Project name: C10_A10_EF_A16_EF_GSG
Status: done
Started: 2026-07-21 11:03:44
| Chain sequence(s) |
A: SLDIQSLDIQCEELSDARWAELLPLLQGSGGSNTKPNEAPHPGFTGSGVRLDDCGLTEARCKDISSALRVGSGGSNTKPNEAPHPGFTGSGELNLRSNELGDVGVHCVLQGLQGSGGSNTKPNEAPHPGFTGSGKLSLQNCCLTGAGCGVLSSTLRTGSGGSNTKPNEAPHPGFTGSGELHLSDNLLGDAGLQLLCEGLLGSGGSNTKPNEAPHPGFTGSGKLQLEYCSLSAASCEPLASVLRAGSGGSNTKPNEAPHPGFTGSGELTVSNNDINEAGVRVLCQGLKDGSGGSNTKPNEAPHPGFTGSGALKLESCGVTSDNCRDLCGIVASGSGGSNTKPNEAPHPGFTGSGELALGSNKLGDVGMAELCPGLLGSGTGNENSHPPYATTGSGTLWIWECGITAKGCGDLCRVLRAGSGTGNENSHPPYATTGSGELSLAGNELGDEGARLLCETLLGSGTGNENSHPPYATTGSGSLWVKSCSFTAACCSHFSSVLAQGSGTGNENSHPPYATTGSGELQISNNRLEDAGVRELCQGLGGSGTGNENSHPPYATTGSGVLWLADCDVSDSSCSSLAATLLAGSGTGNENSHPPYATTGSGELDLSNNCLGDAGILQLVESVRGSGTGNENSHPPYATTGSGQLVLYDIYWSEEMEDRLQALEKDGSGTGNENSHPPYATTGSGRVIS
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| pH calculations | No |
| alphaCutter usage | No |
| Dynamic mode | Yes |
| Automated mutations | No |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:00)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:00)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:00)
[INFO] FoldX: Starting FoldX energy minimization (00:00:01)
[INFO] CABS: Running CABS flex simulation (00:08:07)
[INFO] Analysis: Starting Aggrescan4D on model_8.pdb (02:23:54)
[INFO] Analysis: Starting Aggrescan4D on model_6.pdb (02:23:59)
[INFO] Analysis: Starting Aggrescan4D on model_11.pdb (02:24:05)
[INFO] Analysis: Starting Aggrescan4D on model_7.pdb (02:24:11)
[INFO] Analysis: Starting Aggrescan4D on model_3.pdb (02:24:16)
[INFO] Analysis: Starting Aggrescan4D on model_5.pdb (02:24:21)
[INFO] Analysis: Starting Aggrescan4D on model_1.pdb (02:24:27)
[INFO] Analysis: Starting Aggrescan4D on model_0.pdb (02:24:33)
[INFO] Analysis: Starting Aggrescan4D on model_2.pdb (02:24:38)
[INFO] Analysis: Starting Aggrescan4D on model_4.pdb (02:24:44)
[INFO] Analysis: Starting Aggrescan4D on model_10.pdb (02:24:50)
[INFO] Analysis: Starting Aggrescan4D on model_9.pdb (02:24:56)
[INFO] Analysis: Starting Aggrescan4D on input.pdb (02:25:01)
[INFO] Analysis: Starting Aggrescan4D on folded.pdb (02:25:15)
[INFO] Main: Simulation completed successfully. (02:25:20)
|
Note Your prediction results will be deleted after 360 days.
Drag cursor over the plot to display residue labels.
Show buried residues
- Minimal score value
- -4.1244
- Maximal score value
- 1.7435
- Average score
- -0.7904
- Total score value
- -544.5816
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 | S | A | -0.0152 | |
| 2 | L | A | 1.2872 | |
| 3 | D | A | 0.6545 | |
| 4 | I | A | 1.7435 | |
| 5 | Q | A | 0.6290 | |
| 6 | S | A | -0.0051 | |
| 7 | L | A | 0.0000 | |
| 8 | D | A | -1.5548 | |
| 9 | I | A | 0.0000 | |
| 10 | Q | A | -2.8386 | |
| 11 | C | A | -2.7777 | |
| 12 | E | A | -3.6621 | |
| 13 | E | A | -3.5337 | |
| 14 | L | A | 0.0000 | |
| 15 | S | A | -2.4668 | |
| 16 | D | A | -2.9695 | |
| 17 | A | A | -2.0829 | |
| 18 | R | A | -2.9901 | |
| 19 | W | A | 0.0000 | |
| 20 | A | A | -1.8481 | |
| 21 | E | A | -2.3351 | |
| 22 | L | A | -1.2241 | |
| 23 | L | A | -0.4803 | |
| 24 | P | A | -0.4659 | |
| 25 | L | A | 0.2413 | |
| 26 | L | A | 0.0000 | |
| 27 | Q | A | -1.2245 | |
| 28 | G | A | -0.6456 | |
| 29 | S | A | -0.5123 | |
| 30 | G | A | -0.4540 | |
| 31 | G | A | -0.4022 | |
| 32 | S | A | -0.5470 | |
| 33 | N | A | -0.9729 | |
| 34 | T | A | -0.9833 | |
| 35 | K | A | -1.6593 | |
| 36 | P | A | -1.6420 | |
| 37 | N | A | -2.5052 | |
| 38 | E | A | -2.8177 | |
| 39 | A | A | -2.0221 | |
| 40 | P | A | -1.4768 | |
| 41 | H | A | 0.0000 | |
| 42 | P | A | -0.6945 | |
| 43 | G | A | 0.0000 | |
| 44 | F | A | 0.0000 | |
| 45 | T | A | 0.0000 | |
| 46 | G | A | 0.0000 | |
| 47 | S | A | 0.1004 | |
| 48 | G | A | 0.0000 | |
| 49 | V | A | 0.0000 | |
| 50 | R | A | -1.7133 | |
| 51 | L | A | 0.0000 | |
| 52 | D | A | -2.6970 | |
| 53 | D | A | -3.6510 | |
| 54 | C | A | 0.0000 | |
| 55 | G | A | -2.2463 | |
| 56 | L | A | 0.0000 | |
| 57 | T | A | -1.4136 | |
| 58 | E | A | -2.1464 | |
| 59 | A | A | -1.8836 | |
| 60 | R | A | -2.1003 | |
| 61 | C | A | 0.0000 | |
| 62 | K | A | -2.6641 | |
| 63 | D | A | -2.3335 | |
| 64 | I | A | 0.0000 | |
| 65 | S | A | 0.0000 | |
| 66 | S | A | -1.5428 | |
| 67 | A | A | 0.0000 | |
| 68 | L | A | 0.0000 | |
| 69 | R | A | -2.1118 | |
| 70 | V | A | -0.7112 | |
| 71 | G | A | -0.6586 | |
| 72 | S | A | 0.0000 | |
| 73 | G | A | -0.9689 | |
| 74 | G | A | -1.2751 | |
| 75 | S | A | -1.5491 | |
| 76 | N | A | -2.3630 | |
| 77 | T | A | 0.0000 | |
| 78 | K | A | -3.0748 | |
| 79 | P | A | -2.5758 | |
| 80 | N | A | -3.1943 | |
| 81 | E | A | -2.7524 | |
| 82 | A | A | -1.8905 | |
| 83 | P | A | 0.0000 | |
| 84 | H | A | 0.0000 | |
| 85 | P | A | 0.0000 | |
| 86 | G | A | 0.0000 | |
| 87 | F | A | 0.0000 | |
| 88 | T | A | 0.0000 | |
| 89 | G | A | -0.2466 | |
| 90 | S | A | 0.0056 | |
| 91 | G | A | 0.0000 | |
| 92 | E | A | -0.6532 | |
| 93 | L | A | 0.0000 | |
| 94 | N | A | -0.8413 | |
| 95 | L | A | 0.0000 | |
| 96 | R | A | -2.0985 | |
| 97 | S | A | -2.2514 | |
| 98 | N | A | -2.5429 | |
| 99 | E | A | 0.0000 | |
| 100 | L | A | 0.0000 | |
| 101 | G | A | -0.8314 | |
| 102 | D | A | -0.5436 | |
| 103 | V | A | -0.0436 | |
| 104 | G | A | 0.0000 | |
| 105 | V | A | 0.0000 | |
| 106 | H | A | -0.6750 | |
| 107 | C | A | 0.0000 | |
| 108 | V | A | 0.0000 | |
| 109 | L | A | 0.0000 | |
| 110 | Q | A | -1.5261 | |
| 111 | G | A | 0.0000 | |
| 112 | L | A | 0.0000 | |
| 113 | Q | A | -1.1867 | |
| 114 | G | A | 0.0000 | |
| 115 | S | A | -1.2432 | |
| 116 | G | A | -1.2922 | |
| 117 | G | A | -1.1175 | |
| 118 | S | A | -1.3161 | |
| 119 | N | A | 0.0000 | |
| 120 | T | A | -0.8798 | |
| 121 | K | A | 0.0000 | |
| 122 | P | A | -1.2701 | |
| 123 | N | A | -2.0975 | |
| 124 | E | A | 0.0000 | |
| 125 | A | A | 0.0000 | |
| 126 | P | A | -0.3243 | |
| 127 | H | A | 0.0000 | |
| 128 | P | A | 0.0000 | |
| 129 | G | A | 0.0000 | |
| 130 | F | A | 0.0000 | |
| 131 | T | A | 0.0000 | |
| 132 | G | A | -0.5952 | |
| 133 | S | A | -0.6016 | |
| 134 | G | A | 0.0000 | |
| 135 | K | A | -0.5805 | |
| 136 | L | A | 0.0000 | |
| 137 | S | A | 0.0000 | |
| 138 | L | A | 0.0000 | |
| 139 | Q | A | 0.0000 | |
| 140 | N | A | -1.2997 | |
| 141 | C | A | -0.4520 | |
| 142 | C | A | 0.0000 | |
| 143 | L | A | 0.0000 | |
| 144 | T | A | -0.1273 | |
| 145 | G | A | -0.1201 | |
| 146 | A | A | -0.0689 | |
| 147 | G | A | 0.0000 | |
| 148 | C | A | 0.0000 | |
| 149 | G | A | -0.1235 | |
| 150 | V | A | 0.0002 | |
| 151 | L | A | 0.0000 | |
| 152 | S | A | -0.7937 | |
| 153 | S | A | -0.8176 | |
| 154 | T | A | 0.0000 | |
| 155 | L | A | 0.0000 | |
| 156 | R | A | -2.2019 | |
| 157 | T | A | 0.0000 | |
| 158 | G | A | -1.1045 | |
| 159 | S | A | -1.0794 | |
| 160 | G | A | -1.0128 | |
| 161 | G | A | -1.2699 | |
| 162 | S | A | 0.0000 | |
| 163 | N | A | 0.0000 | |
| 164 | T | A | -1.9079 | |
| 165 | K | A | -2.5255 | |
| 166 | P | A | -1.9965 | |
| 167 | N | A | -2.9427 | |
| 168 | E | A | -3.2535 | |
| 169 | A | A | 0.0000 | |
| 170 | P | A | -1.4051 | |
| 171 | H | A | 0.0000 | |
| 172 | P | A | -0.5961 | |
| 173 | G | A | 0.0000 | |
| 174 | F | A | 0.0000 | |
| 175 | T | A | -0.3323 | |
| 176 | G | A | -0.5445 | |
| 177 | S | A | 0.0000 | |
| 178 | G | A | 0.0000 | |
| 179 | E | A | -0.6266 | |
| 180 | L | A | 0.0000 | |
| 181 | H | A | -0.5383 | |
| 182 | L | A | 0.0000 | |
| 183 | S | A | 0.0000 | |
| 184 | D | A | -0.7742 | |
| 185 | N | A | -0.5129 | |
| 186 | L | A | 0.6823 | |
| 187 | L | A | 0.0000 | |
| 188 | G | A | -0.4487 | |
| 189 | D | A | -0.6838 | |
| 190 | A | A | -0.4869 | |
| 191 | G | A | 0.0000 | |
| 192 | L | A | 0.0000 | |
| 193 | Q | A | -1.1850 | |
| 194 | L | A | -0.3562 | |
| 195 | L | A | 0.0000 | |
| 196 | C | A | 0.0000 | |
| 197 | E | A | -1.7885 | |
| 198 | G | A | 0.0000 | |
| 199 | L | A | 0.0000 | |
| 200 | L | A | -0.5296 | |
| 201 | G | A | -1.1258 | |
| 202 | S | A | 0.0000 | |
| 203 | G | A | 0.0000 | |
| 204 | G | A | -1.1935 | |
| 205 | S | A | -1.1931 | |
| 206 | N | A | -1.3852 | |
| 207 | T | A | -1.2546 | |
| 208 | K | A | 0.0000 | |
| 209 | P | A | -1.4382 | |
| 210 | N | A | -2.3095 | |
| 211 | E | A | 0.0000 | |
| 212 | A | A | -1.0232 | |
| 213 | P | A | -1.1718 | |
| 214 | H | A | -1.2479 | |
| 215 | P | A | 0.0000 | |
| 216 | G | A | -0.3283 | |
| 217 | F | A | -0.1928 | |
| 218 | T | A | -0.2547 | |
| 219 | G | A | -0.5845 | |
| 220 | S | A | -0.4491 | |
| 221 | G | A | 0.0000 | |
| 222 | K | A | -0.5420 | |
| 223 | L | A | -0.2959 | |
| 224 | Q | A | -0.3322 | |
| 225 | L | A | 0.0000 | |
| 226 | E | A | -0.1740 | |
| 227 | Y | A | 0.3423 | |
| 228 | C | A | 0.0000 | |
| 229 | S | A | -0.7119 | |
| 230 | L | A | 0.0000 | |
| 231 | S | A | -1.3820 | |
| 232 | A | A | -1.2630 | |
| 233 | A | A | -0.7044 | |
| 234 | S | A | 0.0000 | |
| 235 | C | A | 0.0000 | |
| 236 | E | A | -1.5887 | |
| 237 | P | A | -1.0938 | |
| 238 | L | A | -0.6123 | |
| 239 | A | A | 0.0000 | |
| 240 | S | A | -1.0458 | |
| 241 | V | A | 0.0000 | |
| 242 | L | A | 0.0000 | |
| 243 | R | A | -1.3279 | |
| 244 | A | A | -0.5571 | |
| 245 | G | A | -0.4577 | |
| 246 | S | A | 0.0000 | |
| 247 | G | A | -1.2548 | |
| 248 | G | A | -1.2964 | |
| 249 | S | A | -1.3772 | |
| 250 | N | A | -1.9231 | |
| 251 | T | A | -2.1188 | |
| 252 | K | A | -3.0981 | |
| 253 | P | A | 0.0000 | |
| 254 | N | A | -3.0583 | |
| 255 | E | A | -3.0554 | |
| 256 | A | A | -2.0096 | |
| 257 | P | A | -1.8615 | |
| 258 | H | A | -1.5372 | |
| 259 | P | A | -0.6544 | |
| 260 | G | A | -0.4409 | |
| 261 | F | A | -0.0031 | |
| 262 | T | A | -0.2929 | |
| 263 | G | A | -0.7235 | |
| 264 | S | A | -0.5142 | |
| 265 | G | A | 0.0000 | |
| 266 | E | A | -0.6025 | |
| 267 | L | A | -0.1203 | |
| 268 | T | A | 0.0000 | |
| 269 | V | A | 0.0000 | |
| 270 | S | A | 0.0000 | |
| 271 | N | A | 0.0000 | |
| 272 | N | A | -1.9517 | |
| 273 | D | A | -2.6312 | |
| 274 | I | A | -2.1583 | |
| 275 | N | A | -2.4678 | |
| 276 | E | A | -2.2526 | |
| 277 | A | A | -1.7316 | |
| 278 | G | A | 0.0000 | |
| 279 | V | A | 0.0000 | |
| 280 | R | A | -3.1824 | |
| 281 | V | A | -2.0136 | |
| 282 | L | A | 0.0000 | |
| 283 | C | A | 0.0000 | |
| 284 | Q | A | -2.6699 | |
| 285 | G | A | 0.0000 | |
| 286 | L | A | 0.0000 | |
| 287 | K | A | -2.4574 | |
| 288 | D | A | -1.9348 | |
| 289 | G | A | 0.0000 | |
| 290 | S | A | -1.4151 | |
| 291 | G | A | -1.8541 | |
| 292 | G | A | -1.4590 | |
| 293 | S | A | -1.3687 | |
| 294 | N | A | -2.1286 | |
| 295 | T | A | -1.9674 | |
| 296 | K | A | -2.4817 | |
| 297 | P | A | 0.0000 | |
| 298 | N | A | 0.0000 | |
| 299 | E | A | 0.0000 | |
| 300 | A | A | 0.0000 | |
| 301 | P | A | 0.0000 | |
| 302 | H | A | -0.3738 | |
| 303 | P | A | 0.0000 | |
| 304 | G | A | 0.0000 | |
| 305 | F | A | 0.0000 | |
| 306 | T | A | -0.3259 | |
| 307 | G | A | -0.6781 | |
| 308 | S | A | -0.6933 | |
| 309 | G | A | 0.0000 | |
| 310 | A | A | 0.0000 | |
| 311 | L | A | -0.3359 | |
| 312 | K | A | -0.7726 | |
| 313 | L | A | 0.0000 | |
| 314 | E | A | -1.0845 | |
| 315 | S | A | -1.3112 | |
| 316 | C | A | -1.5334 | |
| 317 | G | A | -1.2209 | |
| 318 | V | A | 0.0000 | |
| 319 | T | A | -0.6239 | |
| 320 | S | A | -0.8002 | |
| 321 | D | A | -2.1734 | |
| 322 | N | A | 0.0000 | |
| 323 | C | A | 0.0000 | |
| 324 | R | A | -2.8886 | |
| 325 | D | A | -3.0120 | |
| 326 | L | A | 0.0000 | |
| 327 | C | A | -0.9204 | |
| 328 | G | A | -1.3490 | |
| 329 | I | A | 0.0000 | |
| 330 | V | A | -0.2247 | |
| 331 | A | A | -0.3001 | |
| 332 | S | A | -0.9549 | |
| 333 | G | A | 0.0000 | |
| 334 | S | A | -0.1482 | |
| 335 | G | A | -0.4895 | |
| 336 | G | A | -1.0836 | |
| 337 | S | A | -1.3105 | |
| 338 | N | A | -2.2518 | |
| 339 | T | A | -1.9364 | |
| 340 | K | A | -2.4046 | |
| 341 | P | A | -1.8099 | |
| 342 | N | A | 0.0000 | |
| 343 | E | A | -2.1741 | |
| 344 | A | A | 0.0000 | |
| 345 | P | A | 0.0000 | |
| 346 | H | A | 0.0000 | |
| 347 | P | A | 0.1459 | |
| 348 | G | A | 0.0000 | |
| 349 | F | A | 0.3679 | |
| 350 | T | A | 0.0000 | |
| 351 | G | A | -0.6390 | |
| 352 | S | A | -0.5866 | |
| 353 | G | A | 0.0000 | |
| 354 | E | A | -0.7772 | |
| 355 | L | A | -0.1554 | |
| 356 | A | A | -0.2380 | |
| 357 | L | A | 0.0000 | |
| 358 | G | A | 0.0000 | |
| 359 | S | A | -0.9399 | |
| 360 | N | A | -1.4439 | |
| 361 | K | A | 0.0000 | |
| 362 | L | A | 0.2721 | |
| 363 | G | A | -0.0576 | |
| 364 | D | A | -0.2576 | |
| 365 | V | A | 0.7660 | |
| 366 | G | A | 0.0000 | |
| 367 | M | A | 0.0000 | |
| 368 | A | A | -0.3787 | |
| 369 | E | A | -1.0973 | |
| 370 | L | A | 0.0000 | |
| 371 | C | A | -0.4424 | |
| 372 | P | A | -0.6202 | |
| 373 | G | A | 0.0000 | |
| 374 | L | A | 0.2415 | |
| 375 | L | A | 0.0336 | |
| 376 | G | A | -0.6478 | |
| 377 | S | A | -1.0475 | |
| 378 | G | A | -1.4615 | |
| 379 | T | A | 0.0000 | |
| 380 | G | A | -2.1027 | |
| 381 | N | A | -2.5783 | |
| 382 | E | A | -3.1075 | |
| 383 | N | A | 0.0000 | |
| 384 | S | A | -2.2586 | |
| 385 | H | A | 0.0000 | |
| 386 | P | A | -1.1113 | |
| 387 | P | A | -0.7614 | |
| 388 | Y | A | 0.0000 | |
| 389 | A | A | -0.4118 | |
| 390 | T | A | 0.0000 | |
| 391 | T | A | -0.1498 | |
| 392 | G | A | -0.0082 | |
| 393 | S | A | 0.0000 | |
| 394 | G | A | 0.0000 | |
| 395 | T | A | -0.2931 | |
| 396 | L | A | 0.0000 | |
| 397 | W | A | 0.1806 | |
| 398 | I | A | 0.0000 | |
| 399 | W | A | -0.3669 | |
| 400 | E | A | -1.4145 | |
| 401 | C | A | -1.1586 | |
| 402 | G | A | -1.3692 | |
| 403 | I | A | 0.0000 | |
| 404 | T | A | -1.2585 | |
| 405 | A | A | -1.7227 | |
| 406 | K | A | -2.0244 | |
| 407 | G | A | 0.0000 | |
| 408 | C | A | 0.0000 | |
| 409 | G | A | 0.0000 | |
| 410 | D | A | -1.2577 | |
| 411 | L | A | 0.0000 | |
| 412 | C | A | 0.0000 | |
| 413 | R | A | -2.4902 | |
| 414 | V | A | 0.0000 | |
| 415 | L | A | -1.0241 | |
| 416 | R | A | -2.3461 | |
| 417 | A | A | -1.6306 | |
| 418 | G | A | 0.0000 | |
| 419 | S | A | 0.0000 | |
| 420 | G | A | -0.8459 | |
| 421 | T | A | 0.0000 | |
| 422 | G | A | -1.6403 | |
| 423 | N | A | 0.0000 | |
| 424 | E | A | -3.2816 | |
| 425 | N | A | -2.8313 | |
| 426 | S | A | -2.1904 | |
| 427 | H | A | -2.6043 | |
| 428 | P | A | 0.0000 | |
| 429 | P | A | 0.0000 | |
| 430 | Y | A | 0.0000 | |
| 431 | A | A | -0.1876 | |
| 432 | T | A | -0.2154 | |
| 433 | T | A | -0.4118 | |
| 434 | G | A | -0.7098 | |
| 435 | S | A | -0.6919 | |
| 436 | G | A | -0.3455 | |
| 437 | E | A | -0.3946 | |
| 438 | L | A | 0.2025 | |
| 439 | S | A | 0.0000 | |
| 440 | L | A | 0.0000 | |
| 441 | A | A | 0.0000 | |
| 442 | G | A | 0.0000 | |
| 443 | N | A | -2.6293 | |
| 444 | E | A | -2.7895 | |
| 445 | L | A | 0.0000 | |
| 446 | G | A | -1.9643 | |
| 447 | D | A | -1.8424 | |
| 448 | E | A | -2.6351 | |
| 449 | G | A | 0.0000 | |
| 450 | A | A | 0.0000 | |
| 451 | R | A | -2.1715 | |
| 452 | L | A | -1.3074 | |
| 453 | L | A | 0.0000 | |
| 454 | C | A | 0.0000 | |
| 455 | E | A | -0.7905 | |
| 456 | T | A | 0.0000 | |
| 457 | L | A | 0.7668 | |
| 458 | L | A | 0.5641 | |
| 459 | G | A | -0.4335 | |
| 460 | S | A | -0.4451 | |
| 461 | G | A | -0.2187 | |
| 462 | T | A | -0.3791 | |
| 463 | G | A | -0.7892 | |
| 464 | N | A | -1.3618 | |
| 465 | E | A | -1.5684 | |
| 466 | N | A | -1.8631 | |
| 467 | S | A | -1.4007 | |
| 468 | H | A | -1.2361 | |
| 469 | P | A | 0.0000 | |
| 470 | P | A | -0.2070 | |
| 471 | Y | A | 0.0000 | |
| 472 | A | A | 0.0176 | |
| 473 | T | A | -0.3004 | |
| 474 | T | A | -0.5633 | |
| 475 | G | A | -0.8971 | |
| 476 | S | A | -0.7504 | |
| 477 | G | A | -0.4313 | |
| 478 | S | A | 0.0000 | |
| 479 | L | A | 0.0000 | |
| 480 | W | A | -0.0150 | |
| 481 | V | A | 0.0000 | |
| 482 | K | A | -1.3616 | |
| 483 | S | A | -1.8245 | |
| 484 | C | A | 0.0000 | |
| 485 | S | A | 0.0000 | |
| 486 | F | A | 0.0000 | |
| 487 | T | A | -1.2937 | |
| 488 | A | A | -1.1097 | |
| 489 | A | A | -0.7104 | |
| 490 | C | A | -0.9667 | |
| 491 | C | A | 0.0000 | |
| 492 | S | A | -1.0531 | |
| 493 | H | A | -0.8840 | |
| 494 | F | A | 0.0000 | |
| 495 | S | A | -0.7265 | |
| 496 | S | A | -0.2847 | |
| 497 | V | A | 0.3396 | |
| 498 | L | A | 0.2269 | |
| 499 | A | A | -0.1850 | |
| 500 | Q | A | -0.0530 | |
| 501 | G | A | 0.0347 | |
| 502 | S | A | -0.3052 | |
| 503 | G | A | -0.6216 | |
| 504 | T | A | -0.9481 | |
| 505 | G | A | -1.7878 | |
| 506 | N | A | -2.8052 | |
| 507 | E | A | -2.5083 | |
| 508 | N | A | -2.5327 | |
| 509 | S | A | -1.7693 | |
| 510 | H | A | -1.8173 | |
| 511 | P | A | -1.3088 | |
| 512 | P | A | -0.6201 | |
| 513 | Y | A | -0.2138 | |
| 514 | A | A | 0.0000 | |
| 515 | T | A | -0.3635 | |
| 516 | T | A | -0.7121 | |
| 517 | G | A | -1.0388 | |
| 518 | S | A | -0.7790 | |
| 519 | G | A | -0.6300 | |
| 520 | E | A | -0.3884 | |
| 521 | L | A | 0.1306 | |
| 522 | Q | A | -0.0543 | |
| 523 | I | A | 0.0000 | |
| 524 | S | A | -0.9810 | |
| 525 | N | A | -2.0134 | |
| 526 | N | A | -2.2495 | |
| 527 | R | A | -2.5184 | |
| 528 | L | A | 0.0000 | |
| 529 | E | A | -2.9518 | |
| 530 | D | A | -2.2938 | |
| 531 | A | A | -1.5244 | |
| 532 | G | A | 0.0000 | |
| 533 | V | A | 0.0000 | |
| 534 | R | A | -2.4287 | |
| 535 | E | A | -2.1218 | |
| 536 | L | A | 0.0000 | |
| 537 | C | A | -1.1011 | |
| 538 | Q | A | -1.7345 | |
| 539 | G | A | -0.9525 | |
| 540 | L | A | -0.0674 | |
| 541 | G | A | -0.2684 | |
| 542 | G | A | -0.8295 | |
| 543 | S | A | -0.5001 | |
| 544 | G | A | -0.5769 | |
| 545 | T | A | -1.0852 | |
| 546 | G | A | -1.9851 | |
| 547 | N | A | -3.0841 | |
| 548 | E | A | -2.9690 | |
| 549 | N | A | -3.2355 | |
| 550 | S | A | -2.3239 | |
| 551 | H | A | -2.4154 | |
| 552 | P | A | 0.0000 | |
| 553 | P | A | -0.9847 | |
| 554 | Y | A | 0.0000 | |
| 555 | A | A | -0.2042 | |
| 556 | T | A | -0.3259 | |
| 557 | T | A | -0.5539 | |
| 558 | G | A | -0.9000 | |
| 559 | S | A | -0.7681 | |
| 560 | G | A | -0.4218 | |
| 561 | V | A | -0.2433 | |
| 562 | L | A | 0.0000 | |
| 563 | W | A | 0.4074 | |
| 564 | L | A | 0.0000 | |
| 565 | A | A | -0.7827 | |
| 566 | D | A | -1.8729 | |
| 567 | C | A | 0.0000 | |
| 568 | D | A | -2.0979 | |
| 569 | V | A | 0.0000 | |
| 570 | S | A | -1.7101 | |
| 571 | D | A | -2.3255 | |
| 572 | S | A | -1.4770 | |
| 573 | S | A | 0.0000 | |
| 574 | C | A | 0.0000 | |
| 575 | S | A | -1.0385 | |
| 576 | S | A | 0.0000 | |
| 577 | L | A | 0.0000 | |
| 578 | A | A | 0.0000 | |
| 579 | A | A | 0.0887 | |
| 580 | T | A | 0.1101 | |
| 581 | L | A | 0.6559 | |
| 582 | L | A | 0.8138 | |
| 583 | A | A | 0.4124 | |
| 584 | G | A | 0.1623 | |
| 585 | S | A | 0.0000 | |
| 586 | G | A | 0.0000 | |
| 587 | T | A | 0.0000 | |
| 588 | G | A | -2.0686 | |
| 589 | N | A | 0.0000 | |
| 590 | E | A | -3.3188 | |
| 591 | N | A | -3.3683 | |
| 592 | S | A | 0.0000 | |
| 593 | H | A | -1.3411 | |
| 594 | P | A | 0.0000 | |
| 595 | P | A | -0.3255 | |
| 596 | Y | A | 0.0000 | |
| 597 | A | A | -0.1631 | |
| 598 | T | A | -0.2662 | |
| 599 | T | A | -0.4490 | |
| 600 | G | A | -0.7630 | |
| 601 | S | A | -0.7326 | |
| 602 | G | A | -0.6569 | |
| 603 | E | A | -0.7525 | |
| 604 | L | A | 0.0000 | |
| 605 | D | A | 0.2915 | |
| 606 | L | A | 0.0000 | |
| 607 | S | A | 0.0000 | |
| 608 | N | A | -1.2768 | |
| 609 | N | A | -1.7186 | |
| 610 | C | A | -1.1926 | |
| 611 | L | A | 0.0000 | |
| 612 | G | A | -1.3001 | |
| 613 | D | A | -2.0343 | |
| 614 | A | A | -1.2307 | |
| 615 | G | A | 0.0000 | |
| 616 | I | A | 0.0000 | |
| 617 | L | A | -1.1894 | |
| 618 | Q | A | -1.5291 | |
| 619 | L | A | 0.0000 | |
| 620 | V | A | 0.0000 | |
| 621 | E | A | -2.0516 | |
| 622 | S | A | -0.9406 | |
| 623 | V | A | 0.0000 | |
| 624 | R | A | -1.1364 | |
| 625 | G | A | -1.1196 | |
| 626 | S | A | -0.8709 | |
| 627 | G | A | -1.4731 | |
| 628 | T | A | -0.9763 | |
| 629 | G | A | -1.5988 | |
| 630 | N | A | -2.0769 | |
| 631 | E | A | 0.0000 | |
| 632 | N | A | 0.0000 | |
| 633 | S | A | -1.6052 | |
| 634 | H | A | -0.6170 | |
| 635 | P | A | -0.2324 | |
| 636 | P | A | 0.1045 | |
| 637 | Y | A | 0.9954 | |
| 638 | A | A | 0.4258 | |
| 639 | T | A | 0.0000 | |
| 640 | T | A | -0.0093 | |
| 641 | G | A | -0.6245 | |
| 642 | S | A | -0.8117 | |
| 643 | G | A | -0.6941 | |
| 644 | Q | A | -0.7437 | |
| 645 | L | A | 0.0000 | |
| 646 | V | A | 0.5138 | |
| 647 | L | A | 0.0000 | |
| 648 | Y | A | 0.4671 | |
| 649 | D | A | -1.0124 | |
| 650 | I | A | 0.0000 | |
| 651 | Y | A | 0.4890 | |
| 652 | W | A | -0.3169 | |
| 653 | S | A | -2.0212 | |
| 654 | E | A | -3.6993 | |
| 655 | E | A | -3.9568 | |
| 656 | M | A | 0.0000 | |
| 657 | E | A | -3.6386 | |
| 658 | D | A | -4.1244 | |
| 659 | R | A | -3.2617 | |
| 660 | L | A | -2.7223 | |
| 661 | Q | A | -3.1650 | |
| 662 | A | A | -2.9494 | |
| 663 | L | A | 0.0000 | |
| 664 | E | A | -3.4234 | |
| 665 | K | A | -3.2756 | |
| 666 | D | A | -2.6977 | |
| 667 | G | A | -2.1569 | |
| 668 | S | A | -1.4585 | |
| 669 | G | A | -0.9077 | |
| 670 | T | A | -0.8243 | |
| 671 | G | A | -1.1981 | |
| 672 | N | A | -1.2860 | |
| 673 | E | A | -1.9668 | |
| 674 | N | A | -2.3410 | |
| 675 | S | A | -1.3857 | |
| 676 | H | A | 0.0000 | |
| 677 | P | A | -0.9855 | |
| 678 | P | A | -0.9145 | |
| 679 | Y | A | 0.0000 | |
| 680 | A | A | -0.1507 | |
| 681 | T | A | 0.0000 | |
| 682 | T | A | 0.0000 | |
| 683 | G | A | -0.7674 | |
| 684 | S | A | -1.2173 | |
| 685 | G | A | 0.0000 | |
| 686 | R | A | -1.5980 | |
| 687 | V | A | 0.0000 | |
| 688 | I | A | 0.6299 | |
| 689 | S | A | 0.5946 |
3Dmol can be expensive computationally for big molecules. If you experience lag or delay click on the "Play the video" button instead.
CABS-flex predictions of flexibility of input structure
In dynamic mode, A4D analysis is performed on the set of models reflecting fluctuations of the input structure (predicted
by CABS-flex method, models are numbered from 0 to 11) and the input model.
Their A4D scores are provided below in the table.
The right panel presents comparison of the most aggregation prone model (with the highest A4D score, -0.7904 in this case) with the input model
(the most aggregation prone model in blue, input in red) and RMSF plot which shows the extent of residue fluctuations in Angstroms (predicted by CABS-flex).
Model |
Average A4D Score |
|||
| model_10 | -0.7904 | View | CSV | PDB |
| model_8 | -0.797 | View | CSV | PDB |
| model_3 | -0.8022 | View | CSV | PDB |
| model_1 | -0.8065 | View | CSV | PDB |
| model_5 | -0.8066 | View | CSV | PDB |
| model_0 | -0.8083 | View | CSV | PDB |
| model_9 | -0.8101 | View | CSV | PDB |
| CABS_average | -0.8188 | View | CSV | PDB |
| model_7 | -0.8193 | View | CSV | PDB |
| model_2 | -0.8303 | View | CSV | PDB |
| model_11 | -0.8403 | View | CSV | PDB |
| model_6 | -0.8445 | View | CSV | PDB |
| model_4 | -0.8707 | View | CSV | PDB |
| input | -0.9416 | View | CSV | PDB |
ALA alanine
ARG arginine
ASN asparagine
ASP aspartic acid
CYS cysteine
GLN glutamine
GLU glutamic acid
GLY glycine
HIS histidine
ILE isoleucine
LEU leucine
LYS lysine
MET methionine
PHE phenylalanine
PRO proline
SER serine
THR threonine
TRP tryptophan
TYR tyrosine
VAL valine