9.221 4.292 7.387 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -8.216 5.351 8.405 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -10.543 6.346 10.171 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.309 7.421 9.472 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -11.035 7.725 9.160 1.00 0.00 H new ATOM 1256 N ASP A 204 -11.987 7.405 5.824 1.00 0.00 N ATOM 1257 CA ASP A 204 -13.134 8.235 5.473 1.00 0.00 C ATOM 1258 C ASP A 204 -14.228 8.126 6.530 1.00 0.00 C ATOM 1259 O ASP A 204 -14.192 7.241 7.384 1.00 0.00 O ATOM 1260 CB ASP A 204 -13.685 7.828 4.105 1.00 0.00 C ATOM 1261 CG ASP A 204 -13.986 6.344 4.021 1.00 0.00 C ATOM 1262 OD1 ASP A 204 -13.366 5.569 4.779 1.00 0.00 O ATOM 1263 OD2 ASP A 204 -14.841 5.959 3.197 1.00 0.00 O ATOM 0 H ASP A 204 -12.041 6.445 5.483 1.00 0.00 H new ATOM 0 HA ASP A 204 -12.801 9.272 5.428 1.00 0.00 H new ATOM 0 HB2 ASP A 204 -14.595 8.393 3.900 1.00 0.00 H new ATOM 0 HB3 ASP A 204 -12.964 8.094 3.332 1.00 0.00 H new ATOM 1268 N GLN A 205 -15.199 9.031 6.465 1.00 0.00 N ATOM 1269 CA GLN A 205 -16.303 9.037 7.417 1.00 0.00 C ATOM 1270 C GLN A 205 -16.814 7.622 7.666 1.00 0.00 C ATOM 1271 O GLN A 205 -17.274 7.299 8.763 1.00 0.00 O ATOM 1272 CB GLN A 205 -17.442 9.920 6.906 1.00 0.00 C ATOM 1273 CG GLN A 205 -17.919 9.550 5.511 1.00 0.00 C ATOM 1274 CD GLN A 205 -19.121 10.363 5.070 1.00 0.00 C ATOM 1275 OE1 GLN A 205 -19.531 11.304 5.751 1.00 0.00 O ATOM 1276 NE2 GLN A 205 -19.691 10.005 3.926 1.00 0.00 N ATOM 0 H GLN A 205 -15.244 9.770 5.763 1.00 0.00 H new ATOM 0 HA GLN A 205 -15.934 9.442 8.359 1.00 0.00 H new ATOM 0 HB2 GLN A 205 -18.282 9.852 7.598 1.00 0.00 H new ATOM 0 HB3 GLN A 205 -17.113 10.959 6.905 1.00 0.00 H new ATOM 0 HG2 GLN A 205 -17.105 9.698 4.802 1.00 0.00 H new ATOM 0 HG3 GLN A 205 -18.173 8.490 5.487 1.00 0.00 H new ATOM 0 HE21 GLN A 205 -19.318 9.219 3.394 1.00 0.00 H new ATOM 0 HE22 GLN A 205 -20.502 10.516 3.579 1.00 0.00 H new ATOM 1285 N THR A 206 -16.732 6.779 6.641 1.00 0.00 N ATOM 1286 CA THR A 206 -17.188 5.399 6.748 1.00 0.00 C ATOM 1287 C THR A 206 -16.036 4.465 7.103 1.00 0.00 C ATOM 1288 O THR A 206 -16.224 3.465 7.794 1.00 0.00 O ATOM 1289 CB THR A 206 -17.837 4.918 5.437 1.00 0.00 C ATOM 1290 OG1 THR A 206 -16.965 5.182 4.333 1.00 0.00 O ATOM 1291 CG2 THR A 206 -19.173 5.610 5.210 1.00 0.00 C ATOM 0 H THR A 206 -16.354 7.028 5.727 1.00 0.00 H new ATOM 0 HA THR A 206 -17.932 5.374 7.544 1.00 0.00 H new ATOM 0 HB THR A 206 -18.009 3.845 5.515 1.00 0.00 H new ATOM 0 HG1 THR A 206 -17.021 6.130 4.092 1.00 0.00 H new ATOM 0 HG21 THR A 206 -19.613 5.255 4.278 1.00 0.00 H new ATOM 0 HG22 THR A 206 -19.845 5.384 6.038 1.00 0.00 H new ATOM 0 HG23 THR A 206 -19.019 6.687 5.151 1.00 0.00 H new ATOM 1299 N GLY A 207 -14.841 4.799 6.625 1.00 0.00 N ATOM 1300 CA GLY A 207 -13.675 3.980 6.903 1.00 0.00 C ATOM 1301 C GLY A 207 -13.569 2.788 5.973 1.00 0.00 C ATOM 1302 O GLY A 207 -13.018 1.750 6.341 1.00 0.00 O ATOM 0 H GLY A 207 -14.659 5.622 6.050 1.00 0.00 H new ATOM 0 HA2 GLY A 207 -12.776 4.590 6.811 1.00 0.00 H new ATOM 0 HA3 GLY A 207 -13.718 3.630 7.934 1.00 0.00 H new ATOM 1306 N LYS A 208 -14.099 2.934 4.763 1.00 0.00 N ATOM 1307 CA LYS A 208 -14.062 1.862 3.776 1.00 0.00 C ATOM 1308 C LYS A 208 -12.755 1.890 2.990 1.00 0.00 C ATOM 1309 O LYS A 208 -12.116 0.857 2.794 1.00 0.00 O ATOM 1310 CB LYS A 208 -15.249 1.982 2.818 1.00 0.00 C ATOM 1311 CG LYS A 208 -16.598 1.965 3.515 1.00 0.00 C ATOM 1312 CD LYS A 208 -16.902 0.599 4.108 1.00 0.00 C ATOM 1313 CE LYS A 208 -17.233 -0.417 3.025 1.00 0.00 C ATOM 1314 NZ LYS A 208 -18.103 -1.511 3.538 1.00 0.00 N ATOM 0 H LYS A 208 -14.560 3.786 4.442 1.00 0.00 H new ATOM 0 HA LYS A 208 -14.126 0.912 4.306 1.00 0.00 H new ATOM 0 HB2 LYS A 208 -15.155 2.908 2.250 1.00 0.00 H new ATOM 0 HB3 LYS A 208 -15.210 1.163 2.100 1.00 0.00 H new ATOM 0 HG2 LYS A 208 -16.610 2.716 4.305 1.00 0.00 H new ATOM 0 HG3 LYS A 208 -17.379 2.236 2.805 1.00 0.00 H new ATOM 0 HD2 LYS A 208 -16.044 0.252 4.684 1.00 0.00 H new ATOM 0 HD3 LYS A 208 -17.740 0.680 4.801 1.00 0.00 H new ATOM 0 HE2 LYS A 208 -17.732 0.085 2.196 1.00 0.00 H new ATOM 0 HE3 LYS A 208 -16.310 -0.842 2.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 208 -18.306 -2.182 2.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 208 -17.617 -2.007 4.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 208 -18.995 -1.109 3.891 1.00 0.00 H new ATOM 1328 N ALA A 209 -12.365 3.079 2.543 1.00 0.00 N ATOM 1329 CA ALA A 209 -11.132 3.242 1.782 1.00 0.00 C ATOM 1330 C ALA A 209 -10.262 4.344 2.375 1.00 0.00 C ATOM 1331 O ALA A 209 -10.769 5.338 2.895 1.00 0.00 O ATOM 1332 CB ALA A 209 -11.448 3.543 0.324 1.00 0.00 C ATOM 0 H ALA A 209 -12.885 3.943 2.695 1.00 0.00 H new ATOM 0 HA ALA A 209 -10.574 2.307 1.836 1.00 0.00 H new ATOM 0 HB1 ALA A 209 -10.518 3.662 -0.233 1.00 0.00 H new ATOM 0 HB2 ALA A 209 -12.022 2.720 -0.101 1.00 0.00 H new ATOM 0 HB3 ALA A 209 -12.030 4.463 0.260 1.00 0.00 H new ATOM 1338 N VAL A 210 -8.947 4.161 2.296 1.00 0.00 N ATOM 1339 CA VAL A 210 -8.006 5.141 2.824 1.00 0.00 C ATOM 1340 C VAL A 210 -7.603 6.150 1.754 1.00 0.00 C ATOM 1341 O VAL A 210 -7.576 5.831 0.566 1.00 0.00 O ATOM 1342 CB VAL A 210 -6.739 4.461 3.376 1.00 0.00 C ATOM 1343 CG1 VAL A 210 -7.087 3.550 4.544 1.00 0.00 C ATOM 1344 CG2 VAL A 210 -6.030 3.685 2.277 1.00 0.00 C ATOM 0 H VAL A 210 -8.510 3.343 1.871 1.00 0.00 H new ATOM 0 HA VAL A 210 -8.514 5.661 3.636 1.00 0.00 H new ATOM 0 HB VAL A 210 -6.062 5.234 3.739 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -6.179 3.078 4.921 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -7.548 4.137 5.339 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -7.784 2.781 4.211 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -5.137 3.211 2.684 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -6.699 2.920 1.882 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -5.745 4.367 1.476 1.00 0.00 H new ATOM 1354 N ILE A 211 -7.291 7.367 2.185 1.00 0.00 N ATOM 1355 CA ILE A 211 -6.888 8.422 1.264 1.00 0.00 C ATOM 1356 C ILE A 211 -5.489 8.933 1.591 1.00 0.00 C ATOM 1357 O ILE A 211 -5.225 9.379 2.708 1.00 0.00 O ATOM 1358 CB ILE A 211 -7.874 9.605 1.295 1.00 0.00 C ATOM 1359 CG1 ILE A 211 -9.295 9.120 0.999 1.00 0.00 C ATOM 1360 CG2 ILE A 211 -7.453 10.673 0.297 1.00 0.00 C ATOM 1361 CD1 ILE A 211 -10.369 9.956 1.661 1.00 0.00 C ATOM 0 H ILE A 211 -7.309 7.647 3.166 1.00 0.00 H new ATOM 0 HA ILE A 211 -6.889 7.985 0.265 1.00 0.00 H new ATOM 0 HB ILE A 211 -7.861 10.044 2.293 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -9.455 9.125 -0.079 1.00 0.00 H new ATOM 0 HG13 ILE A 211 -9.394 8.087 1.331 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -8.160 11.502 0.331 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -6.457 11.035 0.550 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -7.440 10.248 -0.707 1.00 0.00 H new ATOM 0 HD11 ILE A 211 -11.350 9.555 1.408 1.00 0.00 H new ATOM 0 HD12 ILE A 211 -10.235 9.931 2.742 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -10.297 10.986 1.310 1.00 0.00 H new ATOM 1373 N ILE A 212 -4.596 8.866 0.609 1.00 0.00 N ATOM 1374 CA ILE A 212 -3.224 9.325 0.792 1.00 0.00 C ATOM 1375 C ILE A 212 -3.004 10.679 0.125 1.00 0.00 C ATOM 1376 O ILE A 212 -3.842 11.147 -0.644 1.00 0.00 O ATOM 1377 CB ILE A 212 -2.212 8.314 0.222 1.00 0.00 C ATOM 1378 CG1 ILE A 212 -2.498 8.053 -1.259 1.00 0.00 C ATOM 1379 CG2 ILE A 212 -2.258 7.015 1.012 1.00 0.00 C ATOM 1380 CD1 ILE A 212 -1.423 7.240 -1.947 1.00 0.00 C ATOM 0 H ILE A 212 -4.798 8.499 -0.321 1.00 0.00 H new ATOM 0 HA ILE A 212 -3.064 9.421 1.866 1.00 0.00 H new ATOM 0 HB ILE A 212 -1.211 8.735 0.311 1.00 0.00 H new ATOM 0 HG12 ILE A 212 -3.451 7.532 -1.351 1.00 0.00 H new ATOM 0 HG13 ILE A 212 -2.606 9.008 -1.774 1.00 0.00 H new ATOM 0 HG21 ILE A 212 -1.537 6.311 0.597 1.00 0.00 H new ATOM 0 HG22 ILE A 212 -2.011 7.214 2.055 1.00 0.00 H new ATOM 0 HG23 ILE A 212 -3.259 6.588 0.951 1.00 0.00 H new ATOM 0 HD11 ILE A 212 -1.691 7.093 -2.993 1.00 0.00 H new ATOM 0 HD12 ILE A 212 -0.472 7.769 -1.887 1.00 0.00 H new ATOM 0 HD13 ILE A 212 -1.330 6.271 -1.457 1.00 0.00 H new ATOM 1392 N ASN A 213 -1.869 11.302 0.426 1.00 0.00 N ATOM 1393 CA ASN A 213 -1.537 12.602 -0.145 1.00 0.00 C ATOM 1394 C ASN A 213 -0.044 12.699 -0.447 1.00 0.00 C ATOM 1395 O ASN A 213 0.722 11.783 -0.147 1.00 0.00 O ATOM 1396 CB ASN A 213 -1.949 13.723 0.812 1.00 0.00 C ATOM 1397 CG ASN A 213 -0.900 13.992 1.873 1.00 0.00 C ATOM 1398 OD1 ASN A 213 -0.112 13.112 2.220 1.00 0.00 O ATOM 1399 ND2 ASN A 213 -0.885 15.213 2.394 1.00 0.00 N ATOM 0 H ASN A 213 -1.164 10.928 1.062 1.00 0.00 H new ATOM 0 HA ASN A 213 -2.086 12.711 -1.080 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -2.128 14.635 0.243 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -2.890 13.458 1.294 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -0.201 15.453 3.112 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -1.557 15.911 2.076 1.00 0.00 H new ATOM 1406 N LYS A 214 0.362 13.815 -1.041 1.00 0.00 N ATOM 1407 CA LYS A 214 1.763 14.034 -1.382 1.00 0.00 C ATOM 1408 C LYS A 214 2.410 15.021 -0.416 1.00 0.00 C ATOM 1409 O LYS A 214 2.006 16.182 -0.334 1.00 0.00 O ATOM 1410 CB LYS A 214 1.885 14.554 -2.817 1.00 0.00 C ATOM 1411 CG LYS A 214 3.282 15.029 -3.175 1.00 0.00 C ATOM 1412 CD LYS A 214 4.159 13.880 -3.642 1.00 0.00 C ATOM 1413 CE LYS A 214 5.613 14.308 -3.779 1.00 0.00 C ATOM 1414 NZ LYS A 214 6.242 14.563 -2.453 1.00 0.00 N ATOM 0 H LYS A 214 -0.259 14.583 -1.297 1.00 0.00 H new ATOM 0 HA LYS A 214 2.284 13.080 -1.302 1.00 0.00 H new ATOM 0 HB2 LYS A 214 1.591 13.763 -3.507 1.00 0.00 H new ATOM 0 HB3 LYS A 214 1.184 15.376 -2.957 1.00 0.00 H new ATOM 0 HG2 LYS A 214 3.221 15.783 -3.959 1.00 0.00 H new ATOM 0 HG3 LYS A 214 3.738 15.507 -2.308 1.00 0.00 H new ATOM 0 HD2 LYS A 214 4.087 13.055 -2.934 1.00 0.00 H new ATOM 0 HD3 LYS A 214 3.796 13.510 -4.601 1.00 0.00 H new ATOM 0 HE2 LYS A 214 6.172 13.533 -4.303 1.00 0.00 H new ATOM 0 HE3 LYS A 214 5.670 15.210 -4.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 214 6.612 15.534 -2.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 214 5.532 14.442 -1.703 1.00 0.00 H new ATOM 0 HZ3 LYS A 214 7.021 13.891 -2.304 1.00 0.00 H new ATOM 1428 N THR A 215 3.419 14.554 0.313 1.00 0.00 N ATOM 1429 CA THR A 215 4.122 15.395 1.273 1.00 0.00 C ATOM 1430 C THR A 215 5.632 15.288 1.095 1.00 0.00 C ATOM 1431 O THR A 215 6.143 14.260 0.652 1.00 0.00 O ATOM 1432 CB THR A 215 3.759 15.019 2.722 1.00 0.00 C ATOM 1433 OG1 THR A 215 4.048 13.636 2.956 1.00 0.00 O ATOM 1434 CG2 THR A 215 2.288 15.289 2.999 1.00 0.00 C ATOM 0 H THR A 215 3.767 13.597 0.256 1.00 0.00 H new ATOM 0 HA THR A 215 3.808 16.421 1.083 1.00 0.00 H new ATOM 0 HB THR A 215 4.357 15.634 3.394 1.00 0.00 H new ATOM 0 HG1 THR A 215 3.816 13.405 3.880 1.00 0.00 H new ATOM 0 HG21 THR A 215 2.055 15.016 4.028 1.00 0.00 H new ATOM 0 HG22 THR A 215 2.078 16.348 2.848 1.00 0.00 H new ATOM 0 HG23 THR A 215 1.675 14.697 2.319 1.00 0.00 H new ATOM 1442 N SER A 216 6.342 16.356 1.445 1.00 0.00 N ATOM 1443 CA SER A 216 7.794 16.383 1.320 1.00 0.00 C ATOM 1444 C SER A 216 8.407 15.079 1.824 1.00 0.00 C ATOM 1445 O SER A 216 9.188 14.437 1.123 1.00 0.00 O ATOM 1446 CB SER A 216 8.372 17.566 2.100 1.00 0.00 C ATOM 1447 OG SER A 216 7.887 17.585 3.431 1.00 0.00 O ATOM 0 H SER A 216 5.935 17.214 1.817 1.00 0.00 H new ATOM 0 HA SER A 216 8.041 16.497 0.265 1.00 0.00 H new ATOM 0 HB2 SER A 216 9.460 17.504 2.107 1.00 0.00 H new ATOM 0 HB3 SER A 216 8.109 18.498 1.600 1.00 0.00 H new ATOM 0 HG SER A 216 8.272 18.349 3.909 1.00 0.00 H new ATOM 1453 N ASN A 217 8.046 14.696 3.044 1.00 0.00 N ATOM 1454 CA ASN A 217 8.559 13.469 3.642 1.00 0.00 C ATOM 1455 C ASN A 217 8.586 12.335 2.622 1.00 0.00 C ATOM 1456 O ASN A 217 9.497 11.506 2.621 1.00 0.00 O ATOM 1457 CB ASN A 217 7.704 13.067 4.846 1.00 0.00 C ATOM 1458 CG ASN A 217 7.938 13.963 6.047 1.00 0.00 C ATOM 1459 OD1 ASN A 217 7.185 14.906 6.288 1.00 0.00 O ATOM 1460 ND2 ASN A 217 8.987 13.670 6.807 1.00 0.00 N ATOM 0 H ASN A 217 7.401 15.217 3.638 1.00 0.00 H new ATOM 0 HA ASN A 217 9.579 13.657 3.976 1.00 0.00 H new ATOM 0 HB2 ASN A 217 6.651 13.104 4.568 1.00 0.00 H new ATOM 0 HB3 ASN A 217 7.926 12.035 5.117 1.00 0.00 H new ATOM 0 HD21 ASN A 217 9.195 14.237 7.629 1.00 0.00 H new ATOM 0 HD22 ASN A 217 9.584 12.878 6.569 1.00 0.00 H new ATOM 1467 N THR A 218 7.581 12.305 1.752 1.00 0.00 N ATOM 1468 CA THR A 218 7.488 11.274 0.727 1.00 0.00 C ATOM 1469 C THR A 218 8.648 11.372 -0.258 1.00 0.00 C ATOM 1470 O THR A 218 8.640 12.209 -1.160 1.00 0.00 O ATOM 1471 CB THR A 218 6.161 11.371 -0.050 1.00 0.00 C ATOM 1472 OG1 THR A 218 5.059 11.140 0.834 1.00 0.00 O ATOM 1473 CG2 THR A 218 6.126 10.363 -1.189 1.00 0.00 C ATOM 0 H THR A 218 6.820 12.984 1.737 1.00 0.00 H new ATOM 0 HA THR A 218 7.530 10.314 1.241 1.00 0.00 H new ATOM 0 HB THR A 218 6.084 12.373 -0.472 1.00 0.00 H new ATOM 0 HG1 THR A 218 4.493 10.427 0.472 1.00 0.00 H new ATOM 0 HG21 THR A 218 5.180 10.450 -1.723 1.00 0.00 H new ATOM 0 HG22 THR A 218 6.950 10.561 -1.875 1.00 0.00 H new ATOM 0 HG23 THR A 218 6.224 9.355 -0.786 1.00 0.00 H new ATOM 1481 N ARG A 219 9.645 10.511 -0.078 1.00 0.00 N ATOM 1482 CA ARG A 219 10.812 10.501 -0.951 1.00 0.00 C ATOM 1483 C ARG A 219 11.035 9.113 -1.546 1.00 0.00 C ATOM 1484 O ARG A 219 10.412 8.139 -1.122 1.00 0.00 O ATOM 1485 CB ARG A 219 12.057 10.942 -0.178 1.00 0.00 C ATOM 1486 CG ARG A 219 12.244 12.450 -0.134 1.00 0.00 C ATOM 1487 CD ARG A 219 13.433 12.838 0.729 1.00 0.00 C ATOM 1488 NE ARG A 219 14.704 12.605 0.048 1.00 0.00 N ATOM 1489 CZ ARG A 219 15.885 12.921 0.567 1.00 0.00 C ATOM 1490 NH1 ARG A 219 15.957 13.481 1.767 1.00 0.00 N ATOM 1491 NH2 ARG A 219 16.997 12.678 -0.115 1.00 0.00 N ATOM 0 H ARG A 219 9.667 9.812 0.664 1.00 0.00 H new ATOM 0 HA ARG A 219 10.631 11.202 -1.766 1.00 0.00 H new ATOM 0 HB2 ARG A 219 11.995 10.562 0.842 1.00 0.00 H new ATOM 0 HB3 ARG A 219 12.937 10.488 -0.634 1.00 0.00 H new ATOM 0 HG2 ARG A 219 12.388 12.830 -1.146 1.00 0.00 H new ATOM 0 HG3 ARG A 219 11.341 12.919 0.257 1.00 0.00 H new ATOM 0 HD2 ARG A 219 13.355 13.891 1.001 1.00 0.00 H new ATOM 0 HD3 ARG A 219 13.409 12.267 1.657 1.00 0.00 H new ATOM 0 HE ARG A 219 14.683 12.176 -0.877 1.00 0.00 H new ATOM 0 HH11 ARG A 219 15.104 13.670 2.294 1.00 0.00 H new ATOM 0 HH12 ARG A 219 16.865 13.723 2.163 1.00 0.00 H new ATOM 0 HH21 ARG A 219 16.945 12.248 -1.039 1.00 0.00 H new ATOM 0 HH22 ARG A 219 17.904 12.921 0.284 1.00 0.00 H new ATOM 1505 N ILE A 220 11.926 9.032 -2.528 1.00 0.00 N ATOM 1506 CA ILE A 220 12.230 7.765 -3.180 1.00 0.00 C ATOM 1507 C ILE A 220 13.018 6.845 -2.253 1.00 0.00 C ATOM 1508 O ILE A 220 14.011 7.241 -1.642 1.00 0.00 O ATOM 1509 CB ILE A 220 13.033 7.977 -4.477 1.00 0.00 C ATOM 1510 CG1 ILE A 220 12.170 8.678 -5.528 1.00 0.00 C ATOM 1511 CG2 ILE A 220 13.547 6.646 -5.006 1.00 0.00 C ATOM 1512 CD1 ILE A 220 12.925 9.034 -6.790 1.00 0.00 C ATOM 0 H ILE A 220 12.450 9.829 -2.889 1.00 0.00 H new ATOM 0 HA ILE A 220 11.275 7.300 -3.425 1.00 0.00 H new ATOM 0 HB ILE A 220 13.891 8.613 -4.256 1.00 0.00 H new ATOM 0 HG12 ILE A 220 11.330 8.033 -5.786 1.00 0.00 H new ATOM 0 HG13 ILE A 220 11.752 9.587 -5.096 1.00 0.00 H new ATOM 0 HG21 ILE A 220 14.112 6.813 -5.923 1.00 0.00 H new ATOM 0 HG22 ILE A 220 14.193 6.183 -4.260 1.00 0.00 H new ATOM 0 HG23 ILE A 220 12.704 5.987 -5.214 1.00 0.00 H new ATOM 0 HD11 ILE A 220 12.251 9.528 -7.490 1.00 0.00 H new ATOM 0 HD12 ILE A 220 13.748 9.705 -6.544 1.00 0.00 H new ATOM 0 HD13 ILE A 220 13.320 8.126 -7.246 1.00 0.00 H new ATOM 1524 N PRO A 221 12.566 5.586 -2.145 1.00 0.00 N ATOM 1525 CA PRO A 221 13.215 4.583 -1.296 1.00 0.00 C ATOM 1526 C PRO A 221 14.573 4.154 -1.840 1.00 0.00 C ATOM 1527 O PRO A 221 15.130 4.802 -2.726 1.00 0.00 O ATOM 1528 CB PRO A 221 12.234 3.409 -1.321 1.00 0.00 C ATOM 1529 CG PRO A 221 11.489 3.565 -2.602 1.00 0.00 C ATOM 1530 CD PRO A 221 11.389 5.046 -2.844 1.00 0.00 C ATOM 0 HA PRO A 221 13.418 4.966 -0.296 1.00 0.00 H new ATOM 0 HB2 PRO A 221 12.758 2.454 -1.282 1.00 0.00 H new ATOM 0 HB3 PRO A 221 11.560 3.438 -0.465 1.00 0.00 H new ATOM 0 HG2 PRO A 221 12.012 3.070 -3.420 1.00 0.00 H new ATOM 0 HG3 PRO A 221 10.500 3.112 -2.536 1.00 0.00 H new ATOM 0 HD2 PRO A 221 11.410 5.282 -3.908 1.00 0.00 H new ATOM 0 HD3 PRO A 221 10.461 5.457 -2.445 1.00 0.00 H new ATOM 1538 N GLU A 222 15.101 3.057 -1.305 1.00 0.00 N ATOM 1539 CA GLU A 222 16.395 2.542 -1.738 1.00 0.00 C ATOM 1540 C GLU A 222 16.228 1.542 -2.878 1.00 0.00 C ATOM 1541 O GLU A 222 16.891 1.645 -3.910 1.00 0.00 O ATOM 1542 CB GLU A 222 17.124 1.881 -0.567 1.00 0.00 C ATOM 1543 CG GLU A 222 16.390 0.681 0.008 1.00 0.00 C ATOM 1544 CD GLU A 222 16.922 0.267 1.366 1.00 0.00 C ATOM 1545 OE1 GLU A 222 16.767 1.049 2.328 1.00 0.00 O ATOM 1546 OE2 GLU A 222 17.493 -0.839 1.467 1.00 0.00 O ATOM 0 H GLU A 222 14.653 2.508 -0.571 1.00 0.00 H new ATOM 0 HA GLU A 222 16.989 3.382 -2.098 1.00 0.00 H new ATOM 0 HB2 GLU A 222 18.114 1.567 -0.897 1.00 0.00 H new ATOM 0 HB3 GLU A 222 17.271 2.619 0.222 1.00 0.00 H new ATOM 0 HG2 GLU A 222 15.329 0.916 0.094 1.00 0.00 H new ATOM 0 HG3 GLU A 222 16.476 -0.158 -0.683 1.00 0.00 H new ATOM 1553 N GLN A 223 15.339 0.573 -2.682 1.00 0.00 N ATOM 1554 CA GLN A 223 15.086 -0.447 -3.693 1.00 0.00 C ATOM 1555 C GLN A 223 13.601 -0.787 -3.764 1.00 0.00 C ATOM 1556 O GLN A 223 12.909 -0.801 -2.746 1.00 0.00 O ATOM 1557 CB GLN A 223 15.896 -1.708 -3.388 1.00 0.00 C ATOM 1558 CG GLN A 223 17.294 -1.692 -3.986 1.00 0.00 C ATOM 1559 CD GLN A 223 18.232 -2.669 -3.303 1.00 0.00 C ATOM 1560 OE1 GLN A 223 17.813 -3.733 -2.847 1.00 0.00 O ATOM 1561 NE2 GLN A 223 19.509 -2.311 -3.230 1.00 0.00 N ATOM 0 H GLN A 223 14.782 0.473 -1.833 1.00 0.00 H new ATOM 0 HA GLN A 223 15.395 -0.049 -4.660 1.00 0.00 H new ATOM 0 HB2 GLN A 223 15.973 -1.828 -2.307 1.00 0.00 H new ATOM 0 HB3 GLN A 223 15.357 -2.576 -3.767 1.00 0.00 H new ATOM 0 HG2 GLN A 223 17.234 -1.933 -5.047 1.00 0.00 H new ATOM 0 HG3 GLN A 223 17.706 -0.686 -3.911 1.00 0.00 H new ATOM 0 HE21 GLN A 223 19.812 -1.419 -3.622 1.00 0.00 H new ATOM 0 HE22 GLN A 223 20.187 -2.928 -2.782 1.00 0.00 H new ATOM 1570 N ARG A 224 13.119 -1.060 -4.971 1.00 0.00 N ATOM 1571 CA ARG A 224 11.715 -1.398 -5.175 1.00 0.00 C ATOM 1572 C ARG A 224 11.542 -2.901 -5.380 1.00 0.00 C ATOM 1573 O ARG A 224 12.519 -3.649 -5.419 1.00 0.00 O ATOM 1574 CB ARG A 224 11.155 -0.640 -6.380 1.00 0.00 C ATOM 1575 CG ARG A 224 11.188 0.870 -6.218 1.00 0.00 C ATOM 1576 CD ARG A 224 10.729 1.292 -4.831 1.00 0.00 C ATOM 1577 NE ARG A 224 9.375 0.829 -4.539 1.00 0.00 N ATOM 1578 CZ ARG A 224 8.912 0.643 -3.308 1.00 0.00 C ATOM 1579 NH1 ARG A 224 9.689 0.882 -2.260 1.00 0.00 N ATOM 1580 NH2 ARG A 224 7.668 0.219 -3.122 1.00 0.00 N ATOM 0 H ARG A 224 13.679 -1.054 -5.823 1.00 0.00 H new ATOM 0 HA ARG A 224 11.163 -1.104 -4.282 1.00 0.00 H new ATOM 0 HB2 ARG A 224 11.725 -0.914 -7.268 1.00 0.00 H new ATOM 0 HB3 ARG A 224 10.126 -0.956 -6.551 1.00 0.00 H new ATOM 0 HG2 ARG A 224 12.200 1.234 -6.394 1.00 0.00 H new ATOM 0 HG3 ARG A 224 10.548 1.332 -6.970 1.00 0.00 H new ATOM 0 HD2 ARG A 224 11.417 0.895 -4.085 1.00 0.00 H new ATOM 0 HD3 ARG A 224 10.766 2.378 -4.752 1.00 0.00 H new ATOM 0 HE ARG A 224 8.751 0.638 -5.323 1.00 0.00 H new ATOM 0 HH11 ARG A 224 10.645 1.210 -2.398 1.00 0.00 H new ATOM 0 HH12 ARG A 224 9.330 0.738 -1.316 1.00 0.00 H new ATOM 0 HH21 ARG A 224 7.066 0.036 -3.925 1.00 0.00 H new ATOM 0 HH22 ARG A 224 7.314 0.077 -2.176 1.00 0.00 H new ATOM 1594 N PHE A 225 10.293 -3.335 -5.510 1.00 0.00 N ATOM 1595 CA PHE A 225 9.992 -4.748 -5.710 1.00 0.00 C ATOM 1596 C PHE A 225 9.936 -5.087 -7.197 1.00 0.00 C ATOM 1597 O PHE A 225 9.594 -6.207 -7.576 1.00 0.00 O ATOM 1598 CB PHE A 225 8.663 -5.107 -5.043 1.00 0.00 C ATOM 1599 CG PHE A 225 8.369 -4.293 -3.815 1.00 0.00 C ATOM 1600 CD1 PHE A 225 9.160 -4.412 -2.684 1.00 0.00 C ATOM 1601 CD2 PHE A 225 7.302 -3.410 -3.792 1.00 0.00 C ATOM 1602 CE1 PHE A 225 8.893 -3.665 -1.552 1.00 0.00 C ATOM 1603 CE2 PHE A 225 7.030 -2.660 -2.663 1.00 0.00 C ATOM 1604 CZ PHE A 225 7.826 -2.788 -1.542 1.00 0.00 C ATOM 0 H PHE A 225 9.473 -2.729 -5.480 1.00 0.00 H new ATOM 0 HA PHE A 225 10.790 -5.332 -5.252 1.00 0.00 H new ATOM 0 HB2 PHE A 225 7.856 -4.969 -5.762 1.00 0.00 H new ATOM 0 HB3 PHE A 225 8.674 -6.163 -4.775 1.00 0.00 H new ATOM 0 HD1 PHE A 225 9.995 -5.097 -2.687 1.00 0.00 H new ATOM 0 HD2 PHE A 225 6.676 -3.306 -4.666 1.00 0.00 H new ATOM 0 HE1 PHE A 225 9.518 -3.767 -0.677 1.00 0.00 H new ATOM 0 HE2 PHE A 225 6.196 -1.974 -2.658 1.00 0.00 H new ATOM 0 HZ PHE A 225 7.615 -2.203 -0.659 1.00 0.00 H new ATOM 1614 N SER A 226 10.273 -4.111 -8.033 1.00 0.00 N ATOM 1615 CA SER A 226 10.257 -4.303 -9.479 1.00 0.00 C ATOM 1616 C SER A 226 11.560 -4.938 -9.957 1.00 0.00 C ATOM 1617 O SER A 226 11.707 -5.267 -11.133 1.00 0.00 O ATOM 1618 CB SER A 226 10.036 -2.967 -10.190 1.00 0.00 C ATOM 1619 OG SER A 226 9.905 -3.150 -11.589 1.00 0.00 O ATOM 0 H SER A 226 10.561 -3.179 -7.735 1.00 0.00 H new ATOM 0 HA SER A 226 9.435 -4.976 -9.722 1.00 0.00 H new ATOM 0 HB2 SER A 226 9.140 -2.486 -9.797 1.00 0.00 H new ATOM 0 HB3 SER A 226 10.872 -2.299 -9.984 1.00 0.00 H new ATOM 0 HG SER A 226 10.497 -3.874 -11.881 1.00 0.00 H new ATOM 1625 N GLU A 227 12.503 -5.105 -9.034 1.00 0.00 N ATOM 1626 CA GLU A 227 13.794 -5.699 -9.361 1.00 0.00 C ATOM 1627 C GLU A 227 13.806 -7.189 -9.033 1.00 0.00 C ATOM 1628 O GLU A 227 14.295 -8.004 -9.816 1.00 0.00 O ATOM 1629 CB GLU A 227 14.914 -4.989 -8.599 1.00 0.00 C ATOM 1630 CG GLU A 227 14.831 -5.163 -7.092 1.00 0.00 C ATOM 1631 CD GLU A 227 15.586 -4.086 -6.338 1.00 0.00 C ATOM 1632 OE1 GLU A 227 15.419 -2.895 -6.676 1.00 0.00 O ATOM 1633 OE2 GLU A 227 16.345 -4.434 -5.409 1.00 0.00 O ATOM 0 H GLU A 227 12.397 -4.838 -8.055 1.00 0.00 H new ATOM 0 HA GLU A 227 13.960 -5.579 -10.432 1.00 0.00 H new ATOM 0 HB2 GLU A 227 15.875 -5.367 -8.947 1.00 0.00 H new ATOM 0 HB3 GLU A 227 14.885 -3.925 -8.835 1.00 0.00 H new ATOM 0 HG2 GLU A 227 13.785 -5.150 -6.786 1.00 0.00 H new ATOM 0 HG3 GLU A 227 15.231 -6.140 -6.820 1.00 0.00 H new