USER MOD reduce.3.24.130724 H: found=0, std=0, add=535, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 535 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 157 MET CE :methyl 152:sc= -1.1 (180deg=-2.25!) USER MOD Set 1.2: A 222 SER OG : rot 160:sc= 0 USER MOD Set 2.1: A 201 HIS : no HD1:sc= -0.327 X(o=-0.62,f=-0.8) USER MOD Set 2.2: A 205 GLN : amide:sc= -0.289 X(o=-0.62,f=-0.44) USER MOD Set 3.1: A 162 GLN :FLIP amide:sc= -1.37 F(o=-2.3,f=-1.6) USER MOD Set 3.2: A 217 MET CE :methyl 148:sc= -0.191 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 ASN : amide:sc= -2.98! X(o=-3!,f=-2.6) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc=-0.00285 K(o=-0.0029,f=-1.2) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 176 ASN : amide:sc= -0.0228 X(o=-0.023,f=0) USER MOD Single : A 180 CYS SG : rot 180:sc= -0.0376 USER MOD Single : A 181 THR OG1 : rot 180:sc=-0.00795 USER MOD Single : A 190 SER OG : rot 153:sc= -0.822 USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 193 CYS SG : rot 3:sc= -0.262 USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 198 TYR OH : rot -140:sc= -0.281 USER MOD Single : A 199 SER OG : rot 44:sc= 0.485 USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 209 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 212 HIS : no HE2:sc= -1.3! C(o=-1.3!,f=-10!) USER MOD Single : A 214 SER OG : rot 170:sc= 0 USER MOD Single : A 215 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 221 SER OG : rot 180:sc= 0 USER MOD Single : A 223 SER OG : rot -140:sc= -0.919 USER MOD Single : A 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 217 N LYS A 152 6.325 2.156 2.693 1.00 0.00 N ATOM 218 CA LYS A 152 4.916 2.519 2.602 1.00 0.00 C ATOM 219 C LYS A 152 4.251 1.826 1.417 1.00 0.00 C ATOM 220 O LYS A 152 4.924 1.397 0.478 1.00 0.00 O ATOM 221 CB LYS A 152 4.767 4.036 2.468 1.00 0.00 C ATOM 222 CG LYS A 152 3.327 4.494 2.312 1.00 0.00 C ATOM 223 CD LYS A 152 3.219 6.010 2.327 1.00 0.00 C ATOM 224 CE LYS A 152 3.042 6.542 3.740 1.00 0.00 C ATOM 225 NZ LYS A 152 3.260 8.014 3.810 1.00 0.00 N ATOM 0 HA LYS A 152 4.422 2.191 3.516 1.00 0.00 H new ATOM 0 HB2 LYS A 152 5.198 4.514 3.347 1.00 0.00 H new ATOM 0 HB3 LYS A 152 5.343 4.375 1.607 1.00 0.00 H new ATOM 0 HG2 LYS A 152 2.921 4.109 1.377 1.00 0.00 H new ATOM 0 HG3 LYS A 152 2.722 4.077 3.118 1.00 0.00 H new ATOM 0 HD2 LYS A 152 4.115 6.444 1.883 1.00 0.00 H new ATOM 0 HD3 LYS A 152 2.375 6.322 1.711 1.00 0.00 H new ATOM 0 HE2 LYS A 152 2.038 6.306 4.094 1.00 0.00 H new ATOM 0 HE3 LYS A 152 3.742 6.039 4.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 3.130 8.338 4.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 4.226 8.237 3.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 2.576 8.496 3.193 1.00 0.00 H new ATOM 239 N LEU A 153 2.928 1.720 1.466 1.00 0.00 N ATOM 240 CA LEU A 153 2.172 1.080 0.395 1.00 0.00 C ATOM 241 C LEU A 153 1.057 1.994 -0.105 1.00 0.00 C ATOM 242 O LEU A 153 0.187 2.407 0.662 1.00 0.00 O ATOM 243 CB LEU A 153 1.581 -0.244 0.883 1.00 0.00 C ATOM 244 CG LEU A 153 2.589 -1.339 1.234 1.00 0.00 C ATOM 245 CD1 LEU A 153 1.922 -2.437 2.048 1.00 0.00 C ATOM 246 CD2 LEU A 153 3.214 -1.914 -0.029 1.00 0.00 C ATOM 0 H LEU A 153 2.356 2.069 2.236 1.00 0.00 H new ATOM 0 HA LEU A 153 2.854 0.884 -0.432 1.00 0.00 H new ATOM 0 HB2 LEU A 153 0.971 -0.044 1.764 1.00 0.00 H new ATOM 0 HB3 LEU A 153 0.912 -0.627 0.112 1.00 0.00 H new ATOM 0 HG LEU A 153 3.381 -0.897 1.838 1.00 0.00 H new ATOM 0 HD11 LEU A 153 2.654 -3.208 2.289 1.00 0.00 H new ATOM 0 HD12 LEU A 153 1.523 -2.015 2.970 1.00 0.00 H new ATOM 0 HD13 LEU A 153 1.110 -2.877 1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 153 3.929 -2.692 0.240 1.00 0.00 H new ATOM 0 HD22 LEU A 153 2.434 -2.341 -0.659 1.00 0.00 H new ATOM 0 HD23 LEU A 153 3.728 -1.122 -0.574 1.00 0.00 H new ATOM 258 N PHE A 154 1.088 2.304 -1.397 1.00 0.00 N ATOM 259 CA PHE A 154 0.080 3.167 -2.000 1.00 0.00 C ATOM 260 C PHE A 154 -1.037 2.340 -2.630 1.00 0.00 C ATOM 261 O PHE A 154 -0.784 1.448 -3.440 1.00 0.00 O ATOM 262 CB PHE A 154 0.718 4.071 -3.057 1.00 0.00 C ATOM 263 CG PHE A 154 -0.280 4.867 -3.848 1.00 0.00 C ATOM 264 CD1 PHE A 154 -0.916 5.962 -3.285 1.00 0.00 C ATOM 265 CD2 PHE A 154 -0.584 4.519 -5.154 1.00 0.00 C ATOM 266 CE1 PHE A 154 -1.836 6.695 -4.011 1.00 0.00 C ATOM 267 CE2 PHE A 154 -1.502 5.249 -5.885 1.00 0.00 C ATOM 268 CZ PHE A 154 -2.128 6.339 -5.313 1.00 0.00 C ATOM 0 H PHE A 154 1.800 1.970 -2.046 1.00 0.00 H new ATOM 0 HA PHE A 154 -0.350 3.787 -1.213 1.00 0.00 H new ATOM 0 HB2 PHE A 154 1.411 4.756 -2.567 1.00 0.00 H new ATOM 0 HB3 PHE A 154 1.305 3.458 -3.741 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -0.690 6.246 -2.268 1.00 0.00 H new ATOM 0 HD2 PHE A 154 -0.098 3.667 -5.606 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -2.326 7.545 -3.560 1.00 0.00 H new ATOM 0 HE2 PHE A 154 -1.730 4.967 -6.902 1.00 0.00 H new ATOM 0 HZ PHE A 154 -2.845 6.912 -5.883 1.00 0.00 H new ATOM 278 N VAL A 155 -2.275 2.644 -2.253 1.00 0.00 N ATOM 279 CA VAL A 155 -3.432 1.931 -2.780 1.00 0.00 C ATOM 280 C VAL A 155 -4.310 2.852 -3.620 1.00 0.00 C ATOM 281 O VAL A 155 -4.613 3.974 -3.218 1.00 0.00 O ATOM 282 CB VAL A 155 -4.281 1.323 -1.648 1.00 0.00 C ATOM 283 CG1 VAL A 155 -5.478 0.577 -2.218 1.00 0.00 C ATOM 284 CG2 VAL A 155 -3.433 0.404 -0.781 1.00 0.00 C ATOM 0 H VAL A 155 -2.502 3.380 -1.584 1.00 0.00 H new ATOM 0 HA VAL A 155 -3.048 1.127 -3.408 1.00 0.00 H new ATOM 0 HB VAL A 155 -4.654 2.134 -1.022 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -6.065 0.155 -1.403 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -6.097 1.267 -2.792 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -5.130 -0.226 -2.868 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -4.049 -0.017 0.014 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -3.029 -0.403 -1.393 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -2.613 0.972 -0.342 1.00 0.00 H new ATOM 294 N GLY A 156 -4.716 2.368 -4.790 1.00 0.00 N ATOM 295 CA GLY A 156 -5.556 3.161 -5.669 1.00 0.00 C ATOM 296 C GLY A 156 -6.790 2.408 -6.127 1.00 0.00 C ATOM 297 O GLY A 156 -7.200 1.434 -5.497 1.00 0.00 O ATOM 0 H GLY A 156 -4.478 1.442 -5.145 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.861 4.071 -5.152 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.977 3.468 -6.540 1.00 0.00 H new ATOM 301 N MET A 157 -7.384 2.861 -7.226 1.00 0.00 N ATOM 302 CA MET A 157 -8.578 2.224 -7.767 1.00 0.00 C ATOM 303 C MET A 157 -9.546 1.847 -6.650 1.00 0.00 C ATOM 304 O MET A 157 -10.164 0.781 -6.683 1.00 0.00 O ATOM 305 CB MET A 157 -8.198 0.978 -8.570 1.00 0.00 C ATOM 306 CG MET A 157 -7.377 1.283 -9.812 1.00 0.00 C ATOM 307 SD MET A 157 -7.354 -0.087 -10.984 1.00 0.00 S ATOM 308 CE MET A 157 -6.906 0.766 -12.494 1.00 0.00 C ATOM 0 H MET A 157 -7.058 3.667 -7.759 1.00 0.00 H new ATOM 0 HA MET A 157 -9.072 2.937 -8.427 1.00 0.00 H new ATOM 0 HB2 MET A 157 -7.634 0.301 -7.929 1.00 0.00 H new ATOM 0 HB3 MET A 157 -9.107 0.454 -8.865 1.00 0.00 H new ATOM 0 HG2 MET A 157 -7.782 2.168 -10.302 1.00 0.00 H new ATOM 0 HG3 MET A 157 -6.355 1.521 -9.518 1.00 0.00 H new ATOM 0 HE1 MET A 157 -6.380 0.079 -13.157 1.00 0.00 H new ATOM 0 HE2 MET A 157 -7.807 1.129 -12.988 1.00 0.00 H new ATOM 0 HE3 MET A 157 -6.257 1.609 -12.257 1.00 0.00 H new ATOM 318 N LEU A 158 -9.675 2.726 -5.663 1.00 0.00 N ATOM 319 CA LEU A 158 -10.568 2.486 -4.535 1.00 0.00 C ATOM 320 C LEU A 158 -11.923 3.148 -4.762 1.00 0.00 C ATOM 321 O LEU A 158 -12.054 4.046 -5.593 1.00 0.00 O ATOM 322 CB LEU A 158 -9.942 3.010 -3.242 1.00 0.00 C ATOM 323 CG LEU A 158 -8.848 2.139 -2.623 1.00 0.00 C ATOM 324 CD1 LEU A 158 -8.183 2.860 -1.462 1.00 0.00 C ATOM 325 CD2 LEU A 158 -9.423 0.806 -2.166 1.00 0.00 C ATOM 0 H LEU A 158 -9.172 3.612 -5.621 1.00 0.00 H new ATOM 0 HA LEU A 158 -10.720 1.410 -4.447 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -9.524 3.997 -3.439 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -10.735 3.140 -2.505 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.092 1.945 -3.384 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -7.408 2.224 -1.035 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -7.736 3.788 -1.818 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.928 3.086 -0.699 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -8.631 0.199 -1.728 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -10.200 0.981 -1.422 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -9.851 0.282 -3.021 1.00 0.00 H new ATOM 337 N ASN A 159 -12.928 2.699 -4.017 1.00 0.00 N ATOM 338 CA ASN A 159 -14.273 3.249 -4.137 1.00 0.00 C ATOM 339 C ASN A 159 -14.554 4.247 -3.017 1.00 0.00 C ATOM 340 O ASN A 159 -13.822 4.311 -2.029 1.00 0.00 O ATOM 341 CB ASN A 159 -15.311 2.126 -4.107 1.00 0.00 C ATOM 342 CG ASN A 159 -15.118 1.130 -5.234 1.00 0.00 C ATOM 343 OD1 ASN A 159 -14.469 1.428 -6.236 1.00 0.00 O ATOM 344 ND2 ASN A 159 -15.683 -0.061 -5.075 1.00 0.00 N ATOM 0 H ASN A 159 -12.836 1.956 -3.324 1.00 0.00 H new ATOM 0 HA ASN A 159 -14.341 3.771 -5.091 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -15.251 1.605 -3.151 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -16.310 2.557 -4.173 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -15.587 -0.772 -5.800 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -16.213 -0.265 -4.227 1.00 0.00 H new ATOM 351 N LYS A 160 -15.621 5.023 -3.178 1.00 0.00 N ATOM 352 CA LYS A 160 -16.001 6.017 -2.181 1.00 0.00 C ATOM 353 C LYS A 160 -16.944 5.413 -1.144 1.00 0.00 C ATOM 354 O LYS A 160 -17.910 6.051 -0.727 1.00 0.00 O ATOM 355 CB LYS A 160 -16.669 7.217 -2.856 1.00 0.00 C ATOM 356 CG LYS A 160 -15.707 8.079 -3.653 1.00 0.00 C ATOM 357 CD LYS A 160 -16.416 8.811 -4.780 1.00 0.00 C ATOM 358 CE LYS A 160 -15.428 9.524 -5.691 1.00 0.00 C ATOM 359 NZ LYS A 160 -16.080 10.024 -6.933 1.00 0.00 N ATOM 0 H LYS A 160 -16.238 4.983 -3.989 1.00 0.00 H new ATOM 0 HA LYS A 160 -15.096 6.351 -1.673 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -17.457 6.859 -3.519 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -17.148 7.831 -2.094 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -15.231 8.802 -2.991 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -14.914 7.455 -4.065 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -17.003 8.102 -5.363 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -17.115 9.535 -4.362 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -14.978 10.360 -5.155 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -14.620 8.842 -5.954 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -15.374 10.504 -7.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -16.488 9.224 -7.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -16.835 10.694 -6.683 1.00 0.00 H new ATOM 373 N GLN A 161 -16.654 4.183 -0.732 1.00 0.00 N ATOM 374 CA GLN A 161 -17.477 3.496 0.256 1.00 0.00 C ATOM 375 C GLN A 161 -16.623 2.981 1.411 1.00 0.00 C ATOM 376 O GLN A 161 -16.906 3.262 2.576 1.00 0.00 O ATOM 377 CB GLN A 161 -18.229 2.334 -0.394 1.00 0.00 C ATOM 378 CG GLN A 161 -18.987 2.728 -1.652 1.00 0.00 C ATOM 379 CD GLN A 161 -20.394 3.208 -1.359 1.00 0.00 C ATOM 380 OE1 GLN A 161 -20.715 3.574 -0.228 1.00 0.00 O ATOM 381 NE2 GLN A 161 -21.244 3.210 -2.380 1.00 0.00 N ATOM 0 H GLN A 161 -15.856 3.643 -1.067 1.00 0.00 H new ATOM 0 HA GLN A 161 -18.199 4.211 0.651 1.00 0.00 H new ATOM 0 HB2 GLN A 161 -17.519 1.545 -0.640 1.00 0.00 H new ATOM 0 HB3 GLN A 161 -18.931 1.917 0.328 1.00 0.00 H new ATOM 0 HG2 GLN A 161 -18.439 3.515 -2.170 1.00 0.00 H new ATOM 0 HG3 GLN A 161 -19.032 1.873 -2.327 1.00 0.00 H new ATOM 0 HE21 GLN A 161 -20.936 2.898 -3.301 1.00 0.00 H new ATOM 0 HE22 GLN A 161 -22.205 3.523 -2.243 1.00 0.00 H new ATOM 390 N GLN A 162 -15.580 2.228 1.080 1.00 0.00 N ATOM 391 CA GLN A 162 -14.687 1.674 2.090 1.00 0.00 C ATOM 392 C GLN A 162 -14.128 2.775 2.986 1.00 0.00 C ATOM 393 O GLN A 162 -13.941 3.910 2.547 1.00 0.00 O ATOM 394 CB GLN A 162 -13.540 0.911 1.424 1.00 0.00 C ATOM 395 CG GLN A 162 -13.888 -0.527 1.075 1.00 0.00 C ATOM 396 CD GLN A 162 -12.678 -1.439 1.084 1.00 0.00 C ATOM 397 OE1 GLN A 162 -11.922 -1.432 -0.008 1.00 0.00 O flip ATOM 398 NE2 GLN A 162 -12.424 -2.144 2.061 1.00 0.00 N flip ATOM 0 H GLN A 162 -15.332 1.987 0.120 1.00 0.00 H new ATOM 0 HA GLN A 162 -15.262 0.985 2.708 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -13.245 1.436 0.515 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -12.677 0.916 2.089 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -14.625 -0.901 1.785 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -14.352 -0.555 0.089 1.00 0.00 H new ATOM 0 HE21 GLN A 162 -13.032 -2.119 2.880 1.00 0.00 H new ATOM 0 HE22 GLN A 162 -11.606 -2.753 2.051 1.00 0.00 H new ATOM 407 N SER A 163 -13.865 2.432 4.242 1.00 0.00 N ATOM 408 CA SER A 163 -13.332 3.393 5.201 1.00 0.00 C ATOM 409 C SER A 163 -12.168 2.791 5.983 1.00 0.00 C ATOM 410 O SER A 163 -11.836 1.618 5.816 1.00 0.00 O ATOM 411 CB SER A 163 -14.430 3.845 6.166 1.00 0.00 C ATOM 412 OG SER A 163 -14.164 5.144 6.668 1.00 0.00 O ATOM 0 H SER A 163 -14.012 1.496 4.620 1.00 0.00 H new ATOM 0 HA SER A 163 -12.967 4.258 4.647 1.00 0.00 H new ATOM 0 HB2 SER A 163 -15.393 3.839 5.655 1.00 0.00 H new ATOM 0 HB3 SER A 163 -14.504 3.140 6.994 1.00 0.00 H new ATOM 0 HG SER A 163 -14.881 5.411 7.281 1.00 0.00 H new ATOM 418 N GLU A 164 -11.554 3.604 6.837 1.00 0.00 N ATOM 419 CA GLU A 164 -10.427 3.153 7.645 1.00 0.00 C ATOM 420 C GLU A 164 -10.739 1.818 8.316 1.00 0.00 C ATOM 421 O GLU A 164 -9.897 0.921 8.360 1.00 0.00 O ATOM 422 CB GLU A 164 -10.078 4.200 8.704 1.00 0.00 C ATOM 423 CG GLU A 164 -9.350 5.411 8.145 1.00 0.00 C ATOM 424 CD GLU A 164 -9.541 6.651 8.998 1.00 0.00 C ATOM 425 OE1 GLU A 164 -9.378 6.552 10.232 1.00 0.00 O ATOM 426 OE2 GLU A 164 -9.853 7.719 8.432 1.00 0.00 O ATOM 0 H GLU A 164 -11.818 4.578 6.987 1.00 0.00 H new ATOM 0 HA GLU A 164 -9.571 3.017 6.984 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -10.995 4.531 9.192 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -9.458 3.736 9.471 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -8.286 5.187 8.069 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -9.707 5.611 7.135 1.00 0.00 H new ATOM 433 N ASP A 165 -11.954 1.696 8.839 1.00 0.00 N ATOM 434 CA ASP A 165 -12.379 0.472 9.508 1.00 0.00 C ATOM 435 C ASP A 165 -12.100 -0.749 8.637 1.00 0.00 C ATOM 436 O ASP A 165 -11.392 -1.669 9.048 1.00 0.00 O ATOM 437 CB ASP A 165 -13.868 0.541 9.849 1.00 0.00 C ATOM 438 CG ASP A 165 -14.658 1.340 8.830 1.00 0.00 C ATOM 439 OD1 ASP A 165 -15.043 0.761 7.792 1.00 0.00 O ATOM 440 OD2 ASP A 165 -14.890 2.543 9.070 1.00 0.00 O ATOM 0 H ASP A 165 -12.662 2.430 8.813 1.00 0.00 H new ATOM 0 HA ASP A 165 -11.807 0.376 10.431 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -14.272 -0.470 9.907 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -13.992 0.990 10.834 1.00 0.00 H new ATOM 445 N ASP A 166 -12.662 -0.751 7.433 1.00 0.00 N ATOM 446 CA ASP A 166 -12.473 -1.859 6.504 1.00 0.00 C ATOM 447 C ASP A 166 -11.000 -2.025 6.147 1.00 0.00 C ATOM 448 O ASP A 166 -10.374 -3.025 6.500 1.00 0.00 O ATOM 449 CB ASP A 166 -13.295 -1.632 5.234 1.00 0.00 C ATOM 450 CG ASP A 166 -14.690 -1.117 5.531 1.00 0.00 C ATOM 451 OD1 ASP A 166 -15.519 -1.906 6.030 1.00 0.00 O ATOM 452 OD2 ASP A 166 -14.952 0.075 5.265 1.00 0.00 O ATOM 0 H ASP A 166 -13.252 0.002 7.078 1.00 0.00 H new ATOM 0 HA ASP A 166 -12.815 -2.772 6.992 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -12.777 -0.920 4.592 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -13.367 -2.567 4.679 1.00 0.00 H new ATOM 457 N VAL A 167 -10.451 -1.038 5.446 1.00 0.00 N ATOM 458 CA VAL A 167 -9.050 -1.075 5.041 1.00 0.00 C ATOM 459 C VAL A 167 -8.165 -1.589 6.172 1.00 0.00 C ATOM 460 O VAL A 167 -7.178 -2.284 5.933 1.00 0.00 O ATOM 461 CB VAL A 167 -8.554 0.317 4.608 1.00 0.00 C ATOM 462 CG1 VAL A 167 -7.100 0.253 4.166 1.00 0.00 C ATOM 463 CG2 VAL A 167 -9.433 0.874 3.498 1.00 0.00 C ATOM 0 H VAL A 167 -10.955 -0.203 5.147 1.00 0.00 H new ATOM 0 HA VAL A 167 -8.983 -1.756 4.193 1.00 0.00 H new ATOM 0 HB VAL A 167 -8.619 0.989 5.464 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -6.768 1.246 3.864 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -6.484 -0.100 4.993 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -7.005 -0.433 3.324 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -9.068 1.858 3.204 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -9.402 0.204 2.639 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -10.459 0.959 3.855 1.00 0.00 H new ATOM 473 N ARG A 168 -8.526 -1.241 7.403 1.00 0.00 N ATOM 474 CA ARG A 168 -7.764 -1.666 8.571 1.00 0.00 C ATOM 475 C ARG A 168 -7.799 -3.184 8.720 1.00 0.00 C ATOM 476 O ARG A 168 -6.762 -3.846 8.676 1.00 0.00 O ATOM 477 CB ARG A 168 -8.317 -1.006 9.835 1.00 0.00 C ATOM 478 CG ARG A 168 -7.627 -1.459 11.111 1.00 0.00 C ATOM 479 CD ARG A 168 -8.418 -1.057 12.346 1.00 0.00 C ATOM 480 NE ARG A 168 -8.087 0.294 12.792 1.00 0.00 N ATOM 481 CZ ARG A 168 -8.753 0.937 13.744 1.00 0.00 C ATOM 482 NH1 ARG A 168 -9.782 0.357 14.346 1.00 0.00 N ATOM 483 NH2 ARG A 168 -8.391 2.165 14.095 1.00 0.00 N ATOM 0 H ARG A 168 -9.341 -0.666 7.617 1.00 0.00 H new ATOM 0 HA ARG A 168 -6.729 -1.356 8.431 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -8.218 0.076 9.743 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -9.382 -1.223 9.912 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -7.503 -2.542 11.094 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -6.629 -1.024 11.160 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -9.484 -1.116 12.129 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -8.217 -1.764 13.151 1.00 0.00 H new ATOM 0 HE ARG A 168 -7.301 0.769 12.348 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -10.064 -0.586 14.078 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -10.291 0.854 15.077 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -7.601 2.615 13.633 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -8.903 2.658 14.826 1.00 0.00 H new ATOM 497 N ARG A 169 -8.999 -3.729 8.896 1.00 0.00 N ATOM 498 CA ARG A 169 -9.169 -5.168 9.053 1.00 0.00 C ATOM 499 C ARG A 169 -8.724 -5.909 7.795 1.00 0.00 C ATOM 500 O ARG A 169 -7.921 -6.840 7.861 1.00 0.00 O ATOM 501 CB ARG A 169 -10.629 -5.500 9.364 1.00 0.00 C ATOM 502 CG ARG A 169 -11.611 -4.933 8.352 1.00 0.00 C ATOM 503 CD ARG A 169 -13.050 -5.115 8.810 1.00 0.00 C ATOM 504 NE ARG A 169 -14.003 -4.852 7.735 1.00 0.00 N ATOM 505 CZ ARG A 169 -15.313 -5.045 7.851 1.00 0.00 C ATOM 506 NH1 ARG A 169 -15.821 -5.499 8.988 1.00 0.00 N ATOM 507 NH2 ARG A 169 -16.116 -4.784 6.828 1.00 0.00 N ATOM 0 H ARG A 169 -9.867 -3.195 8.933 1.00 0.00 H new ATOM 0 HA ARG A 169 -8.545 -5.493 9.885 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -10.746 -6.583 9.404 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -10.877 -5.116 10.353 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -11.408 -3.873 8.200 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -11.469 -5.426 7.390 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -13.188 -6.132 9.176 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -13.252 -4.445 9.646 1.00 0.00 H new ATOM 0 HE ARG A 169 -13.644 -4.501 6.847 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -15.206 -5.701 9.776 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -16.827 -5.646 9.074 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -15.728 -4.435 5.951 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -17.121 -4.932 6.918 1.00 0.00 H new ATOM 521 N LEU A 170 -9.253 -5.490 6.651 1.00 0.00 N ATOM 522 CA LEU A 170 -8.912 -6.113 5.377 1.00 0.00 C ATOM 523 C LEU A 170 -7.409 -6.351 5.273 1.00 0.00 C ATOM 524 O LEU A 170 -6.952 -7.494 5.232 1.00 0.00 O ATOM 525 CB LEU A 170 -9.383 -5.236 4.215 1.00 0.00 C ATOM 526 CG LEU A 170 -9.537 -5.937 2.865 1.00 0.00 C ATOM 527 CD1 LEU A 170 -10.854 -6.695 2.804 1.00 0.00 C ATOM 528 CD2 LEU A 170 -9.446 -4.930 1.728 1.00 0.00 C ATOM 0 H LEU A 170 -9.920 -4.721 6.579 1.00 0.00 H new ATOM 0 HA LEU A 170 -9.419 -7.077 5.325 1.00 0.00 H new ATOM 0 HB2 LEU A 170 -10.343 -4.795 4.485 1.00 0.00 H new ATOM 0 HB3 LEU A 170 -8.677 -4.414 4.097 1.00 0.00 H new ATOM 0 HG LEU A 170 -8.724 -6.654 2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 170 -10.946 -7.187 1.836 1.00 0.00 H new ATOM 0 HD12 LEU A 170 -10.880 -7.444 3.596 1.00 0.00 H new ATOM 0 HD13 LEU A 170 -11.681 -5.998 2.937 1.00 0.00 H new ATOM 0 HD21 LEU A 170 -9.558 -5.447 0.775 1.00 0.00 H new ATOM 0 HD22 LEU A 170 -10.238 -4.189 1.834 1.00 0.00 H new ATOM 0 HD23 LEU A 170 -8.477 -4.432 1.760 1.00 0.00 H new ATOM 540 N PHE A 171 -6.644 -5.265 5.232 1.00 0.00 N ATOM 541 CA PHE A 171 -5.192 -5.355 5.134 1.00 0.00 C ATOM 542 C PHE A 171 -4.627 -6.250 6.233 1.00 0.00 C ATOM 543 O PHE A 171 -4.138 -7.347 5.964 1.00 0.00 O ATOM 544 CB PHE A 171 -4.566 -3.962 5.222 1.00 0.00 C ATOM 545 CG PHE A 171 -4.621 -3.196 3.931 1.00 0.00 C ATOM 546 CD1 PHE A 171 -5.838 -2.823 3.384 1.00 0.00 C ATOM 547 CD2 PHE A 171 -3.457 -2.850 3.265 1.00 0.00 C ATOM 548 CE1 PHE A 171 -5.892 -2.119 2.196 1.00 0.00 C ATOM 549 CE2 PHE A 171 -3.504 -2.146 2.077 1.00 0.00 C ATOM 550 CZ PHE A 171 -4.724 -1.779 1.542 1.00 0.00 C ATOM 0 H PHE A 171 -7.006 -4.312 5.265 1.00 0.00 H new ATOM 0 HA PHE A 171 -4.945 -5.796 4.168 1.00 0.00 H new ATOM 0 HB2 PHE A 171 -5.078 -3.391 5.996 1.00 0.00 H new ATOM 0 HB3 PHE A 171 -3.526 -4.059 5.533 1.00 0.00 H new ATOM 0 HD1 PHE A 171 -6.755 -3.085 3.892 1.00 0.00 H new ATOM 0 HD2 PHE A 171 -2.501 -3.134 3.679 1.00 0.00 H new ATOM 0 HE1 PHE A 171 -6.847 -1.835 1.779 1.00 0.00 H new ATOM 0 HE2 PHE A 171 -2.589 -1.883 1.567 1.00 0.00 H new ATOM 0 HZ PHE A 171 -4.764 -1.227 0.614 1.00 0.00 H new ATOM 560 N GLU A 172 -4.698 -5.772 7.472 1.00 0.00 N ATOM 561 CA GLU A 172 -4.193 -6.528 8.611 1.00 0.00 C ATOM 562 C GLU A 172 -4.616 -7.991 8.525 1.00 0.00 C ATOM 563 O GLU A 172 -3.952 -8.874 9.067 1.00 0.00 O ATOM 564 CB GLU A 172 -4.696 -5.917 9.921 1.00 0.00 C ATOM 565 CG GLU A 172 -6.014 -6.502 10.398 1.00 0.00 C ATOM 566 CD GLU A 172 -6.485 -5.891 11.703 1.00 0.00 C ATOM 567 OE1 GLU A 172 -7.049 -4.777 11.669 1.00 0.00 O ATOM 568 OE2 GLU A 172 -6.291 -6.527 12.760 1.00 0.00 O ATOM 0 H GLU A 172 -5.100 -4.866 7.712 1.00 0.00 H new ATOM 0 HA GLU A 172 -3.104 -6.481 8.590 1.00 0.00 H new ATOM 0 HB2 GLU A 172 -3.942 -6.064 10.694 1.00 0.00 H new ATOM 0 HB3 GLU A 172 -4.812 -4.841 9.790 1.00 0.00 H new ATOM 0 HG2 GLU A 172 -6.774 -6.346 9.633 1.00 0.00 H new ATOM 0 HG3 GLU A 172 -5.905 -7.579 10.524 1.00 0.00 H new ATOM 575 N ALA A 173 -5.727 -8.240 7.839 1.00 0.00 N ATOM 576 CA ALA A 173 -6.238 -9.596 7.679 1.00 0.00 C ATOM 577 C ALA A 173 -5.126 -10.559 7.278 1.00 0.00 C ATOM 578 O ALA A 173 -5.248 -11.771 7.453 1.00 0.00 O ATOM 579 CB ALA A 173 -7.357 -9.620 6.648 1.00 0.00 C ATOM 0 H ALA A 173 -6.290 -7.521 7.385 1.00 0.00 H new ATOM 0 HA ALA A 173 -6.636 -9.923 8.640 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.729 -10.639 6.539 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -8.168 -8.971 6.977 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -6.976 -9.268 5.689 1.00 0.00 H new ATOM 585 N PHE A 174 -4.042 -10.012 6.739 1.00 0.00 N ATOM 586 CA PHE A 174 -2.908 -10.823 6.312 1.00 0.00 C ATOM 587 C PHE A 174 -1.663 -10.492 7.130 1.00 0.00 C ATOM 588 O PHE A 174 -1.246 -11.268 7.988 1.00 0.00 O ATOM 589 CB PHE A 174 -2.628 -10.603 4.824 1.00 0.00 C ATOM 590 CG PHE A 174 -3.791 -10.946 3.938 1.00 0.00 C ATOM 591 CD1 PHE A 174 -4.839 -10.055 3.772 1.00 0.00 C ATOM 592 CD2 PHE A 174 -3.837 -12.160 3.271 1.00 0.00 C ATOM 593 CE1 PHE A 174 -5.911 -10.368 2.957 1.00 0.00 C ATOM 594 CE2 PHE A 174 -4.905 -12.478 2.455 1.00 0.00 C ATOM 595 CZ PHE A 174 -5.945 -11.581 2.298 1.00 0.00 C ATOM 0 H PHE A 174 -3.925 -9.010 6.587 1.00 0.00 H new ATOM 0 HA PHE A 174 -3.161 -11.871 6.476 1.00 0.00 H new ATOM 0 HB2 PHE A 174 -2.355 -9.560 4.664 1.00 0.00 H new ATOM 0 HB3 PHE A 174 -1.768 -11.206 4.531 1.00 0.00 H new ATOM 0 HD1 PHE A 174 -4.818 -9.105 4.285 1.00 0.00 H new ATOM 0 HD2 PHE A 174 -3.028 -12.866 3.391 1.00 0.00 H new ATOM 0 HE1 PHE A 174 -6.721 -9.664 2.836 1.00 0.00 H new ATOM 0 HE2 PHE A 174 -4.928 -13.427 1.940 1.00 0.00 H new ATOM 0 HZ PHE A 174 -6.782 -11.828 1.662 1.00 0.00 H new ATOM 605 N GLY A 175 -1.073 -9.332 6.855 1.00 0.00 N ATOM 606 CA GLY A 175 0.118 -8.918 7.573 1.00 0.00 C ATOM 607 C GLY A 175 -0.145 -7.761 8.516 1.00 0.00 C ATOM 608 O GLY A 175 -0.986 -6.907 8.240 1.00 0.00 O ATOM 0 H GLY A 175 -1.399 -8.672 6.148 1.00 0.00 H new ATOM 0 HA2 GLY A 175 0.508 -9.763 8.140 1.00 0.00 H new ATOM 0 HA3 GLY A 175 0.888 -8.631 6.857 1.00 0.00 H new ATOM 612 N ASN A 176 0.574 -7.734 9.633 1.00 0.00 N ATOM 613 CA ASN A 176 0.412 -6.674 10.621 1.00 0.00 C ATOM 614 C ASN A 176 0.534 -5.300 9.970 1.00 0.00 C ATOM 615 O ASN A 176 1.128 -5.159 8.901 1.00 0.00 O ATOM 616 CB ASN A 176 1.455 -6.819 11.731 1.00 0.00 C ATOM 617 CG ASN A 176 0.990 -6.217 13.043 1.00 0.00 C ATOM 618 OD1 ASN A 176 1.544 -5.223 13.513 1.00 0.00 O ATOM 619 ND2 ASN A 176 -0.031 -6.818 13.641 1.00 0.00 N ATOM 0 H ASN A 176 1.275 -8.434 9.877 1.00 0.00 H new ATOM 0 HA ASN A 176 -0.584 -6.764 11.054 1.00 0.00 H new ATOM 0 HB2 ASN A 176 1.680 -7.875 11.879 1.00 0.00 H new ATOM 0 HB3 ASN A 176 2.381 -6.336 11.421 1.00 0.00 H new ATOM 0 HD21 ASN A 176 -0.387 -6.458 14.527 1.00 0.00 H new ATOM 0 HD22 ASN A 176 -0.460 -7.640 13.215 1.00 0.00 H new ATOM 626 N ILE A 177 -0.032 -4.290 10.622 1.00 0.00 N ATOM 627 CA ILE A 177 0.015 -2.927 10.108 1.00 0.00 C ATOM 628 C ILE A 177 0.662 -1.982 11.114 1.00 0.00 C ATOM 629 O ILE A 177 0.535 -2.166 12.324 1.00 0.00 O ATOM 630 CB ILE A 177 -1.393 -2.407 9.763 1.00 0.00 C ATOM 631 CG1 ILE A 177 -1.999 -3.227 8.622 1.00 0.00 C ATOM 632 CG2 ILE A 177 -1.336 -0.933 9.390 1.00 0.00 C ATOM 633 CD1 ILE A 177 -3.449 -2.898 8.345 1.00 0.00 C ATOM 0 H ILE A 177 -0.529 -4.390 11.507 1.00 0.00 H new ATOM 0 HA ILE A 177 0.616 -2.953 9.199 1.00 0.00 H new ATOM 0 HB ILE A 177 -2.029 -2.516 10.641 1.00 0.00 H new ATOM 0 HG12 ILE A 177 -1.417 -3.059 7.716 1.00 0.00 H new ATOM 0 HG13 ILE A 177 -1.915 -4.287 8.863 1.00 0.00 H new ATOM 0 HG21 ILE A 177 -2.339 -0.580 9.149 1.00 0.00 H new ATOM 0 HG22 ILE A 177 -0.942 -0.360 10.229 1.00 0.00 H new ATOM 0 HG23 ILE A 177 -0.687 -0.802 8.524 1.00 0.00 H new ATOM 0 HD11 ILE A 177 -3.812 -3.517 7.525 1.00 0.00 H new ATOM 0 HD12 ILE A 177 -4.043 -3.093 9.238 1.00 0.00 H new ATOM 0 HD13 ILE A 177 -3.538 -1.846 8.073 1.00 0.00 H new ATOM 645 N GLU A 178 1.354 -0.968 10.605 1.00 0.00 N ATOM 646 CA GLU A 178 2.020 0.008 11.460 1.00 0.00 C ATOM 647 C GLU A 178 1.220 1.305 11.531 1.00 0.00 C ATOM 648 O GLU A 178 1.017 1.863 12.609 1.00 0.00 O ATOM 649 CB GLU A 178 3.432 0.294 10.943 1.00 0.00 C ATOM 650 CG GLU A 178 4.347 -0.919 10.969 1.00 0.00 C ATOM 651 CD GLU A 178 4.800 -1.277 12.371 1.00 0.00 C ATOM 652 OE1 GLU A 178 4.081 -0.937 13.333 1.00 0.00 O ATOM 653 OE2 GLU A 178 5.876 -1.899 12.505 1.00 0.00 O ATOM 0 H GLU A 178 1.468 -0.801 9.605 1.00 0.00 H new ATOM 0 HA GLU A 178 2.087 -0.413 12.463 1.00 0.00 H new ATOM 0 HB2 GLU A 178 3.367 0.668 9.921 1.00 0.00 H new ATOM 0 HB3 GLU A 178 3.876 1.087 11.545 1.00 0.00 H new ATOM 0 HG2 GLU A 178 3.828 -1.771 10.530 1.00 0.00 H new ATOM 0 HG3 GLU A 178 5.221 -0.724 10.347 1.00 0.00 H new ATOM 660 N GLU A 179 0.769 1.780 10.374 1.00 0.00 N ATOM 661 CA GLU A 179 -0.007 3.012 10.305 1.00 0.00 C ATOM 662 C GLU A 179 -0.920 3.012 9.082 1.00 0.00 C ATOM 663 O GLU A 179 -0.614 2.387 8.066 1.00 0.00 O ATOM 664 CB GLU A 179 0.924 4.226 10.259 1.00 0.00 C ATOM 665 CG GLU A 179 1.287 4.766 11.632 1.00 0.00 C ATOM 666 CD GLU A 179 0.108 5.406 12.338 1.00 0.00 C ATOM 667 OE1 GLU A 179 -0.383 6.445 11.848 1.00 0.00 O ATOM 668 OE2 GLU A 179 -0.324 4.870 13.380 1.00 0.00 O ATOM 0 H GLU A 179 0.928 1.330 9.472 1.00 0.00 H new ATOM 0 HA GLU A 179 -0.626 3.071 11.200 1.00 0.00 H new ATOM 0 HB2 GLU A 179 1.838 3.953 9.732 1.00 0.00 H new ATOM 0 HB3 GLU A 179 0.447 5.017 9.681 1.00 0.00 H new ATOM 0 HG2 GLU A 179 1.676 3.954 12.246 1.00 0.00 H new ATOM 0 HG3 GLU A 179 2.086 5.500 11.530 1.00 0.00 H new ATOM 675 N CYS A 180 -2.042 3.715 9.189 1.00 0.00 N ATOM 676 CA CYS A 180 -3.001 3.796 8.093 1.00 0.00 C ATOM 677 C CYS A 180 -3.532 5.217 7.939 1.00 0.00 C ATOM 678 O CYS A 180 -3.738 5.926 8.925 1.00 0.00 O ATOM 679 CB CYS A 180 -4.161 2.828 8.331 1.00 0.00 C ATOM 680 SG CYS A 180 -5.416 2.844 7.029 1.00 0.00 S ATOM 0 H CYS A 180 -2.310 4.237 10.023 1.00 0.00 H new ATOM 0 HA CYS A 180 -2.488 3.518 7.172 1.00 0.00 H new ATOM 0 HB2 CYS A 180 -3.763 1.817 8.425 1.00 0.00 H new ATOM 0 HB3 CYS A 180 -4.636 3.073 9.281 1.00 0.00 H new ATOM 0 HG CYS A 180 -6.354 1.992 7.319 1.00 0.00 H new ATOM 686 N THR A 181 -3.752 5.630 6.694 1.00 0.00 N ATOM 687 CA THR A 181 -4.256 6.967 6.410 1.00 0.00 C ATOM 688 C THR A 181 -5.045 6.991 5.106 1.00 0.00 C ATOM 689 O THR A 181 -4.653 6.367 4.120 1.00 0.00 O ATOM 690 CB THR A 181 -3.110 7.992 6.322 1.00 0.00 C ATOM 691 OG1 THR A 181 -2.411 8.055 7.570 1.00 0.00 O ATOM 692 CG2 THR A 181 -3.643 9.371 5.964 1.00 0.00 C ATOM 0 H THR A 181 -3.589 5.057 5.866 1.00 0.00 H new ATOM 0 HA THR A 181 -4.914 7.239 7.235 1.00 0.00 H new ATOM 0 HB THR A 181 -2.425 7.670 5.538 1.00 0.00 H new ATOM 0 HG1 THR A 181 -1.683 8.708 7.505 1.00 0.00 H new ATOM 0 HG21 THR A 181 -2.815 10.078 5.908 1.00 0.00 H new ATOM 0 HG22 THR A 181 -4.148 9.327 4.999 1.00 0.00 H new ATOM 0 HG23 THR A 181 -4.348 9.698 6.728 1.00 0.00 H new ATOM 700 N ILE A 182 -6.159 7.716 5.108 1.00 0.00 N ATOM 701 CA ILE A 182 -7.002 7.823 3.924 1.00 0.00 C ATOM 702 C ILE A 182 -6.640 9.054 3.100 1.00 0.00 C ATOM 703 O ILE A 182 -6.581 10.168 3.621 1.00 0.00 O ATOM 704 CB ILE A 182 -8.494 7.892 4.299 1.00 0.00 C ATOM 705 CG1 ILE A 182 -8.919 6.614 5.026 1.00 0.00 C ATOM 706 CG2 ILE A 182 -9.344 8.108 3.056 1.00 0.00 C ATOM 707 CD1 ILE A 182 -9.023 5.408 4.118 1.00 0.00 C ATOM 0 H ILE A 182 -6.498 8.238 5.916 1.00 0.00 H new ATOM 0 HA ILE A 182 -6.826 6.926 3.330 1.00 0.00 H new ATOM 0 HB ILE A 182 -8.646 8.737 4.970 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -8.202 6.401 5.819 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -9.883 6.782 5.505 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -10.396 8.154 3.338 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -9.055 9.043 2.576 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -9.191 7.281 2.362 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -9.328 4.539 4.701 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -9.762 5.601 3.340 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -8.054 5.214 3.658 1.00 0.00 H new ATOM 719 N LEU A 183 -6.400 8.846 1.810 1.00 0.00 N ATOM 720 CA LEU A 183 -6.045 9.939 0.911 1.00 0.00 C ATOM 721 C LEU A 183 -7.292 10.554 0.283 1.00 0.00 C ATOM 722 O LEU A 183 -7.893 9.975 -0.622 1.00 0.00 O ATOM 723 CB LEU A 183 -5.102 9.439 -0.184 1.00 0.00 C ATOM 724 CG LEU A 183 -3.662 9.158 0.247 1.00 0.00 C ATOM 725 CD1 LEU A 183 -2.915 8.407 -0.844 1.00 0.00 C ATOM 726 CD2 LEU A 183 -2.945 10.455 0.591 1.00 0.00 C ATOM 0 H LEU A 183 -6.445 7.930 1.363 1.00 0.00 H new ATOM 0 HA LEU A 183 -5.538 10.707 1.495 1.00 0.00 H new ATOM 0 HB2 LEU A 183 -5.519 8.524 -0.605 1.00 0.00 H new ATOM 0 HB3 LEU A 183 -5.083 10.178 -0.985 1.00 0.00 H new ATOM 0 HG LEU A 183 -3.686 8.532 1.139 1.00 0.00 H new ATOM 0 HD11 LEU A 183 -1.892 8.216 -0.519 1.00 0.00 H new ATOM 0 HD12 LEU A 183 -3.416 7.459 -1.042 1.00 0.00 H new ATOM 0 HD13 LEU A 183 -2.901 9.007 -1.754 1.00 0.00 H new ATOM 0 HD21 LEU A 183 -1.922 10.235 0.896 1.00 0.00 H new ATOM 0 HD22 LEU A 183 -2.932 11.106 -0.283 1.00 0.00 H new ATOM 0 HD23 LEU A 183 -3.467 10.954 1.407 1.00 0.00 H new ATOM 816 N SER A 190 -13.872 10.727 -0.663 1.00 0.00 N ATOM 817 CA SER A 190 -12.623 9.986 -0.799 1.00 0.00 C ATOM 818 C SER A 190 -12.115 10.038 -2.236 1.00 0.00 C ATOM 819 O SER A 190 -12.896 9.982 -3.186 1.00 0.00 O ATOM 820 CB SER A 190 -12.818 8.532 -0.367 1.00 0.00 C ATOM 821 OG SER A 190 -13.332 7.749 -1.430 1.00 0.00 O ATOM 0 HA SER A 190 -11.880 10.453 -0.152 1.00 0.00 H new ATOM 0 HB2 SER A 190 -11.867 8.118 -0.033 1.00 0.00 H new ATOM 0 HB3 SER A 190 -13.500 8.490 0.482 1.00 0.00 H new ATOM 0 HG SER A 190 -13.056 6.816 -1.312 1.00 0.00 H new ATOM 827 N LYS A 191 -10.799 10.146 -2.388 1.00 0.00 N ATOM 828 CA LYS A 191 -10.183 10.204 -3.708 1.00 0.00 C ATOM 829 C LYS A 191 -9.732 8.819 -4.160 1.00 0.00 C ATOM 830 O LYS A 191 -8.666 8.665 -4.755 1.00 0.00 O ATOM 831 CB LYS A 191 -8.989 11.161 -3.695 1.00 0.00 C ATOM 832 CG LYS A 191 -9.334 12.557 -3.204 1.00 0.00 C ATOM 833 CD LYS A 191 -9.778 13.456 -4.346 1.00 0.00 C ATOM 834 CE LYS A 191 -9.446 14.914 -4.068 1.00 0.00 C ATOM 835 NZ LYS A 191 -9.675 15.772 -5.263 1.00 0.00 N ATOM 0 H LYS A 191 -10.138 10.195 -1.612 1.00 0.00 H new ATOM 0 HA LYS A 191 -10.929 10.572 -4.413 1.00 0.00 H new ATOM 0 HB2 LYS A 191 -8.207 10.744 -3.060 1.00 0.00 H new ATOM 0 HB3 LYS A 191 -8.578 11.230 -4.702 1.00 0.00 H new ATOM 0 HG2 LYS A 191 -10.127 12.496 -2.459 1.00 0.00 H new ATOM 0 HG3 LYS A 191 -8.466 12.995 -2.711 1.00 0.00 H new ATOM 0 HD2 LYS A 191 -9.292 13.141 -5.269 1.00 0.00 H new ATOM 0 HD3 LYS A 191 -10.852 13.349 -4.499 1.00 0.00 H new ATOM 0 HE2 LYS A 191 -10.057 15.274 -3.240 1.00 0.00 H new ATOM 0 HE3 LYS A 191 -8.405 14.996 -3.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 191 -9.437 16.758 -5.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 191 -9.074 15.444 -6.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 191 -10.674 15.714 -5.546 1.00 0.00 H new ATOM 849 N GLY A 192 -10.552 7.812 -3.874 1.00 0.00 N ATOM 850 CA GLY A 192 -10.221 6.452 -4.260 1.00 0.00 C ATOM 851 C GLY A 192 -8.747 6.143 -4.084 1.00 0.00 C ATOM 852 O GLY A 192 -8.130 5.516 -4.947 1.00 0.00 O ATOM 0 H GLY A 192 -11.440 7.914 -3.382 1.00 0.00 H new ATOM 0 HA2 GLY A 192 -10.809 5.755 -3.663 1.00 0.00 H new ATOM 0 HA3 GLY A 192 -10.500 6.295 -5.302 1.00 0.00 H new ATOM 856 N CYS A 193 -8.181 6.585 -2.967 1.00 0.00 N ATOM 857 CA CYS A 193 -6.769 6.354 -2.682 1.00 0.00 C ATOM 858 C CYS A 193 -6.506 6.378 -1.180 1.00 0.00 C ATOM 859 O CYS A 193 -7.196 7.067 -0.430 1.00 0.00 O ATOM 860 CB CYS A 193 -5.908 7.408 -3.380 1.00 0.00 C ATOM 861 SG CYS A 193 -6.028 7.383 -5.184 1.00 0.00 S ATOM 0 H CYS A 193 -8.678 7.105 -2.244 1.00 0.00 H new ATOM 0 HA CYS A 193 -6.503 5.368 -3.063 1.00 0.00 H new ATOM 0 HB2 CYS A 193 -6.199 8.395 -3.021 1.00 0.00 H new ATOM 0 HB3 CYS A 193 -4.867 7.259 -3.094 1.00 0.00 H new ATOM 0 HG CYS A 193 -6.897 6.487 -5.549 1.00 0.00 H new ATOM 867 N ALA A 194 -5.504 5.619 -0.748 1.00 0.00 N ATOM 868 CA ALA A 194 -5.150 5.554 0.665 1.00 0.00 C ATOM 869 C ALA A 194 -3.738 5.010 0.852 1.00 0.00 C ATOM 870 O ALA A 194 -3.169 4.406 -0.058 1.00 0.00 O ATOM 871 CB ALA A 194 -6.153 4.695 1.421 1.00 0.00 C ATOM 0 H ALA A 194 -4.923 5.041 -1.356 1.00 0.00 H new ATOM 0 HA ALA A 194 -5.178 6.566 1.069 1.00 0.00 H new ATOM 0 HB1 ALA A 194 -5.877 4.655 2.475 1.00 0.00 H new ATOM 0 HB2 ALA A 194 -7.149 5.127 1.323 1.00 0.00 H new ATOM 0 HB3 ALA A 194 -6.153 3.686 1.007 1.00 0.00 H new ATOM 877 N PHE A 195 -3.176 5.228 2.036 1.00 0.00 N ATOM 878 CA PHE A 195 -1.829 4.761 2.342 1.00 0.00 C ATOM 879 C PHE A 195 -1.851 3.743 3.478 1.00 0.00 C ATOM 880 O PHE A 195 -2.634 3.864 4.420 1.00 0.00 O ATOM 881 CB PHE A 195 -0.930 5.941 2.717 1.00 0.00 C ATOM 882 CG PHE A 195 -0.427 6.712 1.530 1.00 0.00 C ATOM 883 CD1 PHE A 195 0.342 6.091 0.559 1.00 0.00 C ATOM 884 CD2 PHE A 195 -0.722 8.058 1.386 1.00 0.00 C ATOM 885 CE1 PHE A 195 0.807 6.798 -0.533 1.00 0.00 C ATOM 886 CE2 PHE A 195 -0.261 8.771 0.295 1.00 0.00 C ATOM 887 CZ PHE A 195 0.504 8.139 -0.666 1.00 0.00 C ATOM 0 H PHE A 195 -3.633 5.726 2.800 1.00 0.00 H new ATOM 0 HA PHE A 195 -1.429 4.277 1.451 1.00 0.00 H new ATOM 0 HB2 PHE A 195 -1.483 6.616 3.371 1.00 0.00 H new ATOM 0 HB3 PHE A 195 -0.078 5.571 3.288 1.00 0.00 H new ATOM 0 HD1 PHE A 195 0.581 5.042 0.657 1.00 0.00 H new ATOM 0 HD2 PHE A 195 -1.319 8.556 2.135 1.00 0.00 H new ATOM 0 HE1 PHE A 195 1.407 6.303 -1.282 1.00 0.00 H new ATOM 0 HE2 PHE A 195 -0.498 9.820 0.194 1.00 0.00 H new ATOM 0 HZ PHE A 195 0.865 8.693 -1.520 1.00 0.00 H new ATOM 897 N VAL A 196 -0.986 2.738 3.382 1.00 0.00 N ATOM 898 CA VAL A 196 -0.905 1.699 4.401 1.00 0.00 C ATOM 899 C VAL A 196 0.543 1.309 4.674 1.00 0.00 C ATOM 900 O VAL A 196 1.347 1.177 3.751 1.00 0.00 O ATOM 901 CB VAL A 196 -1.694 0.443 3.985 1.00 0.00 C ATOM 902 CG1 VAL A 196 -1.697 -0.582 5.109 1.00 0.00 C ATOM 903 CG2 VAL A 196 -3.114 0.814 3.586 1.00 0.00 C ATOM 0 H VAL A 196 -0.331 2.622 2.608 1.00 0.00 H new ATOM 0 HA VAL A 196 -1.344 2.111 5.309 1.00 0.00 H new ATOM 0 HB VAL A 196 -1.203 -0.004 3.120 1.00 0.00 H new ATOM 0 HG11 VAL A 196 -2.259 -1.462 4.797 1.00 0.00 H new ATOM 0 HG12 VAL A 196 -0.672 -0.870 5.342 1.00 0.00 H new ATOM 0 HG13 VAL A 196 -2.162 -0.149 5.995 1.00 0.00 H new ATOM 0 HG21 VAL A 196 -3.657 -0.085 3.295 1.00 0.00 H new ATOM 0 HG22 VAL A 196 -3.618 1.285 4.430 1.00 0.00 H new ATOM 0 HG23 VAL A 196 -3.086 1.509 2.746 1.00 0.00 H new ATOM 913 N LYS A 197 0.870 1.125 5.948 1.00 0.00 N ATOM 914 CA LYS A 197 2.222 0.748 6.345 1.00 0.00 C ATOM 915 C LYS A 197 2.223 -0.600 7.059 1.00 0.00 C ATOM 916 O LYS A 197 1.260 -0.954 7.741 1.00 0.00 O ATOM 917 CB LYS A 197 2.826 1.819 7.256 1.00 0.00 C ATOM 918 CG LYS A 197 4.344 1.841 7.245 1.00 0.00 C ATOM 919 CD LYS A 197 4.898 2.654 8.403 1.00 0.00 C ATOM 920 CE LYS A 197 4.967 4.135 8.062 1.00 0.00 C ATOM 921 NZ LYS A 197 6.227 4.482 7.348 1.00 0.00 N ATOM 0 H LYS A 197 0.217 1.231 6.724 1.00 0.00 H new ATOM 0 HA LYS A 197 2.828 0.663 5.443 1.00 0.00 H new ATOM 0 HB2 LYS A 197 2.455 2.797 6.949 1.00 0.00 H new ATOM 0 HB3 LYS A 197 2.481 1.653 8.276 1.00 0.00 H new ATOM 0 HG2 LYS A 197 4.724 0.821 7.301 1.00 0.00 H new ATOM 0 HG3 LYS A 197 4.696 2.261 6.303 1.00 0.00 H new ATOM 0 HD2 LYS A 197 4.270 2.511 9.282 1.00 0.00 H new ATOM 0 HD3 LYS A 197 5.894 2.292 8.660 1.00 0.00 H new ATOM 0 HE2 LYS A 197 4.112 4.405 7.442 1.00 0.00 H new ATOM 0 HE3 LYS A 197 4.895 4.722 8.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 6.236 5.500 7.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 7.043 4.248 7.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 6.284 3.941 6.462 1.00 0.00 H new ATOM 935 N TYR A 198 3.309 -1.348 6.899 1.00 0.00 N ATOM 936 CA TYR A 198 3.435 -2.658 7.527 1.00 0.00 C ATOM 937 C TYR A 198 4.676 -2.721 8.412 1.00 0.00 C ATOM 938 O TYR A 198 5.497 -1.803 8.415 1.00 0.00 O ATOM 939 CB TYR A 198 3.497 -3.754 6.462 1.00 0.00 C ATOM 940 CG TYR A 198 2.140 -4.181 5.953 1.00 0.00 C ATOM 941 CD1 TYR A 198 1.334 -3.301 5.241 1.00 0.00 C ATOM 942 CD2 TYR A 198 1.663 -5.466 6.182 1.00 0.00 C ATOM 943 CE1 TYR A 198 0.093 -3.687 4.774 1.00 0.00 C ATOM 944 CE2 TYR A 198 0.423 -5.861 5.718 1.00 0.00 C ATOM 945 CZ TYR A 198 -0.358 -4.968 5.015 1.00 0.00 C ATOM 946 OH TYR A 198 -1.594 -5.357 4.550 1.00 0.00 O ATOM 0 H TYR A 198 4.115 -1.069 6.340 1.00 0.00 H new ATOM 0 HA TYR A 198 2.557 -2.819 8.153 1.00 0.00 H new ATOM 0 HB2 TYR A 198 4.096 -3.400 5.623 1.00 0.00 H new ATOM 0 HB3 TYR A 198 4.010 -4.622 6.876 1.00 0.00 H new ATOM 0 HD1 TYR A 198 1.684 -2.297 5.049 1.00 0.00 H new ATOM 0 HD2 TYR A 198 2.272 -6.168 6.732 1.00 0.00 H new ATOM 0 HE1 TYR A 198 -0.521 -2.990 4.223 1.00 0.00 H new ATOM 0 HE2 TYR A 198 0.067 -6.864 5.905 1.00 0.00 H new ATOM 0 HH TYR A 198 -2.038 -5.910 5.226 1.00 0.00 H new ATOM 956 N SER A 199 4.807 -3.811 9.160 1.00 0.00 N ATOM 957 CA SER A 199 5.946 -3.995 10.052 1.00 0.00 C ATOM 958 C SER A 199 7.196 -4.378 9.265 1.00 0.00 C ATOM 959 O SER A 199 8.259 -3.782 9.437 1.00 0.00 O ATOM 960 CB SER A 199 5.637 -5.070 11.095 1.00 0.00 C ATOM 961 OG SER A 199 6.343 -4.830 12.300 1.00 0.00 O ATOM 0 H SER A 199 4.138 -4.581 9.166 1.00 0.00 H new ATOM 0 HA SER A 199 6.133 -3.049 10.561 1.00 0.00 H new ATOM 0 HB2 SER A 199 4.566 -5.089 11.295 1.00 0.00 H new ATOM 0 HB3 SER A 199 5.906 -6.050 10.702 1.00 0.00 H new ATOM 0 HG SER A 199 6.292 -3.877 12.525 1.00 0.00 H new ATOM 967 N SER A 200 7.059 -5.379 8.401 1.00 0.00 N ATOM 968 CA SER A 200 8.177 -5.846 7.589 1.00 0.00 C ATOM 969 C SER A 200 7.815 -5.832 6.107 1.00 0.00 C ATOM 970 O SER A 200 6.715 -5.429 5.728 1.00 0.00 O ATOM 971 CB SER A 200 8.586 -7.258 8.012 1.00 0.00 C ATOM 972 OG SER A 200 9.183 -7.253 9.298 1.00 0.00 O ATOM 0 H SER A 200 6.185 -5.882 8.245 1.00 0.00 H new ATOM 0 HA SER A 200 9.017 -5.169 7.747 1.00 0.00 H new ATOM 0 HB2 SER A 200 7.711 -7.907 8.017 1.00 0.00 H new ATOM 0 HB3 SER A 200 9.285 -7.671 7.285 1.00 0.00 H new ATOM 0 HG SER A 200 9.434 -8.167 9.546 1.00 0.00 H new ATOM 978 N HIS A 201 8.750 -6.275 5.272 1.00 0.00 N ATOM 979 CA HIS A 201 8.531 -6.314 3.831 1.00 0.00 C ATOM 980 C HIS A 201 7.700 -7.532 3.440 1.00 0.00 C ATOM 981 O HIS A 201 6.590 -7.399 2.926 1.00 0.00 O ATOM 982 CB HIS A 201 9.869 -6.336 3.091 1.00 0.00 C ATOM 983 CG HIS A 201 9.735 -6.194 1.606 1.00 0.00 C ATOM 984 ND1 HIS A 201 10.149 -5.074 0.916 1.00 0.00 N ATOM 985 CD2 HIS A 201 9.230 -7.040 0.678 1.00 0.00 C ATOM 986 CE1 HIS A 201 9.904 -5.237 -0.372 1.00 0.00 C ATOM 987 NE2 HIS A 201 9.346 -6.422 -0.543 1.00 0.00 N ATOM 0 H HIS A 201 9.666 -6.612 5.569 1.00 0.00 H new ATOM 0 HA HIS A 201 7.982 -5.416 3.548 1.00 0.00 H new ATOM 0 HB2 HIS A 201 10.497 -5.530 3.469 1.00 0.00 H new ATOM 0 HB3 HIS A 201 10.382 -7.271 3.313 1.00 0.00 H new ATOM 0 HD2 HIS A 201 8.813 -8.019 0.863 1.00 0.00 H new ATOM 0 HE1 HIS A 201 10.123 -4.523 -1.152 1.00 0.00 H new ATOM 0 HE2 HIS A 201 9.049 -6.814 -1.437 1.00 0.00 H new ATOM 995 N ALA A 202 8.246 -8.719 3.687 1.00 0.00 N ATOM 996 CA ALA A 202 7.555 -9.960 3.362 1.00 0.00 C ATOM 997 C ALA A 202 6.049 -9.815 3.551 1.00 0.00 C ATOM 998 O ALA A 202 5.278 -9.972 2.605 1.00 0.00 O ATOM 999 CB ALA A 202 8.088 -11.100 4.217 1.00 0.00 C ATOM 0 H ALA A 202 9.165 -8.846 4.111 1.00 0.00 H new ATOM 0 HA ALA A 202 7.743 -10.188 2.313 1.00 0.00 H new ATOM 0 HB1 ALA A 202 7.563 -12.021 3.964 1.00 0.00 H new ATOM 0 HB2 ALA A 202 9.154 -11.227 4.030 1.00 0.00 H new ATOM 0 HB3 ALA A 202 7.929 -10.870 5.270 1.00 0.00 H new ATOM 1005 N GLU A 203 5.637 -9.515 4.779 1.00 0.00 N ATOM 1006 CA GLU A 203 4.222 -9.351 5.090 1.00 0.00 C ATOM 1007 C GLU A 203 3.541 -8.444 4.069 1.00 0.00 C ATOM 1008 O GLU A 203 2.499 -8.789 3.513 1.00 0.00 O ATOM 1009 CB GLU A 203 4.050 -8.773 6.496 1.00 0.00 C ATOM 1010 CG GLU A 203 4.191 -9.807 7.601 1.00 0.00 C ATOM 1011 CD GLU A 203 5.555 -10.469 7.610 1.00 0.00 C ATOM 1012 OE1 GLU A 203 6.530 -9.813 8.030 1.00 0.00 O ATOM 1013 OE2 GLU A 203 5.645 -11.644 7.196 1.00 0.00 O ATOM 0 H GLU A 203 6.262 -9.381 5.574 1.00 0.00 H new ATOM 0 HA GLU A 203 3.751 -10.333 5.048 1.00 0.00 H new ATOM 0 HB2 GLU A 203 4.789 -7.987 6.649 1.00 0.00 H new ATOM 0 HB3 GLU A 203 3.068 -8.306 6.570 1.00 0.00 H new ATOM 0 HG2 GLU A 203 4.017 -9.329 8.565 1.00 0.00 H new ATOM 0 HG3 GLU A 203 3.422 -10.570 7.480 1.00 0.00 H new ATOM 1020 N ALA A 204 4.139 -7.282 3.828 1.00 0.00 N ATOM 1021 CA ALA A 204 3.593 -6.325 2.873 1.00 0.00 C ATOM 1022 C ALA A 204 3.320 -6.988 1.528 1.00 0.00 C ATOM 1023 O ALA A 204 2.187 -6.994 1.048 1.00 0.00 O ATOM 1024 CB ALA A 204 4.543 -5.149 2.702 1.00 0.00 C ATOM 0 H ALA A 204 5.002 -6.980 4.281 1.00 0.00 H new ATOM 0 HA ALA A 204 2.645 -5.957 3.266 1.00 0.00 H new ATOM 0 HB1 ALA A 204 4.122 -4.443 1.986 1.00 0.00 H new ATOM 0 HB2 ALA A 204 4.684 -4.652 3.662 1.00 0.00 H new ATOM 0 HB3 ALA A 204 5.504 -5.508 2.335 1.00 0.00 H new ATOM 1030 N GLN A 205 4.365 -7.544 0.924 1.00 0.00 N ATOM 1031 CA GLN A 205 4.237 -8.208 -0.368 1.00 0.00 C ATOM 1032 C GLN A 205 3.009 -9.113 -0.395 1.00 0.00 C ATOM 1033 O GLN A 205 2.205 -9.056 -1.325 1.00 0.00 O ATOM 1034 CB GLN A 205 5.494 -9.024 -0.672 1.00 0.00 C ATOM 1035 CG GLN A 205 5.746 -9.222 -2.158 1.00 0.00 C ATOM 1036 CD GLN A 205 6.216 -7.954 -2.844 1.00 0.00 C ATOM 1037 OE1 GLN A 205 7.400 -7.618 -2.809 1.00 0.00 O ATOM 1038 NE2 GLN A 205 5.288 -7.242 -3.473 1.00 0.00 N ATOM 0 H GLN A 205 5.310 -7.548 1.308 1.00 0.00 H new ATOM 0 HA GLN A 205 4.117 -7.441 -1.133 1.00 0.00 H new ATOM 0 HB2 GLN A 205 6.356 -8.526 -0.229 1.00 0.00 H new ATOM 0 HB3 GLN A 205 5.408 -10.000 -0.193 1.00 0.00 H new ATOM 0 HG2 GLN A 205 6.494 -10.003 -2.295 1.00 0.00 H new ATOM 0 HG3 GLN A 205 4.830 -9.570 -2.635 1.00 0.00 H new ATOM 0 HE21 GLN A 205 4.318 -7.558 -3.477 1.00 0.00 H new ATOM 0 HE22 GLN A 205 5.545 -6.379 -3.953 1.00 0.00 H new ATOM 1047 N ALA A 206 2.872 -9.947 0.630 1.00 0.00 N ATOM 1048 CA ALA A 206 1.742 -10.862 0.724 1.00 0.00 C ATOM 1049 C ALA A 206 0.420 -10.124 0.539 1.00 0.00 C ATOM 1050 O ALA A 206 -0.358 -10.442 -0.359 1.00 0.00 O ATOM 1051 CB ALA A 206 1.760 -11.588 2.061 1.00 0.00 C ATOM 0 H ALA A 206 3.530 -10.008 1.407 1.00 0.00 H new ATOM 0 HA ALA A 206 1.834 -11.596 -0.077 1.00 0.00 H new ATOM 0 HB1 ALA A 206 0.910 -12.268 2.117 1.00 0.00 H new ATOM 0 HB2 ALA A 206 2.686 -12.156 2.154 1.00 0.00 H new ATOM 0 HB3 ALA A 206 1.697 -10.861 2.871 1.00 0.00 H new ATOM 1057 N ALA A 207 0.174 -9.138 1.396 1.00 0.00 N ATOM 1058 CA ALA A 207 -1.053 -8.354 1.325 1.00 0.00 C ATOM 1059 C ALA A 207 -1.267 -7.794 -0.077 1.00 0.00 C ATOM 1060 O ALA A 207 -2.397 -7.728 -0.563 1.00 0.00 O ATOM 1061 CB ALA A 207 -1.018 -7.226 2.346 1.00 0.00 C ATOM 0 H ALA A 207 0.808 -8.864 2.147 1.00 0.00 H new ATOM 0 HA ALA A 207 -1.890 -9.013 1.556 1.00 0.00 H new ATOM 0 HB1 ALA A 207 -1.940 -6.649 2.282 1.00 0.00 H new ATOM 0 HB2 ALA A 207 -0.921 -7.645 3.348 1.00 0.00 H new ATOM 0 HB3 ALA A 207 -0.168 -6.576 2.141 1.00 0.00 H new ATOM 1067 N ILE A 208 -0.177 -7.392 -0.721 1.00 0.00 N ATOM 1068 CA ILE A 208 -0.247 -6.838 -2.068 1.00 0.00 C ATOM 1069 C ILE A 208 -0.859 -7.839 -3.042 1.00 0.00 C ATOM 1070 O ILE A 208 -2.007 -7.690 -3.460 1.00 0.00 O ATOM 1071 CB ILE A 208 1.146 -6.427 -2.580 1.00 0.00 C ATOM 1072 CG1 ILE A 208 1.762 -5.373 -1.657 1.00 0.00 C ATOM 1073 CG2 ILE A 208 1.053 -5.902 -4.005 1.00 0.00 C ATOM 1074 CD1 ILE A 208 3.239 -5.151 -1.894 1.00 0.00 C ATOM 0 H ILE A 208 0.765 -7.439 -0.332 1.00 0.00 H new ATOM 0 HA ILE A 208 -0.881 -5.953 -2.013 1.00 0.00 H new ATOM 0 HB ILE A 208 1.791 -7.306 -2.579 1.00 0.00 H new ATOM 0 HG12 ILE A 208 1.234 -4.429 -1.794 1.00 0.00 H new ATOM 0 HG13 ILE A 208 1.610 -5.676 -0.621 1.00 0.00 H new ATOM 0 HG21 ILE A 208 2.046 -5.616 -4.353 1.00 0.00 H new ATOM 0 HG22 ILE A 208 0.652 -6.680 -4.654 1.00 0.00 H new ATOM 0 HG23 ILE A 208 0.395 -5.033 -4.031 1.00 0.00 H new ATOM 0 HD11 ILE A 208 3.608 -4.391 -1.205 1.00 0.00 H new ATOM 0 HD12 ILE A 208 3.778 -6.084 -1.729 1.00 0.00 H new ATOM 0 HD13 ILE A 208 3.397 -4.818 -2.920 1.00 0.00 H new ATOM 1086 N ASN A 209 -0.085 -8.858 -3.399 1.00 0.00 N ATOM 1087 CA ASN A 209 -0.552 -9.885 -4.324 1.00 0.00 C ATOM 1088 C ASN A 209 -1.915 -10.422 -3.898 1.00 0.00 C ATOM 1089 O ASN A 209 -2.801 -10.625 -4.727 1.00 0.00 O ATOM 1090 CB ASN A 209 0.459 -11.031 -4.400 1.00 0.00 C ATOM 1091 CG ASN A 209 -0.163 -12.318 -4.906 1.00 0.00 C ATOM 1092 OD1 ASN A 209 -0.584 -12.406 -6.059 1.00 0.00 O ATOM 1093 ND2 ASN A 209 -0.224 -13.325 -4.041 1.00 0.00 N ATOM 0 H ASN A 209 0.868 -8.995 -3.062 1.00 0.00 H new ATOM 0 HA ASN A 209 -0.652 -9.432 -5.310 1.00 0.00 H new ATOM 0 HB2 ASN A 209 1.280 -10.745 -5.057 1.00 0.00 H new ATOM 0 HB3 ASN A 209 0.886 -11.201 -3.412 1.00 0.00 H new ATOM 0 HD21 ASN A 209 -0.632 -14.216 -4.323 1.00 0.00 H new ATOM 0 HD22 ASN A 209 0.138 -13.207 -3.095 1.00 0.00 H new ATOM 1100 N ALA A 210 -2.075 -10.650 -2.598 1.00 0.00 N ATOM 1101 CA ALA A 210 -3.330 -11.160 -2.061 1.00 0.00 C ATOM 1102 C ALA A 210 -4.507 -10.296 -2.500 1.00 0.00 C ATOM 1103 O ALA A 210 -5.545 -10.810 -2.920 1.00 0.00 O ATOM 1104 CB ALA A 210 -3.263 -11.233 -0.543 1.00 0.00 C ATOM 0 H ALA A 210 -1.351 -10.489 -1.898 1.00 0.00 H new ATOM 0 HA ALA A 210 -3.484 -12.164 -2.456 1.00 0.00 H new ATOM 0 HB1 ALA A 210 -4.207 -11.616 -0.155 1.00 0.00 H new ATOM 0 HB2 ALA A 210 -2.452 -11.898 -0.246 1.00 0.00 H new ATOM 0 HB3 ALA A 210 -3.081 -10.237 -0.139 1.00 0.00 H new ATOM 1110 N LEU A 211 -4.340 -8.982 -2.399 1.00 0.00 N ATOM 1111 CA LEU A 211 -5.390 -8.046 -2.785 1.00 0.00 C ATOM 1112 C LEU A 211 -5.124 -7.472 -4.173 1.00 0.00 C ATOM 1113 O LEU A 211 -5.856 -7.753 -5.123 1.00 0.00 O ATOM 1114 CB LEU A 211 -5.490 -6.912 -1.763 1.00 0.00 C ATOM 1115 CG LEU A 211 -5.754 -7.333 -0.317 1.00 0.00 C ATOM 1116 CD1 LEU A 211 -5.595 -6.148 0.622 1.00 0.00 C ATOM 1117 CD2 LEU A 211 -7.143 -7.940 -0.183 1.00 0.00 C ATOM 0 H LEU A 211 -3.488 -8.541 -2.053 1.00 0.00 H new ATOM 0 HA LEU A 211 -6.335 -8.589 -2.811 1.00 0.00 H new ATOM 0 HB2 LEU A 211 -4.561 -6.342 -1.791 1.00 0.00 H new ATOM 0 HB3 LEU A 211 -6.287 -6.238 -2.075 1.00 0.00 H new ATOM 0 HG LEU A 211 -5.020 -8.090 -0.040 1.00 0.00 H new ATOM 0 HD11 LEU A 211 -5.787 -6.467 1.646 1.00 0.00 H new ATOM 0 HD12 LEU A 211 -4.580 -5.758 0.547 1.00 0.00 H new ATOM 0 HD13 LEU A 211 -6.304 -5.368 0.346 1.00 0.00 H new ATOM 0 HD21 LEU A 211 -7.313 -8.234 0.853 1.00 0.00 H new ATOM 0 HD22 LEU A 211 -7.891 -7.205 -0.480 1.00 0.00 H new ATOM 0 HD23 LEU A 211 -7.221 -8.817 -0.826 1.00 0.00 H new ATOM 1129 N HIS A 212 -4.071 -6.669 -4.285 1.00 0.00 N ATOM 1130 CA HIS A 212 -3.707 -6.058 -5.558 1.00 0.00 C ATOM 1131 C HIS A 212 -3.617 -7.110 -6.659 1.00 0.00 C ATOM 1132 O HIS A 212 -2.930 -8.120 -6.512 1.00 0.00 O ATOM 1133 CB HIS A 212 -2.373 -5.320 -5.431 1.00 0.00 C ATOM 1134 CG HIS A 212 -1.695 -5.078 -6.744 1.00 0.00 C ATOM 1135 ND1 HIS A 212 -2.306 -4.432 -7.799 1.00 0.00 N ATOM 1136 CD2 HIS A 212 -0.451 -5.397 -7.171 1.00 0.00 C ATOM 1137 CE1 HIS A 212 -1.468 -4.366 -8.817 1.00 0.00 C ATOM 1138 NE2 HIS A 212 -0.334 -4.944 -8.462 1.00 0.00 N ATOM 0 H HIS A 212 -3.455 -6.426 -3.509 1.00 0.00 H new ATOM 0 HA HIS A 212 -4.485 -5.343 -5.825 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -2.542 -4.363 -4.937 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -1.708 -5.897 -4.789 1.00 0.00 H new ATOM 0 HD1 HIS A 212 -3.257 -4.063 -7.793 1.00 0.00 H new ATOM 0 HD2 HIS A 212 0.309 -5.912 -6.602 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -1.674 -3.916 -9.777 1.00 0.00 H new ATOM 1146 N GLY A 213 -4.316 -6.865 -7.763 1.00 0.00 N ATOM 1147 CA GLY A 213 -4.303 -7.800 -8.873 1.00 0.00 C ATOM 1148 C GLY A 213 -5.189 -9.005 -8.626 1.00 0.00 C ATOM 1149 O GLY A 213 -5.433 -9.801 -9.533 1.00 0.00 O ATOM 0 H GLY A 213 -4.891 -6.035 -7.909 1.00 0.00 H new ATOM 0 HA2 GLY A 213 -4.633 -7.290 -9.778 1.00 0.00 H new ATOM 0 HA3 GLY A 213 -3.281 -8.135 -9.050 1.00 0.00 H new ATOM 1153 N SER A 214 -5.670 -9.142 -7.395 1.00 0.00 N ATOM 1154 CA SER A 214 -6.530 -10.262 -7.030 1.00 0.00 C ATOM 1155 C SER A 214 -8.000 -9.856 -7.075 1.00 0.00 C ATOM 1156 O SER A 214 -8.764 -10.344 -7.907 1.00 0.00 O ATOM 1157 CB SER A 214 -6.173 -10.772 -5.633 1.00 0.00 C ATOM 1158 OG SER A 214 -6.750 -12.043 -5.391 1.00 0.00 O ATOM 0 H SER A 214 -5.479 -8.491 -6.633 1.00 0.00 H new ATOM 0 HA SER A 214 -6.370 -11.062 -7.753 1.00 0.00 H new ATOM 0 HB2 SER A 214 -5.090 -10.836 -5.532 1.00 0.00 H new ATOM 0 HB3 SER A 214 -6.522 -10.062 -4.883 1.00 0.00 H new ATOM 0 HG SER A 214 -6.380 -12.418 -4.565 1.00 0.00 H new ATOM 1164 N GLN A 215 -8.387 -8.959 -6.174 1.00 0.00 N ATOM 1165 CA GLN A 215 -9.766 -8.487 -6.110 1.00 0.00 C ATOM 1166 C GLN A 215 -9.950 -7.228 -6.950 1.00 0.00 C ATOM 1167 O GLN A 215 -8.978 -6.570 -7.323 1.00 0.00 O ATOM 1168 CB GLN A 215 -10.165 -8.210 -4.659 1.00 0.00 C ATOM 1169 CG GLN A 215 -9.711 -9.286 -3.687 1.00 0.00 C ATOM 1170 CD GLN A 215 -10.719 -10.411 -3.549 1.00 0.00 C ATOM 1171 OE1 GLN A 215 -11.300 -10.864 -4.535 1.00 0.00 O ATOM 1172 NE2 GLN A 215 -10.931 -10.869 -2.321 1.00 0.00 N ATOM 0 H GLN A 215 -7.766 -8.545 -5.479 1.00 0.00 H new ATOM 0 HA GLN A 215 -10.410 -9.268 -6.514 1.00 0.00 H new ATOM 0 HB2 GLN A 215 -9.743 -7.253 -4.351 1.00 0.00 H new ATOM 0 HB3 GLN A 215 -11.249 -8.114 -4.601 1.00 0.00 H new ATOM 0 HG2 GLN A 215 -8.759 -9.696 -4.023 1.00 0.00 H new ATOM 0 HG3 GLN A 215 -9.537 -8.837 -2.709 1.00 0.00 H new ATOM 0 HE21 GLN A 215 -10.427 -10.464 -1.532 1.00 0.00 H new ATOM 0 HE22 GLN A 215 -11.597 -11.626 -2.167 1.00 0.00 H new ATOM 1181 N THR A 216 -11.203 -6.897 -7.245 1.00 0.00 N ATOM 1182 CA THR A 216 -11.515 -5.718 -8.043 1.00 0.00 C ATOM 1183 C THR A 216 -12.599 -4.876 -7.379 1.00 0.00 C ATOM 1184 O THR A 216 -13.784 -5.200 -7.457 1.00 0.00 O ATOM 1185 CB THR A 216 -11.976 -6.104 -9.461 1.00 0.00 C ATOM 1186 OG1 THR A 216 -11.161 -7.167 -9.969 1.00 0.00 O ATOM 1187 CG2 THR A 216 -11.903 -4.909 -10.398 1.00 0.00 C ATOM 0 H THR A 216 -12.019 -7.429 -6.943 1.00 0.00 H new ATOM 0 HA THR A 216 -10.598 -5.134 -8.115 1.00 0.00 H new ATOM 0 HB THR A 216 -13.012 -6.437 -9.404 1.00 0.00 H new ATOM 0 HG1 THR A 216 -11.462 -7.408 -10.870 1.00 0.00 H new ATOM 0 HG21 THR A 216 -12.233 -5.206 -11.393 1.00 0.00 H new ATOM 0 HG22 THR A 216 -12.548 -4.114 -10.024 1.00 0.00 H new ATOM 0 HG23 THR A 216 -10.875 -4.549 -10.449 1.00 0.00 H new ATOM 1195 N MET A 217 -12.186 -3.795 -6.727 1.00 0.00 N ATOM 1196 CA MET A 217 -13.123 -2.905 -6.052 1.00 0.00 C ATOM 1197 C MET A 217 -14.438 -2.815 -6.821 1.00 0.00 C ATOM 1198 O MET A 217 -14.462 -2.601 -8.033 1.00 0.00 O ATOM 1199 CB MET A 217 -12.514 -1.511 -5.895 1.00 0.00 C ATOM 1200 CG MET A 217 -11.694 -1.345 -4.626 1.00 0.00 C ATOM 1201 SD MET A 217 -10.769 -2.833 -4.198 1.00 0.00 S ATOM 1202 CE MET A 217 -11.259 -3.056 -2.490 1.00 0.00 C ATOM 0 H MET A 217 -11.208 -3.514 -6.652 1.00 0.00 H new ATOM 0 HA MET A 217 -13.328 -3.317 -5.064 1.00 0.00 H new ATOM 0 HB2 MET A 217 -11.881 -1.301 -6.757 1.00 0.00 H new ATOM 0 HB3 MET A 217 -13.314 -0.771 -5.900 1.00 0.00 H new ATOM 0 HG2 MET A 217 -11.000 -0.514 -4.752 1.00 0.00 H new ATOM 0 HG3 MET A 217 -12.357 -1.084 -3.801 1.00 0.00 H new ATOM 0 HE1 MET A 217 -11.278 -4.120 -2.253 1.00 0.00 H new ATOM 0 HE2 MET A 217 -10.546 -2.551 -1.838 1.00 0.00 H new ATOM 0 HE3 MET A 217 -12.252 -2.633 -2.338 1.00 0.00 H new ATOM 1212 N PRO A 218 -15.558 -2.983 -6.103 1.00 0.00 N ATOM 1213 CA PRO A 218 -16.896 -2.925 -6.698 1.00 0.00 C ATOM 1214 C PRO A 218 -17.086 -1.695 -7.579 1.00 0.00 C ATOM 1215 O PRO A 218 -16.966 -0.562 -7.115 1.00 0.00 O ATOM 1216 CB PRO A 218 -17.823 -2.858 -5.481 1.00 0.00 C ATOM 1217 CG PRO A 218 -17.064 -3.531 -4.390 1.00 0.00 C ATOM 1218 CD PRO A 218 -15.604 -3.242 -4.654 1.00 0.00 C ATOM 0 HA PRO A 218 -17.088 -3.776 -7.352 1.00 0.00 H new ATOM 0 HB2 PRO A 218 -18.060 -1.827 -5.220 1.00 0.00 H new ATOM 0 HB3 PRO A 218 -18.769 -3.363 -5.675 1.00 0.00 H new ATOM 0 HG2 PRO A 218 -17.366 -3.151 -3.414 1.00 0.00 H new ATOM 0 HG3 PRO A 218 -17.254 -4.604 -4.388 1.00 0.00 H new ATOM 0 HD2 PRO A 218 -15.256 -2.382 -4.082 1.00 0.00 H new ATOM 0 HD3 PRO A 218 -14.972 -4.086 -4.377 1.00 0.00 H new ATOM 1226 N GLY A 219 -17.383 -1.926 -8.854 1.00 0.00 N ATOM 1227 CA GLY A 219 -17.584 -0.827 -9.780 1.00 0.00 C ATOM 1228 C GLY A 219 -16.441 -0.682 -10.765 1.00 0.00 C ATOM 1229 O GLY A 219 -16.664 -0.499 -11.962 1.00 0.00 O ATOM 0 H GLY A 219 -17.488 -2.855 -9.262 1.00 0.00 H new ATOM 0 HA2 GLY A 219 -18.514 -0.983 -10.327 1.00 0.00 H new ATOM 0 HA3 GLY A 219 -17.696 0.101 -9.219 1.00 0.00 H new ATOM 1233 N ALA A 220 -15.214 -0.761 -10.262 1.00 0.00 N ATOM 1234 CA ALA A 220 -14.032 -0.638 -11.106 1.00 0.00 C ATOM 1235 C ALA A 220 -13.828 -1.891 -11.950 1.00 0.00 C ATOM 1236 O ALA A 220 -14.062 -3.007 -11.488 1.00 0.00 O ATOM 1237 CB ALA A 220 -12.801 -0.366 -10.254 1.00 0.00 C ATOM 0 H ALA A 220 -15.012 -0.910 -9.273 1.00 0.00 H new ATOM 0 HA ALA A 220 -14.184 0.203 -11.783 1.00 0.00 H new ATOM 0 HB1 ALA A 220 -11.926 -0.276 -10.897 1.00 0.00 H new ATOM 0 HB2 ALA A 220 -12.940 0.562 -9.699 1.00 0.00 H new ATOM 0 HB3 ALA A 220 -12.654 -1.188 -9.554 1.00 0.00 H new ATOM 1243 N SER A 221 -13.390 -1.698 -13.191 1.00 0.00 N ATOM 1244 CA SER A 221 -13.159 -2.813 -14.101 1.00 0.00 C ATOM 1245 C SER A 221 -11.733 -3.338 -13.965 1.00 0.00 C ATOM 1246 O SER A 221 -11.422 -4.445 -14.407 1.00 0.00 O ATOM 1247 CB SER A 221 -13.420 -2.382 -15.546 1.00 0.00 C ATOM 1248 OG SER A 221 -14.807 -2.220 -15.787 1.00 0.00 O ATOM 0 H SER A 221 -13.188 -0.780 -13.588 1.00 0.00 H new ATOM 0 HA SER A 221 -13.850 -3.614 -13.838 1.00 0.00 H new ATOM 0 HB2 SER A 221 -12.901 -1.445 -15.749 1.00 0.00 H new ATOM 0 HB3 SER A 221 -13.013 -3.127 -16.230 1.00 0.00 H new ATOM 0 HG SER A 221 -14.947 -1.943 -16.716 1.00 0.00 H new ATOM 1254 N SER A 222 -10.869 -2.536 -13.350 1.00 0.00 N ATOM 1255 CA SER A 222 -9.475 -2.917 -13.159 1.00 0.00 C ATOM 1256 C SER A 222 -9.243 -3.436 -11.742 1.00 0.00 C ATOM 1257 O SER A 222 -9.831 -2.936 -10.783 1.00 0.00 O ATOM 1258 CB SER A 222 -8.556 -1.726 -13.434 1.00 0.00 C ATOM 1259 OG SER A 222 -8.305 -1.586 -14.822 1.00 0.00 O ATOM 0 H SER A 222 -11.110 -1.618 -12.976 1.00 0.00 H new ATOM 0 HA SER A 222 -9.243 -3.716 -13.863 1.00 0.00 H new ATOM 0 HB2 SER A 222 -9.013 -0.814 -13.050 1.00 0.00 H new ATOM 0 HB3 SER A 222 -7.614 -1.859 -12.902 1.00 0.00 H new ATOM 0 HG SER A 222 -8.001 -0.673 -15.009 1.00 0.00 H new ATOM 1265 N SER A 223 -8.383 -4.441 -11.621 1.00 0.00 N ATOM 1266 CA SER A 223 -8.075 -5.031 -10.323 1.00 0.00 C ATOM 1267 C SER A 223 -7.412 -4.009 -9.405 1.00 0.00 C ATOM 1268 O SER A 223 -6.754 -3.076 -9.868 1.00 0.00 O ATOM 1269 CB SER A 223 -7.162 -6.247 -10.495 1.00 0.00 C ATOM 1270 OG SER A 223 -5.886 -5.862 -10.975 1.00 0.00 O ATOM 0 H SER A 223 -7.887 -4.864 -12.405 1.00 0.00 H new ATOM 0 HA SER A 223 -9.011 -5.351 -9.866 1.00 0.00 H new ATOM 0 HB2 SER A 223 -7.055 -6.763 -9.541 1.00 0.00 H new ATOM 0 HB3 SER A 223 -7.618 -6.953 -11.190 1.00 0.00 H new ATOM 0 HG SER A 223 -5.574 -6.515 -11.636 1.00 0.00 H new ATOM 1276 N LEU A 224 -7.589 -4.191 -8.101 1.00 0.00 N ATOM 1277 CA LEU A 224 -7.009 -3.285 -7.116 1.00 0.00 C ATOM 1278 C LEU A 224 -5.536 -3.026 -7.416 1.00 0.00 C ATOM 1279 O LEU A 224 -4.830 -3.901 -7.917 1.00 0.00 O ATOM 1280 CB LEU A 224 -7.159 -3.866 -5.709 1.00 0.00 C ATOM 1281 CG LEU A 224 -6.482 -3.083 -4.583 1.00 0.00 C ATOM 1282 CD1 LEU A 224 -7.249 -1.805 -4.286 1.00 0.00 C ATOM 1283 CD2 LEU A 224 -6.366 -3.941 -3.332 1.00 0.00 C ATOM 0 H LEU A 224 -8.130 -4.958 -7.701 1.00 0.00 H new ATOM 0 HA LEU A 224 -7.545 -2.337 -7.171 1.00 0.00 H new ATOM 0 HB2 LEU A 224 -8.222 -3.944 -5.482 1.00 0.00 H new ATOM 0 HB3 LEU A 224 -6.758 -4.880 -5.712 1.00 0.00 H new ATOM 0 HG LEU A 224 -5.477 -2.812 -4.908 1.00 0.00 H new ATOM 0 HD11 LEU A 224 -6.753 -1.261 -3.482 1.00 0.00 H new ATOM 0 HD12 LEU A 224 -7.279 -1.183 -5.180 1.00 0.00 H new ATOM 0 HD13 LEU A 224 -8.266 -2.053 -3.982 1.00 0.00 H new ATOM 0 HD21 LEU A 224 -5.882 -3.368 -2.541 1.00 0.00 H new ATOM 0 HD22 LEU A 224 -7.361 -4.243 -3.004 1.00 0.00 H new ATOM 0 HD23 LEU A 224 -5.772 -4.828 -3.553 1.00 0.00 H new ATOM 1295 N VAL A 225 -5.078 -1.817 -7.106 1.00 0.00 N ATOM 1296 CA VAL A 225 -3.688 -1.443 -7.339 1.00 0.00 C ATOM 1297 C VAL A 225 -2.994 -1.068 -6.035 1.00 0.00 C ATOM 1298 O VAL A 225 -3.387 -0.116 -5.361 1.00 0.00 O ATOM 1299 CB VAL A 225 -3.582 -0.262 -8.322 1.00 0.00 C ATOM 1300 CG1 VAL A 225 -2.127 0.121 -8.542 1.00 0.00 C ATOM 1301 CG2 VAL A 225 -4.256 -0.606 -9.642 1.00 0.00 C ATOM 0 H VAL A 225 -5.649 -1.080 -6.693 1.00 0.00 H new ATOM 0 HA VAL A 225 -3.195 -2.313 -7.773 1.00 0.00 H new ATOM 0 HB VAL A 225 -4.097 0.596 -7.889 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -2.072 0.957 -9.239 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -1.679 0.411 -7.591 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -1.585 -0.730 -8.953 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -4.172 0.239 -10.325 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -3.771 -1.477 -10.082 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -5.309 -0.827 -9.466 1.00 0.00 H new ATOM 1311 N VAL A 226 -1.957 -1.823 -5.684 1.00 0.00 N ATOM 1312 CA VAL A 226 -1.205 -1.569 -4.461 1.00 0.00 C ATOM 1313 C VAL A 226 0.288 -1.787 -4.678 1.00 0.00 C ATOM 1314 O VAL A 226 0.728 -2.897 -4.979 1.00 0.00 O ATOM 1315 CB VAL A 226 -1.683 -2.475 -3.311 1.00 0.00 C ATOM 1316 CG1 VAL A 226 -0.980 -2.106 -2.013 1.00 0.00 C ATOM 1317 CG2 VAL A 226 -3.193 -2.384 -3.153 1.00 0.00 C ATOM 0 H VAL A 226 -1.619 -2.616 -6.230 1.00 0.00 H new ATOM 0 HA VAL A 226 -1.381 -0.528 -4.191 1.00 0.00 H new ATOM 0 HB VAL A 226 -1.428 -3.506 -3.554 1.00 0.00 H new ATOM 0 HG11 VAL A 226 -1.330 -2.757 -1.212 1.00 0.00 H new ATOM 0 HG12 VAL A 226 0.096 -2.228 -2.135 1.00 0.00 H new ATOM 0 HG13 VAL A 226 -1.202 -1.069 -1.761 1.00 0.00 H new ATOM 0 HG21 VAL A 226 -3.513 -3.031 -2.336 1.00 0.00 H new ATOM 0 HG22 VAL A 226 -3.474 -1.354 -2.932 1.00 0.00 H new ATOM 0 HG23 VAL A 226 -3.675 -2.702 -4.077 1.00 0.00 H new ATOM 1327 N LYS A 227 1.064 -0.720 -4.524 1.00 0.00 N ATOM 1328 CA LYS A 227 2.510 -0.793 -4.701 1.00 0.00 C ATOM 1329 C LYS A 227 3.235 -0.126 -3.536 1.00 0.00 C ATOM 1330 O LYS A 227 2.611 0.506 -2.683 1.00 0.00 O ATOM 1331 CB LYS A 227 2.917 -0.127 -6.017 1.00 0.00 C ATOM 1332 CG LYS A 227 2.484 1.325 -6.125 1.00 0.00 C ATOM 1333 CD LYS A 227 2.429 1.785 -7.572 1.00 0.00 C ATOM 1334 CE LYS A 227 2.225 3.289 -7.671 1.00 0.00 C ATOM 1335 NZ LYS A 227 1.482 3.667 -8.905 1.00 0.00 N ATOM 0 H LYS A 227 0.716 0.206 -4.277 1.00 0.00 H new ATOM 0 HA LYS A 227 2.795 -1.845 -4.729 1.00 0.00 H new ATOM 0 HB2 LYS A 227 4.000 -0.183 -6.123 1.00 0.00 H new ATOM 0 HB3 LYS A 227 2.487 -0.688 -6.846 1.00 0.00 H new ATOM 0 HG2 LYS A 227 1.503 1.448 -5.666 1.00 0.00 H new ATOM 0 HG3 LYS A 227 3.178 1.955 -5.568 1.00 0.00 H new ATOM 0 HD2 LYS A 227 3.354 1.508 -8.078 1.00 0.00 H new ATOM 0 HD3 LYS A 227 1.617 1.272 -8.087 1.00 0.00 H new ATOM 0 HE2 LYS A 227 1.678 3.640 -6.796 1.00 0.00 H new ATOM 0 HE3 LYS A 227 3.194 3.788 -7.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 1.363 4.700 -8.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 2.016 3.355 -9.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 0.547 3.211 -8.901 1.00 0.00 H new ATOM 1349 N PHE A 228 4.556 -0.269 -3.507 1.00 0.00 N ATOM 1350 CA PHE A 228 5.366 0.320 -2.448 1.00 0.00 C ATOM 1351 C PHE A 228 5.652 1.791 -2.736 1.00 0.00 C ATOM 1352 O PHE A 228 6.597 2.122 -3.451 1.00 0.00 O ATOM 1353 CB PHE A 228 6.681 -0.446 -2.296 1.00 0.00 C ATOM 1354 CG PHE A 228 6.527 -1.770 -1.604 1.00 0.00 C ATOM 1355 CD1 PHE A 228 6.336 -1.833 -0.233 1.00 0.00 C ATOM 1356 CD2 PHE A 228 6.573 -2.953 -2.324 1.00 0.00 C ATOM 1357 CE1 PHE A 228 6.193 -3.049 0.407 1.00 0.00 C ATOM 1358 CE2 PHE A 228 6.430 -4.173 -1.690 1.00 0.00 C ATOM 1359 CZ PHE A 228 6.242 -4.221 -0.323 1.00 0.00 C ATOM 0 H PHE A 228 5.088 -0.788 -4.205 1.00 0.00 H new ATOM 0 HA PHE A 228 4.805 0.253 -1.516 1.00 0.00 H new ATOM 0 HB2 PHE A 228 7.113 -0.609 -3.283 1.00 0.00 H new ATOM 0 HB3 PHE A 228 7.387 0.168 -1.736 1.00 0.00 H new ATOM 0 HD1 PHE A 228 6.298 -0.920 0.343 1.00 0.00 H new ATOM 0 HD2 PHE A 228 6.722 -2.922 -3.393 1.00 0.00 H new ATOM 0 HE1 PHE A 228 6.043 -3.083 1.476 1.00 0.00 H new ATOM 0 HE2 PHE A 228 6.465 -5.088 -2.263 1.00 0.00 H new ATOM 0 HZ PHE A 228 6.133 -5.173 0.175 1.00 0.00 H new