USER MOD reduce.3.24.130724 H: found=0, std=0, add=537, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 536 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 199 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 206 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 145 GLN :FLIP amide:sc= -2.41 F(o=-3.9,f=-2.7) USER MOD Set 2.2: A 200 MET CE :methyl -168:sc= -0.297 (180deg=0) USER MOD Set 3.1: A 188 GLN :FLIP amide:sc=-0.00333 F(o=-0.18,f=0.81) USER MOD Set 3.2: A 192 HIS : no HE2:sc= 0.81 K(o=0.81,f=-3.1!) USER MOD Set 4.1: A 184 HIS : no HD1:sc= -0.51 K(o=-0.51,f=-1.4) USER MOD Set 4.2: A 185 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 140 MET CE :methyl 146:sc= -0.0728 (180deg=-0.938) USER MOD Set 5.2: A 205 SER OG : rot 120:sc= -0.0594 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 ASN : amide:sc= -0.716 K(o=-0.72,f=-7.8!) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 GLN : amide:sc= -0.0236 K(o=-0.024,f=-0.76) USER MOD Single : A 146 SER OG : rot -49:sc= 0.945 USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 163 CYS SG : rot 160:sc= -0.97 USER MOD Single : A 164 THR OG1 : rot 9:sc= 0.455 USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 CYS SG : rot 180:sc= -2.34 USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 182 SER OG : rot -23:sc= 0.557 USER MOD Single : A 183 SER OG : rot 37:sc= 0.8 USER MOD Single : A 195 HIS : no HD1:sc= -0.648 K(o=-0.65,f=-1.8!) USER MOD Single : A 197 SER OG : rot 180:sc= -0.029 USER MOD Single : A 198 GLN : amide:sc= -0.534 K(o=-0.53,f=-4.6!) USER MOD Single : A 204 SER OG : rot 180:sc= 0 USER MOD Single : A 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 201 N LYS A 135 0.250 11.309 0.821 1.00 0.00 N ATOM 202 CA LYS A 135 0.677 10.021 1.355 1.00 0.00 C ATOM 203 C LYS A 135 -0.526 9.136 1.669 1.00 0.00 C ATOM 204 O LYS A 135 -1.275 9.402 2.610 1.00 0.00 O ATOM 205 CB LYS A 135 1.519 10.222 2.617 1.00 0.00 C ATOM 206 CG LYS A 135 2.034 8.926 3.218 1.00 0.00 C ATOM 207 CD LYS A 135 3.214 9.170 4.143 1.00 0.00 C ATOM 208 CE LYS A 135 4.111 7.945 4.238 1.00 0.00 C ATOM 209 NZ LYS A 135 5.391 8.247 4.936 1.00 0.00 N ATOM 0 HA LYS A 135 1.283 9.525 0.597 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.367 10.864 2.379 1.00 0.00 H new ATOM 0 HB3 LYS A 135 0.921 10.746 3.363 1.00 0.00 H new ATOM 0 HG2 LYS A 135 1.232 8.437 3.771 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.331 8.246 2.419 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.793 10.019 3.779 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.851 9.434 5.136 1.00 0.00 H new ATOM 0 HE2 LYS A 135 3.586 7.151 4.769 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.323 7.572 3.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 5.974 7.387 4.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 5.904 8.987 4.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 5.190 8.579 5.901 1.00 0.00 H new ATOM 223 N LEU A 136 -0.704 8.085 0.878 1.00 0.00 N ATOM 224 CA LEU A 136 -1.815 7.160 1.073 1.00 0.00 C ATOM 225 C LEU A 136 -1.376 5.944 1.883 1.00 0.00 C ATOM 226 O LEU A 136 -0.215 5.538 1.832 1.00 0.00 O ATOM 227 CB LEU A 136 -2.374 6.711 -0.279 1.00 0.00 C ATOM 228 CG LEU A 136 -2.682 7.825 -1.280 1.00 0.00 C ATOM 229 CD1 LEU A 136 -3.240 7.243 -2.570 1.00 0.00 C ATOM 230 CD2 LEU A 136 -3.657 8.827 -0.680 1.00 0.00 C ATOM 0 H LEU A 136 -0.093 7.851 0.095 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.596 7.681 1.628 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -1.660 6.026 -0.736 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -3.289 6.146 -0.102 1.00 0.00 H new ATOM 0 HG LEU A 136 -1.753 8.346 -1.512 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -3.454 8.050 -3.271 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -2.509 6.565 -3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -4.158 6.697 -2.355 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -3.865 9.613 -1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -4.586 8.320 -0.419 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -3.220 9.268 0.216 1.00 0.00 H new ATOM 242 N PHE A 137 -2.313 5.367 2.628 1.00 0.00 N ATOM 243 CA PHE A 137 -2.023 4.197 3.449 1.00 0.00 C ATOM 244 C PHE A 137 -2.820 2.987 2.971 1.00 0.00 C ATOM 245 O PHE A 137 -4.047 2.959 3.070 1.00 0.00 O ATOM 246 CB PHE A 137 -2.343 4.485 4.917 1.00 0.00 C ATOM 247 CG PHE A 137 -2.519 3.245 5.747 1.00 0.00 C ATOM 248 CD1 PHE A 137 -1.417 2.551 6.220 1.00 0.00 C ATOM 249 CD2 PHE A 137 -3.785 2.775 6.054 1.00 0.00 C ATOM 250 CE1 PHE A 137 -1.576 1.409 6.983 1.00 0.00 C ATOM 251 CE2 PHE A 137 -3.950 1.634 6.817 1.00 0.00 C ATOM 252 CZ PHE A 137 -2.844 0.951 7.283 1.00 0.00 C ATOM 0 H PHE A 137 -3.279 5.690 2.680 1.00 0.00 H new ATOM 0 HA PHE A 137 -0.961 3.972 3.354 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -1.541 5.087 5.344 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -3.254 5.081 4.972 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -0.423 2.906 5.990 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -4.653 3.306 5.693 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -0.709 0.875 7.344 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -4.943 1.277 7.048 1.00 0.00 H new ATOM 0 HZ PHE A 137 -2.970 0.060 7.881 1.00 0.00 H new ATOM 262 N VAL A 138 -2.114 1.988 2.451 1.00 0.00 N ATOM 263 CA VAL A 138 -2.754 0.774 1.957 1.00 0.00 C ATOM 264 C VAL A 138 -2.725 -0.329 3.009 1.00 0.00 C ATOM 265 O VAL A 138 -1.757 -0.463 3.756 1.00 0.00 O ATOM 266 CB VAL A 138 -2.074 0.263 0.673 1.00 0.00 C ATOM 267 CG1 VAL A 138 -2.860 -0.895 0.077 1.00 0.00 C ATOM 268 CG2 VAL A 138 -1.924 1.392 -0.336 1.00 0.00 C ATOM 0 H VAL A 138 -1.098 1.995 2.361 1.00 0.00 H new ATOM 0 HA VAL A 138 -3.789 1.031 1.732 1.00 0.00 H new ATOM 0 HB VAL A 138 -1.078 -0.099 0.929 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -2.364 -1.243 -0.829 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -2.910 -1.710 0.799 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -3.869 -0.563 -0.166 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -1.442 1.013 -1.237 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -2.908 1.786 -0.590 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -1.315 2.186 0.095 1.00 0.00 H new ATOM 278 N GLY A 139 -3.794 -1.118 3.060 1.00 0.00 N ATOM 279 CA GLY A 139 -3.871 -2.201 4.024 1.00 0.00 C ATOM 280 C GLY A 139 -4.489 -3.455 3.439 1.00 0.00 C ATOM 281 O GLY A 139 -4.720 -3.536 2.233 1.00 0.00 O ATOM 0 H GLY A 139 -4.608 -1.027 2.452 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -2.870 -2.430 4.390 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -4.458 -1.877 4.883 1.00 0.00 H new ATOM 285 N MET A 140 -4.757 -4.436 4.295 1.00 0.00 N ATOM 286 CA MET A 140 -5.352 -5.692 3.855 1.00 0.00 C ATOM 287 C MET A 140 -4.567 -6.287 2.690 1.00 0.00 C ATOM 288 O MET A 140 -5.149 -6.781 1.724 1.00 0.00 O ATOM 289 CB MET A 140 -6.810 -5.475 3.444 1.00 0.00 C ATOM 290 CG MET A 140 -7.779 -5.481 4.615 1.00 0.00 C ATOM 291 SD MET A 140 -7.678 -6.993 5.592 1.00 0.00 S ATOM 292 CE MET A 140 -9.013 -6.733 6.758 1.00 0.00 C ATOM 0 H MET A 140 -4.572 -4.385 5.297 1.00 0.00 H new ATOM 0 HA MET A 140 -5.318 -6.393 4.689 1.00 0.00 H new ATOM 0 HB2 MET A 140 -6.893 -4.523 2.919 1.00 0.00 H new ATOM 0 HB3 MET A 140 -7.100 -6.254 2.739 1.00 0.00 H new ATOM 0 HG2 MET A 140 -7.573 -4.624 5.256 1.00 0.00 H new ATOM 0 HG3 MET A 140 -8.796 -5.362 4.241 1.00 0.00 H new ATOM 0 HE1 MET A 140 -9.479 -7.689 6.997 1.00 0.00 H new ATOM 0 HE2 MET A 140 -8.618 -6.284 7.669 1.00 0.00 H new ATOM 0 HE3 MET A 140 -9.756 -6.068 6.318 1.00 0.00 H new ATOM 302 N LEU A 141 -3.243 -6.237 2.788 1.00 0.00 N ATOM 303 CA LEU A 141 -2.378 -6.772 1.742 1.00 0.00 C ATOM 304 C LEU A 141 -1.813 -8.130 2.144 1.00 0.00 C ATOM 305 O LEU A 141 -1.738 -8.456 3.328 1.00 0.00 O ATOM 306 CB LEU A 141 -1.235 -5.797 1.451 1.00 0.00 C ATOM 307 CG LEU A 141 -1.604 -4.554 0.641 1.00 0.00 C ATOM 308 CD1 LEU A 141 -0.492 -3.519 0.716 1.00 0.00 C ATOM 309 CD2 LEU A 141 -1.890 -4.927 -0.807 1.00 0.00 C ATOM 0 H LEU A 141 -2.745 -5.832 3.581 1.00 0.00 H new ATOM 0 HA LEU A 141 -2.976 -6.901 0.840 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -0.809 -5.474 2.401 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -0.452 -6.335 0.917 1.00 0.00 H new ATOM 0 HG LEU A 141 -2.507 -4.119 1.069 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -0.772 -2.641 0.134 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.334 -3.230 1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 141 0.428 -3.943 0.313 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -2.151 -4.030 -1.369 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -1.004 -5.386 -1.246 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -2.720 -5.633 -0.844 1.00 0.00 H new ATOM 321 N ASN A 142 -1.415 -8.917 1.150 1.00 0.00 N ATOM 322 CA ASN A 142 -0.855 -10.241 1.400 1.00 0.00 C ATOM 323 C ASN A 142 0.669 -10.206 1.343 1.00 0.00 C ATOM 324 O ASN A 142 1.263 -9.222 0.901 1.00 0.00 O ATOM 325 CB ASN A 142 -1.392 -11.246 0.380 1.00 0.00 C ATOM 326 CG ASN A 142 -1.027 -10.875 -1.045 1.00 0.00 C ATOM 327 OD1 ASN A 142 -0.179 -10.013 -1.275 1.00 0.00 O ATOM 328 ND2 ASN A 142 -1.667 -11.527 -2.008 1.00 0.00 N ATOM 0 H ASN A 142 -1.470 -8.661 0.164 1.00 0.00 H new ATOM 0 HA ASN A 142 -1.157 -10.553 2.400 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -0.997 -12.236 0.607 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -2.477 -11.307 0.470 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -1.463 -11.321 -2.986 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -2.363 -12.234 -1.770 1.00 0.00 H new ATOM 335 N LYS A 143 1.298 -11.287 1.792 1.00 0.00 N ATOM 336 CA LYS A 143 2.753 -11.383 1.790 1.00 0.00 C ATOM 337 C LYS A 143 3.266 -11.848 0.432 1.00 0.00 C ATOM 338 O LYS A 143 4.222 -12.619 0.351 1.00 0.00 O ATOM 339 CB LYS A 143 3.222 -12.347 2.882 1.00 0.00 C ATOM 340 CG LYS A 143 2.588 -13.724 2.792 1.00 0.00 C ATOM 341 CD LYS A 143 3.172 -14.676 3.822 1.00 0.00 C ATOM 342 CE LYS A 143 4.520 -15.221 3.375 1.00 0.00 C ATOM 343 NZ LYS A 143 4.960 -16.369 4.215 1.00 0.00 N ATOM 0 H LYS A 143 0.822 -12.110 2.162 1.00 0.00 H new ATOM 0 HA LYS A 143 3.158 -10.391 1.991 1.00 0.00 H new ATOM 0 HB2 LYS A 143 4.305 -12.451 2.822 1.00 0.00 H new ATOM 0 HB3 LYS A 143 2.996 -11.915 3.857 1.00 0.00 H new ATOM 0 HG2 LYS A 143 1.512 -13.640 2.942 1.00 0.00 H new ATOM 0 HG3 LYS A 143 2.740 -14.131 1.792 1.00 0.00 H new ATOM 0 HD2 LYS A 143 3.285 -14.158 4.775 1.00 0.00 H new ATOM 0 HD3 LYS A 143 2.481 -15.502 3.988 1.00 0.00 H new ATOM 0 HE2 LYS A 143 4.457 -15.536 2.333 1.00 0.00 H new ATOM 0 HE3 LYS A 143 5.267 -14.428 3.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 5.882 -16.712 3.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 5.045 -16.062 5.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 4.261 -17.136 4.149 1.00 0.00 H new ATOM 357 N GLN A 144 2.625 -11.375 -0.632 1.00 0.00 N ATOM 358 CA GLN A 144 3.018 -11.743 -1.987 1.00 0.00 C ATOM 359 C GLN A 144 3.234 -10.503 -2.847 1.00 0.00 C ATOM 360 O GLN A 144 4.208 -10.417 -3.595 1.00 0.00 O ATOM 361 CB GLN A 144 1.956 -12.641 -2.623 1.00 0.00 C ATOM 362 CG GLN A 144 1.761 -13.962 -1.897 1.00 0.00 C ATOM 363 CD GLN A 144 2.884 -14.945 -2.163 1.00 0.00 C ATOM 364 OE1 GLN A 144 3.413 -15.015 -3.273 1.00 0.00 O ATOM 365 NE2 GLN A 144 3.255 -15.712 -1.144 1.00 0.00 N ATOM 0 H GLN A 144 1.831 -10.736 -0.582 1.00 0.00 H new ATOM 0 HA GLN A 144 3.959 -12.291 -1.929 1.00 0.00 H new ATOM 0 HB2 GLN A 144 1.007 -12.106 -2.647 1.00 0.00 H new ATOM 0 HB3 GLN A 144 2.235 -12.842 -3.657 1.00 0.00 H new ATOM 0 HG2 GLN A 144 1.692 -13.776 -0.825 1.00 0.00 H new ATOM 0 HG3 GLN A 144 0.814 -14.406 -2.205 1.00 0.00 H new ATOM 0 HE21 GLN A 144 2.789 -15.621 -0.241 1.00 0.00 H new ATOM 0 HE22 GLN A 144 4.006 -16.392 -1.264 1.00 0.00 H new ATOM 374 N GLN A 145 2.319 -9.545 -2.737 1.00 0.00 N ATOM 375 CA GLN A 145 2.409 -8.310 -3.506 1.00 0.00 C ATOM 376 C GLN A 145 3.663 -7.526 -3.132 1.00 0.00 C ATOM 377 O GLN A 145 4.104 -7.554 -1.983 1.00 0.00 O ATOM 378 CB GLN A 145 1.167 -7.448 -3.275 1.00 0.00 C ATOM 379 CG GLN A 145 -0.019 -7.847 -4.138 1.00 0.00 C ATOM 380 CD GLN A 145 -0.977 -6.697 -4.380 1.00 0.00 C ATOM 381 OE1 GLN A 145 -1.877 -6.868 -5.342 1.00 0.00 O flip ATOM 382 NE2 GLN A 145 -0.909 -5.665 -3.711 1.00 0.00 N flip ATOM 0 H GLN A 145 1.507 -9.601 -2.122 1.00 0.00 H new ATOM 0 HA GLN A 145 2.468 -8.573 -4.562 1.00 0.00 H new ATOM 0 HB2 GLN A 145 0.880 -7.513 -2.225 1.00 0.00 H new ATOM 0 HB3 GLN A 145 1.416 -6.406 -3.474 1.00 0.00 H new ATOM 0 HG2 GLN A 145 0.343 -8.221 -5.096 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -0.554 -8.666 -3.657 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -0.202 -5.576 -2.981 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -1.560 -4.900 -3.887 1.00 0.00 H new ATOM 391 N SER A 146 4.233 -6.829 -4.110 1.00 0.00 N ATOM 392 CA SER A 146 5.439 -6.041 -3.884 1.00 0.00 C ATOM 393 C SER A 146 5.210 -4.579 -4.257 1.00 0.00 C ATOM 394 O SER A 146 4.130 -4.206 -4.713 1.00 0.00 O ATOM 395 CB SER A 146 6.604 -6.610 -4.696 1.00 0.00 C ATOM 396 OG SER A 146 6.273 -6.699 -6.071 1.00 0.00 O ATOM 0 H SER A 146 3.879 -6.794 -5.066 1.00 0.00 H new ATOM 0 HA SER A 146 5.685 -6.093 -2.823 1.00 0.00 H new ATOM 0 HB2 SER A 146 7.482 -5.977 -4.571 1.00 0.00 H new ATOM 0 HB3 SER A 146 6.867 -7.598 -4.317 1.00 0.00 H new ATOM 0 HG SER A 146 5.401 -7.135 -6.170 1.00 0.00 H new ATOM 402 N GLU A 147 6.236 -3.757 -4.058 1.00 0.00 N ATOM 403 CA GLU A 147 6.146 -2.336 -4.372 1.00 0.00 C ATOM 404 C GLU A 147 5.803 -2.125 -5.844 1.00 0.00 C ATOM 405 O GLU A 147 4.909 -1.348 -6.178 1.00 0.00 O ATOM 406 CB GLU A 147 7.464 -1.633 -4.038 1.00 0.00 C ATOM 407 CG GLU A 147 7.530 -1.109 -2.614 1.00 0.00 C ATOM 408 CD GLU A 147 8.952 -0.859 -2.150 1.00 0.00 C ATOM 409 OE1 GLU A 147 9.722 -0.233 -2.907 1.00 0.00 O ATOM 410 OE2 GLU A 147 9.293 -1.289 -1.028 1.00 0.00 O ATOM 0 H GLU A 147 7.137 -4.050 -3.681 1.00 0.00 H new ATOM 0 HA GLU A 147 5.349 -1.906 -3.766 1.00 0.00 H new ATOM 0 HB2 GLU A 147 8.288 -2.328 -4.199 1.00 0.00 H new ATOM 0 HB3 GLU A 147 7.608 -0.802 -4.729 1.00 0.00 H new ATOM 0 HG2 GLU A 147 6.961 -0.182 -2.545 1.00 0.00 H new ATOM 0 HG3 GLU A 147 7.054 -1.826 -1.945 1.00 0.00 H new ATOM 417 N GLU A 148 6.522 -2.821 -6.719 1.00 0.00 N ATOM 418 CA GLU A 148 6.295 -2.709 -8.155 1.00 0.00 C ATOM 419 C GLU A 148 4.832 -2.977 -8.497 1.00 0.00 C ATOM 420 O GLU A 148 4.196 -2.196 -9.206 1.00 0.00 O ATOM 421 CB GLU A 148 7.195 -3.686 -8.915 1.00 0.00 C ATOM 422 CG GLU A 148 7.255 -3.421 -10.410 1.00 0.00 C ATOM 423 CD GLU A 148 8.305 -4.263 -11.109 1.00 0.00 C ATOM 424 OE1 GLU A 148 8.207 -5.507 -11.044 1.00 0.00 O ATOM 425 OE2 GLU A 148 9.223 -3.679 -11.721 1.00 0.00 O ATOM 0 H GLU A 148 7.266 -3.468 -6.459 1.00 0.00 H new ATOM 0 HA GLU A 148 6.541 -1.691 -8.457 1.00 0.00 H new ATOM 0 HB2 GLU A 148 8.203 -3.633 -8.504 1.00 0.00 H new ATOM 0 HB3 GLU A 148 6.836 -4.702 -8.749 1.00 0.00 H new ATOM 0 HG2 GLU A 148 6.279 -3.624 -10.851 1.00 0.00 H new ATOM 0 HG3 GLU A 148 7.468 -2.366 -10.580 1.00 0.00 H new ATOM 432 N ASP A 149 4.305 -4.085 -7.989 1.00 0.00 N ATOM 433 CA ASP A 149 2.918 -4.457 -8.239 1.00 0.00 C ATOM 434 C ASP A 149 1.994 -3.254 -8.072 1.00 0.00 C ATOM 435 O ASP A 149 1.425 -2.756 -9.043 1.00 0.00 O ATOM 436 CB ASP A 149 2.489 -5.580 -7.293 1.00 0.00 C ATOM 437 CG ASP A 149 3.177 -6.894 -7.606 1.00 0.00 C ATOM 438 OD1 ASP A 149 3.181 -7.294 -8.789 1.00 0.00 O ATOM 439 OD2 ASP A 149 3.710 -7.524 -6.668 1.00 0.00 O ATOM 0 H ASP A 149 4.818 -4.742 -7.401 1.00 0.00 H new ATOM 0 HA ASP A 149 2.843 -4.811 -9.267 1.00 0.00 H new ATOM 0 HB2 ASP A 149 2.713 -5.291 -6.266 1.00 0.00 H new ATOM 0 HB3 ASP A 149 1.409 -5.714 -7.358 1.00 0.00 H new ATOM 444 N VAL A 150 1.849 -2.793 -6.833 1.00 0.00 N ATOM 445 CA VAL A 150 0.995 -1.649 -6.538 1.00 0.00 C ATOM 446 C VAL A 150 1.290 -0.486 -7.479 1.00 0.00 C ATOM 447 O VAL A 150 0.415 -0.036 -8.220 1.00 0.00 O ATOM 448 CB VAL A 150 1.173 -1.176 -5.084 1.00 0.00 C ATOM 449 CG1 VAL A 150 0.509 0.177 -4.877 1.00 0.00 C ATOM 450 CG2 VAL A 150 0.613 -2.208 -4.116 1.00 0.00 C ATOM 0 H VAL A 150 2.312 -3.195 -6.018 1.00 0.00 H new ATOM 0 HA VAL A 150 -0.034 -1.977 -6.682 1.00 0.00 H new ATOM 0 HB VAL A 150 2.239 -1.065 -4.884 1.00 0.00 H new ATOM 0 HG11 VAL A 150 0.645 0.495 -3.843 1.00 0.00 H new ATOM 0 HG12 VAL A 150 0.961 0.910 -5.545 1.00 0.00 H new ATOM 0 HG13 VAL A 150 -0.556 0.097 -5.094 1.00 0.00 H new ATOM 0 HG21 VAL A 150 0.747 -1.857 -3.093 1.00 0.00 H new ATOM 0 HG22 VAL A 150 -0.449 -2.353 -4.313 1.00 0.00 H new ATOM 0 HG23 VAL A 150 1.139 -3.153 -4.248 1.00 0.00 H new ATOM 460 N LEU A 151 2.527 -0.004 -7.445 1.00 0.00 N ATOM 461 CA LEU A 151 2.939 1.107 -8.296 1.00 0.00 C ATOM 462 C LEU A 151 2.471 0.896 -9.732 1.00 0.00 C ATOM 463 O LEU A 151 2.069 1.842 -10.410 1.00 0.00 O ATOM 464 CB LEU A 151 4.460 1.265 -8.261 1.00 0.00 C ATOM 465 CG LEU A 151 5.058 1.715 -6.927 1.00 0.00 C ATOM 466 CD1 LEU A 151 6.537 1.369 -6.861 1.00 0.00 C ATOM 467 CD2 LEU A 151 4.848 3.209 -6.725 1.00 0.00 C ATOM 0 H LEU A 151 3.262 -0.365 -6.837 1.00 0.00 H new ATOM 0 HA LEU A 151 2.476 2.017 -7.913 1.00 0.00 H new ATOM 0 HB2 LEU A 151 4.911 0.311 -8.535 1.00 0.00 H new ATOM 0 HB3 LEU A 151 4.748 1.985 -9.027 1.00 0.00 H new ATOM 0 HG LEU A 151 4.546 1.185 -6.124 1.00 0.00 H new ATOM 0 HD11 LEU A 151 6.945 1.697 -5.905 1.00 0.00 H new ATOM 0 HD12 LEU A 151 6.663 0.291 -6.959 1.00 0.00 H new ATOM 0 HD13 LEU A 151 7.065 1.871 -7.672 1.00 0.00 H new ATOM 0 HD21 LEU A 151 5.280 3.511 -5.771 1.00 0.00 H new ATOM 0 HD22 LEU A 151 5.333 3.757 -7.533 1.00 0.00 H new ATOM 0 HD23 LEU A 151 3.781 3.430 -6.726 1.00 0.00 H new ATOM 479 N ARG A 152 2.525 -0.351 -10.189 1.00 0.00 N ATOM 480 CA ARG A 152 2.105 -0.686 -11.545 1.00 0.00 C ATOM 481 C ARG A 152 0.594 -0.539 -11.698 1.00 0.00 C ATOM 482 O ARG A 152 0.108 -0.052 -12.720 1.00 0.00 O ATOM 483 CB ARG A 152 2.527 -2.115 -11.893 1.00 0.00 C ATOM 484 CG ARG A 152 3.937 -2.214 -12.452 1.00 0.00 C ATOM 485 CD ARG A 152 3.990 -1.782 -13.909 1.00 0.00 C ATOM 486 NE ARG A 152 5.216 -2.226 -14.568 1.00 0.00 N ATOM 487 CZ ARG A 152 5.405 -2.172 -15.882 1.00 0.00 C ATOM 488 NH1 ARG A 152 4.454 -1.695 -16.673 1.00 0.00 N ATOM 489 NH2 ARG A 152 6.548 -2.595 -16.406 1.00 0.00 N ATOM 0 H ARG A 152 2.855 -1.145 -9.641 1.00 0.00 H new ATOM 0 HA ARG A 152 2.591 0.007 -12.231 1.00 0.00 H new ATOM 0 HB2 ARG A 152 2.455 -2.734 -10.999 1.00 0.00 H new ATOM 0 HB3 ARG A 152 1.827 -2.525 -12.621 1.00 0.00 H new ATOM 0 HG2 ARG A 152 4.608 -1.590 -11.862 1.00 0.00 H new ATOM 0 HG3 ARG A 152 4.294 -3.240 -12.362 1.00 0.00 H new ATOM 0 HD2 ARG A 152 3.127 -2.186 -14.438 1.00 0.00 H new ATOM 0 HD3 ARG A 152 3.920 -0.696 -13.968 1.00 0.00 H new ATOM 0 HE ARG A 152 5.968 -2.598 -13.988 1.00 0.00 H new ATOM 0 HH11 ARG A 152 3.574 -1.368 -16.273 1.00 0.00 H new ATOM 0 HH12 ARG A 152 4.602 -1.655 -17.681 1.00 0.00 H new ATOM 0 HH21 ARG A 152 7.282 -2.962 -15.800 1.00 0.00 H new ATOM 0 HH22 ARG A 152 6.693 -2.553 -17.415 1.00 0.00 H new ATOM 503 N LEU A 153 -0.143 -0.963 -10.678 1.00 0.00 N ATOM 504 CA LEU A 153 -1.599 -0.879 -10.700 1.00 0.00 C ATOM 505 C LEU A 153 -2.071 0.504 -10.262 1.00 0.00 C ATOM 506 O LEU A 153 -3.248 0.841 -10.396 1.00 0.00 O ATOM 507 CB LEU A 153 -2.205 -1.949 -9.789 1.00 0.00 C ATOM 508 CG LEU A 153 -3.642 -1.704 -9.330 1.00 0.00 C ATOM 509 CD1 LEU A 153 -4.603 -1.802 -10.505 1.00 0.00 C ATOM 510 CD2 LEU A 153 -4.029 -2.692 -8.239 1.00 0.00 C ATOM 0 H LEU A 153 0.243 -1.368 -9.825 1.00 0.00 H new ATOM 0 HA LEU A 153 -1.933 -1.050 -11.723 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -2.170 -2.905 -10.312 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -1.574 -2.045 -8.905 1.00 0.00 H new ATOM 0 HG LEU A 153 -3.705 -0.696 -8.920 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -5.621 -1.625 -10.158 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -4.339 -1.055 -11.254 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -4.538 -2.797 -10.946 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -5.055 -2.503 -7.924 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -3.949 -3.709 -8.624 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -3.360 -2.573 -7.387 1.00 0.00 H new ATOM 522 N PHE A 154 -1.146 1.301 -9.739 1.00 0.00 N ATOM 523 CA PHE A 154 -1.467 2.649 -9.283 1.00 0.00 C ATOM 524 C PHE A 154 -1.087 3.685 -10.336 1.00 0.00 C ATOM 525 O PHE A 154 -1.777 4.689 -10.509 1.00 0.00 O ATOM 526 CB PHE A 154 -0.742 2.951 -7.969 1.00 0.00 C ATOM 527 CG PHE A 154 -1.422 2.371 -6.762 1.00 0.00 C ATOM 528 CD1 PHE A 154 -2.012 1.119 -6.818 1.00 0.00 C ATOM 529 CD2 PHE A 154 -1.472 3.079 -5.572 1.00 0.00 C ATOM 530 CE1 PHE A 154 -2.638 0.582 -5.709 1.00 0.00 C ATOM 531 CE2 PHE A 154 -2.096 2.547 -4.459 1.00 0.00 C ATOM 532 CZ PHE A 154 -2.681 1.297 -4.528 1.00 0.00 C ATOM 0 H PHE A 154 -0.168 1.037 -9.620 1.00 0.00 H new ATOM 0 HA PHE A 154 -2.543 2.703 -9.118 1.00 0.00 H new ATOM 0 HB2 PHE A 154 0.274 2.561 -8.026 1.00 0.00 H new ATOM 0 HB3 PHE A 154 -0.662 4.031 -7.847 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -1.982 0.556 -7.739 1.00 0.00 H new ATOM 0 HD2 PHE A 154 -1.018 4.057 -5.513 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -3.093 -0.396 -5.766 1.00 0.00 H new ATOM 0 HE2 PHE A 154 -2.126 3.108 -3.536 1.00 0.00 H new ATOM 0 HZ PHE A 154 -3.171 0.880 -3.660 1.00 0.00 H new ATOM 542 N GLN A 155 0.014 3.432 -11.037 1.00 0.00 N ATOM 543 CA GLN A 155 0.486 4.343 -12.072 1.00 0.00 C ATOM 544 C GLN A 155 -0.657 4.760 -12.993 1.00 0.00 C ATOM 545 O GLN A 155 -0.837 5.938 -13.304 1.00 0.00 O ATOM 546 CB GLN A 155 1.600 3.687 -12.889 1.00 0.00 C ATOM 547 CG GLN A 155 2.675 4.661 -13.345 1.00 0.00 C ATOM 548 CD GLN A 155 3.309 4.257 -14.661 1.00 0.00 C ATOM 549 OE1 GLN A 155 4.275 3.495 -14.690 1.00 0.00 O ATOM 550 NE2 GLN A 155 2.766 4.766 -15.761 1.00 0.00 N ATOM 0 H GLN A 155 0.595 2.604 -10.907 1.00 0.00 H new ATOM 0 HA GLN A 155 0.879 5.235 -11.584 1.00 0.00 H new ATOM 0 HB2 GLN A 155 2.063 2.902 -12.292 1.00 0.00 H new ATOM 0 HB3 GLN A 155 1.163 3.206 -13.764 1.00 0.00 H new ATOM 0 HG2 GLN A 155 2.240 5.655 -13.446 1.00 0.00 H new ATOM 0 HG3 GLN A 155 3.448 4.728 -12.579 1.00 0.00 H new ATOM 0 HE21 GLN A 155 1.965 5.394 -15.691 1.00 0.00 H new ATOM 0 HE22 GLN A 155 3.150 4.529 -16.676 1.00 0.00 H new ATOM 559 N PRO A 156 -1.448 3.773 -13.439 1.00 0.00 N ATOM 560 CA PRO A 156 -2.587 4.014 -14.330 1.00 0.00 C ATOM 561 C PRO A 156 -3.471 5.158 -13.845 1.00 0.00 C ATOM 562 O PRO A 156 -4.276 5.698 -14.604 1.00 0.00 O ATOM 563 CB PRO A 156 -3.354 2.690 -14.290 1.00 0.00 C ATOM 564 CG PRO A 156 -2.326 1.667 -13.951 1.00 0.00 C ATOM 565 CD PRO A 156 -1.291 2.347 -13.109 1.00 0.00 C ATOM 0 HA PRO A 156 -2.268 4.307 -15.330 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -4.149 2.715 -13.544 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -3.824 2.476 -15.250 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -2.775 0.833 -13.411 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -1.878 1.256 -14.856 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -1.455 2.162 -12.047 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -0.288 1.991 -13.343 1.00 0.00 H new ATOM 573 N PHE A 157 -3.316 5.522 -12.577 1.00 0.00 N ATOM 574 CA PHE A 157 -4.101 6.602 -11.990 1.00 0.00 C ATOM 575 C PHE A 157 -3.295 7.897 -11.944 1.00 0.00 C ATOM 576 O PHE A 157 -3.787 8.960 -12.320 1.00 0.00 O ATOM 577 CB PHE A 157 -4.557 6.221 -10.580 1.00 0.00 C ATOM 578 CG PHE A 157 -5.537 5.083 -10.554 1.00 0.00 C ATOM 579 CD1 PHE A 157 -6.828 5.252 -11.028 1.00 0.00 C ATOM 580 CD2 PHE A 157 -5.167 3.844 -10.056 1.00 0.00 C ATOM 581 CE1 PHE A 157 -7.732 4.206 -11.004 1.00 0.00 C ATOM 582 CE2 PHE A 157 -6.066 2.795 -10.030 1.00 0.00 C ATOM 583 CZ PHE A 157 -7.350 2.976 -10.506 1.00 0.00 C ATOM 0 H PHE A 157 -2.654 5.085 -11.936 1.00 0.00 H new ATOM 0 HA PHE A 157 -4.978 6.763 -12.617 1.00 0.00 H new ATOM 0 HB2 PHE A 157 -3.684 5.952 -9.985 1.00 0.00 H new ATOM 0 HB3 PHE A 157 -5.010 7.091 -10.106 1.00 0.00 H new ATOM 0 HD1 PHE A 157 -7.132 6.211 -11.421 1.00 0.00 H new ATOM 0 HD2 PHE A 157 -4.164 3.696 -9.684 1.00 0.00 H new ATOM 0 HE1 PHE A 157 -8.736 4.351 -11.374 1.00 0.00 H new ATOM 0 HE2 PHE A 157 -5.765 1.835 -9.638 1.00 0.00 H new ATOM 0 HZ PHE A 157 -8.054 2.157 -10.489 1.00 0.00 H new ATOM 593 N GLY A 158 -2.054 7.798 -11.479 1.00 0.00 N ATOM 594 CA GLY A 158 -1.200 8.968 -11.391 1.00 0.00 C ATOM 595 C GLY A 158 0.271 8.608 -11.309 1.00 0.00 C ATOM 596 O GLY A 158 0.625 7.433 -11.221 1.00 0.00 O ATOM 0 H GLY A 158 -1.625 6.929 -11.162 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -1.368 9.602 -12.261 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -1.478 9.551 -10.513 1.00 0.00 H new ATOM 600 N VAL A 159 1.129 9.622 -11.340 1.00 0.00 N ATOM 601 CA VAL A 159 2.570 9.407 -11.269 1.00 0.00 C ATOM 602 C VAL A 159 3.048 9.358 -9.823 1.00 0.00 C ATOM 603 O VAL A 159 3.187 10.393 -9.169 1.00 0.00 O ATOM 604 CB VAL A 159 3.340 10.512 -12.016 1.00 0.00 C ATOM 605 CG1 VAL A 159 4.810 10.496 -11.626 1.00 0.00 C ATOM 606 CG2 VAL A 159 3.177 10.351 -13.520 1.00 0.00 C ATOM 0 H VAL A 159 0.852 10.601 -11.414 1.00 0.00 H new ATOM 0 HA VAL A 159 2.771 8.448 -11.747 1.00 0.00 H new ATOM 0 HB VAL A 159 2.924 11.478 -11.730 1.00 0.00 H new ATOM 0 HG11 VAL A 159 5.338 11.284 -12.164 1.00 0.00 H new ATOM 0 HG12 VAL A 159 4.904 10.664 -10.553 1.00 0.00 H new ATOM 0 HG13 VAL A 159 5.244 9.529 -11.881 1.00 0.00 H new ATOM 0 HG21 VAL A 159 3.728 11.140 -14.032 1.00 0.00 H new ATOM 0 HG22 VAL A 159 3.566 9.380 -13.826 1.00 0.00 H new ATOM 0 HG23 VAL A 159 2.121 10.418 -13.781 1.00 0.00 H new ATOM 616 N ILE A 160 3.298 8.150 -9.328 1.00 0.00 N ATOM 617 CA ILE A 160 3.763 7.967 -7.959 1.00 0.00 C ATOM 618 C ILE A 160 5.224 8.377 -7.815 1.00 0.00 C ATOM 619 O ILE A 160 6.065 8.015 -8.639 1.00 0.00 O ATOM 620 CB ILE A 160 3.603 6.505 -7.501 1.00 0.00 C ATOM 621 CG1 ILE A 160 2.176 6.020 -7.761 1.00 0.00 C ATOM 622 CG2 ILE A 160 3.954 6.371 -6.027 1.00 0.00 C ATOM 623 CD1 ILE A 160 2.048 4.513 -7.801 1.00 0.00 C ATOM 0 H ILE A 160 3.186 7.284 -9.855 1.00 0.00 H new ATOM 0 HA ILE A 160 3.146 8.606 -7.328 1.00 0.00 H new ATOM 0 HB ILE A 160 4.288 5.882 -8.076 1.00 0.00 H new ATOM 0 HG12 ILE A 160 1.520 6.412 -6.983 1.00 0.00 H new ATOM 0 HG13 ILE A 160 1.828 6.431 -8.708 1.00 0.00 H new ATOM 0 HG21 ILE A 160 3.836 5.332 -5.718 1.00 0.00 H new ATOM 0 HG22 ILE A 160 4.987 6.682 -5.869 1.00 0.00 H new ATOM 0 HG23 ILE A 160 3.291 7.003 -5.436 1.00 0.00 H new ATOM 0 HD11 ILE A 160 1.009 4.241 -7.989 1.00 0.00 H new ATOM 0 HD12 ILE A 160 2.677 4.115 -8.597 1.00 0.00 H new ATOM 0 HD13 ILE A 160 2.365 4.095 -6.845 1.00 0.00 H new ATOM 635 N ASP A 161 5.521 9.131 -6.762 1.00 0.00 N ATOM 636 CA ASP A 161 6.882 9.587 -6.507 1.00 0.00 C ATOM 637 C ASP A 161 7.702 8.497 -5.825 1.00 0.00 C ATOM 638 O ASP A 161 8.717 8.047 -6.356 1.00 0.00 O ATOM 639 CB ASP A 161 6.866 10.848 -5.642 1.00 0.00 C ATOM 640 CG ASP A 161 6.562 12.098 -6.444 1.00 0.00 C ATOM 641 OD1 ASP A 161 5.955 11.974 -7.529 1.00 0.00 O ATOM 642 OD2 ASP A 161 6.930 13.200 -5.987 1.00 0.00 O ATOM 0 H ASP A 161 4.837 9.439 -6.071 1.00 0.00 H new ATOM 0 HA ASP A 161 7.347 9.819 -7.465 1.00 0.00 H new ATOM 0 HB2 ASP A 161 6.121 10.735 -4.855 1.00 0.00 H new ATOM 0 HB3 ASP A 161 7.833 10.961 -5.152 1.00 0.00 H new ATOM 647 N GLU A 162 7.255 8.078 -4.645 1.00 0.00 N ATOM 648 CA GLU A 162 7.950 7.042 -3.890 1.00 0.00 C ATOM 649 C GLU A 162 6.955 6.085 -3.239 1.00 0.00 C ATOM 650 O GLU A 162 5.895 6.499 -2.769 1.00 0.00 O ATOM 651 CB GLU A 162 8.844 7.672 -2.820 1.00 0.00 C ATOM 652 CG GLU A 162 10.042 6.815 -2.446 1.00 0.00 C ATOM 653 CD GLU A 162 11.126 6.835 -3.505 1.00 0.00 C ATOM 654 OE1 GLU A 162 12.001 7.724 -3.443 1.00 0.00 O ATOM 655 OE2 GLU A 162 11.100 5.960 -4.397 1.00 0.00 O ATOM 0 H GLU A 162 6.416 8.440 -4.192 1.00 0.00 H new ATOM 0 HA GLU A 162 8.571 6.477 -4.584 1.00 0.00 H new ATOM 0 HB2 GLU A 162 9.197 8.639 -3.177 1.00 0.00 H new ATOM 0 HB3 GLU A 162 8.249 7.860 -1.926 1.00 0.00 H new ATOM 0 HG2 GLU A 162 10.456 7.168 -1.501 1.00 0.00 H new ATOM 0 HG3 GLU A 162 9.714 5.788 -2.287 1.00 0.00 H new ATOM 662 N CYS A 163 7.305 4.804 -3.215 1.00 0.00 N ATOM 663 CA CYS A 163 6.444 3.786 -2.623 1.00 0.00 C ATOM 664 C CYS A 163 7.246 2.852 -1.722 1.00 0.00 C ATOM 665 O CYS A 163 8.404 2.542 -2.004 1.00 0.00 O ATOM 666 CB CYS A 163 5.743 2.981 -3.718 1.00 0.00 C ATOM 667 SG CYS A 163 4.931 1.479 -3.125 1.00 0.00 S ATOM 0 H CYS A 163 8.179 4.445 -3.599 1.00 0.00 H new ATOM 0 HA CYS A 163 5.692 4.290 -2.016 1.00 0.00 H new ATOM 0 HB2 CYS A 163 5.001 3.616 -4.202 1.00 0.00 H new ATOM 0 HB3 CYS A 163 6.475 2.709 -4.479 1.00 0.00 H new ATOM 0 HG CYS A 163 4.035 1.101 -3.988 1.00 0.00 H new ATOM 673 N THR A 164 6.622 2.407 -0.636 1.00 0.00 N ATOM 674 CA THR A 164 7.278 1.511 0.308 1.00 0.00 C ATOM 675 C THR A 164 6.259 0.659 1.056 1.00 0.00 C ATOM 676 O THR A 164 5.163 1.120 1.374 1.00 0.00 O ATOM 677 CB THR A 164 8.125 2.293 1.330 1.00 0.00 C ATOM 678 OG1 THR A 164 9.293 2.823 0.695 1.00 0.00 O ATOM 679 CG2 THR A 164 8.534 1.399 2.491 1.00 0.00 C ATOM 0 H THR A 164 5.663 2.652 -0.388 1.00 0.00 H new ATOM 0 HA THR A 164 7.932 0.863 -0.275 1.00 0.00 H new ATOM 0 HB THR A 164 7.520 3.112 1.719 1.00 0.00 H new ATOM 0 HG1 THR A 164 9.228 2.690 -0.274 1.00 0.00 H new ATOM 0 HG21 THR A 164 9.131 1.973 3.199 1.00 0.00 H new ATOM 0 HG22 THR A 164 7.642 1.021 2.991 1.00 0.00 H new ATOM 0 HG23 THR A 164 9.122 0.562 2.116 1.00 0.00 H new ATOM 687 N VAL A 165 6.627 -0.588 1.335 1.00 0.00 N ATOM 688 CA VAL A 165 5.745 -1.504 2.047 1.00 0.00 C ATOM 689 C VAL A 165 6.293 -1.828 3.433 1.00 0.00 C ATOM 690 O VAL A 165 7.497 -2.021 3.607 1.00 0.00 O ATOM 691 CB VAL A 165 5.550 -2.817 1.265 1.00 0.00 C ATOM 692 CG1 VAL A 165 4.615 -3.752 2.016 1.00 0.00 C ATOM 693 CG2 VAL A 165 5.020 -2.530 -0.132 1.00 0.00 C ATOM 0 H VAL A 165 7.530 -0.986 1.078 1.00 0.00 H new ATOM 0 HA VAL A 165 4.782 -1.003 2.147 1.00 0.00 H new ATOM 0 HB VAL A 165 6.518 -3.310 1.169 1.00 0.00 H new ATOM 0 HG11 VAL A 165 4.489 -4.674 1.448 1.00 0.00 H new ATOM 0 HG12 VAL A 165 5.039 -3.983 2.993 1.00 0.00 H new ATOM 0 HG13 VAL A 165 3.646 -3.271 2.145 1.00 0.00 H new ATOM 0 HG21 VAL A 165 4.888 -3.468 -0.671 1.00 0.00 H new ATOM 0 HG22 VAL A 165 4.062 -2.015 -0.059 1.00 0.00 H new ATOM 0 HG23 VAL A 165 5.730 -1.900 -0.668 1.00 0.00 H new ATOM 703 N LEU A 166 5.401 -1.887 4.416 1.00 0.00 N ATOM 704 CA LEU A 166 5.794 -2.188 5.788 1.00 0.00 C ATOM 705 C LEU A 166 6.067 -3.679 5.961 1.00 0.00 C ATOM 706 O LEU A 166 5.345 -4.519 5.424 1.00 0.00 O ATOM 707 CB LEU A 166 4.702 -1.742 6.762 1.00 0.00 C ATOM 708 CG LEU A 166 4.565 -0.233 6.970 1.00 0.00 C ATOM 709 CD1 LEU A 166 3.395 0.074 7.892 1.00 0.00 C ATOM 710 CD2 LEU A 166 5.855 0.347 7.531 1.00 0.00 C ATOM 0 H LEU A 166 4.401 -1.730 4.288 1.00 0.00 H new ATOM 0 HA LEU A 166 6.712 -1.641 6.005 1.00 0.00 H new ATOM 0 HB2 LEU A 166 3.746 -2.128 6.407 1.00 0.00 H new ATOM 0 HB3 LEU A 166 4.894 -2.206 7.729 1.00 0.00 H new ATOM 0 HG LEU A 166 4.371 0.232 6.003 1.00 0.00 H new ATOM 0 HD11 LEU A 166 3.313 1.152 8.029 1.00 0.00 H new ATOM 0 HD12 LEU A 166 2.474 -0.307 7.451 1.00 0.00 H new ATOM 0 HD13 LEU A 166 3.559 -0.403 8.858 1.00 0.00 H new ATOM 0 HD21 LEU A 166 5.739 1.422 7.673 1.00 0.00 H new ATOM 0 HD22 LEU A 166 6.079 -0.123 8.488 1.00 0.00 H new ATOM 0 HD23 LEU A 166 6.672 0.159 6.834 1.00 0.00 H new ATOM 808 N LYS A 174 3.161 -6.806 6.786 1.00 0.00 N ATOM 809 CA LYS A 174 2.056 -6.516 7.691 1.00 0.00 C ATOM 810 C LYS A 174 0.783 -6.202 6.912 1.00 0.00 C ATOM 811 O LYS A 174 -0.160 -5.624 7.451 1.00 0.00 O ATOM 812 CB LYS A 174 2.411 -5.340 8.604 1.00 0.00 C ATOM 813 CG LYS A 174 3.446 -5.682 9.661 1.00 0.00 C ATOM 814 CD LYS A 174 3.959 -4.436 10.363 1.00 0.00 C ATOM 815 CE LYS A 174 5.382 -4.625 10.865 1.00 0.00 C ATOM 816 NZ LYS A 174 5.766 -3.576 11.851 1.00 0.00 N ATOM 0 HA LYS A 174 1.879 -7.401 8.302 1.00 0.00 H new ATOM 0 HB2 LYS A 174 2.785 -4.517 7.994 1.00 0.00 H new ATOM 0 HB3 LYS A 174 1.505 -4.986 9.096 1.00 0.00 H new ATOM 0 HG2 LYS A 174 3.008 -6.360 10.394 1.00 0.00 H new ATOM 0 HG3 LYS A 174 4.280 -6.209 9.198 1.00 0.00 H new ATOM 0 HD2 LYS A 174 3.924 -3.590 9.677 1.00 0.00 H new ATOM 0 HD3 LYS A 174 3.305 -4.194 11.201 1.00 0.00 H new ATOM 0 HE2 LYS A 174 5.477 -5.608 11.325 1.00 0.00 H new ATOM 0 HE3 LYS A 174 6.071 -4.600 10.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 6.742 -3.740 12.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 5.700 -2.639 11.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 5.124 -3.616 12.668 1.00 0.00 H new ATOM 830 N GLY A 175 0.762 -6.589 5.640 1.00 0.00 N ATOM 831 CA GLY A 175 -0.401 -6.341 4.808 1.00 0.00 C ATOM 832 C GLY A 175 -0.728 -4.865 4.694 1.00 0.00 C ATOM 833 O GLY A 175 -1.888 -4.492 4.515 1.00 0.00 O ATOM 0 H GLY A 175 1.530 -7.070 5.171 1.00 0.00 H new ATOM 0 HA2 GLY A 175 -0.226 -6.749 3.813 1.00 0.00 H new ATOM 0 HA3 GLY A 175 -1.260 -6.869 5.222 1.00 0.00 H new ATOM 837 N CYS A 176 0.295 -4.024 4.800 1.00 0.00 N ATOM 838 CA CYS A 176 0.110 -2.580 4.710 1.00 0.00 C ATOM 839 C CYS A 176 1.311 -1.918 4.042 1.00 0.00 C ATOM 840 O CYS A 176 2.413 -2.464 4.044 1.00 0.00 O ATOM 841 CB CYS A 176 -0.107 -1.985 6.102 1.00 0.00 C ATOM 842 SG CYS A 176 1.096 -2.536 7.335 1.00 0.00 S ATOM 0 H CYS A 176 1.261 -4.317 4.948 1.00 0.00 H new ATOM 0 HA CYS A 176 -0.773 -2.389 4.100 1.00 0.00 H new ATOM 0 HB2 CYS A 176 -0.067 -0.898 6.031 1.00 0.00 H new ATOM 0 HB3 CYS A 176 -1.108 -2.246 6.445 1.00 0.00 H new ATOM 0 HG CYS A 176 0.832 -1.978 8.479 1.00 0.00 H new ATOM 848 N ALA A 177 1.088 -0.740 3.470 1.00 0.00 N ATOM 849 CA ALA A 177 2.151 -0.003 2.798 1.00 0.00 C ATOM 850 C ALA A 177 1.792 1.472 2.656 1.00 0.00 C ATOM 851 O ALA A 177 0.668 1.878 2.948 1.00 0.00 O ATOM 852 CB ALA A 177 2.436 -0.614 1.434 1.00 0.00 C ATOM 0 H ALA A 177 0.180 -0.275 3.458 1.00 0.00 H new ATOM 0 HA ALA A 177 3.051 -0.073 3.410 1.00 0.00 H new ATOM 0 HB1 ALA A 177 3.232 -0.054 0.943 1.00 0.00 H new ATOM 0 HB2 ALA A 177 2.746 -1.652 1.558 1.00 0.00 H new ATOM 0 HB3 ALA A 177 1.535 -0.575 0.822 1.00 0.00 H new ATOM 858 N PHE A 178 2.755 2.269 2.205 1.00 0.00 N ATOM 859 CA PHE A 178 2.541 3.700 2.025 1.00 0.00 C ATOM 860 C PHE A 178 2.913 4.133 0.610 1.00 0.00 C ATOM 861 O PHE A 178 4.036 3.909 0.156 1.00 0.00 O ATOM 862 CB PHE A 178 3.361 4.493 3.045 1.00 0.00 C ATOM 863 CG PHE A 178 2.920 4.279 4.465 1.00 0.00 C ATOM 864 CD1 PHE A 178 1.685 4.735 4.898 1.00 0.00 C ATOM 865 CD2 PHE A 178 3.741 3.621 5.367 1.00 0.00 C ATOM 866 CE1 PHE A 178 1.277 4.539 6.204 1.00 0.00 C ATOM 867 CE2 PHE A 178 3.337 3.422 6.674 1.00 0.00 C ATOM 868 CZ PHE A 178 2.104 3.882 7.093 1.00 0.00 C ATOM 0 H PHE A 178 3.691 1.948 1.958 1.00 0.00 H new ATOM 0 HA PHE A 178 1.482 3.905 2.182 1.00 0.00 H new ATOM 0 HB2 PHE A 178 4.410 4.213 2.953 1.00 0.00 H new ATOM 0 HB3 PHE A 178 3.293 5.555 2.808 1.00 0.00 H new ATOM 0 HD1 PHE A 178 1.034 5.250 4.207 1.00 0.00 H new ATOM 0 HD2 PHE A 178 4.707 3.260 5.045 1.00 0.00 H new ATOM 0 HE1 PHE A 178 0.312 4.900 6.529 1.00 0.00 H new ATOM 0 HE2 PHE A 178 3.985 2.907 7.367 1.00 0.00 H new ATOM 0 HZ PHE A 178 1.787 3.728 8.114 1.00 0.00 H new ATOM 878 N VAL A 179 1.963 4.752 -0.083 1.00 0.00 N ATOM 879 CA VAL A 179 2.191 5.217 -1.446 1.00 0.00 C ATOM 880 C VAL A 179 2.100 6.736 -1.531 1.00 0.00 C ATOM 881 O VAL A 179 1.145 7.341 -1.044 1.00 0.00 O ATOM 882 CB VAL A 179 1.177 4.597 -2.426 1.00 0.00 C ATOM 883 CG1 VAL A 179 1.390 5.143 -3.830 1.00 0.00 C ATOM 884 CG2 VAL A 179 1.283 3.080 -2.413 1.00 0.00 C ATOM 0 H VAL A 179 1.028 4.943 0.277 1.00 0.00 H new ATOM 0 HA VAL A 179 3.196 4.901 -1.725 1.00 0.00 H new ATOM 0 HB VAL A 179 0.172 4.870 -2.104 1.00 0.00 H new ATOM 0 HG11 VAL A 179 0.665 4.694 -4.509 1.00 0.00 H new ATOM 0 HG12 VAL A 179 1.259 6.225 -3.823 1.00 0.00 H new ATOM 0 HG13 VAL A 179 2.399 4.902 -4.165 1.00 0.00 H new ATOM 0 HG21 VAL A 179 0.560 2.659 -3.111 1.00 0.00 H new ATOM 0 HG22 VAL A 179 2.289 2.783 -2.710 1.00 0.00 H new ATOM 0 HG23 VAL A 179 1.077 2.709 -1.409 1.00 0.00 H new ATOM 894 N LYS A 180 3.101 7.349 -2.155 1.00 0.00 N ATOM 895 CA LYS A 180 3.135 8.799 -2.307 1.00 0.00 C ATOM 896 C LYS A 180 2.960 9.197 -3.769 1.00 0.00 C ATOM 897 O LYS A 180 3.629 8.661 -4.653 1.00 0.00 O ATOM 898 CB LYS A 180 4.454 9.358 -1.769 1.00 0.00 C ATOM 899 CG LYS A 180 4.675 10.823 -2.103 1.00 0.00 C ATOM 900 CD LYS A 180 6.085 11.268 -1.754 1.00 0.00 C ATOM 901 CE LYS A 180 6.199 11.663 -0.290 1.00 0.00 C ATOM 902 NZ LYS A 180 7.274 12.669 -0.069 1.00 0.00 N ATOM 0 H LYS A 180 3.900 6.864 -2.564 1.00 0.00 H new ATOM 0 HA LYS A 180 2.309 9.219 -1.733 1.00 0.00 H new ATOM 0 HB2 LYS A 180 4.477 9.233 -0.686 1.00 0.00 H new ATOM 0 HB3 LYS A 180 5.279 8.773 -2.175 1.00 0.00 H new ATOM 0 HG2 LYS A 180 4.493 10.986 -3.165 1.00 0.00 H new ATOM 0 HG3 LYS A 180 3.955 11.434 -1.559 1.00 0.00 H new ATOM 0 HD2 LYS A 180 6.786 10.462 -1.970 1.00 0.00 H new ATOM 0 HD3 LYS A 180 6.367 12.113 -2.383 1.00 0.00 H new ATOM 0 HE2 LYS A 180 5.247 12.068 0.052 1.00 0.00 H new ATOM 0 HE3 LYS A 180 6.402 10.776 0.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 7.320 12.912 0.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 8.187 12.274 -0.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 7.067 13.525 -0.622 1.00 0.00 H new ATOM 916 N PHE A 181 2.058 10.141 -4.017 1.00 0.00 N ATOM 917 CA PHE A 181 1.796 10.611 -5.372 1.00 0.00 C ATOM 918 C PHE A 181 2.399 11.995 -5.594 1.00 0.00 C ATOM 919 O PHE A 181 2.797 12.670 -4.644 1.00 0.00 O ATOM 920 CB PHE A 181 0.290 10.650 -5.639 1.00 0.00 C ATOM 921 CG PHE A 181 -0.296 9.307 -5.967 1.00 0.00 C ATOM 922 CD1 PHE A 181 -0.602 8.405 -4.961 1.00 0.00 C ATOM 923 CD2 PHE A 181 -0.541 8.946 -7.282 1.00 0.00 C ATOM 924 CE1 PHE A 181 -1.141 7.168 -5.260 1.00 0.00 C ATOM 925 CE2 PHE A 181 -1.080 7.711 -7.587 1.00 0.00 C ATOM 926 CZ PHE A 181 -1.380 6.820 -6.575 1.00 0.00 C ATOM 0 H PHE A 181 1.496 10.595 -3.297 1.00 0.00 H new ATOM 0 HA PHE A 181 2.264 9.914 -6.068 1.00 0.00 H new ATOM 0 HB2 PHE A 181 -0.216 11.054 -4.762 1.00 0.00 H new ATOM 0 HB3 PHE A 181 0.093 11.335 -6.464 1.00 0.00 H new ATOM 0 HD1 PHE A 181 -0.417 8.672 -3.931 1.00 0.00 H new ATOM 0 HD2 PHE A 181 -0.308 9.638 -8.078 1.00 0.00 H new ATOM 0 HE1 PHE A 181 -1.375 6.474 -4.466 1.00 0.00 H new ATOM 0 HE2 PHE A 181 -1.267 7.442 -8.616 1.00 0.00 H new ATOM 0 HZ PHE A 181 -1.800 5.854 -6.811 1.00 0.00 H new ATOM 936 N SER A 182 2.464 12.410 -6.854 1.00 0.00 N ATOM 937 CA SER A 182 3.023 13.711 -7.203 1.00 0.00 C ATOM 938 C SER A 182 1.991 14.817 -7.004 1.00 0.00 C ATOM 939 O SER A 182 2.286 15.998 -7.189 1.00 0.00 O ATOM 940 CB SER A 182 3.511 13.709 -8.653 1.00 0.00 C ATOM 941 OG SER A 182 4.086 14.957 -8.999 1.00 0.00 O ATOM 0 H SER A 182 2.136 11.864 -7.651 1.00 0.00 H new ATOM 0 HA SER A 182 3.869 13.903 -6.543 1.00 0.00 H new ATOM 0 HB2 SER A 182 4.245 12.916 -8.792 1.00 0.00 H new ATOM 0 HB3 SER A 182 2.677 13.492 -9.320 1.00 0.00 H new ATOM 0 HG SER A 182 3.739 15.653 -8.403 1.00 0.00 H new ATOM 947 N SER A 183 0.779 14.425 -6.625 1.00 0.00 N ATOM 948 CA SER A 183 -0.300 15.381 -6.404 1.00 0.00 C ATOM 949 C SER A 183 -1.427 14.750 -5.592 1.00 0.00 C ATOM 950 O SER A 183 -1.664 13.544 -5.669 1.00 0.00 O ATOM 951 CB SER A 183 -0.842 15.889 -7.741 1.00 0.00 C ATOM 952 OG SER A 183 -0.134 17.038 -8.175 1.00 0.00 O ATOM 0 H SER A 183 0.519 13.452 -6.464 1.00 0.00 H new ATOM 0 HA SER A 183 0.103 16.222 -5.841 1.00 0.00 H new ATOM 0 HB2 SER A 183 -0.761 15.103 -8.492 1.00 0.00 H new ATOM 0 HB3 SER A 183 -1.901 16.127 -7.641 1.00 0.00 H new ATOM 0 HG SER A 183 0.814 16.945 -7.943 1.00 0.00 H new ATOM 958 N HIS A 184 -2.121 15.575 -4.814 1.00 0.00 N ATOM 959 CA HIS A 184 -3.225 15.099 -3.987 1.00 0.00 C ATOM 960 C HIS A 184 -4.315 14.469 -4.848 1.00 0.00 C ATOM 961 O HIS A 184 -4.822 13.390 -4.537 1.00 0.00 O ATOM 962 CB HIS A 184 -3.808 16.249 -3.166 1.00 0.00 C ATOM 963 CG HIS A 184 -4.204 17.434 -3.992 1.00 0.00 C ATOM 964 ND1 HIS A 184 -3.318 18.423 -4.364 1.00 0.00 N ATOM 965 CD2 HIS A 184 -5.400 17.784 -4.521 1.00 0.00 C ATOM 966 CE1 HIS A 184 -3.953 19.331 -5.084 1.00 0.00 C ATOM 967 NE2 HIS A 184 -5.218 18.967 -5.194 1.00 0.00 N ATOM 0 H HIS A 184 -1.939 16.576 -4.739 1.00 0.00 H new ATOM 0 HA HIS A 184 -2.837 14.339 -3.309 1.00 0.00 H new ATOM 0 HB2 HIS A 184 -4.680 15.889 -2.620 1.00 0.00 H new ATOM 0 HB3 HIS A 184 -3.074 16.563 -2.423 1.00 0.00 H new ATOM 0 HD2 HIS A 184 -6.325 17.235 -4.430 1.00 0.00 H new ATOM 0 HE1 HIS A 184 -3.512 20.220 -5.510 1.00 0.00 H new ATOM 0 HE2 HIS A 184 -5.942 19.481 -5.697 1.00 0.00 H new ATOM 975 N THR A 185 -4.674 15.149 -5.932 1.00 0.00 N ATOM 976 CA THR A 185 -5.706 14.658 -6.837 1.00 0.00 C ATOM 977 C THR A 185 -5.463 13.199 -7.207 1.00 0.00 C ATOM 978 O THR A 185 -6.290 12.332 -6.927 1.00 0.00 O ATOM 979 CB THR A 185 -5.771 15.499 -8.125 1.00 0.00 C ATOM 980 OG1 THR A 185 -5.947 16.882 -7.799 1.00 0.00 O ATOM 981 CG2 THR A 185 -6.912 15.034 -9.018 1.00 0.00 C ATOM 0 H THR A 185 -4.265 16.043 -6.205 1.00 0.00 H new ATOM 0 HA THR A 185 -6.656 14.743 -6.309 1.00 0.00 H new ATOM 0 HB THR A 185 -4.833 15.370 -8.664 1.00 0.00 H new ATOM 0 HG1 THR A 185 -5.986 17.410 -8.624 1.00 0.00 H new ATOM 0 HG21 THR A 185 -6.938 15.643 -9.922 1.00 0.00 H new ATOM 0 HG22 THR A 185 -6.760 13.989 -9.289 1.00 0.00 H new ATOM 0 HG23 THR A 185 -7.857 15.136 -8.484 1.00 0.00 H new ATOM 989 N GLU A 186 -4.323 12.936 -7.839 1.00 0.00 N ATOM 990 CA GLU A 186 -3.972 11.581 -8.247 1.00 0.00 C ATOM 991 C GLU A 186 -4.310 10.577 -7.149 1.00 0.00 C ATOM 992 O GLU A 186 -4.974 9.571 -7.396 1.00 0.00 O ATOM 993 CB GLU A 186 -2.483 11.497 -8.590 1.00 0.00 C ATOM 994 CG GLU A 186 -2.170 11.854 -10.034 1.00 0.00 C ATOM 995 CD GLU A 186 -2.519 13.291 -10.369 1.00 0.00 C ATOM 996 OE1 GLU A 186 -3.713 13.573 -10.602 1.00 0.00 O ATOM 997 OE2 GLU A 186 -1.598 14.134 -10.398 1.00 0.00 O ATOM 0 H GLU A 186 -3.628 13.643 -8.079 1.00 0.00 H new ATOM 0 HA GLU A 186 -4.556 11.334 -9.133 1.00 0.00 H new ATOM 0 HB2 GLU A 186 -1.929 12.165 -7.931 1.00 0.00 H new ATOM 0 HB3 GLU A 186 -2.129 10.486 -8.390 1.00 0.00 H new ATOM 0 HG2 GLU A 186 -1.110 11.688 -10.224 1.00 0.00 H new ATOM 0 HG3 GLU A 186 -2.721 11.186 -10.697 1.00 0.00 H new ATOM 1004 N ALA A 187 -3.846 10.858 -5.936 1.00 0.00 N ATOM 1005 CA ALA A 187 -4.100 9.981 -4.799 1.00 0.00 C ATOM 1006 C ALA A 187 -5.596 9.791 -4.576 1.00 0.00 C ATOM 1007 O ALA A 187 -6.094 8.666 -4.571 1.00 0.00 O ATOM 1008 CB ALA A 187 -3.444 10.540 -3.545 1.00 0.00 C ATOM 0 H ALA A 187 -3.292 11.686 -5.715 1.00 0.00 H new ATOM 0 HA ALA A 187 -3.666 9.006 -5.019 1.00 0.00 H new ATOM 0 HB1 ALA A 187 -3.642 9.875 -2.704 1.00 0.00 H new ATOM 0 HB2 ALA A 187 -2.368 10.618 -3.701 1.00 0.00 H new ATOM 0 HB3 ALA A 187 -3.852 11.528 -3.331 1.00 0.00 H new ATOM 1014 N GLN A 188 -6.308 10.898 -4.390 1.00 0.00 N ATOM 1015 CA GLN A 188 -7.747 10.852 -4.165 1.00 0.00 C ATOM 1016 C GLN A 188 -8.401 9.783 -5.034 1.00 0.00 C ATOM 1017 O GLN A 188 -9.147 8.938 -4.541 1.00 0.00 O ATOM 1018 CB GLN A 188 -8.375 12.217 -4.456 1.00 0.00 C ATOM 1019 CG GLN A 188 -8.376 13.153 -3.258 1.00 0.00 C ATOM 1020 CD GLN A 188 -9.627 13.018 -2.413 1.00 0.00 C ATOM 1021 OE1 GLN A 188 -9.699 11.949 -1.628 1.00 0.00 O flip ATOM 1022 NE2 GLN A 188 -10.519 13.865 -2.464 1.00 0.00 N flip ATOM 0 H GLN A 188 -5.911 11.838 -4.391 1.00 0.00 H new ATOM 0 HA GLN A 188 -7.917 10.597 -3.119 1.00 0.00 H new ATOM 0 HB2 GLN A 188 -7.834 12.690 -5.276 1.00 0.00 H new ATOM 0 HB3 GLN A 188 -9.401 12.071 -4.794 1.00 0.00 H new ATOM 0 HG2 GLN A 188 -7.501 12.948 -2.641 1.00 0.00 H new ATOM 0 HG3 GLN A 188 -8.286 14.182 -3.606 1.00 0.00 H new ATOM 0 HE21 GLN A 188 -10.422 14.671 -3.081 1.00 0.00 H new ATOM 0 HE22 GLN A 188 -11.355 13.761 -1.889 1.00 0.00 H new ATOM 1031 N ALA A 189 -8.115 9.827 -6.332 1.00 0.00 N ATOM 1032 CA ALA A 189 -8.673 8.861 -7.270 1.00 0.00 C ATOM 1033 C ALA A 189 -8.236 7.442 -6.922 1.00 0.00 C ATOM 1034 O ALA A 189 -9.066 6.580 -6.632 1.00 0.00 O ATOM 1035 CB ALA A 189 -8.261 9.208 -8.693 1.00 0.00 C ATOM 0 H ALA A 189 -7.500 10.521 -6.757 1.00 0.00 H new ATOM 0 HA ALA A 189 -9.760 8.907 -7.197 1.00 0.00 H new ATOM 0 HB1 ALA A 189 -8.685 8.478 -9.383 1.00 0.00 H new ATOM 0 HB2 ALA A 189 -8.629 10.202 -8.946 1.00 0.00 H new ATOM 0 HB3 ALA A 189 -7.174 9.192 -8.771 1.00 0.00 H new ATOM 1041 N ALA A 190 -6.929 7.206 -6.953 1.00 0.00 N ATOM 1042 CA ALA A 190 -6.382 5.891 -6.639 1.00 0.00 C ATOM 1043 C ALA A 190 -7.104 5.266 -5.450 1.00 0.00 C ATOM 1044 O ALA A 190 -7.299 4.051 -5.399 1.00 0.00 O ATOM 1045 CB ALA A 190 -4.890 5.993 -6.360 1.00 0.00 C ATOM 0 H ALA A 190 -6.229 7.908 -7.192 1.00 0.00 H new ATOM 0 HA ALA A 190 -6.535 5.245 -7.503 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -4.495 5.004 -6.127 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -4.382 6.389 -7.239 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -4.723 6.659 -5.514 1.00 0.00 H new ATOM 1051 N ILE A 191 -7.496 6.103 -4.496 1.00 0.00 N ATOM 1052 CA ILE A 191 -8.196 5.632 -3.307 1.00 0.00 C ATOM 1053 C ILE A 191 -9.566 5.063 -3.665 1.00 0.00 C ATOM 1054 O ILE A 191 -9.791 3.856 -3.576 1.00 0.00 O ATOM 1055 CB ILE A 191 -8.375 6.760 -2.275 1.00 0.00 C ATOM 1056 CG1 ILE A 191 -7.012 7.251 -1.783 1.00 0.00 C ATOM 1057 CG2 ILE A 191 -9.224 6.280 -1.107 1.00 0.00 C ATOM 1058 CD1 ILE A 191 -7.104 8.357 -0.754 1.00 0.00 C ATOM 0 H ILE A 191 -7.341 7.111 -4.523 1.00 0.00 H new ATOM 0 HA ILE A 191 -7.581 4.845 -2.870 1.00 0.00 H new ATOM 0 HB ILE A 191 -8.889 7.593 -2.754 1.00 0.00 H new ATOM 0 HG12 ILE A 191 -6.465 6.411 -1.354 1.00 0.00 H new ATOM 0 HG13 ILE A 191 -6.433 7.606 -2.636 1.00 0.00 H new ATOM 0 HG21 ILE A 191 -9.341 7.089 -0.386 1.00 0.00 H new ATOM 0 HG22 ILE A 191 -10.204 5.974 -1.472 1.00 0.00 H new ATOM 0 HG23 ILE A 191 -8.735 5.433 -0.626 1.00 0.00 H new ATOM 0 HD11 ILE A 191 -6.101 8.656 -0.450 1.00 0.00 H new ATOM 0 HD12 ILE A 191 -7.623 9.213 -1.185 1.00 0.00 H new ATOM 0 HD13 ILE A 191 -7.655 8.000 0.116 1.00 0.00 H new ATOM 1070 N HIS A 192 -10.477 5.942 -4.072 1.00 0.00 N ATOM 1071 CA HIS A 192 -11.824 5.527 -4.446 1.00 0.00 C ATOM 1072 C HIS A 192 -11.790 4.583 -5.644 1.00 0.00 C ATOM 1073 O HIS A 192 -12.777 3.914 -5.948 1.00 0.00 O ATOM 1074 CB HIS A 192 -12.685 6.749 -4.770 1.00 0.00 C ATOM 1075 CG HIS A 192 -12.666 7.796 -3.699 1.00 0.00 C ATOM 1076 ND1 HIS A 192 -11.767 8.842 -3.685 1.00 0.00 N ATOM 1077 CD2 HIS A 192 -13.443 7.956 -2.603 1.00 0.00 C ATOM 1078 CE1 HIS A 192 -11.991 9.598 -2.626 1.00 0.00 C ATOM 1079 NE2 HIS A 192 -13.004 9.083 -1.952 1.00 0.00 N ATOM 0 H HIS A 192 -10.307 6.945 -4.151 1.00 0.00 H new ATOM 0 HA HIS A 192 -12.261 4.996 -3.600 1.00 0.00 H new ATOM 0 HB2 HIS A 192 -12.338 7.190 -5.704 1.00 0.00 H new ATOM 0 HB3 HIS A 192 -13.713 6.426 -4.933 1.00 0.00 H new ATOM 0 HD1 HIS A 192 -11.042 9.006 -4.384 1.00 0.00 H new ATOM 0 HD2 HIS A 192 -14.257 7.316 -2.297 1.00 0.00 H new ATOM 0 HE1 HIS A 192 -11.440 10.487 -2.356 1.00 0.00 H new ATOM 1087 N ALA A 193 -10.646 4.534 -6.319 1.00 0.00 N ATOM 1088 CA ALA A 193 -10.483 3.671 -7.483 1.00 0.00 C ATOM 1089 C ALA A 193 -9.949 2.300 -7.079 1.00 0.00 C ATOM 1090 O ALA A 193 -10.161 1.309 -7.778 1.00 0.00 O ATOM 1091 CB ALA A 193 -9.555 4.323 -8.497 1.00 0.00 C ATOM 0 H ALA A 193 -9.819 5.081 -6.080 1.00 0.00 H new ATOM 0 HA ALA A 193 -11.462 3.530 -7.941 1.00 0.00 H new ATOM 0 HB1 ALA A 193 -9.442 3.668 -9.361 1.00 0.00 H new ATOM 0 HB2 ALA A 193 -9.977 5.276 -8.817 1.00 0.00 H new ATOM 0 HB3 ALA A 193 -8.580 4.493 -8.041 1.00 0.00 H new ATOM 1097 N LEU A 194 -9.255 2.251 -5.947 1.00 0.00 N ATOM 1098 CA LEU A 194 -8.690 1.001 -5.450 1.00 0.00 C ATOM 1099 C LEU A 194 -9.054 0.784 -3.985 1.00 0.00 C ATOM 1100 O LEU A 194 -8.372 0.053 -3.267 1.00 0.00 O ATOM 1101 CB LEU A 194 -7.169 1.006 -5.614 1.00 0.00 C ATOM 1102 CG LEU A 194 -6.649 1.123 -7.047 1.00 0.00 C ATOM 1103 CD1 LEU A 194 -5.146 1.355 -7.052 1.00 0.00 C ATOM 1104 CD2 LEU A 194 -7.001 -0.123 -7.846 1.00 0.00 C ATOM 0 H LEU A 194 -9.070 3.062 -5.356 1.00 0.00 H new ATOM 0 HA LEU A 194 -9.110 0.183 -6.035 1.00 0.00 H new ATOM 0 HB2 LEU A 194 -6.764 1.834 -5.033 1.00 0.00 H new ATOM 0 HB3 LEU A 194 -6.774 0.088 -5.179 1.00 0.00 H new ATOM 0 HG LEU A 194 -7.130 1.980 -7.519 1.00 0.00 H new ATOM 0 HD11 LEU A 194 -4.794 1.436 -8.080 1.00 0.00 H new ATOM 0 HD12 LEU A 194 -4.918 2.277 -6.517 1.00 0.00 H new ATOM 0 HD13 LEU A 194 -4.647 0.519 -6.562 1.00 0.00 H new ATOM 0 HD21 LEU A 194 -6.623 -0.022 -8.863 1.00 0.00 H new ATOM 0 HD22 LEU A 194 -6.549 -0.996 -7.376 1.00 0.00 H new ATOM 0 HD23 LEU A 194 -8.084 -0.245 -7.872 1.00 0.00 H new ATOM 1116 N HIS A 195 -10.136 1.421 -3.548 1.00 0.00 N ATOM 1117 CA HIS A 195 -10.593 1.295 -2.169 1.00 0.00 C ATOM 1118 C HIS A 195 -11.491 0.072 -2.004 1.00 0.00 C ATOM 1119 O HIS A 195 -12.500 -0.067 -2.693 1.00 0.00 O ATOM 1120 CB HIS A 195 -11.346 2.555 -1.742 1.00 0.00 C ATOM 1121 CG HIS A 195 -12.119 2.389 -0.470 1.00 0.00 C ATOM 1122 ND1 HIS A 195 -11.717 1.554 0.552 1.00 0.00 N ATOM 1123 CD2 HIS A 195 -13.275 2.957 -0.056 1.00 0.00 C ATOM 1124 CE1 HIS A 195 -12.593 1.615 1.538 1.00 0.00 C ATOM 1125 NE2 HIS A 195 -13.549 2.460 1.195 1.00 0.00 N ATOM 0 H HIS A 195 -10.712 2.030 -4.129 1.00 0.00 H new ATOM 0 HA HIS A 195 -9.717 1.170 -1.532 1.00 0.00 H new ATOM 0 HB2 HIS A 195 -10.633 3.371 -1.620 1.00 0.00 H new ATOM 0 HB3 HIS A 195 -12.031 2.846 -2.538 1.00 0.00 H new ATOM 0 HD2 HIS A 195 -13.872 3.669 -0.607 1.00 0.00 H new ATOM 0 HE1 HIS A 195 -12.538 1.067 2.467 1.00 0.00 H new ATOM 0 HE2 HIS A 195 -14.358 2.704 1.766 1.00 0.00 H new ATOM 1133 N GLY A 196 -11.115 -0.813 -1.086 1.00 0.00 N ATOM 1134 CA GLY A 196 -11.896 -2.013 -0.848 1.00 0.00 C ATOM 1135 C GLY A 196 -12.538 -2.547 -2.113 1.00 0.00 C ATOM 1136 O GLY A 196 -13.681 -3.002 -2.092 1.00 0.00 O ATOM 0 H GLY A 196 -10.283 -0.720 -0.503 1.00 0.00 H new ATOM 0 HA2 GLY A 196 -11.254 -2.781 -0.418 1.00 0.00 H new ATOM 0 HA3 GLY A 196 -12.672 -1.798 -0.113 1.00 0.00 H new ATOM 1140 N SER A 197 -11.801 -2.491 -3.218 1.00 0.00 N ATOM 1141 CA SER A 197 -12.307 -2.968 -4.499 1.00 0.00 C ATOM 1142 C SER A 197 -11.770 -4.362 -4.810 1.00 0.00 C ATOM 1143 O SER A 197 -12.480 -5.203 -5.362 1.00 0.00 O ATOM 1144 CB SER A 197 -11.920 -1.999 -5.617 1.00 0.00 C ATOM 1145 OG SER A 197 -10.578 -2.200 -6.025 1.00 0.00 O ATOM 0 H SER A 197 -10.851 -2.120 -3.251 1.00 0.00 H new ATOM 0 HA SER A 197 -13.394 -3.022 -4.435 1.00 0.00 H new ATOM 0 HB2 SER A 197 -12.587 -2.136 -6.468 1.00 0.00 H new ATOM 0 HB3 SER A 197 -12.049 -0.973 -5.274 1.00 0.00 H new ATOM 0 HG SER A 197 -10.356 -1.569 -6.742 1.00 0.00 H new ATOM 1151 N GLN A 198 -10.512 -4.598 -4.453 1.00 0.00 N ATOM 1152 CA GLN A 198 -9.879 -5.890 -4.695 1.00 0.00 C ATOM 1153 C GLN A 198 -9.862 -6.734 -3.424 1.00 0.00 C ATOM 1154 O GLN A 198 -10.079 -6.224 -2.324 1.00 0.00 O ATOM 1155 CB GLN A 198 -8.453 -5.693 -5.210 1.00 0.00 C ATOM 1156 CG GLN A 198 -8.386 -5.076 -6.598 1.00 0.00 C ATOM 1157 CD GLN A 198 -7.074 -4.362 -6.857 1.00 0.00 C ATOM 1158 OE1 GLN A 198 -6.416 -4.599 -7.870 1.00 0.00 O ATOM 1159 NE2 GLN A 198 -6.687 -3.483 -5.940 1.00 0.00 N ATOM 0 H GLN A 198 -9.911 -3.913 -3.996 1.00 0.00 H new ATOM 0 HA GLN A 198 -10.461 -6.417 -5.451 1.00 0.00 H new ATOM 0 HB2 GLN A 198 -7.908 -5.057 -4.512 1.00 0.00 H new ATOM 0 HB3 GLN A 198 -7.945 -6.657 -5.225 1.00 0.00 H new ATOM 0 HG2 GLN A 198 -8.524 -5.857 -7.346 1.00 0.00 H new ATOM 0 HG3 GLN A 198 -9.209 -4.371 -6.718 1.00 0.00 H new ATOM 0 HE21 GLN A 198 -7.265 -3.318 -5.116 1.00 0.00 H new ATOM 0 HE22 GLN A 198 -5.812 -2.972 -6.060 1.00 0.00 H new ATOM 1168 N THR A 199 -9.603 -8.028 -3.583 1.00 0.00 N ATOM 1169 CA THR A 199 -9.559 -8.943 -2.450 1.00 0.00 C ATOM 1170 C THR A 199 -8.349 -9.866 -2.535 1.00 0.00 C ATOM 1171 O THR A 199 -8.466 -11.021 -2.944 1.00 0.00 O ATOM 1172 CB THR A 199 -10.838 -9.798 -2.368 1.00 0.00 C ATOM 1173 OG1 THR A 199 -11.994 -8.954 -2.394 1.00 0.00 O ATOM 1174 CG2 THR A 199 -10.846 -10.640 -1.101 1.00 0.00 C ATOM 0 H THR A 199 -9.420 -8.466 -4.486 1.00 0.00 H new ATOM 0 HA THR A 199 -9.482 -8.330 -1.552 1.00 0.00 H new ATOM 0 HB THR A 199 -10.858 -10.466 -3.229 1.00 0.00 H new ATOM 0 HG1 THR A 199 -12.803 -9.505 -2.343 1.00 0.00 H new ATOM 0 HG21 THR A 199 -11.759 -11.235 -1.065 1.00 0.00 H new ATOM 0 HG22 THR A 199 -9.981 -11.303 -1.099 1.00 0.00 H new ATOM 0 HG23 THR A 199 -10.805 -9.987 -0.230 1.00 0.00 H new ATOM 1182 N MET A 200 -7.188 -9.349 -2.146 1.00 0.00 N ATOM 1183 CA MET A 200 -5.956 -10.129 -2.177 1.00 0.00 C ATOM 1184 C MET A 200 -6.217 -11.573 -1.761 1.00 0.00 C ATOM 1185 O MET A 200 -6.963 -11.849 -0.821 1.00 0.00 O ATOM 1186 CB MET A 200 -4.907 -9.502 -1.258 1.00 0.00 C ATOM 1187 CG MET A 200 -4.471 -8.112 -1.692 1.00 0.00 C ATOM 1188 SD MET A 200 -3.984 -8.048 -3.427 1.00 0.00 S ATOM 1189 CE MET A 200 -4.327 -6.333 -3.812 1.00 0.00 C ATOM 0 H MET A 200 -7.075 -8.394 -1.806 1.00 0.00 H new ATOM 0 HA MET A 200 -5.579 -10.127 -3.200 1.00 0.00 H new ATOM 0 HB2 MET A 200 -5.308 -9.448 -0.246 1.00 0.00 H new ATOM 0 HB3 MET A 200 -4.033 -10.153 -1.221 1.00 0.00 H new ATOM 0 HG2 MET A 200 -5.287 -7.410 -1.521 1.00 0.00 H new ATOM 0 HG3 MET A 200 -3.636 -7.787 -1.072 1.00 0.00 H new ATOM 0 HE1 MET A 200 -4.282 -6.186 -4.891 1.00 0.00 H new ATOM 0 HE2 MET A 200 -5.322 -6.071 -3.451 1.00 0.00 H new ATOM 0 HE3 MET A 200 -3.586 -5.696 -3.328 1.00 0.00 H new ATOM 1199 N PRO A 201 -5.588 -12.519 -2.475 1.00 0.00 N ATOM 1200 CA PRO A 201 -5.736 -13.951 -2.197 1.00 0.00 C ATOM 1201 C PRO A 201 -5.561 -14.275 -0.717 1.00 0.00 C ATOM 1202 O PRO A 201 -4.761 -13.648 -0.025 1.00 0.00 O ATOM 1203 CB PRO A 201 -4.616 -14.590 -3.021 1.00 0.00 C ATOM 1204 CG PRO A 201 -4.387 -13.643 -4.148 1.00 0.00 C ATOM 1205 CD PRO A 201 -4.684 -12.263 -3.609 1.00 0.00 C ATOM 0 HA PRO A 201 -6.731 -14.315 -2.452 1.00 0.00 H new ATOM 0 HB2 PRO A 201 -3.713 -14.722 -2.426 1.00 0.00 H new ATOM 0 HB3 PRO A 201 -4.905 -15.576 -3.385 1.00 0.00 H new ATOM 0 HG2 PRO A 201 -3.360 -13.707 -4.507 1.00 0.00 H new ATOM 0 HG3 PRO A 201 -5.035 -13.879 -4.992 1.00 0.00 H new ATOM 0 HD2 PRO A 201 -3.775 -11.754 -3.289 1.00 0.00 H new ATOM 0 HD3 PRO A 201 -5.155 -11.632 -4.362 1.00 0.00 H new ATOM 1213 N GLY A 202 -6.315 -15.260 -0.239 1.00 0.00 N ATOM 1214 CA GLY A 202 -6.228 -15.650 1.156 1.00 0.00 C ATOM 1215 C GLY A 202 -7.039 -14.747 2.063 1.00 0.00 C ATOM 1216 O GLY A 202 -7.669 -15.212 3.012 1.00 0.00 O ATOM 0 H GLY A 202 -6.984 -15.795 -0.793 1.00 0.00 H new ATOM 0 HA2 GLY A 202 -6.577 -16.677 1.265 1.00 0.00 H new ATOM 0 HA3 GLY A 202 -5.184 -15.633 1.470 1.00 0.00 H new ATOM 1220 N ALA A 203 -7.022 -13.450 1.773 1.00 0.00 N ATOM 1221 CA ALA A 203 -7.761 -12.479 2.569 1.00 0.00 C ATOM 1222 C ALA A 203 -9.217 -12.398 2.123 1.00 0.00 C ATOM 1223 O ALA A 203 -9.505 -12.236 0.937 1.00 0.00 O ATOM 1224 CB ALA A 203 -7.102 -11.110 2.478 1.00 0.00 C ATOM 0 H ALA A 203 -6.504 -13.048 0.992 1.00 0.00 H new ATOM 0 HA ALA A 203 -7.744 -12.810 3.608 1.00 0.00 H new ATOM 0 HB1 ALA A 203 -7.665 -10.395 3.078 1.00 0.00 H new ATOM 0 HB2 ALA A 203 -6.080 -11.172 2.852 1.00 0.00 H new ATOM 0 HB3 ALA A 203 -7.088 -10.781 1.439 1.00 0.00 H new ATOM 1230 N SER A 204 -10.132 -12.511 3.080 1.00 0.00 N ATOM 1231 CA SER A 204 -11.559 -12.455 2.785 1.00 0.00 C ATOM 1232 C SER A 204 -12.047 -11.011 2.737 1.00 0.00 C ATOM 1233 O SER A 204 -13.191 -10.743 2.368 1.00 0.00 O ATOM 1234 CB SER A 204 -12.350 -13.239 3.834 1.00 0.00 C ATOM 1235 OG SER A 204 -12.347 -14.626 3.545 1.00 0.00 O ATOM 0 H SER A 204 -9.911 -12.642 4.067 1.00 0.00 H new ATOM 0 HA SER A 204 -11.721 -12.907 1.807 1.00 0.00 H new ATOM 0 HB2 SER A 204 -11.919 -13.069 4.821 1.00 0.00 H new ATOM 0 HB3 SER A 204 -13.376 -12.874 3.868 1.00 0.00 H new ATOM 0 HG SER A 204 -12.858 -15.104 4.231 1.00 0.00 H new ATOM 1241 N SER A 205 -11.172 -10.084 3.113 1.00 0.00 N ATOM 1242 CA SER A 205 -11.514 -8.666 3.118 1.00 0.00 C ATOM 1243 C SER A 205 -10.979 -7.975 1.868 1.00 0.00 C ATOM 1244 O SER A 205 -10.205 -8.555 1.107 1.00 0.00 O ATOM 1245 CB SER A 205 -10.954 -7.989 4.370 1.00 0.00 C ATOM 1246 OG SER A 205 -11.506 -6.694 4.539 1.00 0.00 O ATOM 0 H SER A 205 -10.221 -10.289 3.418 1.00 0.00 H new ATOM 0 HA SER A 205 -12.600 -8.579 3.123 1.00 0.00 H new ATOM 0 HB2 SER A 205 -11.174 -8.599 5.246 1.00 0.00 H new ATOM 0 HB3 SER A 205 -9.869 -7.918 4.295 1.00 0.00 H new ATOM 0 HG SER A 205 -11.980 -6.650 5.396 1.00 0.00 H new ATOM 1252 N SER A 206 -11.396 -6.729 1.664 1.00 0.00 N ATOM 1253 CA SER A 206 -10.962 -5.958 0.505 1.00 0.00 C ATOM 1254 C SER A 206 -9.842 -4.994 0.882 1.00 0.00 C ATOM 1255 O SER A 206 -9.750 -4.548 2.027 1.00 0.00 O ATOM 1256 CB SER A 206 -12.140 -5.183 -0.089 1.00 0.00 C ATOM 1257 OG SER A 206 -13.248 -6.036 -0.320 1.00 0.00 O ATOM 0 H SER A 206 -12.034 -6.232 2.286 1.00 0.00 H new ATOM 0 HA SER A 206 -10.581 -6.655 -0.242 1.00 0.00 H new ATOM 0 HB2 SER A 206 -12.430 -4.380 0.589 1.00 0.00 H new ATOM 0 HB3 SER A 206 -11.836 -4.715 -1.025 1.00 0.00 H new ATOM 0 HG SER A 206 -13.988 -5.516 -0.698 1.00 0.00 H new ATOM 1263 N LEU A 207 -8.992 -4.676 -0.087 1.00 0.00 N ATOM 1264 CA LEU A 207 -7.877 -3.763 0.142 1.00 0.00 C ATOM 1265 C LEU A 207 -8.362 -2.452 0.750 1.00 0.00 C ATOM 1266 O LEU A 207 -9.385 -1.905 0.339 1.00 0.00 O ATOM 1267 CB LEU A 207 -7.140 -3.488 -1.170 1.00 0.00 C ATOM 1268 CG LEU A 207 -5.770 -2.821 -1.044 1.00 0.00 C ATOM 1269 CD1 LEU A 207 -4.745 -3.806 -0.502 1.00 0.00 C ATOM 1270 CD2 LEU A 207 -5.320 -2.266 -2.387 1.00 0.00 C ATOM 0 H LEU A 207 -9.053 -5.037 -1.039 1.00 0.00 H new ATOM 0 HA LEU A 207 -7.191 -4.236 0.845 1.00 0.00 H new ATOM 0 HB2 LEU A 207 -7.014 -4.433 -1.698 1.00 0.00 H new ATOM 0 HB3 LEU A 207 -7.773 -2.857 -1.794 1.00 0.00 H new ATOM 0 HG LEU A 207 -5.855 -1.992 -0.342 1.00 0.00 H new ATOM 0 HD11 LEU A 207 -3.776 -3.314 -0.419 1.00 0.00 H new ATOM 0 HD12 LEU A 207 -5.060 -4.155 0.481 1.00 0.00 H new ATOM 0 HD13 LEU A 207 -4.663 -4.656 -1.180 1.00 0.00 H new ATOM 0 HD21 LEU A 207 -4.343 -1.795 -2.277 1.00 0.00 H new ATOM 0 HD22 LEU A 207 -5.252 -3.077 -3.112 1.00 0.00 H new ATOM 0 HD23 LEU A 207 -6.042 -1.527 -2.736 1.00 0.00 H new ATOM 1282 N VAL A 208 -7.619 -1.951 1.732 1.00 0.00 N ATOM 1283 CA VAL A 208 -7.971 -0.701 2.396 1.00 0.00 C ATOM 1284 C VAL A 208 -7.023 0.422 1.992 1.00 0.00 C ATOM 1285 O VAL A 208 -5.817 0.343 2.221 1.00 0.00 O ATOM 1286 CB VAL A 208 -7.946 -0.853 3.929 1.00 0.00 C ATOM 1287 CG1 VAL A 208 -8.282 0.469 4.602 1.00 0.00 C ATOM 1288 CG2 VAL A 208 -8.907 -1.946 4.371 1.00 0.00 C ATOM 0 H VAL A 208 -6.770 -2.392 2.085 1.00 0.00 H new ATOM 0 HA VAL A 208 -8.983 -0.449 2.080 1.00 0.00 H new ATOM 0 HB VAL A 208 -6.940 -1.142 4.232 1.00 0.00 H new ATOM 0 HG11 VAL A 208 -8.260 0.342 5.684 1.00 0.00 H new ATOM 0 HG12 VAL A 208 -7.551 1.222 4.310 1.00 0.00 H new ATOM 0 HG13 VAL A 208 -9.277 0.791 4.295 1.00 0.00 H new ATOM 0 HG21 VAL A 208 -8.877 -2.040 5.457 1.00 0.00 H new ATOM 0 HG22 VAL A 208 -9.919 -1.690 4.057 1.00 0.00 H new ATOM 0 HG23 VAL A 208 -8.615 -2.893 3.917 1.00 0.00 H new ATOM 1298 N VAL A 209 -7.578 1.469 1.389 1.00 0.00 N ATOM 1299 CA VAL A 209 -6.782 2.610 0.953 1.00 0.00 C ATOM 1300 C VAL A 209 -7.335 3.913 1.520 1.00 0.00 C ATOM 1301 O VAL A 209 -8.466 4.300 1.228 1.00 0.00 O ATOM 1302 CB VAL A 209 -6.738 2.710 -0.583 1.00 0.00 C ATOM 1303 CG1 VAL A 209 -5.646 3.673 -1.025 1.00 0.00 C ATOM 1304 CG2 VAL A 209 -6.529 1.335 -1.200 1.00 0.00 C ATOM 0 H VAL A 209 -8.575 1.550 1.192 1.00 0.00 H new ATOM 0 HA VAL A 209 -5.771 2.453 1.328 1.00 0.00 H new ATOM 0 HB VAL A 209 -7.695 3.099 -0.932 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.630 3.730 -2.113 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -5.844 4.662 -0.612 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -4.680 3.317 -0.666 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.500 1.424 -2.286 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -5.587 0.916 -0.845 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -7.350 0.678 -0.911 1.00 0.00 H new ATOM 1314 N LYS A 210 -6.528 4.587 2.333 1.00 0.00 N ATOM 1315 CA LYS A 210 -6.934 5.849 2.940 1.00 0.00 C ATOM 1316 C LYS A 210 -5.717 6.667 3.360 1.00 0.00 C ATOM 1317 O LYS A 210 -4.654 6.115 3.645 1.00 0.00 O ATOM 1318 CB LYS A 210 -7.830 5.590 4.154 1.00 0.00 C ATOM 1319 CG LYS A 210 -7.152 4.785 5.249 1.00 0.00 C ATOM 1320 CD LYS A 210 -8.002 4.730 6.508 1.00 0.00 C ATOM 1321 CE LYS A 210 -7.191 4.266 7.708 1.00 0.00 C ATOM 1322 NZ LYS A 210 -6.459 5.392 8.351 1.00 0.00 N ATOM 0 H LYS A 210 -5.589 4.280 2.587 1.00 0.00 H new ATOM 0 HA LYS A 210 -7.494 6.417 2.197 1.00 0.00 H new ATOM 0 HB2 LYS A 210 -8.155 6.545 4.565 1.00 0.00 H new ATOM 0 HB3 LYS A 210 -8.726 5.062 3.828 1.00 0.00 H new ATOM 0 HG2 LYS A 210 -6.962 3.773 4.893 1.00 0.00 H new ATOM 0 HG3 LYS A 210 -6.184 5.228 5.482 1.00 0.00 H new ATOM 0 HD2 LYS A 210 -8.420 5.716 6.709 1.00 0.00 H new ATOM 0 HD3 LYS A 210 -8.842 4.053 6.352 1.00 0.00 H new ATOM 0 HE2 LYS A 210 -7.855 3.801 8.437 1.00 0.00 H new ATOM 0 HE3 LYS A 210 -6.479 3.503 7.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 210 -5.918 5.035 9.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 210 -5.807 5.820 7.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 210 -7.140 6.108 8.675 1.00 0.00 H new ATOM 1336 N PHE A 211 -5.880 7.985 3.397 1.00 0.00 N ATOM 1337 CA PHE A 211 -4.794 8.880 3.783 1.00 0.00 C ATOM 1338 C PHE A 211 -4.196 8.462 5.123 1.00 0.00 C ATOM 1339 O PHE A 211 -4.916 8.073 6.042 1.00 0.00 O ATOM 1340 CB PHE A 211 -5.297 10.322 3.863 1.00 0.00 C ATOM 1341 CG PHE A 211 -5.893 10.822 2.578 1.00 0.00 C ATOM 1342 CD1 PHE A 211 -5.092 11.400 1.606 1.00 0.00 C ATOM 1343 CD2 PHE A 211 -7.254 10.713 2.342 1.00 0.00 C ATOM 1344 CE1 PHE A 211 -5.639 11.861 0.423 1.00 0.00 C ATOM 1345 CE2 PHE A 211 -7.806 11.172 1.161 1.00 0.00 C ATOM 1346 CZ PHE A 211 -6.997 11.746 0.200 1.00 0.00 C ATOM 0 H PHE A 211 -6.753 8.458 3.165 1.00 0.00 H new ATOM 0 HA PHE A 211 -4.016 8.816 3.022 1.00 0.00 H new ATOM 0 HB2 PHE A 211 -6.045 10.394 4.653 1.00 0.00 H new ATOM 0 HB3 PHE A 211 -4.469 10.972 4.147 1.00 0.00 H new ATOM 0 HD1 PHE A 211 -4.029 11.491 1.774 1.00 0.00 H new ATOM 0 HD2 PHE A 211 -7.891 10.264 3.090 1.00 0.00 H new ATOM 0 HE1 PHE A 211 -5.005 12.311 -0.326 1.00 0.00 H new ATOM 0 HE2 PHE A 211 -8.869 11.082 0.990 1.00 0.00 H new ATOM 0 HZ PHE A 211 -7.426 12.104 -0.724 1.00 0.00 H new