| Chain sequence(s) |
A: MASHKVTKAHNGATLTVAVGELVEIQLPSNPTTGFAWYFEGGTKESPNESMFTVENKYFPPDSKLLGAGGTEHFHVTVKAAGTHAVNLTYMRPWTGPSHDSERFTVYLKANAMGGSAKVSKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTFGYGLQCFARYPDHMKQHDFFKSAMPEGYVQERTIFFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNSHNVYIMADKQKNGIKVNFKIRHNIEDGSVQLADHYQQNTPIGDGPVLLPDNHYLSTQSALSKDPNEKRDHMVLLEFVTAAGITLGMDELYK
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] (00:00:01)
[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] FoldX: Starting FoldX energy minimalization (00:00:01)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:07:00)
[INFO] Main: Simulation completed successfully. (00:07:02)
|
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 | M | A | 0.9963 | |
| 2 | A | A | -0.1123 | |
| 3 | S | A | -0.4716 | |
| 4 | H | A | -1.1027 | |
| 5 | K | A | -2.0435 | |
| 6 | V | A | 0.0000 | |
| 7 | T | A | -1.6717 | |
| 8 | K | A | -2.4881 | |
| 9 | A | A | -1.3675 | |
| 10 | H | A | -1.6935 | |
| 11 | N | A | -2.3972 | |
| 12 | G | A | -1.4575 | |
| 13 | A | A | -0.5091 | |
| 14 | T | A | -0.2712 | |
| 15 | L | A | -0.1171 | |
| 16 | T | A | -0.5881 | |
| 17 | V | A | 0.0000 | |
| 18 | A | A | -0.6310 | |
| 19 | V | A | -0.7262 | |
| 20 | G | A | -0.7312 | |
| 21 | E | A | -0.5579 | |
| 22 | L | A | -0.1701 | |
| 23 | V | A | 0.0000 | |
| 24 | E | A | -1.1918 | |
| 25 | I | A | 0.0000 | |
| 26 | Q | A | -1.0731 | |
| 27 | L | A | 0.0000 | |
| 28 | P | A | -0.5518 | |
| 29 | S | A | 0.0000 | |
| 30 | N | A | -0.2585 | |
| 31 | P | A | -0.2513 | |
| 32 | T | A | -0.0595 | |
| 33 | T | A | -0.2164 | |
| 34 | G | A | -0.0169 | |
| 35 | F | A | 0.2191 | |
| 36 | A | A | 0.0000 | |
| 37 | W | A | 0.0000 | |
| 38 | Y | A | -1.2350 | |
| 39 | F | A | 0.0000 | |
| 40 | E | A | -2.5484 | |
| 41 | G | A | -1.5181 | |
| 42 | G | A | -1.1558 | |
| 43 | T | A | -1.3915 | |
| 44 | K | A | -2.1424 | |
| 45 | E | A | -3.0391 | |
| 46 | S | A | -2.3726 | |
| 47 | P | A | -2.0036 | |
| 48 | N | A | -1.8490 | |
| 49 | E | A | -2.6817 | |
| 50 | S | A | -1.5263 | |
| 51 | M | A | -1.0864 | |
| 52 | F | A | 0.0000 | |
| 53 | T | A | -1.7423 | |
| 54 | V | A | -1.9193 | |
| 55 | E | A | -2.9405 | |
| 56 | N | A | -2.6208 | |
| 57 | K | A | -2.0918 | |
| 58 | Y | A | -0.2527 | |
| 59 | F | A | 0.3695 | |
| 60 | P | A | -0.6157 | |
| 61 | P | A | -1.0633 | |
| 62 | D | A | -2.0437 | |
| 63 | S | A | -1.2047 | |
| 64 | K | A | -1.1172 | |
| 65 | L | A | 1.0899 | |
| 66 | L | A | 1.6684 | |
| 67 | G | A | 0.4391 | |
| 68 | A | A | -0.0172 | |
| 69 | G | A | -0.3474 | |
| 70 | G | A | -0.4294 | |
| 71 | T | A | -0.1788 | |
| 72 | E | A | 0.0000 | |
| 73 | H | A | -1.0639 | |
| 74 | F | A | 0.0000 | |
| 75 | H | A | -1.5343 | |
| 76 | V | A | 0.0000 | |
| 77 | T | A | -0.9079 | |
| 78 | V | A | 0.0000 | |
| 79 | K | A | -1.7741 | |
| 80 | A | A | -1.0124 | |
| 81 | A | A | -0.7706 | |
| 82 | G | A | -0.8470 | |
| 83 | T | A | -0.5759 | |
| 84 | H | A | 0.0000 | |
| 85 | A | A | -0.1664 | |
| 86 | V | A | 0.0000 | |
| 87 | N | A | -1.6776 | |
| 88 | L | A | 0.0000 | |
| 89 | T | A | 0.0000 | |
| 90 | Y | A | -1.1872 | |
| 91 | M | A | 0.0000 | |
| 92 | R | A | -0.3097 | |
| 93 | P | A | 0.0541 | |
| 94 | W | A | 0.7920 | |
| 95 | T | A | 0.0885 | |
| 96 | G | A | -0.4679 | |
| 97 | P | A | -1.6255 | |
| 98 | S | A | -1.7235 | |
| 99 | H | A | -2.2606 | |
| 100 | D | A | -3.0700 | |
| 101 | S | A | -2.7204 | |
| 102 | E | A | -3.3065 | |
| 103 | R | A | -3.5013 | |
| 104 | F | A | 0.0000 | |
| 105 | T | A | -1.4462 | |
| 106 | V | A | 0.0000 | |
| 107 | Y | A | -0.0188 | |
| 108 | L | A | 0.0000 | |
| 109 | K | A | -1.1966 | |
| 110 | A | A | 0.0000 | |
| 111 | N | A | -1.4327 | |
| 112 | A | A | -0.7722 | |
| 113 | M | A | -0.0892 | |
| 114 | G | A | -0.7997 | |
| 115 | G | A | -1.2490 | |
| 116 | S | A | -0.9201 | |
| 117 | A | A | -1.4113 | |
| 118 | K | A | -1.8787 | |
| 119 | V | A | -0.9868 | |
| 120 | S | A | -1.3619 | |
| 121 | K | A | -2.1564 | |
| 122 | G | A | 0.0000 | |
| 123 | E | A | 0.0000 | |
| 124 | E | A | -1.9219 | |
| 125 | L | A | -0.7376 | |
| 126 | F | A | 0.0000 | |
| 127 | T | A | -0.2701 | |
| 128 | G | A | 0.5129 | |
| 129 | V | A | 1.3619 | |
| 130 | V | A | 0.0000 | |
| 131 | P | A | -0.8843 | |
| 132 | I | A | 0.0000 | |
| 133 | L | A | -1.1274 | |
| 134 | V | A | 0.0000 | |
| 135 | E | A | -2.0343 | |
| 136 | L | A | 0.0000 | |
| 137 | D | A | -3.3224 | |
| 138 | G | A | 0.0000 | |
| 139 | D | A | -2.3992 | |
| 140 | V | A | 0.0000 | |
| 141 | N | A | -1.9431 | |
| 142 | G | A | -1.4429 | |
| 143 | H | A | -1.7672 | |
| 144 | K | A | -2.7028 | |
| 145 | F | A | 0.0000 | |
| 146 | S | A | -1.7688 | |
| 147 | V | A | 0.0000 | |
| 148 | S | A | -1.1509 | |
| 149 | G | A | 0.0000 | |
| 150 | E | A | -2.3511 | |
| 151 | G | A | -1.7590 | |
| 152 | E | A | -1.4273 | |
| 153 | G | A | 0.0000 | |
| 154 | D | A | 0.2575 | |
| 155 | A | A | 0.0000 | |
| 156 | T | A | 0.3377 | |
| 157 | Y | A | 1.1049 | |
| 158 | G | A | 0.0000 | |
| 159 | K | A | -0.0329 | |
| 160 | L | A | 0.0000 | |
| 161 | T | A | -0.6218 | |
| 162 | L | A | 0.0000 | |
| 163 | K | A | -1.4000 | |
| 164 | F | A | 0.0000 | |
| 165 | I | A | -1.2596 | |
| 166 | C | A | 0.0000 | |
| 167 | T | A | -0.8054 | |
| 168 | T | A | -1.1865 | |
| 169 | G | A | -1.7046 | |
| 170 | K | A | -2.2953 | |
| 171 | L | A | 0.0000 | |
| 172 | P | A | -1.1048 | |
| 173 | V | A | 0.0000 | |
| 174 | P | A | 0.0000 | |
| 175 | W | A | 0.0000 | |
| 176 | P | A | 0.0000 | |
| 177 | T | A | 0.0000 | |
| 178 | L | A | 0.0000 | |
| 179 | V | A | 0.0000 | |
| 180 | T | A | 0.0000 | |
| 181 | T | A | 0.0000 | |
| 182 | F | A | 0.0000 | |
| 183 | G | A | 0.0000 | |
| 184 | Y | A | 0.0000 | |
| 185 | G | A | 0.0000 | |
| 186 | L | A | 0.0000 | |
| 187 | Q | A | 0.0000 | |
| 188 | C | A | 0.0000 | |
| 189 | F | A | 0.0000 | |
| 190 | A | A | 0.0000 | |
| 191 | R | A | -0.8297 | |
| 192 | Y | A | 0.0000 | |
| 193 | P | A | -1.3717 | |
| 194 | D | A | -2.4207 | |
| 195 | H | A | -1.1260 | |
| 196 | M | A | 0.0000 | |
| 197 | K | A | -1.6892 | |
| 198 | Q | A | -1.6099 | |
| 199 | H | A | -1.1209 | |
| 200 | D | A | 0.0000 | |
| 201 | F | A | 0.0000 | |
| 202 | F | A | 0.0000 | |
| 203 | K | A | 0.0000 | |
| 204 | S | A | 0.0000 | |
| 205 | A | A | 0.0000 | |
| 206 | M | A | 0.0000 | |
| 207 | P | A | -1.4221 | |
| 208 | E | A | -2.1182 | |
| 209 | G | A | 0.0000 | |
| 210 | Y | A | 0.0000 | |
| 211 | V | A | -0.4421 | |
| 212 | Q | A | 0.0000 | |
| 213 | E | A | -2.1096 | |
| 214 | R | A | 0.0000 | |
| 215 | T | A | -0.5536 | |
| 216 | I | A | 0.0000 | |
| 217 | F | A | 0.3401 | |
| 218 | F | A | 0.0000 | |
| 219 | K | A | -2.0885 | |
| 220 | D | A | -2.7708 | |
| 221 | D | A | -2.4156 | |
| 222 | G | A | 0.0000 | |
| 223 | N | A | -0.8750 | |
| 224 | Y | A | 0.0000 | |
| 225 | K | A | -2.3881 | |
| 226 | T | A | 0.0000 | |
| 227 | R | A | -2.7397 | |
| 228 | A | A | 0.0000 | |
| 229 | E | A | -1.4953 | |
| 230 | V | A | 0.0000 | |
| 231 | K | A | -1.2250 | |
| 232 | F | A | -1.3678 | |
| 233 | E | A | -1.7164 | |
| 234 | G | A | -1.7126 | |
| 235 | D | A | -2.1267 | |
| 236 | T | A | -1.3878 | |
| 237 | L | A | 0.0000 | |
| 238 | V | A | 0.0000 | |
| 239 | N | A | 0.0000 | |
| 240 | R | A | -2.1846 | |
| 241 | I | A | 0.0000 | |
| 242 | E | A | -3.8385 | |
| 243 | L | A | 0.0000 | |
| 244 | K | A | -2.9905 | |
| 245 | G | A | 0.0000 | |
| 246 | I | A | -1.1825 | |
| 247 | D | A | -2.2428 | |
| 248 | F | A | 0.0000 | |
| 249 | K | A | -3.9040 | |
| 250 | E | A | -3.9385 | |
| 251 | D | A | -3.5312 | |
| 252 | G | A | -2.8405 | |
| 253 | N | A | -2.0848 | |
| 254 | I | A | 0.0000 | |
| 255 | L | A | -1.9997 | |
| 256 | G | A | -2.2674 | |
| 257 | H | A | -1.9775 | |
| 258 | K | A | -2.4055 | |
| 259 | L | A | 0.0000 | |
| 260 | E | A | -1.6410 | |
| 261 | Y | A | -0.5664 | |
| 262 | N | A | -0.5996 | |
| 263 | Y | A | -0.7302 | |
| 264 | N | A | -0.9907 | |
| 265 | S | A | -0.9943 | |
| 266 | H | A | 0.0000 | |
| 267 | N | A | -1.3983 | |
| 268 | V | A | 0.0000 | |
| 269 | Y | A | -0.0006 | |
| 270 | I | A | 0.0000 | |
| 271 | M | A | -0.8046 | |
| 272 | A | A | -1.5577 | |
| 273 | D | A | 0.0000 | |
| 274 | K | A | -3.0208 | |
| 275 | Q | A | -2.9721 | |
| 276 | K | A | -3.0917 | |
| 277 | N | A | -2.6858 | |
| 278 | G | A | 0.0000 | |
| 279 | I | A | 0.0000 | |
| 280 | K | A | -1.0776 | |
| 281 | V | A | 0.0000 | |
| 282 | N | A | -0.5316 | |
| 283 | F | A | 0.0000 | |
| 284 | K | A | -1.3048 | |
| 285 | I | A | 0.0000 | |
| 286 | R | A | -1.1244 | |
| 287 | H | A | 0.0000 | |
| 288 | N | A | -1.2615 | |
| 289 | I | A | 0.0000 | |
| 290 | E | A | -3.2206 | |
| 291 | D | A | -2.9804 | |
| 292 | G | A | -1.8200 | |
| 293 | S | A | -0.7909 | |
| 294 | V | A | 0.0515 | |
| 295 | Q | A | 0.0000 | |
| 296 | L | A | -0.6247 | |
| 297 | A | A | 0.0000 | |
| 298 | D | A | -0.4117 | |
| 299 | H | A | 0.0000 | |
| 300 | Y | A | 0.2948 | |
| 301 | Q | A | 0.0000 | |
| 302 | Q | A | -0.9819 | |
| 303 | N | A | 0.0000 | |
| 304 | T | A | -0.6441 | |
| 305 | P | A | -0.7052 | |
| 306 | I | A | -0.0171 | |
| 307 | G | A | -1.1759 | |
| 308 | D | A | -2.1441 | |
| 309 | G | A | -1.4130 | |
| 310 | P | A | -1.1566 | |
| 311 | V | A | -0.5931 | |
| 312 | L | A | 0.0000 | |
| 313 | L | A | -0.5985 | |
| 314 | P | A | 0.0000 | |
| 315 | D | A | -2.1581 | |
| 316 | N | A | -1.5348 | |
| 317 | H | A | 0.0000 | |
| 318 | Y | A | -0.0942 | |
| 319 | L | A | 0.0000 | |
| 320 | S | A | -0.6242 | |
| 321 | T | A | 0.0000 | |
| 322 | Q | A | -1.0754 | |
| 323 | S | A | -0.3001 | |
| 324 | A | A | 0.1227 | |
| 325 | L | A | -0.0208 | |
| 326 | S | A | -0.6719 | |
| 327 | K | A | -1.9106 | |
| 328 | D | A | -2.0534 | |
| 329 | P | A | -1.7530 | |
| 330 | N | A | -2.4389 | |
| 331 | E | A | -2.6705 | |
| 332 | K | A | -3.2926 | |
| 333 | R | A | -3.3892 | |
| 334 | D | A | -2.2861 | |
| 335 | H | A | 0.0000 | |
| 336 | M | A | 0.0000 | |
| 337 | V | A | -0.4990 | |
| 338 | L | A | 0.0000 | |
| 339 | L | A | 0.5503 | |
| 340 | E | A | 0.0000 | |
| 341 | F | A | 0.5681 | |
| 342 | V | A | 0.0000 | |
| 343 | T | A | -0.2787 | |
| 344 | A | A | 0.0000 | |
| 345 | A | A | -0.2776 | |
| 346 | G | A | -0.2881 | |
| 347 | I | A | -0.1512 | |
| 348 | T | A | 0.4488 | |
| 349 | L | A | 1.0818 | |
| 350 | G | A | -0.2559 | |
| 351 | M | A | -0.2455 | |
| 352 | D | A | -1.8415 | |
| 353 | E | A | -2.0136 | |
| 354 | L | A | 0.3448 | |
| 355 | Y | A | 0.2841 | |
| 356 | K | A | -1.4596 |
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