USER MOD reduce.3.24.130724 H: found=0, std=0, add=535, rem=0, adj=15 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 150:sc= -1.54 (180deg=-2.66!) USER MOD Set 1.2: A 222 SER OG : rot -170:sc= 0 USER MOD Set 2.1: A 159 ASN : amide:sc= -4.99! C(o=-6.7!,f=-9.8!) USER MOD Set 2.2: A 162 GLN : amide:sc= -1.69 K(o=-6.7,f=-9.3!) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 176 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 180 CYS SG : rot 180:sc=-0.00933 USER MOD Single : A 181 THR OG1 : rot 98:sc= 0.206 USER MOD Single : A 190 SER OG : rot 180:sc= 0 USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 193 CYS SG : rot 65:sc= -0.807 USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 198 TYR OH : rot 0:sc= -1.13 USER MOD Single : A 199 SER OG : rot 180:sc= -0.377 USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 HIS : no HD1:sc= -0.328 X(o=-0.33,f=-0.039) USER MOD Single : A 205 GLN : amide:sc= -1.37 X(o=-1.4,f=-1.9) USER MOD Single : A 209 ASN : amide:sc= -0.872 K(o=-0.87,f=-1.9!) USER MOD Single : A 212 HIS : no HD1:sc= -7.8! C(o=-7.8!,f=-9.2!) USER MOD Single : A 214 SER OG : rot 175:sc= 0.157 USER MOD Single : A 215 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 216 THR OG1 : rot 180:sc= -0.0123 USER MOD Single : A 217 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 221 SER OG : rot 180:sc= 0 USER MOD Single : A 223 SER OG : rot 180:sc= 0 USER MOD Single : A 227 LYS NZ :NH3+ -141:sc= -1.15 (180deg=-3.07!) USER MOD ----------------------------------------------------------------- ATOM 217 N LYS A 152 6.360 2.074 2.726 1.00 0.00 N ATOM 218 CA LYS A 152 5.004 2.577 2.542 1.00 0.00 C ATOM 219 C LYS A 152 4.316 1.873 1.377 1.00 0.00 C ATOM 220 O LYS A 152 4.975 1.356 0.474 1.00 0.00 O ATOM 221 CB LYS A 152 5.028 4.088 2.297 1.00 0.00 C ATOM 222 CG LYS A 152 3.784 4.804 2.795 1.00 0.00 C ATOM 223 CD LYS A 152 3.504 6.061 1.989 1.00 0.00 C ATOM 224 CE LYS A 152 2.810 7.120 2.831 1.00 0.00 C ATOM 225 NZ LYS A 152 3.786 7.991 3.543 1.00 0.00 N ATOM 0 HA LYS A 152 4.440 2.371 3.452 1.00 0.00 H new ATOM 0 HB2 LYS A 152 5.903 4.514 2.788 1.00 0.00 H new ATOM 0 HB3 LYS A 152 5.140 4.273 1.229 1.00 0.00 H new ATOM 0 HG2 LYS A 152 2.927 4.133 2.733 1.00 0.00 H new ATOM 0 HG3 LYS A 152 3.909 5.065 3.846 1.00 0.00 H new ATOM 0 HD2 LYS A 152 4.440 6.461 1.599 1.00 0.00 H new ATOM 0 HD3 LYS A 152 2.881 5.812 1.130 1.00 0.00 H new ATOM 0 HE2 LYS A 152 2.175 7.733 2.192 1.00 0.00 H new ATOM 0 HE3 LYS A 152 2.158 6.636 3.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 3.273 8.699 4.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 4.375 7.410 4.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 4.392 8.473 2.849 1.00 0.00 H new ATOM 239 N LEU A 153 2.988 1.858 1.403 1.00 0.00 N ATOM 240 CA LEU A 153 2.210 1.218 0.347 1.00 0.00 C ATOM 241 C LEU A 153 1.122 2.154 -0.171 1.00 0.00 C ATOM 242 O LEU A 153 0.304 2.658 0.599 1.00 0.00 O ATOM 243 CB LEU A 153 1.581 -0.077 0.863 1.00 0.00 C ATOM 244 CG LEU A 153 2.510 -1.289 0.941 1.00 0.00 C ATOM 245 CD1 LEU A 153 1.845 -2.423 1.707 1.00 0.00 C ATOM 246 CD2 LEU A 153 2.906 -1.748 -0.455 1.00 0.00 C ATOM 0 H LEU A 153 2.427 2.281 2.143 1.00 0.00 H new ATOM 0 HA LEU A 153 2.885 0.984 -0.476 1.00 0.00 H new ATOM 0 HB2 LEU A 153 1.176 0.110 1.858 1.00 0.00 H new ATOM 0 HB3 LEU A 153 0.739 -0.330 0.219 1.00 0.00 H new ATOM 0 HG LEU A 153 3.413 -0.996 1.476 1.00 0.00 H new ATOM 0 HD11 LEU A 153 2.521 -3.277 1.752 1.00 0.00 H new ATOM 0 HD12 LEU A 153 1.612 -2.091 2.719 1.00 0.00 H new ATOM 0 HD13 LEU A 153 0.925 -2.715 1.200 1.00 0.00 H new ATOM 0 HD21 LEU A 153 3.567 -2.611 -0.380 1.00 0.00 H new ATOM 0 HD22 LEU A 153 2.012 -2.023 -1.015 1.00 0.00 H new ATOM 0 HD23 LEU A 153 3.423 -0.939 -0.971 1.00 0.00 H new ATOM 258 N PHE A 154 1.118 2.381 -1.480 1.00 0.00 N ATOM 259 CA PHE A 154 0.130 3.255 -2.101 1.00 0.00 C ATOM 260 C PHE A 154 -1.031 2.444 -2.672 1.00 0.00 C ATOM 261 O PHE A 154 -0.860 1.675 -3.618 1.00 0.00 O ATOM 262 CB PHE A 154 0.778 4.087 -3.209 1.00 0.00 C ATOM 263 CG PHE A 154 -0.191 4.968 -3.943 1.00 0.00 C ATOM 264 CD1 PHE A 154 -0.861 5.985 -3.282 1.00 0.00 C ATOM 265 CD2 PHE A 154 -0.433 4.780 -5.294 1.00 0.00 C ATOM 266 CE1 PHE A 154 -1.755 6.797 -3.955 1.00 0.00 C ATOM 267 CE2 PHE A 154 -1.326 5.589 -5.973 1.00 0.00 C ATOM 268 CZ PHE A 154 -1.986 6.599 -5.302 1.00 0.00 C ATOM 0 H PHE A 154 1.788 1.972 -2.131 1.00 0.00 H new ATOM 0 HA PHE A 154 -0.259 3.924 -1.334 1.00 0.00 H new ATOM 0 HB2 PHE A 154 1.563 4.707 -2.775 1.00 0.00 H new ATOM 0 HB3 PHE A 154 1.259 3.417 -3.922 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -0.683 6.145 -2.229 1.00 0.00 H new ATOM 0 HD2 PHE A 154 0.082 3.992 -5.824 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -2.272 7.585 -3.428 1.00 0.00 H new ATOM 0 HE2 PHE A 154 -1.507 5.431 -7.026 1.00 0.00 H new ATOM 0 HZ PHE A 154 -2.682 7.234 -5.830 1.00 0.00 H new ATOM 278 N VAL A 155 -2.212 2.623 -2.089 1.00 0.00 N ATOM 279 CA VAL A 155 -3.402 1.910 -2.538 1.00 0.00 C ATOM 280 C VAL A 155 -4.322 2.825 -3.337 1.00 0.00 C ATOM 281 O VAL A 155 -4.686 3.909 -2.882 1.00 0.00 O ATOM 282 CB VAL A 155 -4.186 1.322 -1.350 1.00 0.00 C ATOM 283 CG1 VAL A 155 -5.316 0.431 -1.844 1.00 0.00 C ATOM 284 CG2 VAL A 155 -3.255 0.552 -0.426 1.00 0.00 C ATOM 0 H VAL A 155 -2.370 3.256 -1.305 1.00 0.00 H new ATOM 0 HA VAL A 155 -3.061 1.095 -3.177 1.00 0.00 H new ATOM 0 HB VAL A 155 -4.624 2.144 -0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -5.859 0.025 -0.990 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -5.997 1.016 -2.462 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -4.903 -0.387 -2.434 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -3.826 0.144 0.408 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -2.786 -0.262 -0.978 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -2.485 1.222 -0.044 1.00 0.00 H new ATOM 294 N GLY A 156 -4.697 2.381 -4.533 1.00 0.00 N ATOM 295 CA GLY A 156 -5.572 3.173 -5.378 1.00 0.00 C ATOM 296 C GLY A 156 -6.767 2.383 -5.875 1.00 0.00 C ATOM 297 O GLY A 156 -7.194 1.423 -5.235 1.00 0.00 O ATOM 0 H GLY A 156 -4.410 1.487 -4.932 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.921 4.042 -4.821 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -5.007 3.547 -6.232 1.00 0.00 H new ATOM 301 N MET A 157 -7.309 2.791 -7.018 1.00 0.00 N ATOM 302 CA MET A 157 -8.463 2.114 -7.600 1.00 0.00 C ATOM 303 C MET A 157 -9.397 1.598 -6.510 1.00 0.00 C ATOM 304 O MET A 157 -10.022 0.548 -6.661 1.00 0.00 O ATOM 305 CB MET A 157 -8.007 0.955 -8.489 1.00 0.00 C ATOM 306 CG MET A 157 -7.309 1.404 -9.762 1.00 0.00 C ATOM 307 SD MET A 157 -7.195 0.090 -10.992 1.00 0.00 S ATOM 308 CE MET A 157 -6.877 1.042 -12.476 1.00 0.00 C ATOM 0 H MET A 157 -6.968 3.586 -7.559 1.00 0.00 H new ATOM 0 HA MET A 157 -9.008 2.836 -8.209 1.00 0.00 H new ATOM 0 HB2 MET A 157 -7.332 0.316 -7.920 1.00 0.00 H new ATOM 0 HB3 MET A 157 -8.873 0.348 -8.754 1.00 0.00 H new ATOM 0 HG2 MET A 157 -7.848 2.250 -10.188 1.00 0.00 H new ATOM 0 HG3 MET A 157 -6.307 1.756 -9.518 1.00 0.00 H new ATOM 0 HE1 MET A 157 -6.280 0.448 -13.168 1.00 0.00 H new ATOM 0 HE2 MET A 157 -7.823 1.307 -12.948 1.00 0.00 H new ATOM 0 HE3 MET A 157 -6.334 1.951 -12.216 1.00 0.00 H new ATOM 318 N LEU A 158 -9.486 2.341 -5.413 1.00 0.00 N ATOM 319 CA LEU A 158 -10.344 1.958 -4.297 1.00 0.00 C ATOM 320 C LEU A 158 -11.784 2.400 -4.540 1.00 0.00 C ATOM 321 O LEU A 158 -12.077 3.080 -5.523 1.00 0.00 O ATOM 322 CB LEU A 158 -9.825 2.570 -2.995 1.00 0.00 C ATOM 323 CG LEU A 158 -8.573 1.921 -2.402 1.00 0.00 C ATOM 324 CD1 LEU A 158 -8.096 2.697 -1.183 1.00 0.00 C ATOM 325 CD2 LEU A 158 -8.846 0.469 -2.039 1.00 0.00 C ATOM 0 H LEU A 158 -8.975 3.212 -5.272 1.00 0.00 H new ATOM 0 HA LEU A 158 -10.325 0.871 -4.214 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -9.615 3.625 -3.171 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -10.621 2.523 -2.252 1.00 0.00 H new ATOM 0 HG LEU A 158 -7.784 1.944 -3.154 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -7.205 2.221 -0.774 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -7.860 3.721 -1.473 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.881 2.706 -0.427 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -7.944 0.023 -1.619 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -9.650 0.423 -1.305 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -9.139 -0.081 -2.933 1.00 0.00 H new ATOM 337 N ASN A 159 -12.678 2.010 -3.637 1.00 0.00 N ATOM 338 CA ASN A 159 -14.087 2.368 -3.753 1.00 0.00 C ATOM 339 C ASN A 159 -14.452 3.470 -2.763 1.00 0.00 C ATOM 340 O ASN A 159 -13.861 3.575 -1.688 1.00 0.00 O ATOM 341 CB ASN A 159 -14.967 1.139 -3.513 1.00 0.00 C ATOM 342 CG ASN A 159 -14.471 0.289 -2.359 1.00 0.00 C ATOM 343 OD1 ASN A 159 -13.389 -0.294 -2.424 1.00 0.00 O ATOM 344 ND2 ASN A 159 -15.263 0.214 -1.296 1.00 0.00 N ATOM 0 H ASN A 159 -12.452 1.446 -2.817 1.00 0.00 H new ATOM 0 HA ASN A 159 -14.260 2.740 -4.763 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -15.989 1.461 -3.311 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -14.997 0.534 -4.419 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -14.983 -0.344 -0.489 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -16.152 0.714 -1.286 1.00 0.00 H new ATOM 351 N LYS A 160 -15.430 4.290 -3.133 1.00 0.00 N ATOM 352 CA LYS A 160 -15.876 5.384 -2.279 1.00 0.00 C ATOM 353 C LYS A 160 -16.917 4.900 -1.275 1.00 0.00 C ATOM 354 O LYS A 160 -17.819 5.646 -0.895 1.00 0.00 O ATOM 355 CB LYS A 160 -16.458 6.516 -3.128 1.00 0.00 C ATOM 356 CG LYS A 160 -15.441 7.176 -4.042 1.00 0.00 C ATOM 357 CD LYS A 160 -16.070 8.285 -4.868 1.00 0.00 C ATOM 358 CE LYS A 160 -15.184 8.678 -6.041 1.00 0.00 C ATOM 359 NZ LYS A 160 -15.427 7.817 -7.232 1.00 0.00 N ATOM 0 H LYS A 160 -15.929 4.217 -4.020 1.00 0.00 H new ATOM 0 HA LYS A 160 -15.013 5.758 -1.729 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -17.275 6.122 -3.732 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -16.885 7.271 -2.468 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -14.625 7.584 -3.445 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -15.008 6.428 -4.706 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -17.042 7.958 -5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -16.246 9.156 -4.236 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -15.368 9.720 -6.302 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -14.137 8.604 -5.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -14.805 8.116 -8.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -15.227 6.825 -6.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -16.420 7.907 -7.529 1.00 0.00 H new ATOM 373 N GLN A 161 -16.785 3.648 -0.848 1.00 0.00 N ATOM 374 CA GLN A 161 -17.714 3.066 0.112 1.00 0.00 C ATOM 375 C GLN A 161 -16.984 2.620 1.375 1.00 0.00 C ATOM 376 O GLN A 161 -17.343 3.018 2.483 1.00 0.00 O ATOM 377 CB GLN A 161 -18.449 1.879 -0.512 1.00 0.00 C ATOM 378 CG GLN A 161 -19.824 1.631 0.087 1.00 0.00 C ATOM 379 CD GLN A 161 -20.264 0.186 -0.040 1.00 0.00 C ATOM 380 OE1 GLN A 161 -20.273 -0.379 -1.134 1.00 0.00 O ATOM 381 NE2 GLN A 161 -20.633 -0.422 1.082 1.00 0.00 N ATOM 0 H GLN A 161 -16.043 3.018 -1.152 1.00 0.00 H new ATOM 0 HA GLN A 161 -18.441 3.831 0.385 1.00 0.00 H new ATOM 0 HB2 GLN A 161 -18.554 2.050 -1.583 1.00 0.00 H new ATOM 0 HB3 GLN A 161 -17.842 0.982 -0.391 1.00 0.00 H new ATOM 0 HG2 GLN A 161 -19.813 1.912 1.140 1.00 0.00 H new ATOM 0 HG3 GLN A 161 -20.553 2.273 -0.407 1.00 0.00 H new ATOM 0 HE21 GLN A 161 -20.610 0.084 1.967 1.00 0.00 H new ATOM 0 HE22 GLN A 161 -20.939 -1.395 1.058 1.00 0.00 H new ATOM 390 N GLN A 162 -15.959 1.793 1.199 1.00 0.00 N ATOM 391 CA GLN A 162 -15.180 1.293 2.326 1.00 0.00 C ATOM 392 C GLN A 162 -14.610 2.444 3.147 1.00 0.00 C ATOM 393 O GLN A 162 -14.449 3.557 2.646 1.00 0.00 O ATOM 394 CB GLN A 162 -14.046 0.394 1.830 1.00 0.00 C ATOM 395 CG GLN A 162 -13.100 1.087 0.861 1.00 0.00 C ATOM 396 CD GLN A 162 -11.835 0.290 0.611 1.00 0.00 C ATOM 397 OE1 GLN A 162 -10.725 0.796 0.782 1.00 0.00 O ATOM 398 NE2 GLN A 162 -11.995 -0.963 0.203 1.00 0.00 N ATOM 0 H GLN A 162 -15.649 1.455 0.288 1.00 0.00 H new ATOM 0 HA GLN A 162 -15.844 0.710 2.964 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -13.476 0.035 2.687 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -14.474 -0.482 1.343 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -13.613 1.253 -0.086 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -12.835 2.068 1.256 1.00 0.00 H new ATOM 0 HE21 GLN A 162 -12.933 -1.342 0.074 1.00 0.00 H new ATOM 0 HE22 GLN A 162 -11.180 -1.547 0.018 1.00 0.00 H new ATOM 407 N SER A 163 -14.307 2.169 4.412 1.00 0.00 N ATOM 408 CA SER A 163 -13.758 3.184 5.304 1.00 0.00 C ATOM 409 C SER A 163 -12.484 2.684 5.977 1.00 0.00 C ATOM 410 O SER A 163 -12.017 1.579 5.702 1.00 0.00 O ATOM 411 CB SER A 163 -14.790 3.571 6.365 1.00 0.00 C ATOM 412 OG SER A 163 -16.006 3.986 5.767 1.00 0.00 O ATOM 0 H SER A 163 -14.432 1.253 4.842 1.00 0.00 H new ATOM 0 HA SER A 163 -13.512 4.063 4.708 1.00 0.00 H new ATOM 0 HB2 SER A 163 -14.976 2.722 7.023 1.00 0.00 H new ATOM 0 HB3 SER A 163 -14.394 4.374 6.986 1.00 0.00 H new ATOM 0 HG SER A 163 -16.649 4.226 6.466 1.00 0.00 H new ATOM 418 N GLU A 164 -11.926 3.506 6.861 1.00 0.00 N ATOM 419 CA GLU A 164 -10.705 3.148 7.572 1.00 0.00 C ATOM 420 C GLU A 164 -10.839 1.775 8.225 1.00 0.00 C ATOM 421 O GLU A 164 -9.907 0.970 8.199 1.00 0.00 O ATOM 422 CB GLU A 164 -10.380 4.200 8.635 1.00 0.00 C ATOM 423 CG GLU A 164 -9.499 5.328 8.125 1.00 0.00 C ATOM 424 CD GLU A 164 -9.270 6.406 9.167 1.00 0.00 C ATOM 425 OE1 GLU A 164 -10.155 6.598 10.027 1.00 0.00 O ATOM 426 OE2 GLU A 164 -8.205 7.057 9.122 1.00 0.00 O ATOM 0 H GLU A 164 -12.300 4.424 7.101 1.00 0.00 H new ATOM 0 HA GLU A 164 -9.891 3.110 6.848 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -11.311 4.621 9.014 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -9.884 3.714 9.475 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -8.538 4.920 7.812 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -9.959 5.773 7.243 1.00 0.00 H new ATOM 433 N ASP A 165 -12.003 1.515 8.810 1.00 0.00 N ATOM 434 CA ASP A 165 -12.260 0.240 9.469 1.00 0.00 C ATOM 435 C ASP A 165 -12.081 -0.921 8.495 1.00 0.00 C ATOM 436 O ASP A 165 -11.256 -1.808 8.716 1.00 0.00 O ATOM 437 CB ASP A 165 -13.673 0.219 10.053 1.00 0.00 C ATOM 438 CG ASP A 165 -13.899 1.328 11.061 1.00 0.00 C ATOM 439 OD1 ASP A 165 -14.301 2.435 10.644 1.00 0.00 O ATOM 440 OD2 ASP A 165 -13.674 1.091 12.266 1.00 0.00 O ATOM 0 H ASP A 165 -12.784 2.171 8.841 1.00 0.00 H new ATOM 0 HA ASP A 165 -11.539 0.126 10.279 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -14.398 0.313 9.245 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -13.851 -0.744 10.531 1.00 0.00 H new ATOM 445 N ASP A 166 -12.859 -0.909 7.419 1.00 0.00 N ATOM 446 CA ASP A 166 -12.787 -1.960 6.411 1.00 0.00 C ATOM 447 C ASP A 166 -11.342 -2.219 5.999 1.00 0.00 C ATOM 448 O ASP A 166 -10.825 -3.324 6.168 1.00 0.00 O ATOM 449 CB ASP A 166 -13.620 -1.580 5.186 1.00 0.00 C ATOM 450 CG ASP A 166 -15.101 -1.493 5.497 1.00 0.00 C ATOM 451 OD1 ASP A 166 -15.717 -2.549 5.753 1.00 0.00 O ATOM 452 OD2 ASP A 166 -15.646 -0.369 5.485 1.00 0.00 O ATOM 0 H ASP A 166 -13.547 -0.183 7.222 1.00 0.00 H new ATOM 0 HA ASP A 166 -13.191 -2.874 6.845 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -13.276 -0.621 4.800 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -13.460 -2.317 4.399 1.00 0.00 H new ATOM 457 N VAL A 167 -10.694 -1.194 5.455 1.00 0.00 N ATOM 458 CA VAL A 167 -9.308 -1.310 5.018 1.00 0.00 C ATOM 459 C VAL A 167 -8.413 -1.797 6.152 1.00 0.00 C ATOM 460 O VAL A 167 -7.576 -2.679 5.961 1.00 0.00 O ATOM 461 CB VAL A 167 -8.769 0.035 4.496 1.00 0.00 C ATOM 462 CG1 VAL A 167 -7.302 -0.089 4.115 1.00 0.00 C ATOM 463 CG2 VAL A 167 -9.597 0.517 3.314 1.00 0.00 C ATOM 0 H VAL A 167 -11.107 -0.273 5.306 1.00 0.00 H new ATOM 0 HA VAL A 167 -9.292 -2.039 4.207 1.00 0.00 H new ATOM 0 HB VAL A 167 -8.851 0.774 5.293 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -6.939 0.871 3.748 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -6.723 -0.386 4.989 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -7.191 -0.841 3.334 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -9.203 1.469 2.957 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -9.549 -0.219 2.512 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -10.634 0.648 3.625 1.00 0.00 H new ATOM 473 N ARG A 168 -8.596 -1.217 7.334 1.00 0.00 N ATOM 474 CA ARG A 168 -7.804 -1.592 8.500 1.00 0.00 C ATOM 475 C ARG A 168 -7.828 -3.103 8.710 1.00 0.00 C ATOM 476 O ARG A 168 -6.784 -3.754 8.722 1.00 0.00 O ATOM 477 CB ARG A 168 -8.331 -0.884 9.749 1.00 0.00 C ATOM 478 CG ARG A 168 -7.680 0.466 10.005 1.00 0.00 C ATOM 479 CD ARG A 168 -8.215 1.112 11.273 1.00 0.00 C ATOM 480 NE ARG A 168 -7.551 0.601 12.469 1.00 0.00 N ATOM 481 CZ ARG A 168 -7.783 1.063 13.693 1.00 0.00 C ATOM 482 NH1 ARG A 168 -8.659 2.040 13.881 1.00 0.00 N ATOM 483 NH2 ARG A 168 -7.138 0.548 14.732 1.00 0.00 N ATOM 0 H ARG A 168 -9.285 -0.486 7.510 1.00 0.00 H new ATOM 0 HA ARG A 168 -6.774 -1.284 8.323 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -9.408 -0.746 9.651 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -8.170 -1.526 10.615 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -6.600 0.341 10.087 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -7.861 1.125 9.156 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -8.078 2.192 11.215 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -9.287 0.930 11.348 1.00 0.00 H new ATOM 0 HE ARG A 168 -6.872 -0.152 12.359 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -9.157 2.439 13.085 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -8.835 2.393 14.822 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -6.463 -0.204 14.592 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -7.317 0.904 15.671 1.00 0.00 H new ATOM 497 N ARG A 169 -9.027 -3.653 8.876 1.00 0.00 N ATOM 498 CA ARG A 169 -9.186 -5.087 9.088 1.00 0.00 C ATOM 499 C ARG A 169 -8.691 -5.874 7.878 1.00 0.00 C ATOM 500 O ARG A 169 -7.845 -6.760 8.005 1.00 0.00 O ATOM 501 CB ARG A 169 -10.653 -5.423 9.363 1.00 0.00 C ATOM 502 CG ARG A 169 -11.205 -4.763 10.616 1.00 0.00 C ATOM 503 CD ARG A 169 -12.529 -5.382 11.035 1.00 0.00 C ATOM 504 NE ARG A 169 -12.340 -6.546 11.896 1.00 0.00 N ATOM 505 CZ ARG A 169 -13.342 -7.230 12.438 1.00 0.00 C ATOM 506 NH1 ARG A 169 -14.597 -6.867 12.209 1.00 0.00 N ATOM 507 NH2 ARG A 169 -13.090 -8.279 13.211 1.00 0.00 N ATOM 0 H ARG A 169 -9.901 -3.128 8.868 1.00 0.00 H new ATOM 0 HA ARG A 169 -8.587 -5.370 9.953 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -11.254 -5.117 8.507 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -10.758 -6.504 9.456 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -10.484 -4.860 11.427 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -11.341 -3.697 10.437 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -13.128 -4.637 11.559 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -13.089 -5.675 10.147 1.00 0.00 H new ATOM 0 HE ARG A 169 -11.387 -6.851 12.092 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -14.795 -6.061 11.616 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -15.364 -7.394 12.626 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -12.126 -8.561 13.390 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -13.860 -8.803 13.626 1.00 0.00 H new ATOM 521 N LEU A 170 -9.223 -5.544 6.707 1.00 0.00 N ATOM 522 CA LEU A 170 -8.836 -6.220 5.473 1.00 0.00 C ATOM 523 C LEU A 170 -7.322 -6.395 5.400 1.00 0.00 C ATOM 524 O LEU A 170 -6.815 -7.517 5.418 1.00 0.00 O ATOM 525 CB LEU A 170 -9.328 -5.429 4.259 1.00 0.00 C ATOM 526 CG LEU A 170 -9.357 -6.188 2.932 1.00 0.00 C ATOM 527 CD1 LEU A 170 -10.581 -7.088 2.858 1.00 0.00 C ATOM 528 CD2 LEU A 170 -9.337 -5.215 1.762 1.00 0.00 C ATOM 0 H LEU A 170 -9.924 -4.813 6.585 1.00 0.00 H new ATOM 0 HA LEU A 170 -9.298 -7.207 5.468 1.00 0.00 H new ATOM 0 HB2 LEU A 170 -10.334 -5.067 4.470 1.00 0.00 H new ATOM 0 HB3 LEU A 170 -8.692 -4.552 4.139 1.00 0.00 H new ATOM 0 HG LEU A 170 -8.467 -6.815 2.874 1.00 0.00 H new ATOM 0 HD11 LEU A 170 -10.584 -7.620 1.907 1.00 0.00 H new ATOM 0 HD12 LEU A 170 -10.553 -7.808 3.676 1.00 0.00 H new ATOM 0 HD13 LEU A 170 -11.484 -6.482 2.938 1.00 0.00 H new ATOM 0 HD21 LEU A 170 -9.358 -5.772 0.825 1.00 0.00 H new ATOM 0 HD22 LEU A 170 -10.209 -4.563 1.816 1.00 0.00 H new ATOM 0 HD23 LEU A 170 -8.430 -4.612 1.805 1.00 0.00 H new ATOM 540 N PHE A 171 -6.605 -5.279 5.321 1.00 0.00 N ATOM 541 CA PHE A 171 -5.149 -5.309 5.247 1.00 0.00 C ATOM 542 C PHE A 171 -4.567 -6.183 6.354 1.00 0.00 C ATOM 543 O PHE A 171 -4.012 -7.249 6.089 1.00 0.00 O ATOM 544 CB PHE A 171 -4.583 -3.892 5.350 1.00 0.00 C ATOM 545 CG PHE A 171 -4.639 -3.128 4.057 1.00 0.00 C ATOM 546 CD1 PHE A 171 -5.857 -2.812 3.477 1.00 0.00 C ATOM 547 CD2 PHE A 171 -3.475 -2.727 3.423 1.00 0.00 C ATOM 548 CE1 PHE A 171 -5.911 -2.110 2.287 1.00 0.00 C ATOM 549 CE2 PHE A 171 -3.523 -2.025 2.233 1.00 0.00 C ATOM 550 CZ PHE A 171 -4.743 -1.715 1.666 1.00 0.00 C ATOM 0 H PHE A 171 -7.009 -4.342 5.307 1.00 0.00 H new ATOM 0 HA PHE A 171 -4.867 -5.736 4.285 1.00 0.00 H new ATOM 0 HB2 PHE A 171 -5.137 -3.343 6.112 1.00 0.00 H new ATOM 0 HB3 PHE A 171 -3.547 -3.947 5.686 1.00 0.00 H new ATOM 0 HD1 PHE A 171 -6.774 -3.117 3.959 1.00 0.00 H new ATOM 0 HD2 PHE A 171 -2.518 -2.966 3.863 1.00 0.00 H new ATOM 0 HE1 PHE A 171 -6.866 -1.871 1.844 1.00 0.00 H new ATOM 0 HE2 PHE A 171 -2.608 -1.720 1.748 1.00 0.00 H new ATOM 0 HZ PHE A 171 -4.784 -1.164 0.738 1.00 0.00 H new ATOM 560 N GLU A 172 -4.697 -5.723 7.594 1.00 0.00 N ATOM 561 CA GLU A 172 -4.182 -6.462 8.741 1.00 0.00 C ATOM 562 C GLU A 172 -4.586 -7.932 8.666 1.00 0.00 C ATOM 563 O GLU A 172 -3.936 -8.796 9.255 1.00 0.00 O ATOM 564 CB GLU A 172 -4.695 -5.847 10.044 1.00 0.00 C ATOM 565 CG GLU A 172 -6.007 -6.444 10.525 1.00 0.00 C ATOM 566 CD GLU A 172 -6.407 -5.944 11.899 1.00 0.00 C ATOM 567 OE1 GLU A 172 -6.156 -4.757 12.196 1.00 0.00 O ATOM 568 OE2 GLU A 172 -6.971 -6.741 12.678 1.00 0.00 O ATOM 0 H GLU A 172 -5.154 -4.842 7.830 1.00 0.00 H new ATOM 0 HA GLU A 172 -3.094 -6.400 8.722 1.00 0.00 H new ATOM 0 HB2 GLU A 172 -3.940 -5.978 10.819 1.00 0.00 H new ATOM 0 HB3 GLU A 172 -4.824 -4.774 9.903 1.00 0.00 H new ATOM 0 HG2 GLU A 172 -6.795 -6.203 9.811 1.00 0.00 H new ATOM 0 HG3 GLU A 172 -5.920 -7.530 10.549 1.00 0.00 H new ATOM 575 N ALA A 173 -5.663 -8.208 7.938 1.00 0.00 N ATOM 576 CA ALA A 173 -6.153 -9.572 7.785 1.00 0.00 C ATOM 577 C ALA A 173 -5.052 -10.496 7.276 1.00 0.00 C ATOM 578 O ALA A 173 -5.181 -11.720 7.329 1.00 0.00 O ATOM 579 CB ALA A 173 -7.347 -9.601 6.843 1.00 0.00 C ATOM 0 H ALA A 173 -6.213 -7.505 7.445 1.00 0.00 H new ATOM 0 HA ALA A 173 -6.469 -9.931 8.765 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.703 -10.626 6.738 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -8.145 -8.980 7.248 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -7.050 -9.218 5.867 1.00 0.00 H new ATOM 585 N PHE A 174 -3.970 -9.904 6.781 1.00 0.00 N ATOM 586 CA PHE A 174 -2.847 -10.675 6.260 1.00 0.00 C ATOM 587 C PHE A 174 -1.554 -10.307 6.981 1.00 0.00 C ATOM 588 O PHE A 174 -1.000 -11.106 7.735 1.00 0.00 O ATOM 589 CB PHE A 174 -2.692 -10.439 4.757 1.00 0.00 C ATOM 590 CG PHE A 174 -3.885 -10.877 3.955 1.00 0.00 C ATOM 591 CD1 PHE A 174 -3.985 -12.179 3.493 1.00 0.00 C ATOM 592 CD2 PHE A 174 -4.906 -9.986 3.664 1.00 0.00 C ATOM 593 CE1 PHE A 174 -5.080 -12.584 2.754 1.00 0.00 C ATOM 594 CE2 PHE A 174 -6.004 -10.386 2.926 1.00 0.00 C ATOM 595 CZ PHE A 174 -6.091 -11.687 2.471 1.00 0.00 C ATOM 0 H PHE A 174 -3.847 -8.893 6.730 1.00 0.00 H new ATOM 0 HA PHE A 174 -3.052 -11.731 6.435 1.00 0.00 H new ATOM 0 HB2 PHE A 174 -2.515 -9.378 4.580 1.00 0.00 H new ATOM 0 HB3 PHE A 174 -1.810 -10.973 4.403 1.00 0.00 H new ATOM 0 HD1 PHE A 174 -3.198 -12.886 3.713 1.00 0.00 H new ATOM 0 HD2 PHE A 174 -4.843 -8.968 4.018 1.00 0.00 H new ATOM 0 HE1 PHE A 174 -5.145 -13.602 2.398 1.00 0.00 H new ATOM 0 HE2 PHE A 174 -6.793 -9.682 2.705 1.00 0.00 H new ATOM 0 HZ PHE A 174 -6.948 -12.002 1.895 1.00 0.00 H new ATOM 605 N GLY A 175 -1.077 -9.089 6.742 1.00 0.00 N ATOM 606 CA GLY A 175 0.148 -8.634 7.374 1.00 0.00 C ATOM 607 C GLY A 175 -0.090 -7.500 8.351 1.00 0.00 C ATOM 608 O GLY A 175 -0.992 -6.687 8.160 1.00 0.00 O ATOM 0 H GLY A 175 -1.517 -8.409 6.122 1.00 0.00 H new ATOM 0 HA2 GLY A 175 0.615 -9.468 7.897 1.00 0.00 H new ATOM 0 HA3 GLY A 175 0.849 -8.307 6.606 1.00 0.00 H new ATOM 612 N ASN A 176 0.722 -7.447 9.402 1.00 0.00 N ATOM 613 CA ASN A 176 0.594 -6.405 10.414 1.00 0.00 C ATOM 614 C ASN A 176 0.676 -5.019 9.782 1.00 0.00 C ATOM 615 O ASN A 176 1.282 -4.843 8.724 1.00 0.00 O ATOM 616 CB ASN A 176 1.685 -6.559 11.476 1.00 0.00 C ATOM 617 CG ASN A 176 1.565 -7.861 12.244 1.00 0.00 C ATOM 618 OD1 ASN A 176 2.380 -8.768 12.081 1.00 0.00 O ATOM 619 ND2 ASN A 176 0.543 -7.958 13.086 1.00 0.00 N ATOM 0 H ASN A 176 1.475 -8.113 9.575 1.00 0.00 H new ATOM 0 HA ASN A 176 -0.382 -6.512 10.887 1.00 0.00 H new ATOM 0 HB2 ASN A 176 2.663 -6.512 10.997 1.00 0.00 H new ATOM 0 HB3 ASN A 176 1.630 -5.723 12.173 1.00 0.00 H new ATOM 0 HD21 ASN A 176 0.409 -8.811 13.630 1.00 0.00 H new ATOM 0 HD22 ASN A 176 -0.109 -7.180 13.189 1.00 0.00 H new ATOM 626 N ILE A 177 0.064 -4.038 10.437 1.00 0.00 N ATOM 627 CA ILE A 177 0.070 -2.668 9.940 1.00 0.00 C ATOM 628 C ILE A 177 0.757 -1.728 10.925 1.00 0.00 C ATOM 629 O ILE A 177 0.754 -1.970 12.132 1.00 0.00 O ATOM 630 CB ILE A 177 -1.359 -2.159 9.674 1.00 0.00 C ATOM 631 CG1 ILE A 177 -2.008 -2.963 8.545 1.00 0.00 C ATOM 632 CG2 ILE A 177 -1.339 -0.677 9.333 1.00 0.00 C ATOM 633 CD1 ILE A 177 -3.437 -2.558 8.259 1.00 0.00 C ATOM 0 H ILE A 177 -0.442 -4.167 11.313 1.00 0.00 H new ATOM 0 HA ILE A 177 0.625 -2.676 9.002 1.00 0.00 H new ATOM 0 HB ILE A 177 -1.952 -2.295 10.579 1.00 0.00 H new ATOM 0 HG12 ILE A 177 -1.416 -2.843 7.638 1.00 0.00 H new ATOM 0 HG13 ILE A 177 -1.984 -4.022 8.803 1.00 0.00 H new ATOM 0 HG21 ILE A 177 -2.356 -0.333 9.148 1.00 0.00 H new ATOM 0 HG22 ILE A 177 -0.913 -0.118 10.166 1.00 0.00 H new ATOM 0 HG23 ILE A 177 -0.734 -0.517 8.441 1.00 0.00 H new ATOM 0 HD11 ILE A 177 -3.833 -3.169 7.448 1.00 0.00 H new ATOM 0 HD12 ILE A 177 -4.043 -2.705 9.153 1.00 0.00 H new ATOM 0 HD13 ILE A 177 -3.466 -1.508 7.969 1.00 0.00 H new ATOM 645 N GLU A 178 1.342 -0.655 10.402 1.00 0.00 N ATOM 646 CA GLU A 178 2.031 0.321 11.237 1.00 0.00 C ATOM 647 C GLU A 178 1.244 1.626 11.312 1.00 0.00 C ATOM 648 O GLU A 178 1.157 2.251 12.368 1.00 0.00 O ATOM 649 CB GLU A 178 3.435 0.591 10.691 1.00 0.00 C ATOM 650 CG GLU A 178 4.495 -0.344 11.250 1.00 0.00 C ATOM 651 CD GLU A 178 4.363 -0.548 12.746 1.00 0.00 C ATOM 652 OE1 GLU A 178 4.883 0.294 13.508 1.00 0.00 O ATOM 653 OE2 GLU A 178 3.740 -1.550 13.156 1.00 0.00 O ATOM 0 H GLU A 178 1.352 -0.440 9.405 1.00 0.00 H new ATOM 0 HA GLU A 178 2.112 -0.092 12.242 1.00 0.00 H new ATOM 0 HB2 GLU A 178 3.417 0.499 9.605 1.00 0.00 H new ATOM 0 HB3 GLU A 178 3.713 1.620 10.919 1.00 0.00 H new ATOM 0 HG2 GLU A 178 4.424 -1.309 10.748 1.00 0.00 H new ATOM 0 HG3 GLU A 178 5.483 0.059 11.028 1.00 0.00 H new ATOM 660 N GLU A 179 0.672 2.031 10.182 1.00 0.00 N ATOM 661 CA GLU A 179 -0.108 3.261 10.119 1.00 0.00 C ATOM 662 C GLU A 179 -0.947 3.310 8.845 1.00 0.00 C ATOM 663 O GLU A 179 -0.446 3.056 7.749 1.00 0.00 O ATOM 664 CB GLU A 179 0.816 4.480 10.181 1.00 0.00 C ATOM 665 CG GLU A 179 0.163 5.708 10.793 1.00 0.00 C ATOM 666 CD GLU A 179 -0.745 6.432 9.818 1.00 0.00 C ATOM 667 OE1 GLU A 179 -0.223 7.033 8.855 1.00 0.00 O ATOM 668 OE2 GLU A 179 -1.977 6.399 10.017 1.00 0.00 O ATOM 0 H GLU A 179 0.734 1.525 9.298 1.00 0.00 H new ATOM 0 HA GLU A 179 -0.781 3.279 10.977 1.00 0.00 H new ATOM 0 HB2 GLU A 179 1.703 4.224 10.760 1.00 0.00 H new ATOM 0 HB3 GLU A 179 1.152 4.722 9.173 1.00 0.00 H new ATOM 0 HG2 GLU A 179 -0.414 5.410 11.668 1.00 0.00 H new ATOM 0 HG3 GLU A 179 0.937 6.392 11.139 1.00 0.00 H new ATOM 675 N CYS A 180 -2.225 3.637 8.998 1.00 0.00 N ATOM 676 CA CYS A 180 -3.135 3.718 7.861 1.00 0.00 C ATOM 677 C CYS A 180 -3.733 5.116 7.742 1.00 0.00 C ATOM 678 O CYS A 180 -4.087 5.740 8.742 1.00 0.00 O ATOM 679 CB CYS A 180 -4.252 2.683 8.001 1.00 0.00 C ATOM 680 SG CYS A 180 -5.387 2.628 6.594 1.00 0.00 S ATOM 0 H CYS A 180 -2.655 3.850 9.898 1.00 0.00 H new ATOM 0 HA CYS A 180 -2.566 3.508 6.956 1.00 0.00 H new ATOM 0 HB2 CYS A 180 -3.805 1.697 8.133 1.00 0.00 H new ATOM 0 HB3 CYS A 180 -4.821 2.898 8.905 1.00 0.00 H new ATOM 0 HG CYS A 180 -6.295 1.722 6.804 1.00 0.00 H new ATOM 686 N THR A 181 -3.840 5.605 6.510 1.00 0.00 N ATOM 687 CA THR A 181 -4.392 6.930 6.259 1.00 0.00 C ATOM 688 C THR A 181 -5.128 6.976 4.924 1.00 0.00 C ATOM 689 O THR A 181 -4.595 6.556 3.897 1.00 0.00 O ATOM 690 CB THR A 181 -3.291 8.007 6.262 1.00 0.00 C ATOM 691 OG1 THR A 181 -2.710 8.109 7.567 1.00 0.00 O ATOM 692 CG2 THR A 181 -3.853 9.357 5.845 1.00 0.00 C ATOM 0 H THR A 181 -3.551 5.103 5.671 1.00 0.00 H new ATOM 0 HA THR A 181 -5.095 7.137 7.066 1.00 0.00 H new ATOM 0 HB THR A 181 -2.524 7.714 5.545 1.00 0.00 H new ATOM 0 HG1 THR A 181 -1.881 7.588 7.597 1.00 0.00 H new ATOM 0 HG21 THR A 181 -3.057 10.101 5.855 1.00 0.00 H new ATOM 0 HG22 THR A 181 -4.269 9.283 4.840 1.00 0.00 H new ATOM 0 HG23 THR A 181 -4.637 9.655 6.541 1.00 0.00 H new ATOM 700 N ILE A 182 -6.353 7.488 4.947 1.00 0.00 N ATOM 701 CA ILE A 182 -7.161 7.590 3.738 1.00 0.00 C ATOM 702 C ILE A 182 -6.995 8.955 3.079 1.00 0.00 C ATOM 703 O ILE A 182 -7.107 9.991 3.736 1.00 0.00 O ATOM 704 CB ILE A 182 -8.653 7.354 4.036 1.00 0.00 C ATOM 705 CG1 ILE A 182 -8.835 6.083 4.867 1.00 0.00 C ATOM 706 CG2 ILE A 182 -9.444 7.264 2.739 1.00 0.00 C ATOM 707 CD1 ILE A 182 -8.522 4.813 4.106 1.00 0.00 C ATOM 0 H ILE A 182 -6.808 7.839 5.790 1.00 0.00 H new ATOM 0 HA ILE A 182 -6.808 6.815 3.057 1.00 0.00 H new ATOM 0 HB ILE A 182 -9.032 8.199 4.612 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -8.192 6.138 5.746 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -9.863 6.038 5.226 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -10.497 7.097 2.966 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -9.336 8.194 2.182 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -9.066 6.436 2.139 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -8.673 3.952 4.757 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -9.182 4.734 3.242 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -7.485 4.836 3.770 1.00 0.00 H new ATOM 719 N LEU A 183 -6.728 8.949 1.778 1.00 0.00 N ATOM 720 CA LEU A 183 -6.549 10.188 1.028 1.00 0.00 C ATOM 721 C LEU A 183 -7.850 10.609 0.352 1.00 0.00 C ATOM 722 O LEU A 183 -8.300 9.973 -0.601 1.00 0.00 O ATOM 723 CB LEU A 183 -5.448 10.017 -0.021 1.00 0.00 C ATOM 724 CG LEU A 183 -4.046 9.731 0.518 1.00 0.00 C ATOM 725 CD1 LEU A 183 -3.116 9.314 -0.610 1.00 0.00 C ATOM 726 CD2 LEU A 183 -3.494 10.950 1.243 1.00 0.00 C ATOM 0 H LEU A 183 -6.631 8.101 1.220 1.00 0.00 H new ATOM 0 HA LEU A 183 -6.257 10.969 1.729 1.00 0.00 H new ATOM 0 HB2 LEU A 183 -5.732 9.203 -0.688 1.00 0.00 H new ATOM 0 HB3 LEU A 183 -5.405 10.923 -0.625 1.00 0.00 H new ATOM 0 HG LEU A 183 -4.112 8.909 1.230 1.00 0.00 H new ATOM 0 HD11 LEU A 183 -2.123 9.115 -0.208 1.00 0.00 H new ATOM 0 HD12 LEU A 183 -3.503 8.413 -1.086 1.00 0.00 H new ATOM 0 HD13 LEU A 183 -3.055 10.115 -1.346 1.00 0.00 H new ATOM 0 HD21 LEU A 183 -2.496 10.728 1.620 1.00 0.00 H new ATOM 0 HD22 LEU A 183 -3.442 11.792 0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 183 -4.148 11.205 2.077 1.00 0.00 H new ATOM 816 N SER A 190 -13.339 11.415 -0.796 1.00 0.00 N ATOM 817 CA SER A 190 -12.496 10.267 -1.111 1.00 0.00 C ATOM 818 C SER A 190 -12.220 10.192 -2.609 1.00 0.00 C ATOM 819 O SER A 190 -13.115 10.394 -3.429 1.00 0.00 O ATOM 820 CB SER A 190 -13.162 8.974 -0.638 1.00 0.00 C ATOM 821 OG SER A 190 -12.654 7.853 -1.340 1.00 0.00 O ATOM 0 HA SER A 190 -11.547 10.390 -0.590 1.00 0.00 H new ATOM 0 HB2 SER A 190 -12.994 8.844 0.431 1.00 0.00 H new ATOM 0 HB3 SER A 190 -14.240 9.041 -0.785 1.00 0.00 H new ATOM 0 HG SER A 190 -13.094 7.039 -1.018 1.00 0.00 H new ATOM 827 N LYS A 191 -10.972 9.899 -2.960 1.00 0.00 N ATOM 828 CA LYS A 191 -10.574 9.794 -4.359 1.00 0.00 C ATOM 829 C LYS A 191 -9.996 8.415 -4.659 1.00 0.00 C ATOM 830 O LYS A 191 -9.154 8.263 -5.543 1.00 0.00 O ATOM 831 CB LYS A 191 -9.546 10.875 -4.700 1.00 0.00 C ATOM 832 CG LYS A 191 -8.385 10.940 -3.724 1.00 0.00 C ATOM 833 CD LYS A 191 -7.750 12.320 -3.702 1.00 0.00 C ATOM 834 CE LYS A 191 -6.660 12.416 -2.646 1.00 0.00 C ATOM 835 NZ LYS A 191 -5.349 11.927 -3.155 1.00 0.00 N ATOM 0 H LYS A 191 -10.218 9.730 -2.294 1.00 0.00 H new ATOM 0 HA LYS A 191 -11.462 9.938 -4.975 1.00 0.00 H new ATOM 0 HB2 LYS A 191 -9.158 10.692 -5.702 1.00 0.00 H new ATOM 0 HB3 LYS A 191 -10.045 11.844 -4.724 1.00 0.00 H new ATOM 0 HG2 LYS A 191 -8.735 10.684 -2.724 1.00 0.00 H new ATOM 0 HG3 LYS A 191 -7.635 10.198 -3.999 1.00 0.00 H new ATOM 0 HD2 LYS A 191 -7.329 12.543 -4.682 1.00 0.00 H new ATOM 0 HD3 LYS A 191 -8.515 13.071 -3.505 1.00 0.00 H new ATOM 0 HE2 LYS A 191 -6.560 13.452 -2.321 1.00 0.00 H new ATOM 0 HE3 LYS A 191 -6.950 11.834 -1.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 191 -4.633 12.009 -2.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 191 -5.437 10.931 -3.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 191 -5.060 12.499 -3.974 1.00 0.00 H new ATOM 849 N GLY A 192 -10.456 7.411 -3.917 1.00 0.00 N ATOM 850 CA GLY A 192 -9.974 6.058 -4.120 1.00 0.00 C ATOM 851 C GLY A 192 -8.470 5.948 -3.965 1.00 0.00 C ATOM 852 O GLY A 192 -7.795 5.346 -4.802 1.00 0.00 O ATOM 0 H GLY A 192 -11.153 7.511 -3.180 1.00 0.00 H new ATOM 0 HA2 GLY A 192 -10.459 5.392 -3.406 1.00 0.00 H new ATOM 0 HA3 GLY A 192 -10.259 5.720 -5.116 1.00 0.00 H new ATOM 856 N CYS A 193 -7.943 6.532 -2.895 1.00 0.00 N ATOM 857 CA CYS A 193 -6.508 6.499 -2.634 1.00 0.00 C ATOM 858 C CYS A 193 -6.225 6.588 -1.138 1.00 0.00 C ATOM 859 O CYS A 193 -6.903 7.311 -0.410 1.00 0.00 O ATOM 860 CB CYS A 193 -5.810 7.646 -3.366 1.00 0.00 C ATOM 861 SG CYS A 193 -6.267 7.796 -5.109 1.00 0.00 S ATOM 0 H CYS A 193 -8.488 7.034 -2.194 1.00 0.00 H new ATOM 0 HA CYS A 193 -6.118 5.550 -3.003 1.00 0.00 H new ATOM 0 HB2 CYS A 193 -6.043 8.582 -2.858 1.00 0.00 H new ATOM 0 HB3 CYS A 193 -4.731 7.505 -3.295 1.00 0.00 H new ATOM 0 HG CYS A 193 -7.527 8.102 -5.202 1.00 0.00 H new ATOM 867 N ALA A 194 -5.220 5.845 -0.687 1.00 0.00 N ATOM 868 CA ALA A 194 -4.847 5.839 0.722 1.00 0.00 C ATOM 869 C ALA A 194 -3.440 5.283 0.915 1.00 0.00 C ATOM 870 O ALA A 194 -2.928 4.553 0.066 1.00 0.00 O ATOM 871 CB ALA A 194 -5.852 5.032 1.531 1.00 0.00 C ATOM 0 H ALA A 194 -4.649 5.239 -1.277 1.00 0.00 H new ATOM 0 HA ALA A 194 -4.854 6.869 1.079 1.00 0.00 H new ATOM 0 HB1 ALA A 194 -5.561 5.036 2.581 1.00 0.00 H new ATOM 0 HB2 ALA A 194 -6.842 5.475 1.427 1.00 0.00 H new ATOM 0 HB3 ALA A 194 -5.874 4.006 1.165 1.00 0.00 H new ATOM 877 N PHE A 195 -2.820 5.633 2.037 1.00 0.00 N ATOM 878 CA PHE A 195 -1.471 5.170 2.341 1.00 0.00 C ATOM 879 C PHE A 195 -1.484 4.183 3.505 1.00 0.00 C ATOM 880 O PHE A 195 -1.988 4.487 4.586 1.00 0.00 O ATOM 881 CB PHE A 195 -0.564 6.357 2.674 1.00 0.00 C ATOM 882 CG PHE A 195 -0.076 7.097 1.461 1.00 0.00 C ATOM 883 CD1 PHE A 195 0.591 6.429 0.448 1.00 0.00 C ATOM 884 CD2 PHE A 195 -0.285 8.461 1.335 1.00 0.00 C ATOM 885 CE1 PHE A 195 1.042 7.108 -0.669 1.00 0.00 C ATOM 886 CE2 PHE A 195 0.163 9.145 0.221 1.00 0.00 C ATOM 887 CZ PHE A 195 0.826 8.467 -0.783 1.00 0.00 C ATOM 0 H PHE A 195 -3.230 6.236 2.751 1.00 0.00 H new ATOM 0 HA PHE A 195 -1.082 4.660 1.460 1.00 0.00 H new ATOM 0 HB2 PHE A 195 -1.106 7.049 3.318 1.00 0.00 H new ATOM 0 HB3 PHE A 195 0.295 6.000 3.242 1.00 0.00 H new ATOM 0 HD1 PHE A 195 0.761 5.366 0.531 1.00 0.00 H new ATOM 0 HD2 PHE A 195 -0.804 8.996 2.117 1.00 0.00 H new ATOM 0 HE1 PHE A 195 1.563 6.576 -1.451 1.00 0.00 H new ATOM 0 HE2 PHE A 195 -0.005 10.208 0.136 1.00 0.00 H new ATOM 0 HZ PHE A 195 1.175 8.999 -1.656 1.00 0.00 H new ATOM 897 N VAL A 196 -0.925 2.999 3.275 1.00 0.00 N ATOM 898 CA VAL A 196 -0.871 1.967 4.303 1.00 0.00 C ATOM 899 C VAL A 196 0.567 1.543 4.581 1.00 0.00 C ATOM 900 O VAL A 196 1.373 1.401 3.661 1.00 0.00 O ATOM 901 CB VAL A 196 -1.691 0.728 3.898 1.00 0.00 C ATOM 902 CG1 VAL A 196 -1.585 -0.354 4.962 1.00 0.00 C ATOM 903 CG2 VAL A 196 -3.144 1.107 3.655 1.00 0.00 C ATOM 0 H VAL A 196 -0.503 2.731 2.386 1.00 0.00 H new ATOM 0 HA VAL A 196 -1.301 2.398 5.207 1.00 0.00 H new ATOM 0 HB VAL A 196 -1.282 0.332 2.969 1.00 0.00 H new ATOM 0 HG11 VAL A 196 -2.171 -1.222 4.658 1.00 0.00 H new ATOM 0 HG12 VAL A 196 -0.541 -0.645 5.082 1.00 0.00 H new ATOM 0 HG13 VAL A 196 -1.967 0.028 5.909 1.00 0.00 H new ATOM 0 HG21 VAL A 196 -3.709 0.219 3.370 1.00 0.00 H new ATOM 0 HG22 VAL A 196 -3.567 1.529 4.567 1.00 0.00 H new ATOM 0 HG23 VAL A 196 -3.199 1.845 2.854 1.00 0.00 H new ATOM 913 N LYS A 197 0.882 1.340 5.856 1.00 0.00 N ATOM 914 CA LYS A 197 2.223 0.929 6.257 1.00 0.00 C ATOM 915 C LYS A 197 2.199 -0.454 6.898 1.00 0.00 C ATOM 916 O LYS A 197 1.249 -0.809 7.596 1.00 0.00 O ATOM 917 CB LYS A 197 2.819 1.946 7.234 1.00 0.00 C ATOM 918 CG LYS A 197 3.396 3.176 6.555 1.00 0.00 C ATOM 919 CD LYS A 197 3.726 4.265 7.561 1.00 0.00 C ATOM 920 CE LYS A 197 4.208 5.533 6.873 1.00 0.00 C ATOM 921 NZ LYS A 197 5.663 5.476 6.561 1.00 0.00 N ATOM 0 H LYS A 197 0.227 1.453 6.630 1.00 0.00 H new ATOM 0 HA LYS A 197 2.845 0.885 5.363 1.00 0.00 H new ATOM 0 HB2 LYS A 197 2.046 2.258 7.937 1.00 0.00 H new ATOM 0 HB3 LYS A 197 3.603 1.462 7.816 1.00 0.00 H new ATOM 0 HG2 LYS A 197 4.297 2.901 6.007 1.00 0.00 H new ATOM 0 HG3 LYS A 197 2.683 3.558 5.825 1.00 0.00 H new ATOM 0 HD2 LYS A 197 2.843 4.488 8.160 1.00 0.00 H new ATOM 0 HD3 LYS A 197 4.494 3.908 8.247 1.00 0.00 H new ATOM 0 HE2 LYS A 197 3.645 5.683 5.952 1.00 0.00 H new ATOM 0 HE3 LYS A 197 4.007 6.392 7.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 5.952 6.358 6.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 6.203 5.358 7.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 5.851 4.671 5.930 1.00 0.00 H new ATOM 935 N TYR A 198 3.250 -1.231 6.658 1.00 0.00 N ATOM 936 CA TYR A 198 3.348 -2.576 7.212 1.00 0.00 C ATOM 937 C TYR A 198 4.571 -2.705 8.116 1.00 0.00 C ATOM 938 O TYR A 198 5.377 -1.781 8.223 1.00 0.00 O ATOM 939 CB TYR A 198 3.421 -3.609 6.087 1.00 0.00 C ATOM 940 CG TYR A 198 2.066 -4.053 5.584 1.00 0.00 C ATOM 941 CD1 TYR A 198 1.343 -3.269 4.693 1.00 0.00 C ATOM 942 CD2 TYR A 198 1.509 -5.257 5.999 1.00 0.00 C ATOM 943 CE1 TYR A 198 0.104 -3.671 4.231 1.00 0.00 C ATOM 944 CE2 TYR A 198 0.272 -5.667 5.541 1.00 0.00 C ATOM 945 CZ TYR A 198 -0.427 -4.870 4.658 1.00 0.00 C ATOM 946 OH TYR A 198 -1.660 -5.274 4.200 1.00 0.00 O ATOM 0 H TYR A 198 4.046 -0.952 6.084 1.00 0.00 H new ATOM 0 HA TYR A 198 2.455 -2.761 7.810 1.00 0.00 H new ATOM 0 HB2 TYR A 198 3.988 -3.189 5.256 1.00 0.00 H new ATOM 0 HB3 TYR A 198 3.972 -4.481 6.441 1.00 0.00 H new ATOM 0 HD1 TYR A 198 1.756 -2.330 4.356 1.00 0.00 H new ATOM 0 HD2 TYR A 198 2.053 -5.883 6.691 1.00 0.00 H new ATOM 0 HE1 TYR A 198 -0.445 -3.050 3.539 1.00 0.00 H new ATOM 0 HE2 TYR A 198 -0.146 -6.606 5.872 1.00 0.00 H new ATOM 0 HH TYR A 198 -2.018 -4.600 3.586 1.00 0.00 H new ATOM 956 N SER A 199 4.701 -3.858 8.763 1.00 0.00 N ATOM 957 CA SER A 199 5.823 -4.109 9.660 1.00 0.00 C ATOM 958 C SER A 199 7.104 -4.362 8.871 1.00 0.00 C ATOM 959 O SER A 199 8.129 -3.725 9.110 1.00 0.00 O ATOM 960 CB SER A 199 5.523 -5.305 10.565 1.00 0.00 C ATOM 961 OG SER A 199 5.654 -6.526 9.857 1.00 0.00 O ATOM 0 H SER A 199 4.043 -4.634 8.683 1.00 0.00 H new ATOM 0 HA SER A 199 5.967 -3.223 10.278 1.00 0.00 H new ATOM 0 HB2 SER A 199 6.203 -5.300 11.417 1.00 0.00 H new ATOM 0 HB3 SER A 199 4.512 -5.219 10.964 1.00 0.00 H new ATOM 0 HG SER A 199 5.459 -7.275 10.458 1.00 0.00 H new ATOM 967 N SER A 200 7.036 -5.298 7.930 1.00 0.00 N ATOM 968 CA SER A 200 8.190 -5.640 7.107 1.00 0.00 C ATOM 969 C SER A 200 7.785 -5.808 5.646 1.00 0.00 C ATOM 970 O SER A 200 6.632 -5.581 5.279 1.00 0.00 O ATOM 971 CB SER A 200 8.845 -6.925 7.618 1.00 0.00 C ATOM 972 OG SER A 200 8.102 -8.066 7.226 1.00 0.00 O ATOM 0 H SER A 200 6.194 -5.833 7.719 1.00 0.00 H new ATOM 0 HA SER A 200 8.908 -4.823 7.175 1.00 0.00 H new ATOM 0 HB2 SER A 200 9.861 -6.998 7.231 1.00 0.00 H new ATOM 0 HB3 SER A 200 8.920 -6.892 8.705 1.00 0.00 H new ATOM 0 HG SER A 200 8.542 -8.874 7.563 1.00 0.00 H new ATOM 978 N HIS A 201 8.743 -6.208 4.815 1.00 0.00 N ATOM 979 CA HIS A 201 8.487 -6.408 3.393 1.00 0.00 C ATOM 980 C HIS A 201 7.630 -7.649 3.164 1.00 0.00 C ATOM 981 O HIS A 201 6.586 -7.583 2.515 1.00 0.00 O ATOM 982 CB HIS A 201 9.805 -6.537 2.629 1.00 0.00 C ATOM 983 CG HIS A 201 9.662 -6.346 1.151 1.00 0.00 C ATOM 984 ND1 HIS A 201 10.513 -5.555 0.408 1.00 0.00 N ATOM 985 CD2 HIS A 201 8.760 -6.851 0.276 1.00 0.00 C ATOM 986 CE1 HIS A 201 10.140 -5.580 -0.859 1.00 0.00 C ATOM 987 NE2 HIS A 201 9.079 -6.359 -0.966 1.00 0.00 N ATOM 0 H HIS A 201 9.703 -6.400 5.102 1.00 0.00 H new ATOM 0 HA HIS A 201 7.944 -5.539 3.022 1.00 0.00 H new ATOM 0 HB2 HIS A 201 10.512 -5.803 3.015 1.00 0.00 H new ATOM 0 HB3 HIS A 201 10.231 -7.522 2.820 1.00 0.00 H new ATOM 0 HD2 HIS A 201 7.942 -7.516 0.511 1.00 0.00 H new ATOM 0 HE1 HIS A 201 10.621 -5.053 -1.670 1.00 0.00 H new ATOM 0 HE2 HIS A 201 8.578 -6.562 -1.831 1.00 0.00 H new ATOM 995 N ALA A 202 8.078 -8.779 3.702 1.00 0.00 N ATOM 996 CA ALA A 202 7.351 -10.034 3.557 1.00 0.00 C ATOM 997 C ALA A 202 5.848 -9.819 3.703 1.00 0.00 C ATOM 998 O ALA A 202 5.085 -10.060 2.768 1.00 0.00 O ATOM 999 CB ALA A 202 7.842 -11.049 4.579 1.00 0.00 C ATOM 0 H ALA A 202 8.940 -8.851 4.242 1.00 0.00 H new ATOM 0 HA ALA A 202 7.540 -10.421 2.556 1.00 0.00 H new ATOM 0 HB1 ALA A 202 7.291 -11.982 4.459 1.00 0.00 H new ATOM 0 HB2 ALA A 202 8.905 -11.234 4.426 1.00 0.00 H new ATOM 0 HB3 ALA A 202 7.682 -10.659 5.584 1.00 0.00 H new ATOM 1005 N GLU A 203 5.432 -9.364 4.880 1.00 0.00 N ATOM 1006 CA GLU A 203 4.019 -9.118 5.147 1.00 0.00 C ATOM 1007 C GLU A 203 3.380 -8.328 4.009 1.00 0.00 C ATOM 1008 O GLU A 203 2.258 -8.616 3.592 1.00 0.00 O ATOM 1009 CB GLU A 203 3.851 -8.360 6.466 1.00 0.00 C ATOM 1010 CG GLU A 203 4.154 -9.202 7.694 1.00 0.00 C ATOM 1011 CD GLU A 203 2.969 -10.040 8.133 1.00 0.00 C ATOM 1012 OE1 GLU A 203 2.329 -10.666 7.263 1.00 0.00 O ATOM 1013 OE2 GLU A 203 2.682 -10.070 9.348 1.00 0.00 O ATOM 0 H GLU A 203 6.052 -9.158 5.663 1.00 0.00 H new ATOM 0 HA GLU A 203 3.517 -10.082 5.224 1.00 0.00 H new ATOM 0 HB2 GLU A 203 4.507 -7.490 6.461 1.00 0.00 H new ATOM 0 HB3 GLU A 203 2.829 -7.988 6.534 1.00 0.00 H new ATOM 0 HG2 GLU A 203 4.999 -9.857 7.481 1.00 0.00 H new ATOM 0 HG3 GLU A 203 4.456 -8.549 8.513 1.00 0.00 H new ATOM 1020 N ALA A 204 4.103 -7.330 3.510 1.00 0.00 N ATOM 1021 CA ALA A 204 3.608 -6.499 2.419 1.00 0.00 C ATOM 1022 C ALA A 204 3.305 -7.339 1.183 1.00 0.00 C ATOM 1023 O ALA A 204 2.187 -7.321 0.669 1.00 0.00 O ATOM 1024 CB ALA A 204 4.618 -5.411 2.085 1.00 0.00 C ATOM 0 H ALA A 204 5.033 -7.078 3.844 1.00 0.00 H new ATOM 0 HA ALA A 204 2.679 -6.030 2.744 1.00 0.00 H new ATOM 0 HB1 ALA A 204 4.236 -4.798 1.269 1.00 0.00 H new ATOM 0 HB2 ALA A 204 4.783 -4.786 2.962 1.00 0.00 H new ATOM 0 HB3 ALA A 204 5.560 -5.869 1.784 1.00 0.00 H new ATOM 1030 N GLN A 205 4.307 -8.074 0.712 1.00 0.00 N ATOM 1031 CA GLN A 205 4.146 -8.919 -0.465 1.00 0.00 C ATOM 1032 C GLN A 205 2.876 -9.758 -0.364 1.00 0.00 C ATOM 1033 O GLN A 205 2.145 -9.915 -1.341 1.00 0.00 O ATOM 1034 CB GLN A 205 5.362 -9.832 -0.634 1.00 0.00 C ATOM 1035 CG GLN A 205 5.174 -10.907 -1.692 1.00 0.00 C ATOM 1036 CD GLN A 205 4.461 -10.391 -2.927 1.00 0.00 C ATOM 1037 OE1 GLN A 205 3.440 -10.940 -3.342 1.00 0.00 O ATOM 1038 NE2 GLN A 205 4.996 -9.331 -3.520 1.00 0.00 N ATOM 0 H GLN A 205 5.238 -8.101 1.127 1.00 0.00 H new ATOM 0 HA GLN A 205 4.063 -8.271 -1.337 1.00 0.00 H new ATOM 0 HB2 GLN A 205 6.228 -9.224 -0.895 1.00 0.00 H new ATOM 0 HB3 GLN A 205 5.583 -10.309 0.321 1.00 0.00 H new ATOM 0 HG2 GLN A 205 6.148 -11.304 -1.978 1.00 0.00 H new ATOM 0 HG3 GLN A 205 4.605 -11.734 -1.267 1.00 0.00 H new ATOM 0 HE21 GLN A 205 5.843 -8.908 -3.141 1.00 0.00 H new ATOM 0 HE22 GLN A 205 4.560 -8.939 -4.355 1.00 0.00 H new ATOM 1047 N ALA A 206 2.621 -10.294 0.825 1.00 0.00 N ATOM 1048 CA ALA A 206 1.438 -11.115 1.054 1.00 0.00 C ATOM 1049 C ALA A 206 0.161 -10.318 0.812 1.00 0.00 C ATOM 1050 O ALA A 206 -0.717 -10.747 0.064 1.00 0.00 O ATOM 1051 CB ALA A 206 1.452 -11.677 2.469 1.00 0.00 C ATOM 0 H ALA A 206 3.217 -10.175 1.644 1.00 0.00 H new ATOM 0 HA ALA A 206 1.458 -11.943 0.345 1.00 0.00 H new ATOM 0 HB1 ALA A 206 0.563 -12.288 2.627 1.00 0.00 H new ATOM 0 HB2 ALA A 206 2.343 -12.289 2.608 1.00 0.00 H new ATOM 0 HB3 ALA A 206 1.460 -10.856 3.186 1.00 0.00 H new ATOM 1057 N ALA A 207 0.064 -9.157 1.451 1.00 0.00 N ATOM 1058 CA ALA A 207 -1.106 -8.299 1.303 1.00 0.00 C ATOM 1059 C ALA A 207 -1.273 -7.843 -0.142 1.00 0.00 C ATOM 1060 O ALA A 207 -2.375 -7.498 -0.570 1.00 0.00 O ATOM 1061 CB ALA A 207 -1.000 -7.097 2.230 1.00 0.00 C ATOM 0 H ALA A 207 0.781 -8.789 2.076 1.00 0.00 H new ATOM 0 HA ALA A 207 -1.988 -8.878 1.577 1.00 0.00 H new ATOM 0 HB1 ALA A 207 -1.880 -6.465 2.109 1.00 0.00 H new ATOM 0 HB2 ALA A 207 -0.938 -7.439 3.263 1.00 0.00 H new ATOM 0 HB3 ALA A 207 -0.106 -6.525 1.983 1.00 0.00 H new ATOM 1067 N ILE A 208 -0.174 -7.843 -0.888 1.00 0.00 N ATOM 1068 CA ILE A 208 -0.200 -7.429 -2.286 1.00 0.00 C ATOM 1069 C ILE A 208 -0.896 -8.470 -3.155 1.00 0.00 C ATOM 1070 O ILE A 208 -2.010 -8.252 -3.630 1.00 0.00 O ATOM 1071 CB ILE A 208 1.222 -7.190 -2.829 1.00 0.00 C ATOM 1072 CG1 ILE A 208 1.798 -5.893 -2.258 1.00 0.00 C ATOM 1073 CG2 ILE A 208 1.207 -7.146 -4.349 1.00 0.00 C ATOM 1074 CD1 ILE A 208 3.234 -5.640 -2.663 1.00 0.00 C ATOM 0 H ILE A 208 0.746 -8.125 -0.548 1.00 0.00 H new ATOM 0 HA ILE A 208 -0.758 -6.494 -2.328 1.00 0.00 H new ATOM 0 HB ILE A 208 1.859 -8.017 -2.515 1.00 0.00 H new ATOM 0 HG12 ILE A 208 1.183 -5.056 -2.588 1.00 0.00 H new ATOM 0 HG13 ILE A 208 1.736 -5.925 -1.170 1.00 0.00 H new ATOM 0 HG21 ILE A 208 2.219 -6.976 -4.718 1.00 0.00 H new ATOM 0 HG22 ILE A 208 0.833 -8.094 -4.737 1.00 0.00 H new ATOM 0 HG23 ILE A 208 0.558 -6.336 -4.683 1.00 0.00 H new ATOM 0 HD11 ILE A 208 3.577 -4.704 -2.222 1.00 0.00 H new ATOM 0 HD12 ILE A 208 3.861 -6.458 -2.310 1.00 0.00 H new ATOM 0 HD13 ILE A 208 3.300 -5.575 -3.749 1.00 0.00 H new ATOM 1086 N ASN A 209 -0.232 -9.604 -3.357 1.00 0.00 N ATOM 1087 CA ASN A 209 -0.788 -10.681 -4.168 1.00 0.00 C ATOM 1088 C ASN A 209 -2.164 -11.094 -3.655 1.00 0.00 C ATOM 1089 O ASN A 209 -3.069 -11.381 -4.438 1.00 0.00 O ATOM 1090 CB ASN A 209 0.153 -11.887 -4.165 1.00 0.00 C ATOM 1091 CG ASN A 209 -0.555 -13.174 -4.543 1.00 0.00 C ATOM 1092 OD1 ASN A 209 -1.484 -13.170 -5.351 1.00 0.00 O ATOM 1093 ND2 ASN A 209 -0.119 -14.283 -3.957 1.00 0.00 N ATOM 0 H ASN A 209 0.691 -9.801 -2.970 1.00 0.00 H new ATOM 0 HA ASN A 209 -0.896 -10.315 -5.189 1.00 0.00 H new ATOM 0 HB2 ASN A 209 0.971 -11.708 -4.862 1.00 0.00 H new ATOM 0 HB3 ASN A 209 0.596 -11.996 -3.175 1.00 0.00 H new ATOM 0 HD21 ASN A 209 -0.557 -15.179 -4.171 1.00 0.00 H new ATOM 0 HD22 ASN A 209 0.654 -14.239 -3.293 1.00 0.00 H new ATOM 1100 N ALA A 210 -2.314 -11.120 -2.335 1.00 0.00 N ATOM 1101 CA ALA A 210 -3.580 -11.494 -1.717 1.00 0.00 C ATOM 1102 C ALA A 210 -4.708 -10.577 -2.177 1.00 0.00 C ATOM 1103 O ALA A 210 -5.763 -11.042 -2.610 1.00 0.00 O ATOM 1104 CB ALA A 210 -3.457 -11.464 -0.201 1.00 0.00 C ATOM 0 H ALA A 210 -1.574 -10.886 -1.673 1.00 0.00 H new ATOM 0 HA ALA A 210 -3.823 -12.509 -2.030 1.00 0.00 H new ATOM 0 HB1 ALA A 210 -4.410 -11.745 0.247 1.00 0.00 H new ATOM 0 HB2 ALA A 210 -2.686 -12.166 0.115 1.00 0.00 H new ATOM 0 HB3 ALA A 210 -3.187 -10.459 0.122 1.00 0.00 H new ATOM 1110 N LEU A 211 -4.479 -9.272 -2.080 1.00 0.00 N ATOM 1111 CA LEU A 211 -5.477 -8.288 -2.486 1.00 0.00 C ATOM 1112 C LEU A 211 -5.165 -7.736 -3.873 1.00 0.00 C ATOM 1113 O LEU A 211 -5.899 -7.983 -4.831 1.00 0.00 O ATOM 1114 CB LEU A 211 -5.538 -7.145 -1.471 1.00 0.00 C ATOM 1115 CG LEU A 211 -5.730 -7.554 -0.010 1.00 0.00 C ATOM 1116 CD1 LEU A 211 -5.507 -6.365 0.911 1.00 0.00 C ATOM 1117 CD2 LEU A 211 -7.118 -8.142 0.201 1.00 0.00 C ATOM 0 H LEU A 211 -3.612 -8.871 -1.724 1.00 0.00 H new ATOM 0 HA LEU A 211 -6.447 -8.785 -2.523 1.00 0.00 H new ATOM 0 HB2 LEU A 211 -4.616 -6.568 -1.548 1.00 0.00 H new ATOM 0 HB3 LEU A 211 -6.355 -6.480 -1.752 1.00 0.00 H new ATOM 0 HG LEU A 211 -4.992 -8.319 0.233 1.00 0.00 H new ATOM 0 HD11 LEU A 211 -5.648 -6.675 1.946 1.00 0.00 H new ATOM 0 HD12 LEU A 211 -4.493 -5.988 0.780 1.00 0.00 H new ATOM 0 HD13 LEU A 211 -6.220 -5.578 0.668 1.00 0.00 H new ATOM 0 HD21 LEU A 211 -7.237 -8.428 1.246 1.00 0.00 H new ATOM 0 HD22 LEU A 211 -7.871 -7.399 -0.060 1.00 0.00 H new ATOM 0 HD23 LEU A 211 -7.241 -9.021 -0.432 1.00 0.00 H new ATOM 1129 N HIS A 212 -4.071 -6.988 -3.974 1.00 0.00 N ATOM 1130 CA HIS A 212 -3.659 -6.403 -5.245 1.00 0.00 C ATOM 1131 C HIS A 212 -3.646 -7.456 -6.349 1.00 0.00 C ATOM 1132 O HIS A 212 -3.115 -8.552 -6.169 1.00 0.00 O ATOM 1133 CB HIS A 212 -2.275 -5.767 -5.114 1.00 0.00 C ATOM 1134 CG HIS A 212 -1.850 -5.003 -6.329 1.00 0.00 C ATOM 1135 ND1 HIS A 212 -2.708 -4.696 -7.364 1.00 0.00 N ATOM 1136 CD2 HIS A 212 -0.648 -4.481 -6.671 1.00 0.00 C ATOM 1137 CE1 HIS A 212 -2.052 -4.020 -8.291 1.00 0.00 C ATOM 1138 NE2 HIS A 212 -0.801 -3.876 -7.895 1.00 0.00 N ATOM 0 H HIS A 212 -3.454 -6.773 -3.191 1.00 0.00 H new ATOM 0 HA HIS A 212 -4.381 -5.631 -5.512 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -2.272 -5.097 -4.254 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -1.543 -6.549 -4.912 1.00 0.00 H new ATOM 0 HD2 HIS A 212 0.261 -4.531 -6.090 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -2.469 -3.648 -9.216 1.00 0.00 H new ATOM 0 HE2 HIS A 212 -0.067 -3.394 -8.414 1.00 0.00 H new ATOM 1146 N GLY A 213 -4.234 -7.117 -7.492 1.00 0.00 N ATOM 1147 CA GLY A 213 -4.279 -8.044 -8.607 1.00 0.00 C ATOM 1148 C GLY A 213 -5.203 -9.217 -8.349 1.00 0.00 C ATOM 1149 O GLY A 213 -5.383 -10.077 -9.212 1.00 0.00 O ATOM 0 H GLY A 213 -4.680 -6.216 -7.666 1.00 0.00 H new ATOM 0 HA2 GLY A 213 -4.609 -7.516 -9.502 1.00 0.00 H new ATOM 0 HA3 GLY A 213 -3.274 -8.415 -8.808 1.00 0.00 H new ATOM 1153 N SER A 214 -5.790 -9.255 -7.157 1.00 0.00 N ATOM 1154 CA SER A 214 -6.697 -10.335 -6.786 1.00 0.00 C ATOM 1155 C SER A 214 -8.149 -9.930 -7.020 1.00 0.00 C ATOM 1156 O SER A 214 -8.802 -10.426 -7.938 1.00 0.00 O ATOM 1157 CB SER A 214 -6.493 -10.718 -5.319 1.00 0.00 C ATOM 1158 OG SER A 214 -6.782 -12.089 -5.105 1.00 0.00 O ATOM 0 H SER A 214 -5.654 -8.551 -6.432 1.00 0.00 H new ATOM 0 HA SER A 214 -6.473 -11.197 -7.415 1.00 0.00 H new ATOM 0 HB2 SER A 214 -5.464 -10.510 -5.025 1.00 0.00 H new ATOM 0 HB3 SER A 214 -7.135 -10.105 -4.687 1.00 0.00 H new ATOM 0 HG SER A 214 -6.564 -12.329 -4.180 1.00 0.00 H new ATOM 1164 N GLN A 215 -8.647 -9.025 -6.183 1.00 0.00 N ATOM 1165 CA GLN A 215 -10.022 -8.554 -6.299 1.00 0.00 C ATOM 1166 C GLN A 215 -10.077 -7.200 -6.999 1.00 0.00 C ATOM 1167 O GLN A 215 -9.054 -6.537 -7.174 1.00 0.00 O ATOM 1168 CB GLN A 215 -10.666 -8.451 -4.915 1.00 0.00 C ATOM 1169 CG GLN A 215 -10.845 -9.794 -4.226 1.00 0.00 C ATOM 1170 CD GLN A 215 -11.379 -9.659 -2.813 1.00 0.00 C ATOM 1171 OE1 GLN A 215 -12.277 -8.859 -2.551 1.00 0.00 O ATOM 1172 NE2 GLN A 215 -10.827 -10.442 -1.894 1.00 0.00 N ATOM 0 H GLN A 215 -8.119 -8.604 -5.418 1.00 0.00 H new ATOM 0 HA GLN A 215 -10.577 -9.276 -6.899 1.00 0.00 H new ATOM 0 HB2 GLN A 215 -10.052 -7.808 -4.285 1.00 0.00 H new ATOM 0 HB3 GLN A 215 -11.639 -7.969 -5.011 1.00 0.00 H new ATOM 0 HG2 GLN A 215 -11.528 -10.410 -4.811 1.00 0.00 H new ATOM 0 HG3 GLN A 215 -9.888 -10.315 -4.200 1.00 0.00 H new ATOM 0 HE21 GLN A 215 -10.085 -11.091 -2.156 1.00 0.00 H new ATOM 0 HE22 GLN A 215 -11.145 -10.395 -0.926 1.00 0.00 H new ATOM 1181 N THR A 216 -11.278 -6.795 -7.401 1.00 0.00 N ATOM 1182 CA THR A 216 -11.466 -5.522 -8.084 1.00 0.00 C ATOM 1183 C THR A 216 -12.545 -4.687 -7.404 1.00 0.00 C ATOM 1184 O THR A 216 -13.732 -4.835 -7.694 1.00 0.00 O ATOM 1185 CB THR A 216 -11.847 -5.728 -9.562 1.00 0.00 C ATOM 1186 OG1 THR A 216 -10.922 -6.625 -10.186 1.00 0.00 O ATOM 1187 CG2 THR A 216 -11.859 -4.403 -10.308 1.00 0.00 C ATOM 0 H THR A 216 -12.135 -7.331 -7.265 1.00 0.00 H new ATOM 0 HA THR A 216 -10.515 -4.992 -8.032 1.00 0.00 H new ATOM 0 HB THR A 216 -12.849 -6.156 -9.600 1.00 0.00 H new ATOM 0 HG1 THR A 216 -11.172 -6.752 -11.125 1.00 0.00 H new ATOM 0 HG21 THR A 216 -12.131 -4.574 -11.350 1.00 0.00 H new ATOM 0 HG22 THR A 216 -12.586 -3.733 -9.849 1.00 0.00 H new ATOM 0 HG23 THR A 216 -10.869 -3.950 -10.261 1.00 0.00 H new ATOM 1195 N MET A 217 -12.125 -3.808 -6.500 1.00 0.00 N ATOM 1196 CA MET A 217 -13.057 -2.948 -5.780 1.00 0.00 C ATOM 1197 C MET A 217 -14.207 -2.516 -6.685 1.00 0.00 C ATOM 1198 O MET A 217 -14.012 -2.145 -7.843 1.00 0.00 O ATOM 1199 CB MET A 217 -12.331 -1.716 -5.236 1.00 0.00 C ATOM 1200 CG MET A 217 -11.163 -2.054 -4.323 1.00 0.00 C ATOM 1201 SD MET A 217 -11.686 -2.845 -2.790 1.00 0.00 S ATOM 1202 CE MET A 217 -10.210 -3.764 -2.362 1.00 0.00 C ATOM 0 H MET A 217 -11.146 -3.673 -6.249 1.00 0.00 H new ATOM 0 HA MET A 217 -13.468 -3.517 -4.946 1.00 0.00 H new ATOM 0 HB2 MET A 217 -11.967 -1.120 -6.073 1.00 0.00 H new ATOM 0 HB3 MET A 217 -13.042 -1.097 -4.689 1.00 0.00 H new ATOM 0 HG2 MET A 217 -10.474 -2.713 -4.850 1.00 0.00 H new ATOM 0 HG3 MET A 217 -10.615 -1.142 -4.088 1.00 0.00 H new ATOM 0 HE1 MET A 217 -10.377 -4.308 -1.432 1.00 0.00 H new ATOM 0 HE2 MET A 217 -9.977 -4.470 -3.159 1.00 0.00 H new ATOM 0 HE3 MET A 217 -9.376 -3.074 -2.234 1.00 0.00 H new ATOM 1212 N PRO A 218 -15.434 -2.564 -6.146 1.00 0.00 N ATOM 1213 CA PRO A 218 -16.639 -2.181 -6.888 1.00 0.00 C ATOM 1214 C PRO A 218 -16.490 -0.830 -7.579 1.00 0.00 C ATOM 1215 O PRO A 218 -15.948 0.115 -7.007 1.00 0.00 O ATOM 1216 CB PRO A 218 -17.716 -2.110 -5.802 1.00 0.00 C ATOM 1217 CG PRO A 218 -17.251 -3.051 -4.745 1.00 0.00 C ATOM 1218 CD PRO A 218 -15.740 -2.995 -4.772 1.00 0.00 C ATOM 0 HA PRO A 218 -16.866 -2.886 -7.688 1.00 0.00 H new ATOM 0 HB2 PRO A 218 -17.819 -1.097 -5.413 1.00 0.00 H new ATOM 0 HB3 PRO A 218 -18.691 -2.403 -6.192 1.00 0.00 H new ATOM 0 HG2 PRO A 218 -17.635 -2.760 -3.767 1.00 0.00 H new ATOM 0 HG3 PRO A 218 -17.607 -4.063 -4.939 1.00 0.00 H new ATOM 0 HD2 PRO A 218 -15.352 -2.292 -4.035 1.00 0.00 H new ATOM 0 HD3 PRO A 218 -15.299 -3.966 -4.549 1.00 0.00 H new ATOM 1226 N GLY A 219 -16.975 -0.745 -8.814 1.00 0.00 N ATOM 1227 CA GLY A 219 -16.885 0.495 -9.563 1.00 0.00 C ATOM 1228 C GLY A 219 -15.742 0.490 -10.558 1.00 0.00 C ATOM 1229 O GLY A 219 -15.909 0.897 -11.707 1.00 0.00 O ATOM 0 H GLY A 219 -17.429 -1.513 -9.309 1.00 0.00 H new ATOM 0 HA2 GLY A 219 -17.823 0.665 -10.092 1.00 0.00 H new ATOM 0 HA3 GLY A 219 -16.755 1.326 -8.870 1.00 0.00 H new ATOM 1233 N ALA A 220 -14.576 0.030 -10.115 1.00 0.00 N ATOM 1234 CA ALA A 220 -13.401 -0.026 -10.975 1.00 0.00 C ATOM 1235 C ALA A 220 -13.369 -1.323 -11.777 1.00 0.00 C ATOM 1236 O ALA A 220 -13.735 -2.384 -11.274 1.00 0.00 O ATOM 1237 CB ALA A 220 -12.133 0.115 -10.146 1.00 0.00 C ATOM 0 H ALA A 220 -14.421 -0.309 -9.166 1.00 0.00 H new ATOM 0 HA ALA A 220 -13.456 0.805 -11.679 1.00 0.00 H new ATOM 0 HB1 ALA A 220 -11.263 0.071 -10.801 1.00 0.00 H new ATOM 0 HB2 ALA A 220 -12.145 1.071 -9.622 1.00 0.00 H new ATOM 0 HB3 ALA A 220 -12.081 -0.696 -9.420 1.00 0.00 H new ATOM 1243 N SER A 221 -12.930 -1.228 -13.029 1.00 0.00 N ATOM 1244 CA SER A 221 -12.855 -2.394 -13.902 1.00 0.00 C ATOM 1245 C SER A 221 -11.468 -3.027 -13.844 1.00 0.00 C ATOM 1246 O SER A 221 -11.264 -4.145 -14.318 1.00 0.00 O ATOM 1247 CB SER A 221 -13.189 -2.000 -15.342 1.00 0.00 C ATOM 1248 OG SER A 221 -14.586 -1.842 -15.517 1.00 0.00 O ATOM 0 H SER A 221 -12.621 -0.357 -13.461 1.00 0.00 H new ATOM 0 HA SER A 221 -13.584 -3.126 -13.555 1.00 0.00 H new ATOM 0 HB2 SER A 221 -12.680 -1.070 -15.595 1.00 0.00 H new ATOM 0 HB3 SER A 221 -12.818 -2.763 -16.026 1.00 0.00 H new ATOM 0 HG SER A 221 -14.773 -1.589 -16.445 1.00 0.00 H new ATOM 1254 N SER A 222 -10.518 -2.304 -13.261 1.00 0.00 N ATOM 1255 CA SER A 222 -9.149 -2.792 -13.144 1.00 0.00 C ATOM 1256 C SER A 222 -8.887 -3.347 -11.747 1.00 0.00 C ATOM 1257 O SER A 222 -9.384 -2.816 -10.754 1.00 0.00 O ATOM 1258 CB SER A 222 -8.156 -1.670 -13.454 1.00 0.00 C ATOM 1259 OG SER A 222 -7.965 -1.529 -14.851 1.00 0.00 O ATOM 0 H SER A 222 -10.671 -1.378 -12.862 1.00 0.00 H new ATOM 0 HA SER A 222 -9.014 -3.597 -13.867 1.00 0.00 H new ATOM 0 HB2 SER A 222 -8.521 -0.731 -13.037 1.00 0.00 H new ATOM 0 HB3 SER A 222 -7.201 -1.882 -12.973 1.00 0.00 H new ATOM 0 HG SER A 222 -7.216 -0.920 -15.019 1.00 0.00 H new ATOM 1265 N SER A 223 -8.103 -4.418 -11.680 1.00 0.00 N ATOM 1266 CA SER A 223 -7.778 -5.049 -10.406 1.00 0.00 C ATOM 1267 C SER A 223 -7.152 -4.041 -9.446 1.00 0.00 C ATOM 1268 O SER A 223 -6.464 -3.110 -9.866 1.00 0.00 O ATOM 1269 CB SER A 223 -6.823 -6.224 -10.623 1.00 0.00 C ATOM 1270 OG SER A 223 -7.457 -7.269 -11.340 1.00 0.00 O ATOM 0 H SER A 223 -7.681 -4.867 -12.493 1.00 0.00 H new ATOM 0 HA SER A 223 -8.704 -5.420 -9.965 1.00 0.00 H new ATOM 0 HB2 SER A 223 -5.943 -5.885 -11.169 1.00 0.00 H new ATOM 0 HB3 SER A 223 -6.476 -6.598 -9.660 1.00 0.00 H new ATOM 0 HG SER A 223 -6.826 -8.008 -11.468 1.00 0.00 H new ATOM 1276 N LEU A 224 -7.396 -4.235 -8.154 1.00 0.00 N ATOM 1277 CA LEU A 224 -6.857 -3.344 -7.132 1.00 0.00 C ATOM 1278 C LEU A 224 -5.439 -2.906 -7.485 1.00 0.00 C ATOM 1279 O LEU A 224 -4.746 -3.570 -8.256 1.00 0.00 O ATOM 1280 CB LEU A 224 -6.864 -4.037 -5.768 1.00 0.00 C ATOM 1281 CG LEU A 224 -6.152 -3.297 -4.636 1.00 0.00 C ATOM 1282 CD1 LEU A 224 -6.811 -1.951 -4.379 1.00 0.00 C ATOM 1283 CD2 LEU A 224 -6.146 -4.140 -3.369 1.00 0.00 C ATOM 0 H LEU A 224 -7.963 -5.001 -7.790 1.00 0.00 H new ATOM 0 HA LEU A 224 -7.491 -2.458 -7.086 1.00 0.00 H new ATOM 0 HB2 LEU A 224 -7.900 -4.202 -5.472 1.00 0.00 H new ATOM 0 HB3 LEU A 224 -6.404 -5.019 -5.879 1.00 0.00 H new ATOM 0 HG LEU A 224 -5.119 -3.121 -4.937 1.00 0.00 H new ATOM 0 HD11 LEU A 224 -6.290 -1.439 -3.570 1.00 0.00 H new ATOM 0 HD12 LEU A 224 -6.763 -1.344 -5.283 1.00 0.00 H new ATOM 0 HD13 LEU A 224 -7.854 -2.104 -4.100 1.00 0.00 H new ATOM 0 HD21 LEU A 224 -5.635 -3.598 -2.574 1.00 0.00 H new ATOM 0 HD22 LEU A 224 -7.172 -4.348 -3.065 1.00 0.00 H new ATOM 0 HD23 LEU A 224 -5.627 -5.079 -3.559 1.00 0.00 H new ATOM 1295 N VAL A 225 -5.012 -1.784 -6.913 1.00 0.00 N ATOM 1296 CA VAL A 225 -3.676 -1.259 -7.164 1.00 0.00 C ATOM 1297 C VAL A 225 -2.963 -0.924 -5.858 1.00 0.00 C ATOM 1298 O VAL A 225 -3.275 0.073 -5.206 1.00 0.00 O ATOM 1299 CB VAL A 225 -3.725 0.002 -8.047 1.00 0.00 C ATOM 1300 CG1 VAL A 225 -2.322 0.533 -8.299 1.00 0.00 C ATOM 1301 CG2 VAL A 225 -4.435 -0.295 -9.359 1.00 0.00 C ATOM 0 H VAL A 225 -5.573 -1.222 -6.273 1.00 0.00 H new ATOM 0 HA VAL A 225 -3.123 -2.039 -7.687 1.00 0.00 H new ATOM 0 HB VAL A 225 -4.289 0.772 -7.520 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -2.377 1.424 -8.925 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -1.852 0.786 -7.348 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -1.730 -0.230 -8.805 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -4.461 0.607 -9.971 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -3.900 -1.080 -9.893 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -5.454 -0.624 -9.155 1.00 0.00 H new ATOM 1311 N VAL A 226 -2.003 -1.762 -5.482 1.00 0.00 N ATOM 1312 CA VAL A 226 -1.243 -1.555 -4.255 1.00 0.00 C ATOM 1313 C VAL A 226 0.251 -1.743 -4.495 1.00 0.00 C ATOM 1314 O VAL A 226 0.742 -2.869 -4.570 1.00 0.00 O ATOM 1315 CB VAL A 226 -1.699 -2.518 -3.143 1.00 0.00 C ATOM 1316 CG1 VAL A 226 -1.040 -2.158 -1.821 1.00 0.00 C ATOM 1317 CG2 VAL A 226 -3.215 -2.504 -3.015 1.00 0.00 C ATOM 0 H VAL A 226 -1.733 -2.592 -6.010 1.00 0.00 H new ATOM 0 HA VAL A 226 -1.430 -0.530 -3.936 1.00 0.00 H new ATOM 0 HB VAL A 226 -1.390 -3.528 -3.412 1.00 0.00 H new ATOM 0 HG11 VAL A 226 -1.374 -2.849 -1.048 1.00 0.00 H new ATOM 0 HG12 VAL A 226 0.043 -2.225 -1.924 1.00 0.00 H new ATOM 0 HG13 VAL A 226 -1.315 -1.141 -1.542 1.00 0.00 H new ATOM 0 HG21 VAL A 226 -3.520 -3.190 -2.225 1.00 0.00 H new ATOM 0 HG22 VAL A 226 -3.550 -1.496 -2.770 1.00 0.00 H new ATOM 0 HG23 VAL A 226 -3.663 -2.816 -3.959 1.00 0.00 H new ATOM 1327 N LYS A 227 0.970 -0.632 -4.614 1.00 0.00 N ATOM 1328 CA LYS A 227 2.409 -0.673 -4.843 1.00 0.00 C ATOM 1329 C LYS A 227 3.142 0.239 -3.864 1.00 0.00 C ATOM 1330 O LYS A 227 2.637 1.297 -3.489 1.00 0.00 O ATOM 1331 CB LYS A 227 2.729 -0.256 -6.281 1.00 0.00 C ATOM 1332 CG LYS A 227 2.168 1.103 -6.660 1.00 0.00 C ATOM 1333 CD LYS A 227 2.131 1.291 -8.167 1.00 0.00 C ATOM 1334 CE LYS A 227 0.921 0.607 -8.784 1.00 0.00 C ATOM 1335 NZ LYS A 227 1.161 -0.845 -9.012 1.00 0.00 N ATOM 0 H LYS A 227 0.579 0.308 -4.556 1.00 0.00 H new ATOM 0 HA LYS A 227 2.748 -1.696 -4.683 1.00 0.00 H new ATOM 0 HB2 LYS A 227 3.811 -0.243 -6.414 1.00 0.00 H new ATOM 0 HB3 LYS A 227 2.333 -1.007 -6.965 1.00 0.00 H new ATOM 0 HG2 LYS A 227 1.162 1.208 -6.255 1.00 0.00 H new ATOM 0 HG3 LYS A 227 2.776 1.887 -6.210 1.00 0.00 H new ATOM 0 HD2 LYS A 227 2.108 2.355 -8.402 1.00 0.00 H new ATOM 0 HD3 LYS A 227 3.043 0.887 -8.608 1.00 0.00 H new ATOM 0 HE2 LYS A 227 0.059 0.734 -8.129 1.00 0.00 H new ATOM 0 HE3 LYS A 227 0.676 1.088 -9.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 0.732 -1.130 -9.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 2.184 -1.027 -9.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 0.735 -1.393 -8.238 1.00 0.00 H new ATOM 1349 N PHE A 228 4.335 -0.179 -3.454 1.00 0.00 N ATOM 1350 CA PHE A 228 5.138 0.601 -2.519 1.00 0.00 C ATOM 1351 C PHE A 228 5.233 2.057 -2.965 1.00 0.00 C ATOM 1352 O PHE A 228 5.427 2.343 -4.146 1.00 0.00 O ATOM 1353 CB PHE A 228 6.540 0.001 -2.394 1.00 0.00 C ATOM 1354 CG PHE A 228 6.540 -1.489 -2.204 1.00 0.00 C ATOM 1355 CD1 PHE A 228 6.494 -2.340 -3.296 1.00 0.00 C ATOM 1356 CD2 PHE A 228 6.586 -2.038 -0.933 1.00 0.00 C ATOM 1357 CE1 PHE A 228 6.493 -3.711 -3.124 1.00 0.00 C ATOM 1358 CE2 PHE A 228 6.585 -3.409 -0.754 1.00 0.00 C ATOM 1359 CZ PHE A 228 6.540 -4.247 -1.851 1.00 0.00 C ATOM 0 H PHE A 228 4.767 -1.053 -3.754 1.00 0.00 H new ATOM 0 HA PHE A 228 4.649 0.570 -1.545 1.00 0.00 H new ATOM 0 HB2 PHE A 228 7.112 0.245 -3.289 1.00 0.00 H new ATOM 0 HB3 PHE A 228 7.052 0.467 -1.552 1.00 0.00 H new ATOM 0 HD1 PHE A 228 6.459 -1.927 -4.293 1.00 0.00 H new ATOM 0 HD2 PHE A 228 6.623 -1.387 -0.072 1.00 0.00 H new ATOM 0 HE1 PHE A 228 6.456 -4.363 -3.984 1.00 0.00 H new ATOM 0 HE2 PHE A 228 6.619 -3.824 0.242 1.00 0.00 H new ATOM 0 HZ PHE A 228 6.542 -5.318 -1.714 1.00 0.00 H new