4dfr.pdb
来自「药物开发中的基于结构的从头设计代码」· PDB 代码 · 共 800 行 · 第 1/5 页
PDB
800 行
ATOM 145 HA VAL 10 28.528 46.008 28.913 1.00 0.00
ATOM 146 HB VAL 10 28.849 44.508 30.684 1.00 0.00
ATOM 147 HG13VAL 10 29.806 46.746 31.406 1.00 0.00
ATOM 148 HG12VAL 10 29.199 45.763 32.782 1.00 0.00
ATOM 149 HG11VAL 10 28.223 47.137 32.161 1.00 0.00
ATOM 150 HG23VAL 10 26.423 45.903 32.031 1.00 0.00
ATOM 151 HG22VAL 10 27.477 44.684 32.825 1.00 0.00
ATOM 152 HG21VAL 10 26.441 44.208 31.437 1.00 0.00
ATOM 153 N ASP 11 27.178 43.958 27.990 1.00 0.00
ATOM 154 CA ASP 11 26.437 43.030 27.202 1.00 0.00
ATOM 155 C ASP 11 25.631 43.587 26.224 1.00 0.00
ATOM 156 O ASP 11 24.708 43.102 25.650 1.00 0.00
ATOM 157 CB ASP 11 25.887 41.915 28.115 1.00 0.00
ATOM 158 CG ASP 11 27.010 40.987 28.659 1.00 0.00
ATOM 159 OD1 ASP 11 28.246 40.834 28.387 1.00 0.00
ATOM 160 OD2 ASP 11 26.684 40.374 29.755 1.00 0.00
ATOM 161 H ASP 11 28.169 43.920 27.859 1.00 0.00
ATOM 162 HA ASP 11 27.202 42.513 26.604 1.00 0.00
ATOM 163 HB2 ASP 11 25.174 41.307 27.539 1.00 0.00
ATOM 164 HB1 ASP 11 25.369 42.379 28.967 1.00 0.00
ATOM 165 N ARG 12 25.897 44.951 25.915 1.00 0.00
ATOM 166 CA ARG 12 25.118 45.556 24.885 1.00 0.00
ATOM 167 C ARG 12 23.571 45.863 25.143 1.00 0.00
ATOM 168 O ARG 12 22.788 46.089 24.319 1.00 0.00
ATOM 169 CB ARG 12 25.258 44.894 23.466 1.00 0.00
ATOM 170 CG ARG 12 26.563 44.184 23.046 1.00 0.00
ATOM 171 CD ARG 12 26.624 43.756 21.538 1.00 0.00
ATOM 172 NE ARG 12 25.594 43.118 20.751 1.00 0.00
ATOM 173 CZ ARG 12 24.764 42.037 20.935 1.00 0.00
ATOM 174 NH1 ARG 12 25.011 41.205 22.046 1.00 0.00
ATOM 175 NH2 ARG 12 23.631 41.657 20.185 1.00 0.00
ATOM 176 H ARG 12 26.603 45.465 26.402 1.00 0.00
ATOM 177 HA ARG 12 25.577 46.551 24.783 1.00 0.00
ATOM 178 HB2 ARG 12 25.085 45.693 22.730 1.00 0.00
ATOM 179 HB1 ARG 12 24.456 44.145 23.389 1.00 0.00
ATOM 180 HG2 ARG 12 26.674 43.280 23.663 1.00 0.00
ATOM 181 HG1 ARG 12 27.402 44.867 23.242 1.00 0.00
ATOM 182 HD2 ARG 12 27.484 43.073 21.477 1.00 0.00
ATOM 183 HD1 ARG 12 26.854 44.684 20.995 1.00 0.00
ATOM 184 HE ARG 12 25.447 43.579 19.842 1.00 0.00
ATOM 185 HH11ARG 12 25.791 41.417 22.685 1.00 0.00
ATOM 186 HH12ARG 12 24.412 40.385 22.219 1.00 0.00
ATOM 187 HH21ARG 12 23.333 42.224 19.378 1.00 0.00
ATOM 188 HH22ARG 12 23.102 40.812 20.444 1.00 0.00
ATOM 189 N VAL 13 23.258 45.774 26.393 1.00 0.00
ATOM 190 CA VAL 13 21.851 46.081 26.982 1.00 0.00
ATOM 191 C VAL 13 21.501 47.639 26.629 1.00 0.00
ATOM 192 O VAL 13 22.396 48.495 26.864 1.00 0.00
ATOM 193 CB VAL 13 21.809 45.750 28.512 1.00 0.00
ATOM 194 CG1 VAL 13 20.392 46.267 28.990 1.00 0.00
ATOM 195 CG2 VAL 13 22.074 44.144 28.666 1.00 0.00
ATOM 196 H VAL 13 23.973 45.486 27.030 1.00 0.00
ATOM 197 HA VAL 13 21.109 45.441 26.483 1.00 0.00
ATOM 198 HB VAL 13 22.596 46.292 29.056 1.00 0.00
ATOM 199 HG13VAL 13 20.317 47.350 28.811 1.00 0.00
ATOM 200 HG12VAL 13 20.271 46.064 30.064 1.00 0.00
ATOM 201 HG11VAL 13 19.603 45.747 28.427 1.00 0.00
ATOM 202 HG23VAL 13 21.285 43.590 28.137 1.00 0.00
ATOM 203 HG22VAL 13 22.063 43.871 29.732 1.00 0.00
ATOM 204 HG21VAL 13 23.053 43.891 28.233 1.00 0.00
ATOM 205 N ILE 14 20.383 47.817 26.158 1.00 0.00
ATOM 206 CA ILE 14 19.856 49.004 25.783 1.00 0.00
ATOM 207 C ILE 14 18.462 49.302 26.496 1.00 0.00
ATOM 208 O ILE 14 17.884 48.221 26.864 1.00 0.00
ATOM 209 CB ILE 14 19.912 49.520 24.275 1.00 0.00
ATOM 210 CG1 ILE 14 18.947 48.463 23.473 1.00 0.00
ATOM 211 CG2 ILE 14 21.422 49.456 23.856 1.00 0.00
ATOM 212 CD1 ILE 14 18.816 48.818 21.928 1.00 0.00
ATOM 213 H ILE 14 19.807 47.008 26.040 1.00 0.00
ATOM 214 HA ILE 14 20.542 49.709 26.275 1.00 0.00
ATOM 215 HB ILE 14 19.533 50.547 24.170 1.00 0.00
ATOM 216 HG12ILE 14 17.945 48.484 23.927 1.00 0.00
ATOM 217 HG11ILE 14 19.372 47.453 23.569 1.00 0.00
ATOM 218 HG23ILE 14 22.013 50.110 24.514 1.00 0.00
ATOM 219 HG22ILE 14 21.528 49.792 22.814 1.00 0.00
ATOM 220 HG21ILE 14 21.784 48.421 23.946 1.00 0.00
ATOM 221 HD13ILE 14 18.375 49.820 21.818 1.00 0.00
ATOM 222 HD12ILE 14 18.170 48.077 21.435 1.00 0.00
ATOM 223 HD11ILE 14 19.813 48.803 21.462 1.00 0.00
ATOM 224 N GLY 15 18.043 50.546 26.423 1.00 0.00
ATOM 225 CA GLY 15 16.742 50.699 27.048 1.00 0.00
ATOM 226 C GLY 15 15.633 50.053 26.254 1.00 0.00
ATOM 227 O GLY 15 15.661 50.037 25.025 1.00 0.00
ATOM 228 H GLY 15 18.554 51.290 25.993 1.00 0.00
ATOM 229 HA1 GLY 15 16.775 50.237 28.046 1.00 0.00
ATOM 230 HA2 GLY 15 16.524 51.773 27.148 1.00 0.00
ATOM 231 N MET 16 14.552 49.730 27.048 1.00 0.00
ATOM 232 CA MET 16 13.302 49.181 26.401 1.00 0.00
ATOM 233 C MET 16 12.156 50.311 26.452 1.00 0.00
ATOM 234 O MET 16 11.457 50.634 25.496 1.00 0.00
ATOM 235 CB MET 16 13.055 47.914 27.173 1.00 0.00
ATOM 236 CG MET 16 12.049 47.010 26.452 1.00 0.00
ATOM 237 SD MET 16 11.872 45.653 27.489 1.00 0.00
ATOM 238 CE MET 16 11.830 45.548 29.262 1.00 0.00
ATOM 239 H MET 16 14.595 49.858 28.039 1.00 0.00
ATOM 240 HA MET 16 13.484 48.930 25.346 1.00 0.00
ATOM 241 HB2 MET 16 12.658 48.171 28.166 1.00 0.00
ATOM 242 HB1 MET 16 14.006 47.373 27.287 1.00 0.00
ATOM 243 HG2 MET 16 12.437 46.701 25.470 1.00 0.00
ATOM 244 HG1 MET 16 11.087 47.527 26.320 1.00 0.00
ATOM 245 LPD2 MET 16 12.385 45.245 27.313 1.00 0.00
ATOM 246 LPD1 MET 16 11.284 45.374 27.295 1.00 0.00
ATOM 247 HE3 MET 16 12.777 45.926 29.674 1.00 0.00
ATOM 248 HE2 MET 16 11.691 44.499 29.564 1.00 0.00
ATOM 249 HE1 MET 16 10.996 46.154 29.646 1.00 0.00
ATOM 250 N GLU 17 11.867 50.699 27.592 1.00 0.00
ATOM 251 CA GLU 17 10.851 51.619 27.909 1.00 0.00
ATOM 252 C GLU 17 11.242 52.588 29.218 1.00 0.00
ATOM 253 O GLU 17 11.070 53.775 28.939 1.00 0.00
ATOM 254 CB GLU 17 9.476 51.014 28.166 1.00 0.00
ATOM 255 CG GLU 17 8.371 51.700 28.828 1.00 0.00
ATOM 256 CD GLU 17 6.954 51.264 28.600 1.00 0.00
ATOM 257 OE1 GLU 17 6.563 50.860 27.489 1.00 0.00
ATOM 258 OE2 GLU 17 6.418 51.078 29.674 1.00 0.00
ATOM 259 H GLU 17 12.401 50.327 28.351 1.00 0.00
ATOM 260 HA GLU 17 10.752 52.275 27.031 1.00 0.00
ATOM 261 HB2 GLU 17 9.660 50.110 28.764 1.00 0.00
ATOM 262 HB1 GLU 17 9.092 50.727 27.176 1.00 0.00
ATOM 263 HG2 GLU 17 8.428 52.755 28.523 1.00 0.00
ATOM 264 HG1 GLU 17 8.554 51.620 29.910 1.00 0.00
ATOM 265 N ASN 18 11.480 51.983 30.329 1.00 0.00
ATOM 266 CA ASN 18 11.825 52.838 31.476 1.00 0.00
ATOM 267 C ASN 18 13.172 53.460 31.285 1.00 0.00
ATOM 268 O ASN 18 14.067 52.814 30.527 1.00 0.00
ATOM 269 CB ASN 18 11.666 51.918 32.727 1.00 0.00
ATOM 270 CG ASN 18 10.100 51.644 33.028 1.00 0.00
ATOM 271 OD1 ASN 18 9.247 52.346 32.462 1.00 0.00
ATOM 272 ND2 ASN 18 10.128 50.675 33.911 1.00 0.00
ATOM 273 H ASN 18 11.433 50.987 30.408 1.00 0.00
ATOM 274 HA ASN 18 11.096 53.658 31.554 1.00 0.00
ATOM 275 HB2 ASN 18 12.122 52.409 33.599 1.00 0.00
ATOM 276 HB1 ASN 18 12.172 50.960 32.539 1.00 0.00
ATOM 277 HD21ASN 18 11.004 50.305 34.220 1.00 0.00
ATOM 278 HD22ASN 18 9.273 50.306 34.276 1.00 0.00
ATOM 279 N ALA 19 13.405 54.526 31.932 1.00 0.00
ATOM 280 CA ALA 19 14.780 55.260 31.851 1.00 0.00
ATOM 281 C ALA 19 15.773 54.396 32.462 1.00 0.00
ATOM 282 O ALA 19 15.600 53.533 33.367 1.00 0.00
ATOM 283 CB ALA 19 14.715 56.552 32.697 1.00 0.00
ATOM 284 H ALA 19 12.685 54.908 32.512 1.00 0.00
ATOM 285 HA ALA 19 15.040 55.488 30.807 1.00 0.00
ATOM 286 HB3 ALA 19 14.494 56.294 33.743 1.00 0.00
ATOM 287 HB2 ALA 19 13.923 57.207 32.306 1.00 0.00
ATOM 288 HB1 ALA 19 15.682 57.074 32.644 1.00 0.00
ATOM 289 N MET 20 16.961 54.453 31.822 1.00 0.00
ATOM 290 CA MET 20 18.215 53.605 32.219 1.00 0.00
ATOM 291 C MET 20 18.770 54.098 33.565 1.00 0.00
ATOM 292 O MET 20 18.625 55.252 33.801 1.00 0.00
ATOM 293 CB MET 20 19.180 53.678 31.101 1.00 0.00
ATOM 294 CG MET 20 18.691 52.943 29.792 1.00 0.00
ATOM 295 SD MET 20 18.369 51.159 30.093 1.00 0.00
ATOM 296 CE MET 20 20.047 50.497 29.792 1.00 0.00
ATOM 297 H MET 20 17.045 55.077 31.045 1.00 0.00
ATOM 298 HA MET 20 17.914 52.554 32.344 1.00 0.00
ATOM 299 HB2 MET 20 20.124 53.217 31.426 1.00 0.00
ATOM 300 HB1 MET 20 19.353 54.737 30.860 1.00 0.00
ATOM 301 HG2 MET 20 19.467 53.039 29.018 1.00 0.00
ATOM 302 HG1 MET 20 17.763 53.418 29.442 1.00 0.00
ATOM 303 LPD2 MET 20 17.915 50.906 29.656 1.00 0.00
ATOM 304 LPD1 MET 20 18.161 51.043 30.729 1.00 0.00
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