USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 553 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 216 ASN : amide:sc= -0.2 K(o=-0.14,f=-1.2) USER MOD Set 1.2: A 220 LYS NZ :NH3+ -113:sc= 0.0615 (180deg=0) USER MOD Set 2.1: A 181 THR OG1 : rot -35:sc= 0.141 USER MOD Set 2.2: A 195 THR OG1 : rot 70:sc= -0.332 USER MOD Set 3.1: A 178 TYR OH : rot 63:sc= -1.05 USER MOD Set 3.2: A 196 CYS SG : rot 85:sc= 0.01 USER MOD Single : A 159 ASN :FLIP amide:sc= 1.04 F(o=-0.27,f=1) USER MOD Single : A 165 GLN : amide:sc= -1.11 K(o=-1.1,f=-5.1!) USER MOD Single : A 170 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 179 THR OG1 : rot 180:sc=-0.000989 USER MOD Single : A 182 GLN : amide:sc=-0.00685 K(o=-0.0068,f=-0.93) USER MOD Single : A 184 SER OG : rot 180:sc=-0.00586 USER MOD Single : A 188 HIS :FLIP no HE2:sc= -6.64! C(o=-7.9!,f=-6.6!) USER MOD Single : A 190 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 206 SER OG : rot 180:sc= 0 USER MOD Single : A 208 THR OG1 : rot 180:sc= -0.269 USER MOD Single : A 209 SER OG : rot 180:sc= 0 USER MOD Single : A 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 211 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 221 MET CE :methyl -168:sc= -3.18 (180deg=-3.25) USER MOD ----------------------------------------------------------------- ATOM 192 N ASN A 159 9.654 4.479 0.682 1.00 0.00 N ATOM 193 CA ASN A 159 8.766 3.337 0.866 1.00 0.00 C ATOM 194 C ASN A 159 7.341 3.681 0.443 1.00 0.00 C ATOM 195 O ASN A 159 6.869 4.804 0.620 1.00 0.00 O ATOM 196 CB ASN A 159 8.781 2.884 2.328 1.00 0.00 C ATOM 197 CG ASN A 159 8.230 3.940 3.266 1.00 0.00 C ATOM 198 OD1 ASN A 159 7.602 3.499 4.349 1.00 0.00 O flip ATOM 199 ND2 ASN A 159 8.369 5.138 3.019 1.00 0.00 N flip ATOM 0 HA ASN A 159 9.126 2.523 0.236 1.00 0.00 H new ATOM 0 HB2 ASN A 159 8.194 1.971 2.429 1.00 0.00 H new ATOM 0 HB3 ASN A 159 9.803 2.640 2.620 1.00 0.00 H new ATOM 0 HD21 ASN A 159 8.859 5.431 2.174 1.00 0.00 H new ATOM 0 HD22 ASN A 159 7.994 5.838 3.659 1.00 0.00 H new ATOM 206 N PRO A 160 6.639 2.691 -0.129 1.00 0.00 N ATOM 207 CA PRO A 160 5.258 2.864 -0.588 1.00 0.00 C ATOM 208 C PRO A 160 4.278 3.023 0.569 1.00 0.00 C ATOM 209 O PRO A 160 3.473 3.955 0.591 1.00 0.00 O ATOM 210 CB PRO A 160 4.974 1.570 -1.355 1.00 0.00 C ATOM 211 CG PRO A 160 5.902 0.567 -0.762 1.00 0.00 C ATOM 212 CD PRO A 160 7.139 1.328 -0.371 1.00 0.00 C ATOM 0 HA PRO A 160 5.138 3.766 -1.188 1.00 0.00 H new ATOM 0 HB2 PRO A 160 3.934 1.263 -1.242 1.00 0.00 H new ATOM 0 HB3 PRO A 160 5.155 1.695 -2.423 1.00 0.00 H new ATOM 0 HG2 PRO A 160 5.451 0.083 0.104 1.00 0.00 H new ATOM 0 HG3 PRO A 160 6.138 -0.219 -1.480 1.00 0.00 H new ATOM 0 HD2 PRO A 160 7.605 0.907 0.520 1.00 0.00 H new ATOM 0 HD3 PRO A 160 7.889 1.310 -1.162 1.00 0.00 H new ATOM 220 N VAL A 161 4.351 2.108 1.530 1.00 0.00 N ATOM 221 CA VAL A 161 3.471 2.148 2.692 1.00 0.00 C ATOM 222 C VAL A 161 3.453 3.537 3.321 1.00 0.00 C ATOM 223 O VAL A 161 2.411 4.013 3.769 1.00 0.00 O ATOM 224 CB VAL A 161 3.900 1.120 3.756 1.00 0.00 C ATOM 225 CG1 VAL A 161 2.989 1.198 4.972 1.00 0.00 C ATOM 226 CG2 VAL A 161 3.902 -0.284 3.171 1.00 0.00 C ATOM 0 H VAL A 161 5.010 1.330 1.527 1.00 0.00 H new ATOM 0 HA VAL A 161 2.470 1.899 2.340 1.00 0.00 H new ATOM 0 HB VAL A 161 4.915 1.357 4.076 1.00 0.00 H new ATOM 0 HG11 VAL A 161 3.307 0.465 5.713 1.00 0.00 H new ATOM 0 HG12 VAL A 161 3.043 2.197 5.404 1.00 0.00 H new ATOM 0 HG13 VAL A 161 1.962 0.988 4.672 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.208 -0.997 3.937 1.00 0.00 H new ATOM 0 HG22 VAL A 161 2.900 -0.534 2.822 1.00 0.00 H new ATOM 0 HG23 VAL A 161 4.600 -0.329 2.335 1.00 0.00 H new ATOM 236 N GLY A 162 4.615 4.183 3.349 1.00 0.00 N ATOM 237 CA GLY A 162 4.711 5.512 3.925 1.00 0.00 C ATOM 238 C GLY A 162 4.295 6.596 2.951 1.00 0.00 C ATOM 239 O GLY A 162 3.969 7.711 3.356 1.00 0.00 O ATOM 0 H GLY A 162 5.491 3.810 2.983 1.00 0.00 H new ATOM 0 HA2 GLY A 162 4.083 5.566 4.814 1.00 0.00 H new ATOM 0 HA3 GLY A 162 5.736 5.692 4.248 1.00 0.00 H new ATOM 243 N ALA A 163 4.309 6.270 1.663 1.00 0.00 N ATOM 244 CA ALA A 163 3.930 7.225 0.628 1.00 0.00 C ATOM 245 C ALA A 163 2.415 7.301 0.480 1.00 0.00 C ATOM 246 O ALA A 163 1.825 8.379 0.568 1.00 0.00 O ATOM 247 CB ALA A 163 4.574 6.849 -0.698 1.00 0.00 C ATOM 0 H ALA A 163 4.579 5.352 1.311 1.00 0.00 H new ATOM 0 HA ALA A 163 4.289 8.210 0.927 1.00 0.00 H new ATOM 0 HB1 ALA A 163 4.283 7.570 -1.462 1.00 0.00 H new ATOM 0 HB2 ALA A 163 5.659 6.853 -0.590 1.00 0.00 H new ATOM 0 HB3 ALA A 163 4.243 5.854 -0.994 1.00 0.00 H new ATOM 253 N LEU A 164 1.789 6.152 0.253 1.00 0.00 N ATOM 254 CA LEU A 164 0.340 6.088 0.092 1.00 0.00 C ATOM 255 C LEU A 164 -0.364 6.928 1.153 1.00 0.00 C ATOM 256 O LEU A 164 -1.316 7.648 0.857 1.00 0.00 O ATOM 257 CB LEU A 164 -0.139 4.638 0.172 1.00 0.00 C ATOM 258 CG LEU A 164 -1.523 4.354 -0.413 1.00 0.00 C ATOM 259 CD1 LEU A 164 -1.537 4.632 -1.908 1.00 0.00 C ATOM 260 CD2 LEU A 164 -1.937 2.917 -0.131 1.00 0.00 C ATOM 0 H LEU A 164 2.262 5.251 0.176 1.00 0.00 H new ATOM 0 HA LEU A 164 0.091 6.492 -0.889 1.00 0.00 H new ATOM 0 HB2 LEU A 164 0.587 4.008 -0.342 1.00 0.00 H new ATOM 0 HB3 LEU A 164 -0.140 4.334 1.219 1.00 0.00 H new ATOM 0 HG LEU A 164 -2.243 5.018 0.066 1.00 0.00 H new ATOM 0 HD11 LEU A 164 -2.530 4.424 -2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 164 -1.286 5.678 -2.086 1.00 0.00 H new ATOM 0 HD13 LEU A 164 -0.806 3.994 -2.404 1.00 0.00 H new ATOM 0 HD21 LEU A 164 -2.924 2.733 -0.555 1.00 0.00 H new ATOM 0 HD22 LEU A 164 -1.216 2.235 -0.582 1.00 0.00 H new ATOM 0 HD23 LEU A 164 -1.968 2.752 0.946 1.00 0.00 H new ATOM 272 N GLN A 165 0.114 6.830 2.390 1.00 0.00 N ATOM 273 CA GLN A 165 -0.469 7.582 3.495 1.00 0.00 C ATOM 274 C GLN A 165 -0.612 9.057 3.134 1.00 0.00 C ATOM 275 O GLN A 165 -1.573 9.713 3.534 1.00 0.00 O ATOM 276 CB GLN A 165 0.391 7.433 4.751 1.00 0.00 C ATOM 277 CG GLN A 165 -0.125 8.227 5.940 1.00 0.00 C ATOM 278 CD GLN A 165 -1.095 7.435 6.794 1.00 0.00 C ATOM 279 OE1 GLN A 165 -0.690 6.592 7.595 1.00 0.00 O ATOM 280 NE2 GLN A 165 -2.385 7.701 6.626 1.00 0.00 N ATOM 0 H GLN A 165 0.902 6.238 2.652 1.00 0.00 H new ATOM 0 HA GLN A 165 -1.462 7.177 3.693 1.00 0.00 H new ATOM 0 HB2 GLN A 165 0.442 6.379 5.023 1.00 0.00 H new ATOM 0 HB3 GLN A 165 1.408 7.753 4.525 1.00 0.00 H new ATOM 0 HG2 GLN A 165 0.718 8.544 6.554 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -0.617 9.132 5.582 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -2.676 8.408 5.951 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -3.085 7.198 7.172 1.00 0.00 H new ATOM 289 N GLU A 166 0.352 9.572 2.377 1.00 0.00 N ATOM 290 CA GLU A 166 0.333 10.970 1.964 1.00 0.00 C ATOM 291 C GLU A 166 -0.785 11.225 0.957 1.00 0.00 C ATOM 292 O GLU A 166 -1.512 12.215 1.056 1.00 0.00 O ATOM 293 CB GLU A 166 1.681 11.364 1.356 1.00 0.00 C ATOM 294 CG GLU A 166 2.775 11.575 2.388 1.00 0.00 C ATOM 295 CD GLU A 166 3.905 12.445 1.871 1.00 0.00 C ATOM 296 OE1 GLU A 166 4.540 12.057 0.868 1.00 0.00 O ATOM 297 OE2 GLU A 166 4.155 13.512 2.469 1.00 0.00 O ATOM 0 H GLU A 166 1.155 9.042 2.038 1.00 0.00 H new ATOM 0 HA GLU A 166 0.149 11.580 2.848 1.00 0.00 H new ATOM 0 HB2 GLU A 166 1.996 10.588 0.658 1.00 0.00 H new ATOM 0 HB3 GLU A 166 1.556 12.280 0.779 1.00 0.00 H new ATOM 0 HG2 GLU A 166 2.346 12.035 3.278 1.00 0.00 H new ATOM 0 HG3 GLU A 166 3.176 10.607 2.690 1.00 0.00 H new ATOM 304 N LEU A 167 -0.917 10.326 -0.012 1.00 0.00 N ATOM 305 CA LEU A 167 -1.946 10.453 -1.038 1.00 0.00 C ATOM 306 C LEU A 167 -3.339 10.442 -0.417 1.00 0.00 C ATOM 307 O LEU A 167 -4.107 11.392 -0.572 1.00 0.00 O ATOM 308 CB LEU A 167 -1.821 9.318 -2.056 1.00 0.00 C ATOM 309 CG LEU A 167 -0.397 8.929 -2.456 1.00 0.00 C ATOM 310 CD1 LEU A 167 -0.409 8.096 -3.729 1.00 0.00 C ATOM 311 CD2 LEU A 167 0.464 10.170 -2.636 1.00 0.00 C ATOM 0 H LEU A 167 -0.325 9.501 -0.109 1.00 0.00 H new ATOM 0 HA LEU A 167 -1.802 11.407 -1.546 1.00 0.00 H new ATOM 0 HB2 LEU A 167 -2.317 8.436 -1.650 1.00 0.00 H new ATOM 0 HB3 LEU A 167 -2.365 9.603 -2.957 1.00 0.00 H new ATOM 0 HG LEU A 167 0.033 8.326 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 167 0.613 7.828 -3.998 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -0.990 7.189 -3.565 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -0.858 8.673 -4.537 1.00 0.00 H new ATOM 0 HD21 LEU A 167 1.474 9.874 -2.920 1.00 0.00 H new ATOM 0 HD22 LEU A 167 0.037 10.799 -3.417 1.00 0.00 H new ATOM 0 HD23 LEU A 167 0.499 10.727 -1.700 1.00 0.00 H new ATOM 323 N VAL A 168 -3.659 9.362 0.289 1.00 0.00 N ATOM 324 CA VAL A 168 -4.958 9.229 0.937 1.00 0.00 C ATOM 325 C VAL A 168 -5.379 10.537 1.597 1.00 0.00 C ATOM 326 O VAL A 168 -6.540 10.940 1.517 1.00 0.00 O ATOM 327 CB VAL A 168 -4.944 8.113 1.998 1.00 0.00 C ATOM 328 CG1 VAL A 168 -4.965 6.745 1.335 1.00 0.00 C ATOM 329 CG2 VAL A 168 -3.732 8.256 2.906 1.00 0.00 C ATOM 0 H VAL A 168 -3.036 8.566 0.427 1.00 0.00 H new ATOM 0 HA VAL A 168 -5.675 8.971 0.158 1.00 0.00 H new ATOM 0 HB VAL A 168 -5.841 8.207 2.610 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -4.955 5.969 2.101 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -5.867 6.647 0.731 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -4.088 6.636 0.697 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -3.738 7.459 3.650 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -2.821 8.189 2.311 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -3.766 9.222 3.409 1.00 0.00 H new ATOM 339 N VAL A 169 -4.428 11.198 2.250 1.00 0.00 N ATOM 340 CA VAL A 169 -4.700 12.462 2.923 1.00 0.00 C ATOM 341 C VAL A 169 -5.146 13.529 1.929 1.00 0.00 C ATOM 342 O VAL A 169 -6.016 14.346 2.231 1.00 0.00 O ATOM 343 CB VAL A 169 -3.460 12.971 3.683 1.00 0.00 C ATOM 344 CG1 VAL A 169 -3.727 14.344 4.281 1.00 0.00 C ATOM 345 CG2 VAL A 169 -3.054 11.980 4.763 1.00 0.00 C ATOM 0 H VAL A 169 -3.462 10.879 2.327 1.00 0.00 H new ATOM 0 HA VAL A 169 -5.503 12.275 3.636 1.00 0.00 H new ATOM 0 HB VAL A 169 -2.635 13.063 2.977 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -2.840 14.687 4.814 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -3.967 15.048 3.484 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -4.566 14.282 4.974 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -2.177 12.355 5.290 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -3.875 11.854 5.469 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -2.819 11.019 4.305 1.00 0.00 H new ATOM 355 N GLN A 170 -4.545 13.515 0.744 1.00 0.00 N ATOM 356 CA GLN A 170 -4.881 14.482 -0.294 1.00 0.00 C ATOM 357 C GLN A 170 -6.251 14.181 -0.895 1.00 0.00 C ATOM 358 O GLN A 170 -7.023 15.093 -1.193 1.00 0.00 O ATOM 359 CB GLN A 170 -3.817 14.473 -1.393 1.00 0.00 C ATOM 360 CG GLN A 170 -2.458 14.970 -0.926 1.00 0.00 C ATOM 361 CD GLN A 170 -2.400 16.480 -0.801 1.00 0.00 C ATOM 362 OE1 GLN A 170 -2.386 17.022 0.304 1.00 0.00 O ATOM 363 NE2 GLN A 170 -2.365 17.167 -1.936 1.00 0.00 N ATOM 0 H GLN A 170 -3.823 12.845 0.479 1.00 0.00 H new ATOM 0 HA GLN A 170 -4.913 15.471 0.163 1.00 0.00 H new ATOM 0 HB2 GLN A 170 -3.712 13.458 -1.777 1.00 0.00 H new ATOM 0 HB3 GLN A 170 -4.157 15.094 -2.222 1.00 0.00 H new ATOM 0 HG2 GLN A 170 -2.223 14.520 0.039 1.00 0.00 H new ATOM 0 HG3 GLN A 170 -1.693 14.638 -1.628 1.00 0.00 H new ATOM 0 HE21 GLN A 170 -2.378 16.676 -2.830 1.00 0.00 H new ATOM 0 HE22 GLN A 170 -2.325 18.186 -1.914 1.00 0.00 H new ATOM 372 N LYS A 171 -6.546 12.898 -1.070 1.00 0.00 N ATOM 373 CA LYS A 171 -7.822 12.476 -1.634 1.00 0.00 C ATOM 374 C LYS A 171 -8.920 12.501 -0.575 1.00 0.00 C ATOM 375 O LYS A 171 -10.107 12.544 -0.898 1.00 0.00 O ATOM 376 CB LYS A 171 -7.702 11.069 -2.225 1.00 0.00 C ATOM 377 CG LYS A 171 -6.823 11.003 -3.462 1.00 0.00 C ATOM 378 CD LYS A 171 -7.615 11.298 -4.725 1.00 0.00 C ATOM 379 CE LYS A 171 -6.782 11.055 -5.974 1.00 0.00 C ATOM 380 NZ LYS A 171 -7.630 10.940 -7.193 1.00 0.00 N ATOM 0 H LYS A 171 -5.918 12.131 -0.829 1.00 0.00 H new ATOM 0 HA LYS A 171 -8.089 13.175 -2.426 1.00 0.00 H new ATOM 0 HB2 LYS A 171 -7.299 10.398 -1.466 1.00 0.00 H new ATOM 0 HB3 LYS A 171 -8.698 10.703 -2.477 1.00 0.00 H new ATOM 0 HG2 LYS A 171 -6.006 11.719 -3.368 1.00 0.00 H new ATOM 0 HG3 LYS A 171 -6.372 10.013 -3.537 1.00 0.00 H new ATOM 0 HD2 LYS A 171 -8.506 10.670 -4.752 1.00 0.00 H new ATOM 0 HD3 LYS A 171 -7.955 12.333 -4.709 1.00 0.00 H new ATOM 0 HE2 LYS A 171 -6.072 11.872 -6.101 1.00 0.00 H new ATOM 0 HE3 LYS A 171 -6.199 10.142 -5.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 171 -7.025 10.775 -8.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 171 -8.291 10.144 -7.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 171 -8.167 11.820 -7.326 1.00 0.00 H new ATOM 394 N GLY A 172 -8.516 12.477 0.691 1.00 0.00 N ATOM 395 CA GLY A 172 -9.477 12.499 1.778 1.00 0.00 C ATOM 396 C GLY A 172 -10.006 11.118 2.113 1.00 0.00 C ATOM 397 O GLY A 172 -11.208 10.938 2.309 1.00 0.00 O ATOM 0 H GLY A 172 -7.539 12.443 0.984 1.00 0.00 H new ATOM 0 HA2 GLY A 172 -9.010 12.930 2.663 1.00 0.00 H new ATOM 0 HA3 GLY A 172 -10.310 13.148 1.509 1.00 0.00 H new ATOM 401 N TRP A 173 -9.108 10.143 2.177 1.00 0.00 N ATOM 402 CA TRP A 173 -9.491 8.770 2.489 1.00 0.00 C ATOM 403 C TRP A 173 -8.880 8.321 3.811 1.00 0.00 C ATOM 404 O TRP A 173 -8.141 9.071 4.450 1.00 0.00 O ATOM 405 CB TRP A 173 -9.054 7.829 1.365 1.00 0.00 C ATOM 406 CG TRP A 173 -9.635 8.187 0.031 1.00 0.00 C ATOM 407 CD1 TRP A 173 -10.854 8.755 -0.207 1.00 0.00 C ATOM 408 CD2 TRP A 173 -9.022 8.000 -1.249 1.00 0.00 C ATOM 409 NE1 TRP A 173 -11.036 8.932 -1.557 1.00 0.00 N ATOM 410 CE2 TRP A 173 -9.925 8.478 -2.219 1.00 0.00 C ATOM 411 CE3 TRP A 173 -7.796 7.477 -1.671 1.00 0.00 C ATOM 412 CZ2 TRP A 173 -9.641 8.446 -3.581 1.00 0.00 C ATOM 413 CZ3 TRP A 173 -7.515 7.446 -3.024 1.00 0.00 C ATOM 414 CH2 TRP A 173 -8.434 7.929 -3.966 1.00 0.00 C ATOM 0 H TRP A 173 -8.109 10.276 2.017 1.00 0.00 H new ATOM 0 HA TRP A 173 -10.576 8.734 2.582 1.00 0.00 H new ATOM 0 HB2 TRP A 173 -7.966 7.840 1.294 1.00 0.00 H new ATOM 0 HB3 TRP A 173 -9.347 6.810 1.619 1.00 0.00 H new ATOM 0 HD1 TRP A 173 -11.570 9.025 0.555 1.00 0.00 H new ATOM 0 HE1 TRP A 173 -11.864 9.336 -1.996 1.00 0.00 H new ATOM 0 HE3 TRP A 173 -7.081 7.104 -0.953 1.00 0.00 H new ATOM 0 HZ2 TRP A 173 -10.348 8.816 -4.308 1.00 0.00 H new ATOM 0 HZ3 TRP A 173 -6.571 7.043 -3.361 1.00 0.00 H new ATOM 0 HH2 TRP A 173 -8.184 7.892 -5.016 1.00 0.00 H new ATOM 425 N ARG A 174 -9.192 7.094 4.216 1.00 0.00 N ATOM 426 CA ARG A 174 -8.673 6.547 5.464 1.00 0.00 C ATOM 427 C ARG A 174 -7.609 5.487 5.192 1.00 0.00 C ATOM 428 O ARG A 174 -7.460 5.017 4.063 1.00 0.00 O ATOM 429 CB ARG A 174 -9.809 5.944 6.292 1.00 0.00 C ATOM 430 CG ARG A 174 -10.587 4.861 5.562 1.00 0.00 C ATOM 431 CD ARG A 174 -9.859 3.527 5.606 1.00 0.00 C ATOM 432 NE ARG A 174 -10.785 2.397 5.587 1.00 0.00 N ATOM 433 CZ ARG A 174 -10.488 1.195 6.069 1.00 0.00 C ATOM 434 NH1 ARG A 174 -9.296 0.968 6.604 1.00 0.00 N ATOM 435 NH2 ARG A 174 -11.384 0.218 6.016 1.00 0.00 N ATOM 0 H ARG A 174 -9.801 6.460 3.698 1.00 0.00 H new ATOM 0 HA ARG A 174 -8.215 7.361 6.026 1.00 0.00 H new ATOM 0 HB2 ARG A 174 -9.396 5.526 7.210 1.00 0.00 H new ATOM 0 HB3 ARG A 174 -10.496 6.739 6.584 1.00 0.00 H new ATOM 0 HG2 ARG A 174 -11.574 4.753 6.013 1.00 0.00 H new ATOM 0 HG3 ARG A 174 -10.741 5.159 4.525 1.00 0.00 H new ATOM 0 HD2 ARG A 174 -9.182 3.455 4.755 1.00 0.00 H new ATOM 0 HD3 ARG A 174 -9.246 3.478 6.506 1.00 0.00 H new ATOM 0 HE ARG A 174 -11.710 2.539 5.181 1.00 0.00 H new ATOM 0 HH11 ARG A 174 -8.605 1.717 6.646 1.00 0.00 H new ATOM 0 HH12 ARG A 174 -9.070 0.044 6.973 1.00 0.00 H new ATOM 0 HH21 ARG A 174 -12.302 0.389 5.605 1.00 0.00 H new ATOM 0 HH22 ARG A 174 -11.155 -0.704 6.386 1.00 0.00 H new ATOM 449 N LEU A 175 -6.872 5.115 6.232 1.00 0.00 N ATOM 450 CA LEU A 175 -5.822 4.111 6.106 1.00 0.00 C ATOM 451 C LEU A 175 -6.310 2.910 5.303 1.00 0.00 C ATOM 452 O LEU A 175 -7.421 2.414 5.495 1.00 0.00 O ATOM 453 CB LEU A 175 -5.354 3.657 7.490 1.00 0.00 C ATOM 454 CG LEU A 175 -4.503 4.659 8.273 1.00 0.00 C ATOM 455 CD1 LEU A 175 -4.474 4.295 9.749 1.00 0.00 C ATOM 456 CD2 LEU A 175 -3.092 4.716 7.707 1.00 0.00 C ATOM 0 H LEU A 175 -6.982 5.494 7.173 1.00 0.00 H new ATOM 0 HA LEU A 175 -4.984 4.563 5.576 1.00 0.00 H new ATOM 0 HB2 LEU A 175 -6.233 3.413 8.087 1.00 0.00 H new ATOM 0 HB3 LEU A 175 -4.781 2.737 7.374 1.00 0.00 H new ATOM 0 HG LEU A 175 -4.953 5.647 8.173 1.00 0.00 H new ATOM 0 HD11 LEU A 175 -3.864 5.018 10.290 1.00 0.00 H new ATOM 0 HD12 LEU A 175 -5.489 4.306 10.147 1.00 0.00 H new ATOM 0 HD13 LEU A 175 -4.048 3.299 9.870 1.00 0.00 H new ATOM 0 HD21 LEU A 175 -2.501 5.434 8.276 1.00 0.00 H new ATOM 0 HD22 LEU A 175 -2.632 3.730 7.777 1.00 0.00 H new ATOM 0 HD23 LEU A 175 -3.131 5.025 6.662 1.00 0.00 H new ATOM 468 N PRO A 176 -5.462 2.428 4.383 1.00 0.00 N ATOM 469 CA PRO A 176 -5.784 1.277 3.534 1.00 0.00 C ATOM 470 C PRO A 176 -5.828 -0.029 4.320 1.00 0.00 C ATOM 471 O PRO A 176 -5.240 -0.136 5.396 1.00 0.00 O ATOM 472 CB PRO A 176 -4.639 1.252 2.519 1.00 0.00 C ATOM 473 CG PRO A 176 -3.504 1.925 3.213 1.00 0.00 C ATOM 474 CD PRO A 176 -4.122 2.969 4.101 1.00 0.00 C ATOM 0 HA PRO A 176 -6.771 1.369 3.081 1.00 0.00 H new ATOM 0 HB2 PRO A 176 -4.382 0.231 2.237 1.00 0.00 H new ATOM 0 HB3 PRO A 176 -4.910 1.777 1.603 1.00 0.00 H new ATOM 0 HG2 PRO A 176 -2.924 1.210 3.797 1.00 0.00 H new ATOM 0 HG3 PRO A 176 -2.821 2.378 2.495 1.00 0.00 H new ATOM 0 HD2 PRO A 176 -3.546 3.111 5.015 1.00 0.00 H new ATOM 0 HD3 PRO A 176 -4.176 3.938 3.604 1.00 0.00 H new ATOM 482 N GLU A 177 -6.527 -1.019 3.775 1.00 0.00 N ATOM 483 CA GLU A 177 -6.646 -2.318 4.428 1.00 0.00 C ATOM 484 C GLU A 177 -5.609 -3.297 3.885 1.00 0.00 C ATOM 485 O GLU A 177 -5.223 -3.226 2.718 1.00 0.00 O ATOM 486 CB GLU A 177 -8.053 -2.887 4.228 1.00 0.00 C ATOM 487 CG GLU A 177 -8.363 -4.073 5.125 1.00 0.00 C ATOM 488 CD GLU A 177 -9.850 -4.251 5.364 1.00 0.00 C ATOM 489 OE1 GLU A 177 -10.416 -3.484 6.171 1.00 0.00 O ATOM 490 OE2 GLU A 177 -10.447 -5.156 4.746 1.00 0.00 O ATOM 0 H GLU A 177 -7.019 -0.947 2.884 1.00 0.00 H new ATOM 0 HA GLU A 177 -6.466 -2.178 5.494 1.00 0.00 H new ATOM 0 HB2 GLU A 177 -8.784 -2.100 4.415 1.00 0.00 H new ATOM 0 HB3 GLU A 177 -8.169 -3.189 3.187 1.00 0.00 H new ATOM 0 HG2 GLU A 177 -7.960 -4.980 4.674 1.00 0.00 H new ATOM 0 HG3 GLU A 177 -7.858 -3.942 6.082 1.00 0.00 H new ATOM 497 N TYR A 178 -5.161 -4.209 4.741 1.00 0.00 N ATOM 498 CA TYR A 178 -4.165 -5.200 4.350 1.00 0.00 C ATOM 499 C TYR A 178 -4.549 -6.587 4.857 1.00 0.00 C ATOM 500 O TYR A 178 -4.551 -6.842 6.062 1.00 0.00 O ATOM 501 CB TYR A 178 -2.788 -4.810 4.888 1.00 0.00 C ATOM 502 CG TYR A 178 -2.215 -3.568 4.244 1.00 0.00 C ATOM 503 CD1 TYR A 178 -1.701 -3.605 2.953 1.00 0.00 C ATOM 504 CD2 TYR A 178 -2.186 -2.358 4.926 1.00 0.00 C ATOM 505 CE1 TYR A 178 -1.176 -2.473 2.361 1.00 0.00 C ATOM 506 CE2 TYR A 178 -1.664 -1.221 4.341 1.00 0.00 C ATOM 507 CZ TYR A 178 -1.160 -1.283 3.058 1.00 0.00 C ATOM 508 OH TYR A 178 -0.638 -0.153 2.472 1.00 0.00 O ATOM 0 H TYR A 178 -5.472 -4.283 5.710 1.00 0.00 H new ATOM 0 HA TYR A 178 -4.126 -5.229 3.261 1.00 0.00 H new ATOM 0 HB2 TYR A 178 -2.859 -4.651 5.964 1.00 0.00 H new ATOM 0 HB3 TYR A 178 -2.099 -5.640 4.734 1.00 0.00 H new ATOM 0 HD1 TYR A 178 -1.712 -4.535 2.404 1.00 0.00 H new ATOM 0 HD2 TYR A 178 -2.578 -2.306 5.931 1.00 0.00 H new ATOM 0 HE1 TYR A 178 -0.780 -2.519 1.357 1.00 0.00 H new ATOM 0 HE2 TYR A 178 -1.650 -0.288 4.885 1.00 0.00 H new ATOM 0 HH TYR A 178 -1.167 0.079 1.681 1.00 0.00 H new ATOM 518 N THR A 179 -4.873 -7.481 3.928 1.00 0.00 N ATOM 519 CA THR A 179 -5.259 -8.842 4.279 1.00 0.00 C ATOM 520 C THR A 179 -4.763 -9.839 3.239 1.00 0.00 C ATOM 521 O THR A 179 -4.742 -9.546 2.043 1.00 0.00 O ATOM 522 CB THR A 179 -6.787 -8.975 4.415 1.00 0.00 C ATOM 523 OG1 THR A 179 -7.297 -7.932 5.252 1.00 0.00 O ATOM 524 CG2 THR A 179 -7.163 -10.329 4.998 1.00 0.00 C ATOM 0 H THR A 179 -4.876 -7.287 2.927 1.00 0.00 H new ATOM 0 HA THR A 179 -4.796 -9.064 5.240 1.00 0.00 H new ATOM 0 HB THR A 179 -7.226 -8.890 3.421 1.00 0.00 H new ATOM 0 HG1 THR A 179 -8.269 -8.023 5.332 1.00 0.00 H new ATOM 0 HG21 THR A 179 -8.247 -10.399 5.085 1.00 0.00 H new ATOM 0 HG22 THR A 179 -6.799 -11.121 4.343 1.00 0.00 H new ATOM 0 HG23 THR A 179 -6.712 -10.438 5.984 1.00 0.00 H new ATOM 532 N VAL A 180 -4.366 -11.021 3.700 1.00 0.00 N ATOM 533 CA VAL A 180 -3.873 -12.064 2.808 1.00 0.00 C ATOM 534 C VAL A 180 -5.023 -12.781 2.112 1.00 0.00 C ATOM 535 O VAL A 180 -5.957 -13.256 2.760 1.00 0.00 O ATOM 536 CB VAL A 180 -3.023 -13.098 3.570 1.00 0.00 C ATOM 537 CG1 VAL A 180 -2.544 -14.193 2.629 1.00 0.00 C ATOM 538 CG2 VAL A 180 -1.845 -12.419 4.254 1.00 0.00 C ATOM 0 H VAL A 180 -4.376 -11.280 4.686 1.00 0.00 H new ATOM 0 HA VAL A 180 -3.250 -11.573 2.060 1.00 0.00 H new ATOM 0 HB VAL A 180 -3.644 -13.558 4.338 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.945 -14.914 3.185 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -3.405 -14.698 2.190 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.939 -13.753 1.837 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.255 -13.164 4.788 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -1.221 -11.931 3.505 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -2.214 -11.675 4.960 1.00 0.00 H new ATOM 548 N THR A 181 -4.951 -12.858 0.787 1.00 0.00 N ATOM 549 CA THR A 181 -5.986 -13.518 0.002 1.00 0.00 C ATOM 550 C THR A 181 -5.546 -14.912 -0.428 1.00 0.00 C ATOM 551 O THR A 181 -6.335 -15.857 -0.401 1.00 0.00 O ATOM 552 CB THR A 181 -6.349 -12.698 -1.251 1.00 0.00 C ATOM 553 OG1 THR A 181 -5.162 -12.366 -1.980 1.00 0.00 O ATOM 554 CG2 THR A 181 -7.089 -11.425 -0.869 1.00 0.00 C ATOM 0 H THR A 181 -4.186 -12.471 0.235 1.00 0.00 H new ATOM 0 HA THR A 181 -6.864 -13.599 0.642 1.00 0.00 H new ATOM 0 HB THR A 181 -7.002 -13.304 -1.878 1.00 0.00 H new ATOM 0 HG1 THR A 181 -4.426 -12.207 -1.352 1.00 0.00 H new ATOM 0 HG21 THR A 181 -7.335 -10.863 -1.770 1.00 0.00 H new ATOM 0 HG22 THR A 181 -8.007 -11.682 -0.340 1.00 0.00 H new ATOM 0 HG23 THR A 181 -6.456 -10.816 -0.223 1.00 0.00 H new ATOM 562 N GLN A 182 -4.283 -15.034 -0.822 1.00 0.00 N ATOM 563 CA GLN A 182 -3.739 -16.315 -1.257 1.00 0.00 C ATOM 564 C GLN A 182 -2.359 -16.554 -0.653 1.00 0.00 C ATOM 565 O GLN A 182 -1.715 -15.625 -0.166 1.00 0.00 O ATOM 566 CB GLN A 182 -3.656 -16.366 -2.783 1.00 0.00 C ATOM 567 CG GLN A 182 -4.915 -16.906 -3.443 1.00 0.00 C ATOM 568 CD GLN A 182 -5.001 -16.551 -4.915 1.00 0.00 C ATOM 569 OE1 GLN A 182 -4.039 -16.055 -5.502 1.00 0.00 O ATOM 570 NE2 GLN A 182 -6.156 -16.805 -5.519 1.00 0.00 N ATOM 0 H GLN A 182 -3.617 -14.262 -0.849 1.00 0.00 H new ATOM 0 HA GLN A 182 -4.409 -17.102 -0.910 1.00 0.00 H new ATOM 0 HB2 GLN A 182 -3.459 -15.363 -3.162 1.00 0.00 H new ATOM 0 HB3 GLN A 182 -2.809 -16.988 -3.072 1.00 0.00 H new ATOM 0 HG2 GLN A 182 -4.942 -17.990 -3.332 1.00 0.00 H new ATOM 0 HG3 GLN A 182 -5.790 -16.511 -2.926 1.00 0.00 H new ATOM 0 HE21 GLN A 182 -6.927 -17.217 -4.993 1.00 0.00 H new ATOM 0 HE22 GLN A 182 -6.272 -16.588 -6.509 1.00 0.00 H new ATOM 579 N GLU A 183 -1.912 -17.805 -0.688 1.00 0.00 N ATOM 580 CA GLU A 183 -0.608 -18.165 -0.142 1.00 0.00 C ATOM 581 C GLU A 183 -0.021 -19.364 -0.882 1.00 0.00 C ATOM 582 O GLU A 183 -0.476 -20.495 -0.712 1.00 0.00 O ATOM 583 CB GLU A 183 -0.725 -18.480 1.351 1.00 0.00 C ATOM 584 CG GLU A 183 -1.117 -17.280 2.197 1.00 0.00 C ATOM 585 CD GLU A 183 -1.557 -17.671 3.594 1.00 0.00 C ATOM 586 OE1 GLU A 183 -2.157 -18.756 3.747 1.00 0.00 O ATOM 587 OE2 GLU A 183 -1.301 -16.892 4.536 1.00 0.00 O ATOM 0 H GLU A 183 -2.432 -18.586 -1.088 1.00 0.00 H new ATOM 0 HA GLU A 183 0.061 -17.315 -0.275 1.00 0.00 H new ATOM 0 HB2 GLU A 183 -1.464 -19.269 1.490 1.00 0.00 H new ATOM 0 HB3 GLU A 183 0.229 -18.869 1.707 1.00 0.00 H new ATOM 0 HG2 GLU A 183 -0.271 -16.596 2.265 1.00 0.00 H new ATOM 0 HG3 GLU A 183 -1.925 -16.740 1.703 1.00 0.00 H new ATOM 594 N SER A 184 0.992 -19.107 -1.703 1.00 0.00 N ATOM 595 CA SER A 184 1.639 -20.163 -2.472 1.00 0.00 C ATOM 596 C SER A 184 3.135 -20.211 -2.178 1.00 0.00 C ATOM 597 O SER A 184 3.673 -19.339 -1.496 1.00 0.00 O ATOM 598 CB SER A 184 1.409 -19.947 -3.969 1.00 0.00 C ATOM 599 OG SER A 184 1.674 -21.131 -4.702 1.00 0.00 O ATOM 0 H SER A 184 1.382 -18.177 -1.853 1.00 0.00 H new ATOM 0 HA SER A 184 1.198 -21.115 -2.177 1.00 0.00 H new ATOM 0 HB2 SER A 184 0.380 -19.632 -4.140 1.00 0.00 H new ATOM 0 HB3 SER A 184 2.052 -19.143 -4.327 1.00 0.00 H new ATOM 0 HG SER A 184 1.518 -20.967 -5.656 1.00 0.00 H new ATOM 605 N GLY A 185 3.803 -21.236 -2.698 1.00 0.00 N ATOM 606 CA GLY A 185 5.230 -21.380 -2.481 1.00 0.00 C ATOM 607 C GLY A 185 5.549 -22.215 -1.256 1.00 0.00 C ATOM 608 O GLY A 185 4.832 -22.187 -0.256 1.00 0.00 O ATOM 0 H GLY A 185 3.380 -21.970 -3.266 1.00 0.00 H new ATOM 0 HA2 GLY A 185 5.683 -21.840 -3.359 1.00 0.00 H new ATOM 0 HA3 GLY A 185 5.679 -20.393 -2.371 1.00 0.00 H new ATOM 612 N PRO A 186 6.649 -22.979 -1.327 1.00 0.00 N ATOM 613 CA PRO A 186 7.085 -23.841 -0.224 1.00 0.00 C ATOM 614 C PRO A 186 7.599 -23.041 0.968 1.00 0.00 C ATOM 615 O PRO A 186 7.364 -21.838 1.067 1.00 0.00 O ATOM 616 CB PRO A 186 8.218 -24.664 -0.844 1.00 0.00 C ATOM 617 CG PRO A 186 8.736 -23.818 -1.956 1.00 0.00 C ATOM 618 CD PRO A 186 7.550 -23.062 -2.488 1.00 0.00 C ATOM 0 HA PRO A 186 6.267 -24.444 0.170 1.00 0.00 H new ATOM 0 HB2 PRO A 186 8.998 -24.878 -0.113 1.00 0.00 H new ATOM 0 HB3 PRO A 186 7.855 -25.623 -1.213 1.00 0.00 H new ATOM 0 HG2 PRO A 186 9.507 -23.134 -1.600 1.00 0.00 H new ATOM 0 HG3 PRO A 186 9.189 -24.432 -2.735 1.00 0.00 H new ATOM 0 HD2 PRO A 186 7.833 -22.073 -2.849 1.00 0.00 H new ATOM 0 HD3 PRO A 186 7.082 -23.584 -3.323 1.00 0.00 H new ATOM 626 N ALA A 187 8.302 -23.718 1.870 1.00 0.00 N ATOM 627 CA ALA A 187 8.851 -23.070 3.054 1.00 0.00 C ATOM 628 C ALA A 187 10.071 -22.225 2.702 1.00 0.00 C ATOM 629 O ALA A 187 10.223 -21.103 3.186 1.00 0.00 O ATOM 630 CB ALA A 187 9.212 -24.109 4.105 1.00 0.00 C ATOM 0 H ALA A 187 8.505 -24.715 1.803 1.00 0.00 H new ATOM 0 HA ALA A 187 8.088 -22.407 3.461 1.00 0.00 H new ATOM 0 HB1 ALA A 187 9.621 -23.611 4.984 1.00 0.00 H new ATOM 0 HB2 ALA A 187 8.319 -24.667 4.387 1.00 0.00 H new ATOM 0 HB3 ALA A 187 9.955 -24.795 3.698 1.00 0.00 H new ATOM 636 N HIS A 188 10.939 -22.771 1.856 1.00 0.00 N ATOM 637 CA HIS A 188 12.146 -22.067 1.439 1.00 0.00 C ATOM 638 C HIS A 188 11.805 -20.907 0.509 1.00 0.00 C ATOM 639 O HIS A 188 12.599 -19.982 0.338 1.00 0.00 O ATOM 640 CB HIS A 188 13.108 -23.029 0.740 1.00 0.00 C ATOM 641 CG HIS A 188 12.531 -23.666 -0.487 1.00 0.00 C ATOM 642 ND1 HIS A 188 12.790 -23.455 -1.798 1.00 0.00 N flip ATOM 643 CD2 HIS A 188 11.564 -24.647 -0.442 1.00 0.00 C flip ATOM 644 CE1 HIS A 188 11.984 -24.305 -2.515 1.00 0.00 C flip ATOM 645 NE2 HIS A 188 11.254 -25.013 -1.673 1.00 0.00 N flip ATOM 0 H HIS A 188 10.829 -23.698 1.446 1.00 0.00 H new ATOM 0 HA HIS A 188 12.628 -21.666 2.330 1.00 0.00 H new ATOM 0 HB2 HIS A 188 14.015 -22.489 0.467 1.00 0.00 H new ATOM 0 HB3 HIS A 188 13.401 -23.810 1.441 1.00 0.00 H new ATOM 0 HD1 HIS A 188 13.460 -22.788 -2.182 1.00 0.00 H new ATOM 0 HD2 HIS A 188 11.128 -25.053 0.459 1.00 0.00 H new ATOM 0 HE1 HIS A 188 11.952 -24.382 -3.592 1.00 0.00 H new ATOM 653 N ARG A 189 10.619 -20.963 -0.088 1.00 0.00 N ATOM 654 CA ARG A 189 10.173 -19.917 -1.001 1.00 0.00 C ATOM 655 C ARG A 189 8.743 -19.492 -0.684 1.00 0.00 C ATOM 656 O ARG A 189 7.895 -19.414 -1.573 1.00 0.00 O ATOM 657 CB ARG A 189 10.263 -20.403 -2.449 1.00 0.00 C ATOM 658 CG ARG A 189 11.683 -20.448 -2.989 1.00 0.00 C ATOM 659 CD ARG A 189 11.712 -20.246 -4.497 1.00 0.00 C ATOM 660 NE ARG A 189 10.968 -21.286 -5.202 1.00 0.00 N ATOM 661 CZ ARG A 189 10.864 -21.346 -6.525 1.00 0.00 C ATOM 662 NH1 ARG A 189 11.454 -20.431 -7.282 1.00 0.00 N ATOM 663 NH2 ARG A 189 10.169 -22.323 -7.093 1.00 0.00 N ATOM 0 H ARG A 189 9.950 -21.721 0.044 1.00 0.00 H new ATOM 0 HA ARG A 189 10.827 -19.054 -0.873 1.00 0.00 H new ATOM 0 HB2 ARG A 189 9.826 -21.399 -2.517 1.00 0.00 H new ATOM 0 HB3 ARG A 189 9.663 -19.748 -3.081 1.00 0.00 H new ATOM 0 HG2 ARG A 189 12.282 -19.676 -2.506 1.00 0.00 H new ATOM 0 HG3 ARG A 189 12.138 -21.407 -2.740 1.00 0.00 H new ATOM 0 HD2 ARG A 189 11.291 -19.271 -4.740 1.00 0.00 H new ATOM 0 HD3 ARG A 189 12.746 -20.242 -4.843 1.00 0.00 H new ATOM 0 HE ARG A 189 10.503 -22.006 -4.649 1.00 0.00 H new ATOM 0 HH11 ARG A 189 11.989 -19.679 -6.849 1.00 0.00 H new ATOM 0 HH12 ARG A 189 11.372 -20.480 -8.298 1.00 0.00 H new ATOM 0 HH21 ARG A 189 9.714 -23.029 -6.514 1.00 0.00 H new ATOM 0 HH22 ARG A 189 10.090 -22.368 -8.109 1.00 0.00 H new ATOM 677 N LYS A 190 8.481 -19.217 0.589 1.00 0.00 N ATOM 678 CA LYS A 190 7.154 -18.799 1.025 1.00 0.00 C ATOM 679 C LYS A 190 6.702 -17.551 0.272 1.00 0.00 C ATOM 680 O LYS A 190 7.479 -16.616 0.080 1.00 0.00 O ATOM 681 CB LYS A 190 7.152 -18.527 2.531 1.00 0.00 C ATOM 682 CG LYS A 190 7.147 -19.788 3.377 1.00 0.00 C ATOM 683 CD LYS A 190 5.737 -20.319 3.578 1.00 0.00 C ATOM 684 CE LYS A 190 5.679 -21.330 4.713 1.00 0.00 C ATOM 685 NZ LYS A 190 5.559 -20.667 6.041 1.00 0.00 N ATOM 0 H LYS A 190 9.171 -19.276 1.338 1.00 0.00 H new ATOM 0 HA LYS A 190 6.456 -19.607 0.807 1.00 0.00 H new ATOM 0 HB2 LYS A 190 8.029 -17.932 2.785 1.00 0.00 H new ATOM 0 HB3 LYS A 190 6.277 -17.928 2.782 1.00 0.00 H new ATOM 0 HG2 LYS A 190 7.759 -20.552 2.897 1.00 0.00 H new ATOM 0 HG3 LYS A 190 7.600 -19.579 4.346 1.00 0.00 H new ATOM 0 HD2 LYS A 190 5.062 -19.490 3.793 1.00 0.00 H new ATOM 0 HD3 LYS A 190 5.387 -20.784 2.656 1.00 0.00 H new ATOM 0 HE2 LYS A 190 4.830 -21.997 4.562 1.00 0.00 H new ATOM 0 HE3 LYS A 190 6.577 -21.948 4.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 190 5.522 -21.390 6.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 190 6.381 -20.050 6.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 190 4.689 -20.098 6.067 1.00 0.00 H new ATOM 699 N GLU A 191 5.442 -17.545 -0.150 1.00 0.00 N ATOM 700 CA GLU A 191 4.888 -16.411 -0.881 1.00 0.00 C ATOM 701 C GLU A 191 3.434 -16.167 -0.487 1.00 0.00 C ATOM 702 O GLU A 191 2.592 -17.059 -0.595 1.00 0.00 O ATOM 703 CB GLU A 191 4.985 -16.652 -2.389 1.00 0.00 C ATOM 704 CG GLU A 191 4.234 -15.624 -3.219 1.00 0.00 C ATOM 705 CD GLU A 191 4.555 -15.722 -4.698 1.00 0.00 C ATOM 706 OE1 GLU A 191 4.229 -16.762 -5.309 1.00 0.00 O ATOM 707 OE2 GLU A 191 5.131 -14.759 -5.245 1.00 0.00 O ATOM 0 H GLU A 191 4.786 -18.311 0.001 1.00 0.00 H new ATOM 0 HA GLU A 191 5.470 -15.526 -0.623 1.00 0.00 H new ATOM 0 HB2 GLU A 191 6.035 -16.647 -2.683 1.00 0.00 H new ATOM 0 HB3 GLU A 191 4.595 -17.644 -2.616 1.00 0.00 H new ATOM 0 HG2 GLU A 191 3.162 -15.758 -3.074 1.00 0.00 H new ATOM 0 HG3 GLU A 191 4.481 -14.624 -2.863 1.00 0.00 H new ATOM 714 N PHE A 192 3.147 -14.954 -0.028 1.00 0.00 N ATOM 715 CA PHE A 192 1.796 -14.592 0.385 1.00 0.00 C ATOM 716 C PHE A 192 1.236 -13.482 -0.501 1.00 0.00 C ATOM 717 O PHE A 192 1.883 -12.457 -0.716 1.00 0.00 O ATOM 718 CB PHE A 192 1.790 -14.144 1.848 1.00 0.00 C ATOM 719 CG PHE A 192 2.048 -15.261 2.818 1.00 0.00 C ATOM 720 CD1 PHE A 192 3.189 -16.040 2.710 1.00 0.00 C ATOM 721 CD2 PHE A 192 1.150 -15.533 3.837 1.00 0.00 C ATOM 722 CE1 PHE A 192 3.430 -17.069 3.601 1.00 0.00 C ATOM 723 CE2 PHE A 192 1.386 -16.560 4.731 1.00 0.00 C ATOM 724 CZ PHE A 192 2.526 -17.330 4.612 1.00 0.00 C ATOM 0 H PHE A 192 3.832 -14.204 0.068 1.00 0.00 H new ATOM 0 HA PHE A 192 1.162 -15.472 0.279 1.00 0.00 H new ATOM 0 HB2 PHE A 192 2.547 -13.372 1.986 1.00 0.00 H new ATOM 0 HB3 PHE A 192 0.826 -13.690 2.077 1.00 0.00 H new ATOM 0 HD1 PHE A 192 3.898 -15.841 1.920 1.00 0.00 H new ATOM 0 HD2 PHE A 192 0.255 -14.936 3.934 1.00 0.00 H new ATOM 0 HE1 PHE A 192 4.324 -17.668 3.507 1.00 0.00 H new ATOM 0 HE2 PHE A 192 0.679 -16.760 5.522 1.00 0.00 H new ATOM 0 HZ PHE A 192 2.710 -18.135 5.308 1.00 0.00 H new ATOM 734 N THR A 193 0.028 -13.696 -1.013 1.00 0.00 N ATOM 735 CA THR A 193 -0.620 -12.716 -1.877 1.00 0.00 C ATOM 736 C THR A 193 -1.547 -11.808 -1.078 1.00 0.00 C ATOM 737 O THR A 193 -2.688 -12.168 -0.791 1.00 0.00 O ATOM 738 CB THR A 193 -1.428 -13.401 -2.995 1.00 0.00 C ATOM 739 OG1 THR A 193 -0.633 -14.410 -3.627 1.00 0.00 O ATOM 740 CG2 THR A 193 -1.885 -12.386 -4.032 1.00 0.00 C ATOM 0 H THR A 193 -0.521 -14.539 -0.845 1.00 0.00 H new ATOM 0 HA THR A 193 0.172 -12.117 -2.327 1.00 0.00 H new ATOM 0 HB THR A 193 -2.309 -13.861 -2.546 1.00 0.00 H new ATOM 0 HG1 THR A 193 -1.155 -14.842 -4.335 1.00 0.00 H new ATOM 0 HG21 THR A 193 -2.454 -12.893 -4.812 1.00 0.00 H new ATOM 0 HG22 THR A 193 -2.514 -11.635 -3.554 1.00 0.00 H new ATOM 0 HG23 THR A 193 -1.015 -11.901 -4.475 1.00 0.00 H new ATOM 748 N MET A 194 -1.050 -10.627 -0.723 1.00 0.00 N ATOM 749 CA MET A 194 -1.837 -9.666 0.041 1.00 0.00 C ATOM 750 C MET A 194 -2.439 -8.606 -0.875 1.00 0.00 C ATOM 751 O MET A 194 -1.768 -8.088 -1.768 1.00 0.00 O ATOM 752 CB MET A 194 -0.968 -8.999 1.110 1.00 0.00 C ATOM 753 CG MET A 194 -1.757 -8.145 2.088 1.00 0.00 C ATOM 754 SD MET A 194 -0.697 -7.229 3.223 1.00 0.00 S ATOM 755 CE MET A 194 -0.367 -8.479 4.462 1.00 0.00 C ATOM 0 H MET A 194 -0.107 -10.313 -0.952 1.00 0.00 H new ATOM 0 HA MET A 194 -2.650 -10.205 0.527 1.00 0.00 H new ATOM 0 HB2 MET A 194 -0.432 -9.770 1.664 1.00 0.00 H new ATOM 0 HB3 MET A 194 -0.218 -8.378 0.621 1.00 0.00 H new ATOM 0 HG2 MET A 194 -2.379 -7.444 1.532 1.00 0.00 H new ATOM 0 HG3 MET A 194 -2.430 -8.783 2.661 1.00 0.00 H new ATOM 0 HE1 MET A 194 0.279 -8.063 5.235 1.00 0.00 H new ATOM 0 HE2 MET A 194 -1.306 -8.804 4.910 1.00 0.00 H new ATOM 0 HE3 MET A 194 0.128 -9.331 3.996 1.00 0.00 H new ATOM 765 N THR A 195 -3.710 -8.288 -0.649 1.00 0.00 N ATOM 766 CA THR A 195 -4.404 -7.291 -1.455 1.00 0.00 C ATOM 767 C THR A 195 -4.729 -6.049 -0.633 1.00 0.00 C ATOM 768 O THR A 195 -5.207 -6.149 0.498 1.00 0.00 O ATOM 769 CB THR A 195 -5.708 -7.856 -2.048 1.00 0.00 C ATOM 770 OG1 THR A 195 -5.454 -9.119 -2.674 1.00 0.00 O ATOM 771 CG2 THR A 195 -6.304 -6.892 -3.062 1.00 0.00 C ATOM 0 H THR A 195 -4.280 -8.707 0.086 1.00 0.00 H new ATOM 0 HA THR A 195 -3.732 -7.019 -2.269 1.00 0.00 H new ATOM 0 HB THR A 195 -6.422 -7.990 -1.236 1.00 0.00 H new ATOM 0 HG1 THR A 195 -5.255 -9.790 -1.988 1.00 0.00 H new ATOM 0 HG21 THR A 195 -7.224 -7.313 -3.467 1.00 0.00 H new ATOM 0 HG22 THR A 195 -6.523 -5.942 -2.575 1.00 0.00 H new ATOM 0 HG23 THR A 195 -5.592 -6.730 -3.871 1.00 0.00 H new ATOM 779 N CYS A 196 -4.468 -4.880 -1.208 1.00 0.00 N ATOM 780 CA CYS A 196 -4.733 -3.617 -0.527 1.00 0.00 C ATOM 781 C CYS A 196 -6.112 -3.080 -0.896 1.00 0.00 C ATOM 782 O CYS A 196 -6.381 -2.781 -2.059 1.00 0.00 O ATOM 783 CB CYS A 196 -3.659 -2.588 -0.882 1.00 0.00 C ATOM 784 SG CYS A 196 -3.517 -1.231 0.305 1.00 0.00 S ATOM 0 H CYS A 196 -4.073 -4.780 -2.143 1.00 0.00 H new ATOM 0 HA CYS A 196 -4.710 -3.799 0.547 1.00 0.00 H new ATOM 0 HB2 CYS A 196 -2.696 -3.094 -0.956 1.00 0.00 H new ATOM 0 HB3 CYS A 196 -3.878 -2.174 -1.866 1.00 0.00 H new ATOM 0 HG CYS A 196 -2.743 -1.591 1.285 1.00 0.00 H new ATOM 790 N ARG A 197 -6.982 -2.963 0.102 1.00 0.00 N ATOM 791 CA ARG A 197 -8.334 -2.464 -0.118 1.00 0.00 C ATOM 792 C ARG A 197 -8.427 -0.978 0.215 1.00 0.00 C ATOM 793 O ARG A 197 -8.027 -0.548 1.297 1.00 0.00 O ATOM 794 CB ARG A 197 -9.335 -3.252 0.729 1.00 0.00 C ATOM 795 CG ARG A 197 -10.726 -3.323 0.121 1.00 0.00 C ATOM 796 CD ARG A 197 -11.636 -4.245 0.916 1.00 0.00 C ATOM 797 NE ARG A 197 -13.035 -3.833 0.841 1.00 0.00 N ATOM 798 CZ ARG A 197 -14.021 -4.459 1.473 1.00 0.00 C ATOM 799 NH1 ARG A 197 -13.762 -5.521 2.225 1.00 0.00 N ATOM 800 NH2 ARG A 197 -15.269 -4.023 1.355 1.00 0.00 N ATOM 0 H ARG A 197 -6.775 -3.207 1.070 1.00 0.00 H new ATOM 0 HA ARG A 197 -8.576 -2.597 -1.172 1.00 0.00 H new ATOM 0 HB2 ARG A 197 -8.958 -4.265 0.872 1.00 0.00 H new ATOM 0 HB3 ARG A 197 -9.402 -2.794 1.716 1.00 0.00 H new ATOM 0 HG2 ARG A 197 -11.160 -2.324 0.086 1.00 0.00 H new ATOM 0 HG3 ARG A 197 -10.657 -3.677 -0.908 1.00 0.00 H new ATOM 0 HD2 ARG A 197 -11.538 -5.263 0.540 1.00 0.00 H new ATOM 0 HD3 ARG A 197 -11.317 -4.258 1.958 1.00 0.00 H new ATOM 0 HE ARG A 197 -13.268 -3.019 0.272 1.00 0.00 H new ATOM 0 HH11 ARG A 197 -12.804 -5.858 2.319 1.00 0.00 H new ATOM 0 HH12 ARG A 197 -14.521 -6.000 2.710 1.00 0.00 H new ATOM 0 HH21 ARG A 197 -15.472 -3.206 0.778 1.00 0.00 H new ATOM 0 HH22 ARG A 197 -16.026 -4.505 1.841 1.00 0.00 H new ATOM 814 N VAL A 198 -8.957 -0.199 -0.722 1.00 0.00 N ATOM 815 CA VAL A 198 -9.103 1.239 -0.528 1.00 0.00 C ATOM 816 C VAL A 198 -10.558 1.669 -0.681 1.00 0.00 C ATOM 817 O VAL A 198 -11.353 0.983 -1.323 1.00 0.00 O ATOM 818 CB VAL A 198 -8.237 2.031 -1.525 1.00 0.00 C ATOM 819 CG1 VAL A 198 -8.629 3.501 -1.523 1.00 0.00 C ATOM 820 CG2 VAL A 198 -6.761 1.863 -1.198 1.00 0.00 C ATOM 0 H VAL A 198 -9.293 -0.539 -1.623 1.00 0.00 H new ATOM 0 HA VAL A 198 -8.767 1.457 0.486 1.00 0.00 H new ATOM 0 HB VAL A 198 -8.411 1.635 -2.526 1.00 0.00 H new ATOM 0 HG11 VAL A 198 -8.006 4.045 -2.234 1.00 0.00 H new ATOM 0 HG12 VAL A 198 -9.676 3.599 -1.809 1.00 0.00 H new ATOM 0 HG13 VAL A 198 -8.486 3.914 -0.525 1.00 0.00 H new ATOM 0 HG21 VAL A 198 -6.163 2.429 -1.912 1.00 0.00 H new ATOM 0 HG22 VAL A 198 -6.567 2.231 -0.190 1.00 0.00 H new ATOM 0 HG23 VAL A 198 -6.493 0.808 -1.257 1.00 0.00 H new ATOM 830 N GLU A 199 -10.898 2.809 -0.088 1.00 0.00 N ATOM 831 CA GLU A 199 -12.258 3.330 -0.160 1.00 0.00 C ATOM 832 C GLU A 199 -12.900 2.993 -1.502 1.00 0.00 C ATOM 833 O GLU A 199 -13.860 2.225 -1.567 1.00 0.00 O ATOM 834 CB GLU A 199 -12.259 4.846 0.052 1.00 0.00 C ATOM 835 CG GLU A 199 -11.862 5.264 1.458 1.00 0.00 C ATOM 836 CD GLU A 199 -12.864 4.817 2.504 1.00 0.00 C ATOM 837 OE1 GLU A 199 -12.996 3.594 2.716 1.00 0.00 O ATOM 838 OE2 GLU A 199 -13.516 5.692 3.112 1.00 0.00 O ATOM 0 H GLU A 199 -10.251 3.389 0.447 1.00 0.00 H new ATOM 0 HA GLU A 199 -12.842 2.859 0.631 1.00 0.00 H new ATOM 0 HB2 GLU A 199 -11.574 5.305 -0.661 1.00 0.00 H new ATOM 0 HB3 GLU A 199 -13.254 5.234 -0.166 1.00 0.00 H new ATOM 0 HG2 GLU A 199 -10.884 4.845 1.695 1.00 0.00 H new ATOM 0 HG3 GLU A 199 -11.762 6.349 1.496 1.00 0.00 H new ATOM 845 N ARG A 200 -12.364 3.574 -2.571 1.00 0.00 N ATOM 846 CA ARG A 200 -12.885 3.336 -3.912 1.00 0.00 C ATOM 847 C ARG A 200 -11.792 2.805 -4.834 1.00 0.00 C ATOM 848 O ARG A 200 -11.786 3.086 -6.033 1.00 0.00 O ATOM 849 CB ARG A 200 -13.473 4.626 -4.489 1.00 0.00 C ATOM 850 CG ARG A 200 -14.790 5.034 -3.850 1.00 0.00 C ATOM 851 CD ARG A 200 -15.934 4.149 -4.318 1.00 0.00 C ATOM 852 NE ARG A 200 -16.430 4.545 -5.633 1.00 0.00 N ATOM 853 CZ ARG A 200 -17.264 3.807 -6.357 1.00 0.00 C ATOM 854 NH1 ARG A 200 -17.692 2.640 -5.897 1.00 0.00 N ATOM 855 NH2 ARG A 200 -17.671 4.236 -7.545 1.00 0.00 N ATOM 0 H ARG A 200 -11.570 4.213 -2.534 1.00 0.00 H new ATOM 0 HA ARG A 200 -13.672 2.585 -3.841 1.00 0.00 H new ATOM 0 HB2 ARG A 200 -12.752 5.433 -4.361 1.00 0.00 H new ATOM 0 HB3 ARG A 200 -13.623 4.499 -5.561 1.00 0.00 H new ATOM 0 HG2 ARG A 200 -14.703 4.975 -2.765 1.00 0.00 H new ATOM 0 HG3 ARG A 200 -15.008 6.073 -4.096 1.00 0.00 H new ATOM 0 HD2 ARG A 200 -15.599 3.112 -4.354 1.00 0.00 H new ATOM 0 HD3 ARG A 200 -16.748 4.196 -3.594 1.00 0.00 H new ATOM 0 HE ARG A 200 -16.119 5.437 -6.017 1.00 0.00 H new ATOM 0 HH11 ARG A 200 -17.381 2.306 -4.985 1.00 0.00 H new ATOM 0 HH12 ARG A 200 -18.332 2.076 -6.455 1.00 0.00 H new ATOM 0 HH21 ARG A 200 -17.343 5.133 -7.903 1.00 0.00 H new ATOM 0 HH22 ARG A 200 -18.311 3.669 -8.100 1.00 0.00 H new ATOM 869 N PHE A 201 -10.868 2.037 -4.266 1.00 0.00 N ATOM 870 CA PHE A 201 -9.768 1.468 -5.037 1.00 0.00 C ATOM 871 C PHE A 201 -9.356 0.111 -4.475 1.00 0.00 C ATOM 872 O PHE A 201 -9.515 -0.154 -3.283 1.00 0.00 O ATOM 873 CB PHE A 201 -8.570 2.419 -5.035 1.00 0.00 C ATOM 874 CG PHE A 201 -8.662 3.502 -6.072 1.00 0.00 C ATOM 875 CD1 PHE A 201 -9.554 4.552 -5.918 1.00 0.00 C ATOM 876 CD2 PHE A 201 -7.858 3.471 -7.199 1.00 0.00 C ATOM 877 CE1 PHE A 201 -9.641 5.549 -6.871 1.00 0.00 C ATOM 878 CE2 PHE A 201 -7.940 4.465 -8.155 1.00 0.00 C ATOM 879 CZ PHE A 201 -8.832 5.506 -7.990 1.00 0.00 C ATOM 0 H PHE A 201 -10.859 1.794 -3.275 1.00 0.00 H new ATOM 0 HA PHE A 201 -10.110 1.328 -6.063 1.00 0.00 H new ATOM 0 HB2 PHE A 201 -8.482 2.877 -4.050 1.00 0.00 H new ATOM 0 HB3 PHE A 201 -7.659 1.844 -5.202 1.00 0.00 H new ATOM 0 HD1 PHE A 201 -10.187 4.591 -5.044 1.00 0.00 H new ATOM 0 HD2 PHE A 201 -7.158 2.659 -7.332 1.00 0.00 H new ATOM 0 HE1 PHE A 201 -10.341 6.361 -6.741 1.00 0.00 H new ATOM 0 HE2 PHE A 201 -7.308 4.428 -9.030 1.00 0.00 H new ATOM 0 HZ PHE A 201 -8.897 6.285 -8.735 1.00 0.00 H new ATOM 889 N ILE A 202 -8.826 -0.746 -5.342 1.00 0.00 N ATOM 890 CA ILE A 202 -8.390 -2.075 -4.933 1.00 0.00 C ATOM 891 C ILE A 202 -7.228 -2.561 -5.792 1.00 0.00 C ATOM 892 O ILE A 202 -7.211 -2.353 -7.004 1.00 0.00 O ATOM 893 CB ILE A 202 -9.540 -3.096 -5.019 1.00 0.00 C ATOM 894 CG1 ILE A 202 -10.642 -2.742 -4.018 1.00 0.00 C ATOM 895 CG2 ILE A 202 -9.019 -4.503 -4.766 1.00 0.00 C ATOM 896 CD1 ILE A 202 -11.850 -3.647 -4.104 1.00 0.00 C ATOM 0 H ILE A 202 -8.688 -0.543 -6.332 1.00 0.00 H new ATOM 0 HA ILE A 202 -8.063 -1.995 -3.896 1.00 0.00 H new ATOM 0 HB ILE A 202 -9.963 -3.061 -6.023 1.00 0.00 H new ATOM 0 HG12 ILE A 202 -10.234 -2.790 -3.009 1.00 0.00 H new ATOM 0 HG13 ILE A 202 -10.957 -1.712 -4.186 1.00 0.00 H new ATOM 0 HG21 ILE A 202 -9.843 -5.213 -4.830 1.00 0.00 H new ATOM 0 HG22 ILE A 202 -8.266 -4.752 -5.514 1.00 0.00 H new ATOM 0 HG23 ILE A 202 -8.574 -4.553 -3.772 1.00 0.00 H new ATOM 0 HD11 ILE A 202 -12.590 -3.337 -3.366 1.00 0.00 H new ATOM 0 HD12 ILE A 202 -12.283 -3.581 -5.102 1.00 0.00 H new ATOM 0 HD13 ILE A 202 -11.549 -4.676 -3.906 1.00 0.00 H new ATOM 908 N GLU A 203 -6.259 -3.211 -5.154 1.00 0.00 N ATOM 909 CA GLU A 203 -5.093 -3.728 -5.861 1.00 0.00 C ATOM 910 C GLU A 203 -4.515 -4.943 -5.142 1.00 0.00 C ATOM 911 O GLU A 203 -4.411 -4.959 -3.915 1.00 0.00 O ATOM 912 CB GLU A 203 -4.024 -2.641 -5.990 1.00 0.00 C ATOM 913 CG GLU A 203 -2.742 -3.123 -6.648 1.00 0.00 C ATOM 914 CD GLU A 203 -2.992 -3.834 -7.963 1.00 0.00 C ATOM 915 OE1 GLU A 203 -3.522 -3.190 -8.893 1.00 0.00 O ATOM 916 OE2 GLU A 203 -2.659 -5.034 -8.063 1.00 0.00 O ATOM 0 H GLU A 203 -6.259 -3.392 -4.150 1.00 0.00 H new ATOM 0 HA GLU A 203 -5.411 -4.035 -6.857 1.00 0.00 H new ATOM 0 HB2 GLU A 203 -4.430 -1.811 -6.569 1.00 0.00 H new ATOM 0 HB3 GLU A 203 -3.790 -2.254 -4.998 1.00 0.00 H new ATOM 0 HG2 GLU A 203 -2.084 -2.271 -6.819 1.00 0.00 H new ATOM 0 HG3 GLU A 203 -2.221 -3.797 -5.968 1.00 0.00 H new ATOM 923 N ILE A 204 -4.141 -5.958 -5.914 1.00 0.00 N ATOM 924 CA ILE A 204 -3.573 -7.176 -5.350 1.00 0.00 C ATOM 925 C ILE A 204 -2.050 -7.154 -5.415 1.00 0.00 C ATOM 926 O ILE A 204 -1.467 -6.747 -6.419 1.00 0.00 O ATOM 927 CB ILE A 204 -4.088 -8.429 -6.084 1.00 0.00 C ATOM 928 CG1 ILE A 204 -5.614 -8.507 -5.995 1.00 0.00 C ATOM 929 CG2 ILE A 204 -3.453 -9.682 -5.501 1.00 0.00 C ATOM 930 CD1 ILE A 204 -6.231 -9.446 -7.008 1.00 0.00 C ATOM 0 H ILE A 204 -4.221 -5.961 -6.931 1.00 0.00 H new ATOM 0 HA ILE A 204 -3.889 -7.218 -4.308 1.00 0.00 H new ATOM 0 HB ILE A 204 -3.807 -8.358 -7.135 1.00 0.00 H new ATOM 0 HG12 ILE A 204 -5.895 -8.831 -4.993 1.00 0.00 H new ATOM 0 HG13 ILE A 204 -6.030 -7.509 -6.136 1.00 0.00 H new ATOM 0 HG21 ILE A 204 -3.827 -10.559 -6.030 1.00 0.00 H new ATOM 0 HG22 ILE A 204 -2.370 -9.626 -5.611 1.00 0.00 H new ATOM 0 HG23 ILE A 204 -3.707 -9.760 -4.444 1.00 0.00 H new ATOM 0 HD11 ILE A 204 -7.314 -9.451 -6.887 1.00 0.00 H new ATOM 0 HD12 ILE A 204 -5.980 -9.111 -8.015 1.00 0.00 H new ATOM 0 HD13 ILE A 204 -5.844 -10.453 -6.854 1.00 0.00 H new ATOM 942 N GLY A 205 -1.410 -7.596 -4.337 1.00 0.00 N ATOM 943 CA GLY A 205 0.040 -7.620 -4.292 1.00 0.00 C ATOM 944 C GLY A 205 0.586 -8.979 -3.903 1.00 0.00 C ATOM 945 O GLY A 205 -0.174 -9.890 -3.574 1.00 0.00 O ATOM 0 H GLY A 205 -1.870 -7.938 -3.493 1.00 0.00 H new ATOM 0 HA2 GLY A 205 0.435 -7.339 -5.268 1.00 0.00 H new ATOM 0 HA3 GLY A 205 0.391 -6.874 -3.579 1.00 0.00 H new ATOM 949 N SER A 206 1.907 -9.118 -3.942 1.00 0.00 N ATOM 950 CA SER A 206 2.554 -10.379 -3.596 1.00 0.00 C ATOM 951 C SER A 206 3.939 -10.134 -3.004 1.00 0.00 C ATOM 952 O SER A 206 4.689 -9.285 -3.482 1.00 0.00 O ATOM 953 CB SER A 206 2.666 -11.275 -4.831 1.00 0.00 C ATOM 954 OG SER A 206 3.294 -10.591 -5.902 1.00 0.00 O ATOM 0 H SER A 206 2.551 -8.373 -4.210 1.00 0.00 H new ATOM 0 HA SER A 206 1.941 -10.880 -2.847 1.00 0.00 H new ATOM 0 HB2 SER A 206 3.235 -12.171 -4.584 1.00 0.00 H new ATOM 0 HB3 SER A 206 1.673 -11.603 -5.137 1.00 0.00 H new ATOM 0 HG SER A 206 3.355 -11.185 -6.679 1.00 0.00 H new ATOM 960 N GLY A 207 4.270 -10.886 -1.959 1.00 0.00 N ATOM 961 CA GLY A 207 5.563 -10.737 -1.318 1.00 0.00 C ATOM 962 C GLY A 207 5.988 -11.986 -0.571 1.00 0.00 C ATOM 963 O GLY A 207 5.197 -12.580 0.163 1.00 0.00 O ATOM 0 H GLY A 207 3.666 -11.596 -1.545 1.00 0.00 H new ATOM 0 HA2 GLY A 207 6.313 -10.495 -2.071 1.00 0.00 H new ATOM 0 HA3 GLY A 207 5.526 -9.897 -0.624 1.00 0.00 H new ATOM 967 N THR A 208 7.241 -12.389 -0.759 1.00 0.00 N ATOM 968 CA THR A 208 7.769 -13.577 -0.101 1.00 0.00 C ATOM 969 C THR A 208 7.282 -13.668 1.341 1.00 0.00 C ATOM 970 O THR A 208 7.031 -14.759 1.853 1.00 0.00 O ATOM 971 CB THR A 208 9.310 -13.587 -0.112 1.00 0.00 C ATOM 972 OG1 THR A 208 9.812 -12.416 0.541 1.00 0.00 O ATOM 973 CG2 THR A 208 9.840 -13.648 -1.536 1.00 0.00 C ATOM 0 H THR A 208 7.909 -11.909 -1.362 1.00 0.00 H new ATOM 0 HA THR A 208 7.403 -14.438 -0.661 1.00 0.00 H new ATOM 0 HB THR A 208 9.650 -14.474 0.423 1.00 0.00 H new ATOM 0 HG1 THR A 208 10.792 -12.431 0.531 1.00 0.00 H new ATOM 0 HG21 THR A 208 10.930 -13.654 -1.519 1.00 0.00 H new ATOM 0 HG22 THR A 208 9.480 -14.556 -2.020 1.00 0.00 H new ATOM 0 HG23 THR A 208 9.491 -12.778 -2.092 1.00 0.00 H new ATOM 981 N SER A 209 7.150 -12.516 1.991 1.00 0.00 N ATOM 982 CA SER A 209 6.695 -12.468 3.375 1.00 0.00 C ATOM 983 C SER A 209 5.594 -11.426 3.549 1.00 0.00 C ATOM 984 O SER A 209 5.594 -10.388 2.887 1.00 0.00 O ATOM 985 CB SER A 209 7.866 -12.149 4.308 1.00 0.00 C ATOM 986 OG SER A 209 7.483 -12.270 5.667 1.00 0.00 O ATOM 0 H SER A 209 7.352 -11.604 1.581 1.00 0.00 H new ATOM 0 HA SER A 209 6.290 -13.447 3.633 1.00 0.00 H new ATOM 0 HB2 SER A 209 8.696 -12.824 4.099 1.00 0.00 H new ATOM 0 HB3 SER A 209 8.223 -11.137 4.116 1.00 0.00 H new ATOM 0 HG SER A 209 8.249 -12.063 6.242 1.00 0.00 H new ATOM 992 N LYS A 210 4.655 -11.711 4.445 1.00 0.00 N ATOM 993 CA LYS A 210 3.548 -10.801 4.709 1.00 0.00 C ATOM 994 C LYS A 210 4.030 -9.354 4.751 1.00 0.00 C ATOM 995 O LYS A 210 3.553 -8.508 3.994 1.00 0.00 O ATOM 996 CB LYS A 210 2.869 -11.161 6.033 1.00 0.00 C ATOM 997 CG LYS A 210 2.201 -12.525 6.022 1.00 0.00 C ATOM 998 CD LYS A 210 1.346 -12.737 7.261 1.00 0.00 C ATOM 999 CE LYS A 210 1.021 -14.208 7.468 1.00 0.00 C ATOM 1000 NZ LYS A 210 -0.281 -14.395 8.167 1.00 0.00 N ATOM 0 H LYS A 210 4.639 -12.566 5.001 1.00 0.00 H new ATOM 0 HA LYS A 210 2.827 -10.902 3.898 1.00 0.00 H new ATOM 0 HB2 LYS A 210 3.611 -11.135 6.831 1.00 0.00 H new ATOM 0 HB3 LYS A 210 2.123 -10.402 6.267 1.00 0.00 H new ATOM 0 HG2 LYS A 210 1.581 -12.621 5.130 1.00 0.00 H new ATOM 0 HG3 LYS A 210 2.962 -13.303 5.966 1.00 0.00 H new ATOM 0 HD2 LYS A 210 1.870 -12.352 8.136 1.00 0.00 H new ATOM 0 HD3 LYS A 210 0.421 -12.168 7.168 1.00 0.00 H new ATOM 0 HE2 LYS A 210 0.991 -14.713 6.502 1.00 0.00 H new ATOM 0 HE3 LYS A 210 1.815 -14.677 8.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 210 -0.467 -15.411 8.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 210 -0.244 -13.935 9.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 210 -1.043 -13.970 7.601 1.00 0.00 H new ATOM 1014 N LYS A 211 4.979 -9.077 5.638 1.00 0.00 N ATOM 1015 CA LYS A 211 5.529 -7.734 5.776 1.00 0.00 C ATOM 1016 C LYS A 211 5.791 -7.110 4.409 1.00 0.00 C ATOM 1017 O LYS A 211 5.535 -5.924 4.198 1.00 0.00 O ATOM 1018 CB LYS A 211 6.826 -7.772 6.588 1.00 0.00 C ATOM 1019 CG LYS A 211 7.935 -8.570 5.925 1.00 0.00 C ATOM 1020 CD LYS A 211 9.218 -8.523 6.739 1.00 0.00 C ATOM 1021 CE LYS A 211 10.090 -7.344 6.336 1.00 0.00 C ATOM 1022 NZ LYS A 211 11.459 -7.444 6.914 1.00 0.00 N ATOM 0 H LYS A 211 5.384 -9.765 6.273 1.00 0.00 H new ATOM 0 HA LYS A 211 4.797 -7.121 6.301 1.00 0.00 H new ATOM 0 HB2 LYS A 211 7.172 -6.752 6.752 1.00 0.00 H new ATOM 0 HB3 LYS A 211 6.618 -8.200 7.569 1.00 0.00 H new ATOM 0 HG2 LYS A 211 7.617 -9.606 5.804 1.00 0.00 H new ATOM 0 HG3 LYS A 211 8.122 -8.175 4.926 1.00 0.00 H new ATOM 0 HD2 LYS A 211 8.975 -8.452 7.799 1.00 0.00 H new ATOM 0 HD3 LYS A 211 9.772 -9.451 6.601 1.00 0.00 H new ATOM 0 HE2 LYS A 211 10.157 -7.297 5.249 1.00 0.00 H new ATOM 0 HE3 LYS A 211 9.623 -6.417 6.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 211 12.022 -6.622 6.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 211 11.397 -7.464 7.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 211 11.915 -8.316 6.578 1.00 0.00 H new ATOM 1036 N LEU A 212 6.302 -7.915 3.485 1.00 0.00 N ATOM 1037 CA LEU A 212 6.598 -7.442 2.137 1.00 0.00 C ATOM 1038 C LEU A 212 5.317 -7.278 1.324 1.00 0.00 C ATOM 1039 O LEU A 212 4.997 -6.182 0.867 1.00 0.00 O ATOM 1040 CB LEU A 212 7.543 -8.414 1.429 1.00 0.00 C ATOM 1041 CG LEU A 212 9.019 -8.318 1.818 1.00 0.00 C ATOM 1042 CD1 LEU A 212 9.756 -9.592 1.437 1.00 0.00 C ATOM 1043 CD2 LEU A 212 9.666 -7.108 1.158 1.00 0.00 C ATOM 0 H LEU A 212 6.520 -8.899 3.644 1.00 0.00 H new ATOM 0 HA LEU A 212 7.083 -6.469 2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 212 7.201 -9.430 1.626 1.00 0.00 H new ATOM 0 HB3 LEU A 212 7.460 -8.252 0.354 1.00 0.00 H new ATOM 0 HG LEU A 212 9.083 -8.196 2.899 1.00 0.00 H new ATOM 0 HD11 LEU A 212 10.805 -9.505 1.722 1.00 0.00 H new ATOM 0 HD12 LEU A 212 9.309 -10.440 1.955 1.00 0.00 H new ATOM 0 HD13 LEU A 212 9.684 -9.746 0.360 1.00 0.00 H new ATOM 0 HD21 LEU A 212 10.716 -7.055 1.446 1.00 0.00 H new ATOM 0 HD22 LEU A 212 9.591 -7.201 0.075 1.00 0.00 H new ATOM 0 HD23 LEU A 212 9.155 -6.201 1.481 1.00 0.00 H new ATOM 1055 N ALA A 213 4.588 -8.376 1.151 1.00 0.00 N ATOM 1056 CA ALA A 213 3.341 -8.353 0.397 1.00 0.00 C ATOM 1057 C ALA A 213 2.582 -7.051 0.631 1.00 0.00 C ATOM 1058 O ALA A 213 2.020 -6.472 -0.298 1.00 0.00 O ATOM 1059 CB ALA A 213 2.475 -9.546 0.774 1.00 0.00 C ATOM 0 H ALA A 213 4.840 -9.292 1.523 1.00 0.00 H new ATOM 0 HA ALA A 213 3.585 -8.415 -0.664 1.00 0.00 H new ATOM 0 HB1 ALA A 213 1.547 -9.516 0.204 1.00 0.00 H new ATOM 0 HB2 ALA A 213 3.010 -10.469 0.550 1.00 0.00 H new ATOM 0 HB3 ALA A 213 2.247 -9.508 1.839 1.00 0.00 H new ATOM 1065 N LYS A 214 2.568 -6.596 1.880 1.00 0.00 N ATOM 1066 CA LYS A 214 1.879 -5.362 2.237 1.00 0.00 C ATOM 1067 C LYS A 214 2.426 -4.182 1.441 1.00 0.00 C ATOM 1068 O LYS A 214 1.684 -3.500 0.734 1.00 0.00 O ATOM 1069 CB LYS A 214 2.022 -5.090 3.736 1.00 0.00 C ATOM 1070 CG LYS A 214 1.438 -3.757 4.171 1.00 0.00 C ATOM 1071 CD LYS A 214 1.772 -3.447 5.620 1.00 0.00 C ATOM 1072 CE LYS A 214 1.252 -2.079 6.032 1.00 0.00 C ATOM 1073 NZ LYS A 214 1.788 -1.657 7.356 1.00 0.00 N ATOM 0 H LYS A 214 3.026 -7.064 2.662 1.00 0.00 H new ATOM 0 HA LYS A 214 0.823 -5.482 1.994 1.00 0.00 H new ATOM 0 HB2 LYS A 214 1.532 -5.890 4.290 1.00 0.00 H new ATOM 0 HB3 LYS A 214 3.078 -5.119 4.003 1.00 0.00 H new ATOM 0 HG2 LYS A 214 1.823 -2.964 3.530 1.00 0.00 H new ATOM 0 HG3 LYS A 214 0.356 -3.774 4.042 1.00 0.00 H new ATOM 0 HD2 LYS A 214 1.339 -4.211 6.266 1.00 0.00 H new ATOM 0 HD3 LYS A 214 2.852 -3.484 5.761 1.00 0.00 H new ATOM 0 HE2 LYS A 214 1.529 -1.343 5.277 1.00 0.00 H new ATOM 0 HE3 LYS A 214 0.163 -2.101 6.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 214 1.410 -0.720 7.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 214 1.503 -2.346 8.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 214 2.826 -1.611 7.312 1.00 0.00 H new ATOM 1087 N ARG A 215 3.729 -3.949 1.558 1.00 0.00 N ATOM 1088 CA ARG A 215 4.376 -2.852 0.849 1.00 0.00 C ATOM 1089 C ARG A 215 4.235 -3.022 -0.661 1.00 0.00 C ATOM 1090 O ARG A 215 4.144 -2.043 -1.400 1.00 0.00 O ATOM 1091 CB ARG A 215 5.856 -2.773 1.228 1.00 0.00 C ATOM 1092 CG ARG A 215 6.759 -3.603 0.330 1.00 0.00 C ATOM 1093 CD ARG A 215 8.091 -3.901 1.001 1.00 0.00 C ATOM 1094 NE ARG A 215 9.010 -2.769 0.922 1.00 0.00 N ATOM 1095 CZ ARG A 215 9.759 -2.504 -0.142 1.00 0.00 C ATOM 1096 NH1 ARG A 215 9.699 -3.286 -1.211 1.00 0.00 N ATOM 1097 NH2 ARG A 215 10.571 -1.454 -0.138 1.00 0.00 N ATOM 0 H ARG A 215 4.358 -4.506 2.137 1.00 0.00 H new ATOM 0 HA ARG A 215 3.884 -1.924 1.141 1.00 0.00 H new ATOM 0 HB2 ARG A 215 6.177 -1.732 1.190 1.00 0.00 H new ATOM 0 HB3 ARG A 215 5.977 -3.106 2.259 1.00 0.00 H new ATOM 0 HG2 ARG A 215 6.261 -4.539 0.076 1.00 0.00 H new ATOM 0 HG3 ARG A 215 6.933 -3.071 -0.605 1.00 0.00 H new ATOM 0 HD2 ARG A 215 7.921 -4.157 2.047 1.00 0.00 H new ATOM 0 HD3 ARG A 215 8.547 -4.772 0.530 1.00 0.00 H new ATOM 0 HE ARG A 215 9.080 -2.148 1.728 1.00 0.00 H new ATOM 0 HH11 ARG A 215 9.076 -4.094 -1.218 1.00 0.00 H new ATOM 0 HH12 ARG A 215 10.276 -3.080 -2.027 1.00 0.00 H new ATOM 0 HH21 ARG A 215 10.620 -0.850 0.683 1.00 0.00 H new ATOM 0 HH22 ARG A 215 11.146 -1.251 -0.956 1.00 0.00 H new ATOM 1111 N ASN A 216 4.218 -4.272 -1.111 1.00 0.00 N ATOM 1112 CA ASN A 216 4.088 -4.571 -2.533 1.00 0.00 C ATOM 1113 C ASN A 216 2.737 -4.106 -3.066 1.00 0.00 C ATOM 1114 O ASN A 216 2.658 -3.476 -4.120 1.00 0.00 O ATOM 1115 CB ASN A 216 4.256 -6.072 -2.777 1.00 0.00 C ATOM 1116 CG ASN A 216 4.630 -6.387 -4.212 1.00 0.00 C ATOM 1117 OD1 ASN A 216 3.829 -6.201 -5.129 1.00 0.00 O ATOM 1118 ND2 ASN A 216 5.852 -6.866 -4.414 1.00 0.00 N ATOM 0 H ASN A 216 4.293 -5.094 -0.512 1.00 0.00 H new ATOM 0 HA ASN A 216 4.873 -4.033 -3.065 1.00 0.00 H new ATOM 0 HB2 ASN A 216 5.025 -6.462 -2.110 1.00 0.00 H new ATOM 0 HB3 ASN A 216 3.327 -6.584 -2.526 1.00 0.00 H new ATOM 0 HD21 ASN A 216 6.160 -7.096 -5.359 1.00 0.00 H new ATOM 0 HD22 ASN A 216 6.483 -7.004 -3.624 1.00 0.00 H new ATOM 1125 N ALA A 217 1.676 -4.420 -2.329 1.00 0.00 N ATOM 1126 CA ALA A 217 0.328 -4.032 -2.726 1.00 0.00 C ATOM 1127 C ALA A 217 0.176 -2.515 -2.741 1.00 0.00 C ATOM 1128 O ALA A 217 -0.340 -1.943 -3.700 1.00 0.00 O ATOM 1129 CB ALA A 217 -0.697 -4.659 -1.793 1.00 0.00 C ATOM 0 H ALA A 217 1.724 -4.942 -1.454 1.00 0.00 H new ATOM 0 HA ALA A 217 0.153 -4.398 -3.738 1.00 0.00 H new ATOM 0 HB1 ALA A 217 -1.699 -4.361 -2.101 1.00 0.00 H new ATOM 0 HB2 ALA A 217 -0.612 -5.745 -1.836 1.00 0.00 H new ATOM 0 HB3 ALA A 217 -0.515 -4.321 -0.773 1.00 0.00 H new ATOM 1135 N ALA A 218 0.628 -1.869 -1.671 1.00 0.00 N ATOM 1136 CA ALA A 218 0.542 -0.418 -1.562 1.00 0.00 C ATOM 1137 C ALA A 218 1.293 0.263 -2.701 1.00 0.00 C ATOM 1138 O ALA A 218 0.798 1.219 -3.299 1.00 0.00 O ATOM 1139 CB ALA A 218 1.088 0.043 -0.218 1.00 0.00 C ATOM 0 H ALA A 218 1.057 -2.328 -0.867 1.00 0.00 H new ATOM 0 HA ALA A 218 -0.508 -0.134 -1.633 1.00 0.00 H new ATOM 0 HB1 ALA A 218 1.018 1.129 -0.150 1.00 0.00 H new ATOM 0 HB2 ALA A 218 0.507 -0.409 0.585 1.00 0.00 H new ATOM 0 HB3 ALA A 218 2.131 -0.260 -0.126 1.00 0.00 H new ATOM 1145 N ALA A 219 2.489 -0.235 -2.997 1.00 0.00 N ATOM 1146 CA ALA A 219 3.306 0.325 -4.066 1.00 0.00 C ATOM 1147 C ALA A 219 2.503 0.467 -5.355 1.00 0.00 C ATOM 1148 O ALA A 219 2.288 1.575 -5.846 1.00 0.00 O ATOM 1149 CB ALA A 219 4.535 -0.541 -4.300 1.00 0.00 C ATOM 0 H ALA A 219 2.913 -1.025 -2.511 1.00 0.00 H new ATOM 0 HA ALA A 219 3.629 1.320 -3.759 1.00 0.00 H new ATOM 0 HB1 ALA A 219 5.136 -0.111 -5.101 1.00 0.00 H new ATOM 0 HB2 ALA A 219 5.127 -0.586 -3.386 1.00 0.00 H new ATOM 0 HB3 ALA A 219 4.223 -1.547 -4.581 1.00 0.00 H new ATOM 1155 N LYS A 220 2.063 -0.663 -5.899 1.00 0.00 N ATOM 1156 CA LYS A 220 1.283 -0.665 -7.131 1.00 0.00 C ATOM 1157 C LYS A 220 0.091 0.280 -7.022 1.00 0.00 C ATOM 1158 O LYS A 220 -0.239 0.990 -7.972 1.00 0.00 O ATOM 1159 CB LYS A 220 0.797 -2.082 -7.448 1.00 0.00 C ATOM 1160 CG LYS A 220 1.924 -3.073 -7.680 1.00 0.00 C ATOM 1161 CD LYS A 220 1.399 -4.404 -8.191 1.00 0.00 C ATOM 1162 CE LYS A 220 2.421 -5.104 -9.075 1.00 0.00 C ATOM 1163 NZ LYS A 220 3.484 -5.770 -8.273 1.00 0.00 N ATOM 0 H LYS A 220 2.233 -1.589 -5.506 1.00 0.00 H new ATOM 0 HA LYS A 220 1.926 -0.318 -7.940 1.00 0.00 H new ATOM 0 HB2 LYS A 220 0.176 -2.437 -6.625 1.00 0.00 H new ATOM 0 HB3 LYS A 220 0.164 -2.050 -8.335 1.00 0.00 H new ATOM 0 HG2 LYS A 220 2.631 -2.659 -8.399 1.00 0.00 H new ATOM 0 HG3 LYS A 220 2.470 -3.229 -6.750 1.00 0.00 H new ATOM 0 HD2 LYS A 220 1.147 -5.045 -7.346 1.00 0.00 H new ATOM 0 HD3 LYS A 220 0.480 -4.242 -8.754 1.00 0.00 H new ATOM 0 HE2 LYS A 220 1.917 -5.844 -9.696 1.00 0.00 H new ATOM 0 HE3 LYS A 220 2.876 -4.378 -9.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 4.393 -5.291 -8.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 3.241 -5.718 -7.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 3.562 -6.767 -8.559 1.00 0.00 H new ATOM 1177 N MET A 221 -0.551 0.284 -5.858 1.00 0.00 N ATOM 1178 CA MET A 221 -1.705 1.144 -5.626 1.00 0.00 C ATOM 1179 C MET A 221 -1.347 2.609 -5.859 1.00 0.00 C ATOM 1180 O MET A 221 -2.170 3.390 -6.340 1.00 0.00 O ATOM 1181 CB MET A 221 -2.230 0.956 -4.201 1.00 0.00 C ATOM 1182 CG MET A 221 -3.691 1.340 -4.036 1.00 0.00 C ATOM 1183 SD MET A 221 -4.510 0.409 -2.726 1.00 0.00 S ATOM 1184 CE MET A 221 -6.015 -0.092 -3.557 1.00 0.00 C ATOM 0 H MET A 221 -0.292 -0.298 -5.062 1.00 0.00 H new ATOM 0 HA MET A 221 -2.485 0.862 -6.333 1.00 0.00 H new ATOM 0 HB2 MET A 221 -2.102 -0.087 -3.910 1.00 0.00 H new ATOM 0 HB3 MET A 221 -1.626 1.554 -3.518 1.00 0.00 H new ATOM 0 HG2 MET A 221 -3.760 2.406 -3.817 1.00 0.00 H new ATOM 0 HG3 MET A 221 -4.215 1.173 -4.977 1.00 0.00 H new ATOM 0 HE1 MET A 221 -6.719 -0.489 -2.826 1.00 0.00 H new ATOM 0 HE2 MET A 221 -6.458 0.769 -4.057 1.00 0.00 H new ATOM 0 HE3 MET A 221 -5.785 -0.861 -4.294 1.00 0.00 H new ATOM 1194 N LEU A 222 -0.117 2.974 -5.516 1.00 0.00 N ATOM 1195 CA LEU A 222 0.349 4.346 -5.689 1.00 0.00 C ATOM 1196 C LEU A 222 0.014 4.864 -7.083 1.00 0.00 C ATOM 1197 O LEU A 222 -0.497 5.974 -7.239 1.00 0.00 O ATOM 1198 CB LEU A 222 1.859 4.425 -5.452 1.00 0.00 C ATOM 1199 CG LEU A 222 2.355 3.902 -4.104 1.00 0.00 C ATOM 1200 CD1 LEU A 222 3.870 4.003 -4.017 1.00 0.00 C ATOM 1201 CD2 LEU A 222 1.702 4.666 -2.962 1.00 0.00 C ATOM 0 H LEU A 222 0.575 2.340 -5.117 1.00 0.00 H new ATOM 0 HA LEU A 222 -0.162 4.972 -4.957 1.00 0.00 H new ATOM 0 HB2 LEU A 222 2.360 3.867 -6.242 1.00 0.00 H new ATOM 0 HB3 LEU A 222 2.168 5.465 -5.551 1.00 0.00 H new ATOM 0 HG LEU A 222 2.075 2.852 -4.019 1.00 0.00 H new ATOM 0 HD11 LEU A 222 4.205 3.626 -3.051 1.00 0.00 H new ATOM 0 HD12 LEU A 222 4.320 3.411 -4.813 1.00 0.00 H new ATOM 0 HD13 LEU A 222 4.172 5.045 -4.125 1.00 0.00 H new ATOM 0 HD21 LEU A 222 2.067 4.280 -2.010 1.00 0.00 H new ATOM 0 HD22 LEU A 222 1.950 5.724 -3.043 1.00 0.00 H new ATOM 0 HD23 LEU A 222 0.620 4.542 -3.013 1.00 0.00 H new ATOM 1213 N LEU A 223 0.302 4.053 -8.095 1.00 0.00 N ATOM 1214 CA LEU A 223 0.028 4.428 -9.478 1.00 0.00 C ATOM 1215 C LEU A 223 -1.459 4.302 -9.793 1.00 0.00 C ATOM 1216 O LEU A 223 -2.051 5.189 -10.409 1.00 0.00 O ATOM 1217 CB LEU A 223 0.839 3.552 -10.435 1.00 0.00 C ATOM 1218 CG LEU A 223 2.360 3.683 -10.338 1.00 0.00 C ATOM 1219 CD1 LEU A 223 3.041 2.493 -10.997 1.00 0.00 C ATOM 1220 CD2 LEU A 223 2.825 4.985 -10.974 1.00 0.00 C ATOM 0 H LEU A 223 0.725 3.132 -7.984 1.00 0.00 H new ATOM 0 HA LEU A 223 0.321 5.469 -9.610 1.00 0.00 H new ATOM 0 HB2 LEU A 223 0.572 2.510 -10.257 1.00 0.00 H new ATOM 0 HB3 LEU A 223 0.538 3.788 -11.456 1.00 0.00 H new ATOM 0 HG LEU A 223 2.638 3.697 -9.284 1.00 0.00 H new ATOM 0 HD11 LEU A 223 4.123 2.603 -10.918 1.00 0.00 H new ATOM 0 HD12 LEU A 223 2.733 1.575 -10.497 1.00 0.00 H new ATOM 0 HD13 LEU A 223 2.756 2.447 -12.048 1.00 0.00 H new ATOM 0 HD21 LEU A 223 3.910 5.061 -10.896 1.00 0.00 H new ATOM 0 HD22 LEU A 223 2.535 5.001 -12.025 1.00 0.00 H new ATOM 0 HD23 LEU A 223 2.364 5.827 -10.458 1.00 0.00 H new ATOM 1232 N ARG A 224 -2.058 3.196 -9.363 1.00 0.00 N ATOM 1233 CA ARG A 224 -3.476 2.955 -9.598 1.00 0.00 C ATOM 1234 C ARG A 224 -4.303 4.188 -9.247 1.00 0.00 C ATOM 1235 O ARG A 224 -5.044 4.709 -10.080 1.00 0.00 O ATOM 1236 CB ARG A 224 -3.954 1.756 -8.777 1.00 0.00 C ATOM 1237 CG ARG A 224 -3.380 0.429 -9.245 1.00 0.00 C ATOM 1238 CD ARG A 224 -4.131 -0.108 -10.454 1.00 0.00 C ATOM 1239 NE ARG A 224 -3.745 -1.480 -10.772 1.00 0.00 N ATOM 1240 CZ ARG A 224 -2.586 -1.806 -11.333 1.00 0.00 C ATOM 1241 NH1 ARG A 224 -1.703 -0.864 -11.634 1.00 0.00 N ATOM 1242 NH2 ARG A 224 -2.308 -3.078 -11.592 1.00 0.00 N ATOM 0 H ARG A 224 -1.583 2.453 -8.850 1.00 0.00 H new ATOM 0 HA ARG A 224 -3.611 2.738 -10.658 1.00 0.00 H new ATOM 0 HB2 ARG A 224 -3.684 1.911 -7.732 1.00 0.00 H new ATOM 0 HB3 ARG A 224 -5.042 1.707 -8.821 1.00 0.00 H new ATOM 0 HG2 ARG A 224 -2.327 0.555 -9.496 1.00 0.00 H new ATOM 0 HG3 ARG A 224 -3.429 -0.297 -8.433 1.00 0.00 H new ATOM 0 HD2 ARG A 224 -5.203 -0.068 -10.262 1.00 0.00 H new ATOM 0 HD3 ARG A 224 -3.937 0.532 -11.315 1.00 0.00 H new ATOM 0 HE ARG A 224 -4.401 -2.229 -10.551 1.00 0.00 H new ATOM 0 HH11 ARG A 224 -1.913 0.114 -11.435 1.00 0.00 H new ATOM 0 HH12 ARG A 224 -0.814 -1.117 -12.065 1.00 0.00 H new ATOM 0 HH21 ARG A 224 -2.985 -3.805 -11.360 1.00 0.00 H new ATOM 0 HH22 ARG A 224 -1.418 -3.328 -12.023 1.00 0.00 H new ATOM 1256 N VAL A 225 -4.171 4.649 -8.007 1.00 0.00 N ATOM 1257 CA VAL A 225 -4.905 5.821 -7.545 1.00 0.00 C ATOM 1258 C VAL A 225 -4.413 7.086 -8.240 1.00 0.00 C ATOM 1259 O VAL A 225 -5.185 8.014 -8.481 1.00 0.00 O ATOM 1260 CB VAL A 225 -4.774 6.001 -6.021 1.00 0.00 C ATOM 1261 CG1 VAL A 225 -5.434 4.843 -5.288 1.00 0.00 C ATOM 1262 CG2 VAL A 225 -3.311 6.129 -5.624 1.00 0.00 C ATOM 0 H VAL A 225 -3.563 4.229 -7.305 1.00 0.00 H new ATOM 0 HA VAL A 225 -5.953 5.657 -7.795 1.00 0.00 H new ATOM 0 HB VAL A 225 -5.286 6.920 -5.736 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -5.331 4.987 -4.212 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -6.491 4.802 -5.549 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -4.953 3.908 -5.576 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -3.237 6.256 -4.544 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -2.773 5.229 -5.922 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -2.873 6.994 -6.122 1.00 0.00 H new