| Chain sequence(s) |
A: GSFIEHFARHVTAAPDAPALVHRDRVLTYRELDELAGRLSGRLIGRGVRRGDRVAVLMPRSADWVVTMFAVFKAGWVPVPVDAGYPAPRVAFMVADSGASRMVCSAATRDGVPEGIEAIVVTDEEAFEASAAGPNPDHPALVGYTSGSTGIPKGVMHSHANLLHYQRAIDACFPLNSQDRVGVYTPLYFDLSLHDMWYPWCAGATLRFVADLAPLSPAEFIHHHQLTVWLSVPTVIELALQRQTLTPHSLPSLRLSFFCGQALLHDLAEQWQQATQQPVINLYGPTEATIAVTSARFVAHSGNAQGSIGRPLPGFQLQVLDASLRAVAPGVIGDIYIRGDGMMPGYLRRAGLTAEVFVADPSAPGARMYRTGDLGQWDADGYFWFAGRADDQVKVRGFRIEPAEVEAALTAQPGVHEAVVRAVDGRLVGYVVAEGDAEPAVLRERVGAVLPEYMVPAAVITLDALPLTGNGKVDRAALPAPVFAADG
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | Yes |
| alphaCutter usage | No |
| Dynamic mode | No |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:01)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:01)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:01)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:01)
[INFO] PDB-Info: The input structure is globular. Max score is recommended for pH analysis. (00:00:04)
[INFO] FoldX: Starting FoldX energy minimization (00:00:04)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (00:07:29)
[INFO] agg3D: Running pKa-ANI on
/STORAGE/DATA/lcbio/aggreskan/ae415de5c3db767/tmp/folded.pdb (00:07:29)
[INFO] Main: Simulation completed successfully. (00:12:08)
|
The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan4D score | mutation |
|---|---|---|---|---|
| 1 | G | A | -0.6998 | |
| 2 | S | A | 0.0000 | |
| 3 | F | A | 0.0000 | |
| 4 | I | A | -0.5668 | |
| 5 | E | A | -1.3461 | |
| 6 | H | A | -1.1047 | |
| 7 | F | A | 0.0000 | |
| 8 | A | A | -1.3025 | |
| 9 | R | A | -2.0609 | |
| 10 | H | A | -1.4285 | |
| 11 | V | A | -1.3703 | |
| 12 | T | A | -0.9818 | |
| 13 | A | A | -0.6861 | |
| 14 | A | A | -0.9869 | |
| 15 | P | A | -1.6978 | |
| 16 | D | A | -2.2511 | |
| 17 | A | A | -1.2313 | |
| 18 | P | A | -0.7820 | |
| 19 | A | A | 0.0000 | |
| 20 | L | A | 0.0000 | |
| 21 | V | A | 0.0000 | |
| 22 | H | A | -1.9788 | |
| 23 | R | A | -3.1267 | |
| 24 | D | A | -3.2181 | |
| 25 | R | A | -2.6547 | |
| 26 | V | A | -0.5735 | |
| 27 | L | A | 0.0000 | |
| 28 | T | A | -1.2847 | |
| 29 | Y | A | 0.0000 | |
| 30 | R | A | -2.4910 | |
| 31 | E | A | -2.1056 | |
| 32 | L | A | 0.0000 | |
| 33 | D | A | -1.7509 | |
| 34 | E | A | -2.7159 | |
| 35 | L | A | -1.2198 | |
| 36 | A | A | 0.0000 | |
| 37 | G | A | 0.0000 | |
| 38 | R | A | -2.2018 | |
| 39 | L | A | -1.0129 | |
| 40 | S | A | 0.0000 | |
| 41 | G | A | 0.0000 | |
| 42 | R | A | 0.0000 | |
| 43 | L | A | 0.0000 | |
| 44 | I | A | -0.3512 | |
| 45 | G | A | -0.4221 | |
| 46 | R | A | -0.9347 | |
| 47 | G | A | -1.2401 | |
| 48 | V | A | -1.5722 | |
| 49 | R | A | -2.7657 | |
| 50 | R | A | -2.7066 | |
| 51 | G | A | -2.0181 | |
| 52 | D | A | -1.7984 | |
| 53 | R | A | -1.3340 | |
| 54 | V | A | 0.0000 | |
| 55 | A | A | 0.0000 | |
| 56 | V | A | 0.0000 | |
| 57 | L | A | 0.0000 | |
| 58 | M | A | 0.0000 | |
| 59 | P | A | -0.9306 | |
| 60 | R | A | -1.5439 | |
| 61 | S | A | -1.2725 | |
| 62 | A | A | 0.0000 | |
| 63 | D | A | -1.3228 | |
| 64 | W | A | -0.7342 | |
| 65 | V | A | 0.0000 | |
| 66 | V | A | 0.0000 | |
| 67 | T | A | 0.0000 | |
| 68 | M | A | 0.0000 | |
| 69 | F | A | 0.0000 | |
| 70 | A | A | 0.0000 | |
| 71 | V | A | 0.0000 | |
| 72 | F | A | 0.0000 | |
| 73 | K | A | 0.0000 | |
| 74 | A | A | 0.0000 | |
| 75 | G | A | 0.0000 | |
| 76 | W | A | 0.0000 | |
| 77 | V | A | 0.0000 | |
| 78 | P | A | 0.0000 | |
| 79 | V | A | 0.0000 | |
| 80 | P | A | -0.1266 | |
| 81 | V | A | 0.0000 | |
| 82 | D | A | -0.8901 | |
| 83 | A | A | -0.5259 | |
| 84 | G | A | -0.8900 | |
| 85 | Y | A | -0.4608 | |
| 86 | P | A | -0.2103 | |
| 87 | A | A | -0.0747 | |
| 88 | P | A | 0.1749 | |
| 89 | R | A | 0.0000 | |
| 90 | V | A | 0.0000 | |
| 91 | A | A | -0.0921 | |
| 92 | F | A | 0.5281 | |
| 93 | M | A | 0.0000 | |
| 94 | V | A | 0.0000 | |
| 95 | A | A | 0.0517 | |
| 96 | D | A | 0.0000 | |
| 97 | S | A | 0.0000 | |
| 98 | G | A | -0.7674 | |
| 99 | A | A | 0.0000 | |
| 100 | S | A | -0.9727 | |
| 101 | R | A | -1.1792 | |
| 102 | M | A | 0.0000 | |
| 103 | V | A | 0.0000 | |
| 104 | C | A | 0.0000 | |
| 105 | S | A | -0.8369 | |
| 106 | A | A | -0.5983 | |
| 107 | A | A | -0.7533 | |
| 108 | T | A | -1.3643 | |
| 109 | R | A | -2.3910 | |
| 110 | D | A | -2.8401 | |
| 111 | G | A | -1.8347 | |
| 112 | V | A | -1.7298 | |
| 113 | P | A | -1.6235 | |
| 114 | E | A | -2.3906 | |
| 115 | G | A | -1.6361 | |
| 116 | I | A | -1.4009 | |
| 117 | E | A | -2.0424 | |
| 118 | A | A | -1.5290 | |
| 119 | I | A | 0.0000 | |
| 120 | V | A | -0.2246 | |
| 121 | V | A | -0.7277 | |
| 122 | T | A | -1.4820 | |
| 123 | D | A | -2.9029 | |
| 124 | E | A | -3.0989 | |
| 125 | E | A | -2.6054 | |
| 126 | A | A | -1.5625 | |
| 127 | F | A | -1.2125 | |
| 128 | E | A | -2.1965 | |
| 129 | A | A | -1.5775 | |
| 130 | S | A | -0.8806 | |
| 131 | A | A | -0.2578 | |
| 132 | A | A | -0.4473 | |
| 133 | G | A | -0.4791 | |
| 134 | P | A | -0.9615 | |
| 135 | N | A | -1.5934 | |
| 136 | P | A | -1.4508 | |
| 137 | D | A | -2.1862 | |
| 138 | H | A | -1.7115 | |
| 139 | P | A | -0.7828 | |
| 140 | A | A | 0.0000 | |
| 141 | L | A | 0.0333 | |
| 142 | V | A | 0.0000 | |
| 143 | G | A | 0.0427 | |
| 144 | Y | A | 0.1537 | |
| 145 | T | A | 0.1345 | |
| 146 | S | A | 0.0000 | |
| 147 | G | A | 0.0000 | |
| 148 | S | A | -0.3677 | |
| 149 | T | A | 0.1805 | |
| 150 | G | A | 0.3063 | |
| 151 | I | A | 1.0238 | |
| 152 | P | A | 0.0000 | |
| 153 | K | A | 0.0000 | |
| 154 | G | A | 0.0000 | |
| 155 | V | A | 0.0000 | |
| 156 | M | A | -0.1016 | |
| 157 | H | A | 0.0000 | |
| 158 | S | A | -0.4873 | |
| 159 | H | A | 0.0000 | |
| 160 | A | A | -0.5655 | |
| 161 | N | A | 0.0000 | |
| 162 | L | A | 0.0000 | |
| 163 | L | A | -0.4457 | |
| 164 | H | A | -1.1476 | |
| 165 | Y | A | 0.0000 | |
| 166 | Q | A | 0.0000 | |
| 167 | R | A | -2.1044 | |
| 168 | A | A | 0.0000 | |
| 169 | I | A | 0.0000 | |
| 170 | D | A | -1.3100 | |
| 171 | A | A | -0.6752 | |
| 172 | C | A | -0.0997 | |
| 173 | F | A | -0.1650 | |
| 174 | P | A | -0.6982 | |
| 175 | L | A | 0.0000 | |
| 176 | N | A | -1.2661 | |
| 177 | S | A | -1.1531 | |
| 178 | Q | A | -1.6087 | |
| 179 | D | A | 0.0000 | |
| 180 | R | A | -1.1929 | |
| 181 | V | A | 0.0000 | |
| 182 | G | A | 0.0000 | |
| 183 | V | A | 0.0000 | |
| 184 | Y | A | 0.0000 | |
| 185 | T | A | -0.1720 | |
| 186 | P | A | 0.0000 | |
| 187 | L | A | 0.4484 | |
| 188 | Y | A | -0.4027 | |
| 189 | F | A | 0.0000 | |
| 190 | D | A | -1.6616 | |
| 191 | L | A | 0.0000 | |
| 192 | S | A | -0.4624 | |
| 193 | L | A | 0.0000 | |
| 194 | H | A | 0.0000 | |
| 195 | D | A | 0.0000 | |
| 196 | M | A | 0.0000 | |
| 197 | W | A | 0.0000 | |
| 198 | Y | A | 0.0000 | |
| 199 | P | A | 0.0000 | |
| 200 | W | A | 0.0000 | |
| 201 | C | A | -0.6799 | |
| 202 | A | A | -0.7612 | |
| 203 | G | A | 0.0000 | |
| 204 | A | A | 0.0000 | |
| 205 | T | A | 0.0000 | |
| 206 | L | A | 0.0000 | |
| 207 | R | A | -0.5199 | |
| 208 | F | A | 0.0000 | |
| 209 | V | A | 0.0000 | |
| 210 | A | A | 0.0000 | |
| 211 | D | A | -1.0847 | |
| 212 | L | A | 0.8650 | |
| 213 | A | A | 0.3032 | |
| 214 | P | A | -0.2145 | |
| 215 | L | A | -0.4622 | |
| 216 | S | A | 0.0000 | |
| 217 | P | A | 0.0000 | |
| 218 | A | A | -1.3094 | |
| 219 | E | A | -1.8544 | |
| 220 | F | A | 0.0000 | |
| 221 | I | A | 0.0000 | |
| 222 | H | A | -1.8093 | |
| 223 | H | A | -2.0855 | |
| 224 | H | A | -1.7894 | |
| 225 | Q | A | -1.9184 | |
| 226 | L | A | 0.0000 | |
| 227 | T | A | -0.9503 | |
| 228 | V | A | 0.0000 | |
| 229 | W | A | 0.0000 | |
| 230 | L | A | 0.0000 | |
| 231 | S | A | 0.0000 | |
| 232 | V | A | 0.0457 | |
| 233 | P | A | 0.0000 | |
| 234 | T | A | -0.4713 | |
| 235 | V | A | 0.0000 | |
| 236 | I | A | 0.0000 | |
| 237 | E | A | -1.8529 | |
| 238 | L | A | -1.3568 | |
| 239 | A | A | 0.0000 | |
| 240 | L | A | -1.4249 | |
| 241 | Q | A | -2.4605 | |
| 242 | R | A | -2.9451 | |
| 243 | Q | A | -2.5129 | |
| 244 | T | A | -1.1267 | |
| 245 | L | A | 0.0000 | |
| 246 | T | A | -0.7634 | |
| 247 | P | A | -1.3110 | |
| 248 | H | A | -1.6823 | |
| 249 | S | A | -0.9560 | |
| 250 | L | A | 0.0000 | |
| 251 | P | A | -1.1658 | |
| 252 | S | A | -1.0795 | |
| 253 | L | A | 0.0000 | |
| 254 | R | A | -1.0246 | |
| 255 | L | A | 0.0000 | |
| 256 | S | A | 0.0000 | |
| 257 | F | A | 0.0000 | |
| 258 | F | A | 0.0000 | |
| 259 | C | A | 0.2067 | |
| 260 | G | A | -0.3919 | |
| 261 | Q | A | -0.5060 | |
| 262 | A | A | 0.0052 | |
| 263 | L | A | 0.1342 | |
| 264 | L | A | 0.1126 | |
| 265 | H | A | -0.9777 | |
| 266 | D | A | -2.1004 | |
| 267 | L | A | -1.0985 | |
| 268 | A | A | 0.0000 | |
| 269 | E | A | -1.6970 | |
| 270 | Q | A | -1.4956 | |
| 271 | W | A | 0.0000 | |
| 272 | Q | A | -1.4663 | |
| 273 | Q | A | -1.8493 | |
| 274 | A | A | 0.0000 | |
| 275 | T | A | 0.0000 | |
| 276 | Q | A | -1.8974 | |
| 277 | Q | A | -1.4267 | |
| 278 | P | A | -0.9105 | |
| 279 | V | A | 0.0000 | |
| 280 | I | A | 0.0000 | |
| 281 | N | A | -0.5258 | |
| 282 | L | A | 0.0000 | |
| 283 | Y | A | 0.0272 | |
| 284 | G | A | -0.0053 | |
| 285 | P | A | -0.1384 | |
| 286 | T | A | 0.0432 | |
| 287 | E | A | 0.0000 | |
| 288 | A | A | 0.0000 | |
| 289 | T | A | 0.0000 | |
| 290 | I | A | 0.4074 | |
| 291 | A | A | 0.0000 | |
| 292 | V | A | 0.0000 | |
| 293 | T | A | 0.0000 | |
| 294 | S | A | -0.7086 | |
| 295 | A | A | 0.0000 | |
| 296 | R | A | -1.5820 | |
| 297 | F | A | 0.0000 | |
| 298 | V | A | 0.4625 | |
| 299 | A | A | -0.8545 | |
| 300 | H | A | -1.3926 | |
| 301 | S | A | -0.8611 | |
| 302 | G | A | -1.3430 | |
| 303 | N | A | -1.6297 | |
| 304 | A | A | -1.2215 | |
| 305 | Q | A | -1.5671 | |
| 306 | G | A | -0.6233 | |
| 307 | S | A | -0.7902 | |
| 308 | I | A | 0.0000 | |
| 309 | G | A | 0.0000 | |
| 310 | R | A | -1.6184 | |
| 311 | P | A | -0.9851 | |
| 312 | L | A | 0.0000 | |
| 313 | P | A | -1.2313 | |
| 314 | G | A | -1.5890 | |
| 315 | F | A | 0.0000 | |
| 316 | Q | A | -1.8165 | |
| 317 | L | A | 0.0000 | |
| 318 | Q | A | -1.1389 | |
| 319 | V | A | 0.0000 | |
| 320 | L | A | 0.0000 | |
| 321 | D | A | -0.7353 | |
| 322 | A | A | -0.4494 | |
| 323 | S | A | -0.4538 | |
| 324 | L | A | -0.3489 | |
| 325 | R | A | -1.6987 | |
| 326 | A | A | -0.8543 | |
| 327 | V | A | 0.0000 | |
| 328 | A | A | 0.0913 | |
| 329 | P | A | -0.0945 | |
| 330 | G | A | 0.2633 | |
| 331 | V | A | 1.4233 | |
| 332 | I | A | 1.5608 | |
| 333 | G | A | 0.0000 | |
| 334 | D | A | -0.4436 | |
| 335 | I | A | 0.0000 | |
| 336 | Y | A | 0.0000 | |
| 337 | I | A | 0.0000 | |
| 338 | R | A | -1.9246 | |
| 339 | G | A | -1.9183 | |
| 340 | D | A | -2.1750 | |
| 341 | G | A | 0.0000 | |
| 342 | M | A | -0.8109 | |
| 343 | M | A | 0.0000 | |
| 344 | P | A | -0.1987 | |
| 345 | G | A | 0.0000 | |
| 346 | Y | A | 0.0000 | |
| 347 | L | A | 0.0000 | |
| 348 | R | A | -2.1069 | |
| 349 | R | A | -1.3684 | |
| 350 | A | A | -1.0482 | |
| 351 | G | A | -1.1033 | |
| 352 | L | A | -0.8437 | |
| 353 | T | A | -0.8029 | |
| 354 | A | A | -0.9414 | |
| 355 | E | A | -1.7277 | |
| 356 | V | A | -1.0130 | |
| 357 | F | A | 0.0000 | |
| 358 | V | A | -0.7816 | |
| 359 | A | A | -0.7168 | |
| 360 | D | A | 0.0000 | |
| 361 | P | A | -0.7989 | |
| 362 | S | A | -0.9423 | |
| 363 | A | A | -0.6761 | |
| 364 | P | A | -0.8042 | |
| 365 | G | A | -1.0539 | |
| 366 | A | A | -1.3056 | |
| 367 | R | A | -2.0923 | |
| 368 | M | A | 0.0000 | |
| 369 | Y | A | 0.0000 | |
| 370 | R | A | -1.4392 | |
| 371 | T | A | 0.0000 | |
| 372 | G | A | -0.9649 | |
| 373 | D | A | 0.0000 | |
| 374 | L | A | 0.2244 | |
| 375 | G | A | 0.0000 | |
| 376 | Q | A | 0.6265 | |
| 377 | W | A | -0.0425 | |
| 378 | D | A | -0.7337 | |
| 379 | A | A | -0.9711 | |
| 380 | D | A | -1.9325 | |
| 381 | G | A | -1.2887 | |
| 382 | Y | A | -0.7147 | |
| 383 | F | A | 0.0000 | |
| 384 | W | A | 0.0059 | |
| 385 | F | A | 0.5372 | |
| 386 | A | A | 0.2989 | |
| 387 | G | A | -0.2459 | |
| 388 | R | A | -1.0865 | |
| 389 | A | A | -1.2098 | |
| 390 | D | A | -2.3230 | |
| 391 | D | A | -2.2509 | |
| 392 | Q | A | 0.0000 | |
| 393 | V | A | -1.1512 | |
| 394 | K | A | -1.3032 | |
| 395 | V | A | 0.0000 | |
| 396 | R | A | -0.8411 | |
| 397 | G | A | -0.8443 | |
| 398 | F | A | -0.6024 | |
| 399 | R | A | -0.6597 | |
| 400 | I | A | 0.0000 | |
| 401 | E | A | 0.0000 | |
| 402 | P | A | 0.0000 | |
| 403 | A | A | -0.2484 | |
| 404 | E | A | 0.0000 | |
| 405 | V | A | 0.0000 | |
| 406 | E | A | -0.5514 | |
| 407 | A | A | -0.1966 | |
| 408 | A | A | -0.0656 | |
| 409 | L | A | 0.0000 | |
| 410 | T | A | -0.8725 | |
| 411 | A | A | -0.5248 | |
| 412 | Q | A | 0.0000 | |
| 413 | P | A | -1.0142 | |
| 414 | G | A | -2.0252 | |
| 415 | V | A | 0.0000 | |
| 416 | H | A | -2.1598 | |
| 417 | E | A | -2.1014 | |
| 418 | A | A | -0.9699 | |
| 419 | V | A | 0.0000 | |
| 420 | V | A | 0.0000 | |
| 421 | R | A | -0.8974 | |
| 422 | A | A | -1.0148 | |
| 423 | V | A | -0.9501 | |
| 424 | D | A | -2.1062 | |
| 425 | G | A | -1.8721 | |
| 426 | R | A | -1.4427 | |
| 427 | L | A | 0.0000 | |
| 428 | V | A | 0.0000 | |
| 429 | G | A | 0.0000 | |
| 430 | Y | A | 0.0000 | |
| 431 | V | A | 0.0000 | |
| 432 | V | A | -1.3912 | |
| 433 | A | A | -2.3768 | |
| 434 | E | A | -3.0918 | |
| 435 | G | A | -2.5704 | |
| 436 | D | A | -2.9296 | |
| 437 | A | A | -2.1365 | |
| 438 | E | A | -2.3805 | |
| 439 | P | A | -1.1699 | |
| 440 | A | A | -0.8577 | |
| 441 | V | A | -0.8575 | |
| 442 | L | A | 0.0000 | |
| 443 | R | A | -2.0472 | |
| 444 | E | A | -2.2571 | |
| 445 | R | A | -1.7822 | |
| 446 | V | A | 0.0000 | |
| 447 | G | A | -1.4157 | |
| 448 | A | A | -0.8123 | |
| 449 | V | A | 0.0460 | |
| 450 | L | A | 0.0000 | |
| 451 | P | A | 0.0000 | |
| 452 | E | A | -1.6548 | |
| 453 | Y | A | -0.7383 | |
| 454 | M | A | 0.0000 | |
| 455 | V | A | -0.9745 | |
| 456 | P | A | 0.0000 | |
| 457 | A | A | -0.3523 | |
| 458 | A | A | 0.2718 | |
| 459 | V | A | 0.0000 | |
| 460 | I | A | 0.4005 | |
| 461 | T | A | -0.5405 | |
| 462 | L | A | -0.6167 | |
| 463 | D | A | -1.7721 | |
| 464 | A | A | -0.6258 | |
| 465 | L | A | -0.1754 | |
| 466 | P | A | 0.2098 | |
| 467 | L | A | 0.5515 | |
| 468 | T | A | -0.6354 | |
| 469 | G | A | -1.1363 | |
| 470 | N | A | -1.8525 | |
| 471 | G | A | -1.3064 | |
| 472 | K | A | -1.7270 | |
| 473 | V | A | -0.2790 | |
| 474 | D | A | -0.4784 | |
| 475 | R | A | -0.6198 | |
| 476 | A | A | -0.0725 | |
| 477 | A | A | 0.1043 | |
| 478 | L | A | 0.0000 | |
| 479 | P | A | 0.1711 | |
| 480 | A | A | 0.5559 | |
| 481 | P | A | 0.8025 | |
| 482 | V | A | 1.9853 | |
| 483 | F | A | 0.9111 | |
| 484 | A | A | 0.1514 | |
| 485 | A | A | -0.5829 | |
| 486 | D | A | -1.9215 | |
| 487 | G | A | -1.3078 |
Calculations for various pH values
This page contains details and comparisons for all models calculated at different pH points.
Please find suggestions on interpreting the results below. More details can be found in the Tutorial.
The input structure is globular. Max score is recommended for pH analysis.
pH |
Average A4D Score |
Max A4D Score |
|||
| 4.0 | -0.2653 | 2.9493 | View | CSV | PDB |
| 4.5 | -0.3307 | 2.9088 | View | CSV | PDB |
| 5.0 | -0.4097 | 2.8622 | View | CSV | PDB |
| 5.5 | -0.4921 | 2.8126 | View | CSV | PDB |
| 6.0 | -0.5696 | 2.762 | View | CSV | PDB |
| 6.5 | -0.6363 | 2.7116 | View | CSV | PDB |
| 7.0 | -0.6907 | 2.6625 | View | CSV | PDB |
| 7.5 | -0.7361 | 2.6169 | View | CSV | PDB |
| 8.0 | -0.7754 | 2.5839 | View | CSV | PDB |
| 8.5 | -0.8072 | 2.5839 | View | CSV | PDB |
| 9.0 | -0.8281 | 2.5839 | View | CSV | PDB |