| Chain sequence(s) |
A: AGEGDQQDAAHNMGNHLPLLPAESEEEDEMEVEDQDSKEAKKPNIINFDTSLPTSHTYLGADMEEFHGRTLHDDDSCQVIPVLPQVMMILIPGQTLPLQLFHPQEVSMVRNLIQKDRTFAVLAYSNVQEREAQFGTTAEIYAYREEQDFPNSGIEIVKVKAIGRQRFKVLELRTQSDGIQQAKVQILPECVLPSTMSAVQLESLNKCQIFPSKPVSREDQCSYKWWQKYQKRKFHCANLTSWPRWLYSLYDAETLMDRIKKQLREWDENLKDDSLPSNPIDFSYRVAACLPIDDVLRIQLLKIGSAIQRLRCELDIMNKCTSLCCKQCQETEITTKNEIFSLSLCGPMAAYVNPHGYVHETLTVYKACNLNLIGRPSTEHSWFPGYAWTVAQCKICASHIGWKFTATKKDMSPQKFWGLTRSALLPTIPDTEDEISPDKVILCL
input PDB |
| Selected Chain(s) | A |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| 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 minimalization (00:00:00)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:11:35)
[INFO] Main: Simulation completed successfully. (00:11:39)
|
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
| residue index | residue name | chain | Aggrescan3D score | mutation |
|---|---|---|---|---|
| residue index | residue name | chain | Aggrescan3D score | |
| 1 | A | A | -0.6555 | |
| 2 | G | A | -1.6768 | |
| 3 | E | A | -2.8309 | |
| 4 | G | A | -2.7683 | |
| 5 | D | A | -3.8458 | |
| 6 | Q | A | -3.4399 | |
| 7 | Q | A | -3.3371 | |
| 8 | D | A | -3.2219 | |
| 9 | A | A | -1.9410 | |
| 10 | A | A | -1.6967 | |
| 11 | H | A | -1.9455 | |
| 12 | N | A | -1.3162 | |
| 13 | M | A | 0.0000 | |
| 14 | G | A | -0.1874 | |
| 15 | N | A | -0.5456 | |
| 16 | H | A | -0.4726 | |
| 17 | L | A | 1.2001 | |
| 18 | P | A | 1.1689 | |
| 19 | L | A | 2.3702 | |
| 20 | L | A | 2.0396 | |
| 21 | P | A | 0.3763 | |
| 22 | A | A | -0.6526 | |
| 23 | E | A | -2.3110 | |
| 24 | S | A | -2.7090 | |
| 25 | E | A | -3.8844 | |
| 26 | E | A | -4.5548 | |
| 27 | E | A | -4.4667 | |
| 28 | D | A | -4.1664 | |
| 29 | E | A | -3.5859 | |
| 30 | M | A | -1.6074 | |
| 31 | E | A | -2.2485 | |
| 32 | V | A | -1.2946 | |
| 33 | E | A | -2.8406 | |
| 34 | D | A | -2.5791 | |
| 35 | Q | A | -2.5647 | |
| 36 | D | A | -2.2153 | |
| 37 | S | A | -2.4635 | |
| 38 | K | A | -3.2037 | |
| 39 | E | A | -3.3011 | |
| 40 | A | A | -2.4678 | |
| 41 | K | A | -2.9937 | |
| 42 | K | A | -1.7981 | |
| 43 | P | A | -0.9581 | |
| 44 | N | A | -1.1683 | |
| 45 | I | A | 0.8099 | |
| 46 | I | A | -0.0248 | |
| 47 | N | A | -1.2895 | |
| 48 | F | A | 0.0000 | |
| 49 | D | A | -1.5858 | |
| 50 | T | A | -0.3193 | |
| 51 | S | A | 0.0782 | |
| 52 | L | A | 0.1753 | |
| 53 | P | A | 0.0000 | |
| 54 | T | A | 0.4471 | |
| 55 | S | A | 0.1386 | |
| 56 | H | A | 0.0000 | |
| 57 | T | A | -0.2681 | |
| 58 | Y | A | -0.2943 | |
| 59 | L | A | 0.0000 | |
| 60 | G | A | -0.9227 | |
| 61 | A | A | -1.2634 | |
| 62 | D | A | -2.6438 | |
| 63 | M | A | -2.5425 | |
| 64 | E | A | -3.2542 | |
| 65 | E | A | -3.0951 | |
| 66 | F | A | -1.7628 | |
| 67 | H | A | -1.8856 | |
| 68 | G | A | -2.0424 | |
| 69 | R | A | -2.2393 | |
| 70 | T | A | -1.1323 | |
| 71 | L | A | -0.5262 | |
| 72 | H | A | -1.3539 | |
| 73 | D | A | -2.9520 | |
| 74 | D | A | -3.4754 | |
| 75 | D | A | -3.1096 | |
| 76 | S | A | -1.8660 | |
| 77 | C | A | -0.1221 | |
| 78 | Q | A | 0.3557 | |
| 79 | V | A | 1.2577 | |
| 80 | I | A | 0.0000 | |
| 81 | P | A | -0.1132 | |
| 82 | V | A | 0.0000 | |
| 83 | L | A | 0.0000 | |
| 84 | P | A | -0.9407 | |
| 85 | Q | A | -0.9979 | |
| 86 | V | A | 0.0000 | |
| 87 | M | A | 0.2581 | |
| 88 | M | A | 0.0000 | |
| 89 | I | A | 0.0000 | |
| 90 | L | A | 0.0000 | |
| 91 | I | A | 0.0000 | |
| 92 | P | A | 0.0000 | |
| 93 | G | A | -0.8489 | |
| 94 | Q | A | 0.0000 | |
| 95 | T | A | 0.0226 | |
| 96 | L | A | 0.0000 | |
| 97 | P | A | 0.0000 | |
| 98 | L | A | 0.0000 | |
| 99 | Q | A | 0.0000 | |
| 100 | L | A | 0.0000 | |
| 101 | F | A | 0.5120 | |
| 102 | H | A | -0.6551 | |
| 103 | P | A | -0.5367 | |
| 104 | Q | A | -1.0862 | |
| 105 | E | A | 0.0000 | |
| 106 | V | A | 0.0000 | |
| 107 | S | A | -0.8613 | |
| 108 | M | A | 0.0000 | |
| 109 | V | A | 0.0000 | |
| 110 | R | A | -1.5340 | |
| 111 | N | A | -2.0913 | |
| 112 | L | A | 0.0000 | |
| 113 | I | A | -1.3863 | |
| 114 | Q | A | -2.4744 | |
| 115 | K | A | -2.8832 | |
| 116 | D | A | -2.2140 | |
| 117 | R | A | -1.6083 | |
| 118 | T | A | 0.0000 | |
| 119 | F | A | 0.0000 | |
| 120 | A | A | 0.0000 | |
| 121 | V | A | 0.0000 | |
| 122 | L | A | 0.0000 | |
| 123 | A | A | 0.0000 | |
| 124 | Y | A | 0.0000 | |
| 125 | S | A | -1.1426 | |
| 126 | N | A | -1.9935 | |
| 127 | V | A | -1.3288 | |
| 128 | Q | A | -2.5524 | |
| 129 | E | A | -3.5722 | |
| 130 | R | A | -3.4165 | |
| 131 | E | A | -3.2292 | |
| 132 | A | A | -1.4934 | |
| 133 | Q | A | -1.0961 | |
| 134 | F | A | -0.5196 | |
| 135 | G | A | 0.0000 | |
| 136 | T | A | 0.0000 | |
| 137 | T | A | 0.0000 | |
| 138 | A | A | 0.0000 | |
| 139 | E | A | 0.0000 | |
| 140 | I | A | 0.0000 | |
| 141 | Y | A | -0.9511 | |
| 142 | A | A | 0.0000 | |
| 143 | Y | A | 0.0000 | |
| 144 | R | A | -2.3524 | |
| 145 | E | A | -2.3676 | |
| 146 | E | A | -2.0928 | |
| 147 | Q | A | -2.0957 | |
| 148 | D | A | -1.8282 | |
| 149 | F | A | 0.1754 | |
| 150 | P | A | -0.7475 | |
| 151 | N | A | -1.0849 | |
| 152 | S | A | -0.4022 | |
| 153 | G | A | -0.3930 | |
| 154 | I | A | 0.5790 | |
| 155 | E | A | -0.7730 | |
| 156 | I | A | -0.6989 | |
| 157 | V | A | 0.0000 | |
| 158 | K | A | -0.7093 | |
| 159 | V | A | 0.0000 | |
| 160 | K | A | -0.3941 | |
| 161 | A | A | 0.0000 | |
| 162 | I | A | 0.1583 | |
| 163 | G | A | 0.0000 | |
| 164 | R | A | -0.7339 | |
| 165 | Q | A | -0.7355 | |
| 166 | R | A | 0.0000 | |
| 167 | F | A | 0.0000 | |
| 168 | K | A | -1.0285 | |
| 169 | V | A | 0.0000 | |
| 170 | L | A | 0.0996 | |
| 171 | E | A | -1.6245 | |
| 172 | L | A | -1.2608 | |
| 173 | R | A | -2.2073 | |
| 174 | T | A | -1.6603 | |
| 175 | Q | A | -1.8565 | |
| 176 | S | A | -1.4940 | |
| 177 | D | A | -1.8704 | |
| 178 | G | A | -1.7021 | |
| 179 | I | A | 0.0000 | |
| 180 | Q | A | -1.3611 | |
| 181 | Q | A | -0.9287 | |
| 182 | A | A | 0.0000 | |
| 183 | K | A | -0.4223 | |
| 184 | V | A | 0.0000 | |
| 185 | Q | A | -1.1218 | |
| 186 | I | A | 0.0000 | |
| 187 | L | A | -1.3934 | |
| 188 | P | A | -1.3192 | |
| 189 | E | A | 0.0859 | |
| 190 | C | A | 1.4832 | |
| 191 | V | A | 2.5946 | |
| 192 | L | A | 2.3241 | |
| 193 | P | A | 0.8209 | |
| 194 | S | A | 0.2943 | |
| 195 | T | A | 0.2505 | |
| 196 | M | A | 0.0000 | |
| 197 | S | A | -0.0395 | |
| 198 | A | A | 0.1725 | |
| 199 | V | A | 0.4469 | |
| 200 | Q | A | -0.1988 | |
| 201 | L | A | -0.2841 | |
| 202 | E | A | -1.8597 | |
| 203 | S | A | -1.1517 | |
| 204 | L | A | -1.0390 | |
| 205 | N | A | -1.4813 | |
| 206 | K | A | -1.4563 | |
| 207 | C | A | -0.2249 | |
| 208 | Q | A | 0.0463 | |
| 209 | I | A | 1.5094 | |
| 210 | F | A | 0.6296 | |
| 211 | P | A | 0.0104 | |
| 212 | S | A | -0.1648 | |
| 213 | K | A | -0.5256 | |
| 214 | P | A | -0.2329 | |
| 215 | V | A | 0.7345 | |
| 216 | S | A | -1.2509 | |
| 217 | R | A | -2.9030 | |
| 218 | E | A | -3.3806 | |
| 219 | D | A | -3.4465 | |
| 220 | Q | A | -2.5582 | |
| 221 | C | A | -1.7226 | |
| 222 | S | A | -1.7020 | |
| 223 | Y | A | -0.8227 | |
| 224 | K | A | -1.9483 | |
| 225 | W | A | 0.0000 | |
| 226 | W | A | 0.0000 | |
| 227 | Q | A | -1.8309 | |
| 228 | K | A | -2.2697 | |
| 229 | Y | A | 0.0000 | |
| 230 | Q | A | -1.7910 | |
| 231 | K | A | -2.7930 | |
| 232 | R | A | -1.8584 | |
| 233 | K | A | -1.2389 | |
| 234 | F | A | 0.0000 | |
| 235 | H | A | -1.5273 | |
| 236 | C | A | 0.0000 | |
| 237 | A | A | 0.0000 | |
| 238 | N | A | -0.5473 | |
| 239 | L | A | 1.1133 | |
| 240 | T | A | 0.6160 | |
| 241 | S | A | 0.4057 | |
| 242 | W | A | 1.1943 | |
| 243 | P | A | 0.5469 | |
| 244 | R | A | -0.2622 | |
| 245 | W | A | 1.2010 | |
| 246 | L | A | 1.3687 | |
| 247 | Y | A | 1.0675 | |
| 248 | S | A | 0.0000 | |
| 249 | L | A | 1.0581 | |
| 250 | Y | A | 1.1303 | |
| 251 | D | A | 0.0000 | |
| 252 | A | A | -0.2436 | |
| 253 | E | A | -0.9971 | |
| 254 | T | A | 0.0000 | |
| 255 | L | A | 0.0000 | |
| 256 | M | A | -1.1035 | |
| 257 | D | A | -1.6825 | |
| 258 | R | A | -2.0362 | |
| 259 | I | A | 0.0000 | |
| 260 | K | A | -2.4026 | |
| 261 | K | A | -3.0041 | |
| 262 | Q | A | -2.2680 | |
| 263 | L | A | 0.0000 | |
| 264 | R | A | -3.3470 | |
| 265 | E | A | -3.4272 | |
| 266 | W | A | 0.0000 | |
| 267 | D | A | -2.5315 | |
| 268 | E | A | -3.4252 | |
| 269 | N | A | -2.7803 | |
| 270 | L | A | -2.8407 | |
| 271 | K | A | -3.6242 | |
| 272 | D | A | -3.3818 | |
| 273 | D | A | -3.0594 | |
| 274 | S | A | -1.5974 | |
| 275 | L | A | -1.5125 | |
| 276 | P | A | -1.3252 | |
| 277 | S | A | -1.3417 | |
| 278 | N | A | -1.2598 | |
| 279 | P | A | -0.6379 | |
| 280 | I | A | -0.3857 | |
| 281 | D | A | -1.7361 | |
| 282 | F | A | 0.0000 | |
| 283 | S | A | 0.0000 | |
| 284 | Y | A | 0.0000 | |
| 285 | R | A | -0.8014 | |
| 286 | V | A | 0.0000 | |
| 287 | A | A | 0.0000 | |
| 288 | A | A | -0.1685 | |
| 289 | C | A | 0.0000 | |
| 290 | L | A | 0.0000 | |
| 291 | P | A | -0.1684 | |
| 292 | I | A | 0.0000 | |
| 293 | D | A | -0.1465 | |
| 294 | D | A | -0.2268 | |
| 295 | V | A | 1.1440 | |
| 296 | L | A | 0.0000 | |
| 297 | R | A | 0.0000 | |
| 298 | I | A | -0.0298 | |
| 299 | Q | A | -0.4493 | |
| 300 | L | A | 0.0000 | |
| 301 | L | A | 0.0000 | |
| 302 | K | A | -1.3731 | |
| 303 | I | A | 0.0000 | |
| 304 | G | A | -0.1765 | |
| 305 | S | A | 0.0000 | |
| 306 | A | A | 0.0000 | |
| 307 | I | A | 0.7391 | |
| 308 | Q | A | -0.1972 | |
| 309 | R | A | 0.0000 | |
| 310 | L | A | 0.0000 | |
| 311 | R | A | -0.0098 | |
| 312 | C | A | 0.0000 | |
| 313 | E | A | 0.0000 | |
| 314 | L | A | -0.6490 | |
| 315 | D | A | -0.3605 | |
| 316 | I | A | 0.0000 | |
| 317 | M | A | 0.0000 | |
| 318 | N | A | -1.6199 | |
| 319 | K | A | -1.1252 | |
| 320 | C | A | -0.4654 | |
| 321 | T | A | -0.6314 | |
| 322 | S | A | 0.0000 | |
| 323 | L | A | 0.0000 | |
| 324 | C | A | 0.0000 | |
| 325 | C | A | 0.0000 | |
| 326 | K | A | -2.0142 | |
| 327 | Q | A | -1.7827 | |
| 328 | C | A | -1.4192 | |
| 329 | Q | A | -2.7382 | |
| 330 | E | A | -2.7077 | |
| 331 | T | A | 0.0000 | |
| 332 | E | A | -2.0431 | |
| 333 | I | A | 0.0000 | |
| 334 | T | A | 0.0000 | |
| 335 | T | A | -0.8168 | |
| 336 | K | A | -1.2509 | |
| 337 | N | A | -1.8104 | |
| 338 | E | A | -1.1923 | |
| 339 | I | A | 0.0000 | |
| 340 | F | A | 0.0000 | |
| 341 | S | A | 0.0000 | |
| 342 | L | A | 0.0000 | |
| 343 | S | A | 0.0000 | |
| 344 | L | A | 1.3765 | |
| 345 | C | A | 0.8436 | |
| 346 | G | A | 0.4720 | |
| 347 | P | A | 0.0000 | |
| 348 | M | A | 0.0000 | |
| 349 | A | A | 0.2017 | |
| 350 | A | A | 0.0000 | |
| 351 | Y | A | 0.0000 | |
| 352 | V | A | 0.0000 | |
| 353 | N | A | 0.0000 | |
| 354 | P | A | -0.3958 | |
| 355 | H | A | -0.0547 | |
| 356 | G | A | 0.3437 | |
| 357 | Y | A | 1.0471 | |
| 358 | V | A | 0.7587 | |
| 359 | H | A | 0.3698 | |
| 360 | E | A | 0.0000 | |
| 361 | T | A | 0.0000 | |
| 362 | L | A | 0.0000 | |
| 363 | T | A | 0.0000 | |
| 364 | V | A | 0.0000 | |
| 365 | Y | A | -0.9197 | |
| 366 | K | A | -1.0344 | |
| 367 | A | A | 0.0000 | |
| 368 | C | A | -1.1263 | |
| 369 | N | A | -1.3926 | |
| 370 | L | A | 0.0000 | |
| 371 | N | A | -1.4787 | |
| 372 | L | A | -1.0058 | |
| 373 | I | A | -0.6333 | |
| 374 | G | A | -1.5203 | |
| 375 | R | A | -2.1295 | |
| 376 | P | A | -1.3329 | |
| 377 | S | A | 0.0000 | |
| 378 | T | A | -1.0864 | |
| 379 | E | A | -2.0929 | |
| 380 | H | A | -1.2012 | |
| 381 | S | A | -0.7368 | |
| 382 | W | A | 0.0000 | |
| 383 | F | A | 0.0000 | |
| 384 | P | A | -0.4284 | |
| 385 | G | A | -0.4912 | |
| 386 | Y | A | 0.0000 | |
| 387 | A | A | 0.0000 | |
| 388 | W | A | 0.0000 | |
| 389 | T | A | 0.0000 | |
| 390 | V | A | -0.1936 | |
| 391 | A | A | 0.0000 | |
| 392 | Q | A | -0.1646 | |
| 393 | C | A | 0.0000 | |
| 394 | K | A | -1.0726 | |
| 395 | I | A | 0.8644 | |
| 396 | C | A | 0.7021 | |
| 397 | A | A | 0.3430 | |
| 398 | S | A | 0.1024 | |
| 399 | H | A | -0.3933 | |
| 400 | I | A | 0.0000 | |
| 401 | G | A | 0.0000 | |
| 402 | W | A | 0.0000 | |
| 403 | K | A | -0.3848 | |
| 404 | F | A | 0.0000 | |
| 405 | T | A | -1.2029 | |
| 406 | A | A | -1.8341 | |
| 407 | T | A | -1.7483 | |
| 408 | K | A | -3.2101 | |
| 409 | K | A | -3.5239 | |
| 410 | D | A | -3.3955 | |
| 411 | M | A | -2.2045 | |
| 412 | S | A | -1.3172 | |
| 413 | P | A | 0.0000 | |
| 414 | Q | A | -2.1879 | |
| 415 | K | A | -1.5969 | |
| 416 | F | A | 0.0000 | |
| 417 | W | A | 0.0000 | |
| 418 | G | A | 0.0000 | |
| 419 | L | A | 0.0000 | |
| 420 | T | A | 0.0000 | |
| 421 | R | A | 0.0000 | |
| 422 | S | A | -0.6528 | |
| 423 | A | A | 0.0000 | |
| 424 | L | A | 0.0000 | |
| 425 | L | A | -0.9199 | |
| 426 | P | A | 0.0000 | |
| 427 | T | A | -1.0590 | |
| 428 | I | A | -0.8640 | |
| 429 | P | A | -1.2615 | |
| 430 | D | A | -3.0299 | |
| 431 | T | A | -2.4951 | |
| 432 | E | A | -3.3849 | |
| 433 | D | A | -3.3025 | |
| 434 | E | A | -2.7289 | |
| 435 | I | A | 0.0035 | |
| 436 | S | A | -0.9589 | |
| 437 | P | A | -2.0380 | |
| 438 | D | A | -2.4761 | |
| 439 | K | A | -1.8214 | |
| 440 | V | A | 0.1071 | |
| 441 | I | A | 1.6360 | |
| 442 | L | A | 1.2569 | |
| 443 | C | A | 1.3383 | |
| 444 | L | A | 0.8236 |
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