| Chain sequence(s) |
A: MFTVNYILDLFHTINATEVQHTLMLALMHKRPASLHEVLRLAGLLQGYKDFLSLTKQAEAFFQAGDYRSAFNTISKMWVHPQIVPALLLMECFETRELTVPYWYKSIKLRRQYIQKKNGGVRPIIVAHKGLRICMAVINRLLQSCCVSWSNQTFGFRPGFGTHHAVLHLAQKAQQMLNKQQQAVLVTFDLQAAYNSVDIKHLMQTLQLQYLPNDMKKLIWMWQHLPLAQLNAGINGLAQGYAYSPTLFAWYVDQLVGQHMDFTIYADNFAGVFLTQQDAQFAVKEAQTLLQKSGLLIAPSSIKMHLLDKNQHSELNWLGHKVLFPSCTVKLQHHQLLVNQHSPQVWTIQKWDKMLRTLGWVQLALNADWRRF
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 (00:13:01)
[INFO] Main: Simulation completed successfully. (00:13:05)
|
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 | 2.2088 | |
| 2 | F | A | 2.8504 | |
| 3 | T | A | 2.1360 | |
| 4 | V | A | 2.6820 | |
| 5 | N | A | 1.1774 | |
| 6 | Y | A | 2.4445 | |
| 7 | I | A | 3.3694 | |
| 8 | L | A | 2.3866 | |
| 9 | D | A | 0.5512 | |
| 10 | L | A | 2.1704 | |
| 11 | F | A | 2.5542 | |
| 12 | H | A | 0.3467 | |
| 13 | T | A | 0.5233 | |
| 14 | I | A | 1.3565 | |
| 15 | N | A | -0.7616 | |
| 16 | A | A | -0.4423 | |
| 17 | T | A | -0.6102 | |
| 18 | E | A | -1.3464 | |
| 19 | V | A | 0.4539 | |
| 20 | Q | A | -0.4100 | |
| 21 | H | A | -0.7947 | |
| 22 | T | A | 0.2543 | |
| 23 | L | A | 1.0980 | |
| 24 | M | A | 0.7871 | |
| 25 | L | A | 0.6232 | |
| 26 | A | A | 0.0337 | |
| 27 | L | A | 0.0636 | |
| 28 | M | A | -0.3372 | |
| 29 | H | A | -1.6557 | |
| 30 | K | A | -2.5978 | |
| 31 | R | A | -2.5942 | |
| 32 | P | A | -1.5891 | |
| 33 | A | A | 0.0000 | |
| 34 | S | A | -0.5937 | |
| 35 | L | A | -0.4089 | |
| 36 | H | A | -1.3627 | |
| 37 | E | A | -1.2605 | |
| 38 | V | A | 0.0000 | |
| 39 | L | A | 0.0000 | |
| 40 | R | A | -2.1203 | |
| 41 | L | A | -0.5260 | |
| 42 | A | A | -0.9294 | |
| 43 | G | A | -1.0977 | |
| 44 | L | A | 0.0000 | |
| 45 | L | A | -1.6237 | |
| 46 | Q | A | -1.9297 | |
| 47 | G | A | 0.0000 | |
| 48 | Y | A | -1.0381 | |
| 49 | K | A | -1.5429 | |
| 50 | D | A | -1.2354 | |
| 51 | F | A | 0.0000 | |
| 52 | L | A | -0.4996 | |
| 53 | S | A | -0.8968 | |
| 54 | L | A | -0.9060 | |
| 55 | T | A | -1.0562 | |
| 56 | K | A | -1.8354 | |
| 57 | Q | A | -1.3286 | |
| 58 | A | A | 0.0000 | |
| 59 | E | A | -1.3998 | |
| 60 | A | A | -1.0537 | |
| 61 | F | A | -1.1001 | |
| 62 | F | A | 0.0000 | |
| 63 | Q | A | -1.2950 | |
| 64 | A | A | -0.7949 | |
| 65 | G | A | -1.2899 | |
| 66 | D | A | -1.6465 | |
| 67 | Y | A | -1.4659 | |
| 68 | R | A | -2.4418 | |
| 69 | S | A | -1.5835 | |
| 70 | A | A | 0.0000 | |
| 71 | F | A | 0.0000 | |
| 72 | N | A | -1.9690 | |
| 73 | T | A | 0.0000 | |
| 74 | I | A | 0.0000 | |
| 75 | S | A | -0.7986 | |
| 76 | K | A | -0.9480 | |
| 77 | M | A | 0.0000 | |
| 78 | W | A | 0.0000 | |
| 79 | V | A | 0.8821 | |
| 80 | H | A | 0.0531 | |
| 81 | P | A | -0.1326 | |
| 82 | Q | A | -0.4354 | |
| 83 | I | A | 0.0000 | |
| 84 | V | A | 0.0000 | |
| 85 | P | A | 0.0000 | |
| 86 | A | A | 0.0000 | |
| 87 | L | A | 0.0000 | |
| 88 | L | A | 0.0000 | |
| 89 | L | A | 0.0000 | |
| 90 | M | A | -0.3850 | |
| 91 | E | A | -1.1640 | |
| 92 | C | A | 0.0000 | |
| 93 | F | A | -1.1183 | |
| 94 | E | A | -2.0090 | |
| 95 | T | A | -1.8325 | |
| 96 | R | A | -2.1979 | |
| 97 | E | A | -2.5459 | |
| 98 | L | A | 0.0000 | |
| 99 | T | A | -0.5996 | |
| 100 | V | A | 0.3280 | |
| 101 | P | A | 0.0000 | |
| 102 | Y | A | 0.2686 | |
| 103 | W | A | 0.0000 | |
| 104 | Y | A | 0.7859 | |
| 105 | K | A | -0.7818 | |
| 106 | S | A | -0.5434 | |
| 107 | I | A | -0.8283 | |
| 108 | K | A | -2.4179 | |
| 109 | L | A | 0.0000 | |
| 110 | R | A | -2.6190 | |
| 111 | R | A | -1.6977 | |
| 112 | Q | A | -0.8281 | |
| 113 | Y | A | 0.3771 | |
| 114 | I | A | 0.1077 | |
| 115 | Q | A | -1.7136 | |
| 116 | K | A | -2.8684 | |
| 117 | K | A | -3.1320 | |
| 118 | N | A | -2.8300 | |
| 119 | G | A | -2.3631 | |
| 120 | G | A | -1.2500 | |
| 121 | V | A | -0.0358 | |
| 122 | R | A | -0.8201 | |
| 123 | P | A | -0.3551 | |
| 124 | I | A | -0.0627 | |
| 125 | I | A | 0.0000 | |
| 126 | V | A | -1.1325 | |
| 127 | A | A | 0.0000 | |
| 128 | H | A | -1.6855 | |
| 129 | K | A | -1.6686 | |
| 130 | G | A | 0.0000 | |
| 131 | L | A | 0.0000 | |
| 132 | R | A | -1.0203 | |
| 133 | I | A | 0.0000 | |
| 134 | C | A | 0.0000 | |
| 135 | M | A | 0.0000 | |
| 136 | A | A | 0.0000 | |
| 137 | V | A | 0.0000 | |
| 138 | I | A | 0.0000 | |
| 139 | N | A | 0.0000 | |
| 140 | R | A | -0.5754 | |
| 141 | L | A | 0.0000 | |
| 142 | L | A | 0.0000 | |
| 143 | Q | A | -0.2883 | |
| 144 | S | A | 0.0000 | |
| 145 | C | A | 0.0000 | |
| 146 | C | A | 0.0000 | |
| 147 | V | A | -0.2273 | |
| 148 | S | A | -0.6037 | |
| 149 | W | A | 0.0000 | |
| 150 | S | A | -1.2613 | |
| 151 | N | A | -1.6512 | |
| 152 | Q | A | -1.3953 | |
| 153 | T | A | 0.0000 | |
| 154 | F | A | 0.0000 | |
| 155 | G | A | 0.0000 | |
| 156 | F | A | 0.8305 | |
| 157 | R | A | 0.3375 | |
| 158 | P | A | -0.0860 | |
| 159 | G | A | -0.1446 | |
| 160 | F | A | 0.4973 | |
| 161 | G | A | 0.1103 | |
| 162 | T | A | 0.0436 | |
| 163 | H | A | -0.5883 | |
| 164 | H | A | -0.3714 | |
| 165 | A | A | 0.0000 | |
| 166 | V | A | 0.0000 | |
| 167 | L | A | -0.1849 | |
| 168 | H | A | -0.8217 | |
| 169 | L | A | 0.0000 | |
| 170 | A | A | 0.0000 | |
| 171 | Q | A | -1.7495 | |
| 172 | K | A | -2.0761 | |
| 173 | A | A | 0.0000 | |
| 174 | Q | A | -2.3662 | |
| 175 | Q | A | -2.8535 | |
| 176 | M | A | -2.4337 | |
| 177 | L | A | 0.0000 | |
| 178 | N | A | -3.4026 | |
| 179 | K | A | -3.3933 | |
| 180 | Q | A | -3.2413 | |
| 181 | Q | A | -3.1599 | |
| 182 | Q | A | -2.4384 | |
| 183 | A | A | 0.0000 | |
| 184 | V | A | 0.0000 | |
| 185 | L | A | 0.0000 | |
| 186 | V | A | 0.0000 | |
| 187 | T | A | 0.0000 | |
| 188 | F | A | 0.0000 | |
| 189 | D | A | -1.1781 | |
| 190 | L | A | 0.0000 | |
| 191 | Q | A | -1.1580 | |
| 192 | A | A | -0.9205 | |
| 193 | A | A | 0.0000 | |
| 194 | Y | A | 0.0000 | |
| 195 | N | A | -1.5453 | |
| 196 | S | A | -1.1009 | |
| 197 | V | A | 0.0000 | |
| 198 | D | A | -2.1504 | |
| 199 | I | A | -1.5516 | |
| 200 | K | A | -2.2645 | |
| 201 | H | A | -1.9532 | |
| 202 | L | A | 0.0000 | |
| 203 | M | A | -1.5116 | |
| 204 | Q | A | -1.8901 | |
| 205 | T | A | -1.0611 | |
| 206 | L | A | 0.0000 | |
| 207 | Q | A | -1.2089 | |
| 208 | L | A | 0.0000 | |
| 209 | Q | A | -1.6044 | |
| 210 | Y | A | -1.3318 | |
| 211 | L | A | 0.0000 | |
| 212 | P | A | -1.3349 | |
| 213 | N | A | -2.1917 | |
| 214 | D | A | 0.0000 | |
| 215 | M | A | 0.0000 | |
| 216 | K | A | -1.5413 | |
| 217 | K | A | -1.7065 | |
| 218 | L | A | 0.0000 | |
| 219 | I | A | 0.0000 | |
| 220 | W | A | -0.3354 | |
| 221 | M | A | -0.4751 | |
| 222 | W | A | 0.0000 | |
| 223 | Q | A | 0.0000 | |
| 224 | H | A | -1.1877 | |
| 225 | L | A | 0.0000 | |
| 226 | P | A | -1.6470 | |
| 227 | L | A | 0.0000 | |
| 228 | A | A | -1.7555 | |
| 229 | Q | A | -1.9246 | |
| 230 | L | A | -0.9438 | |
| 231 | N | A | -1.3388 | |
| 232 | A | A | -1.0249 | |
| 233 | G | A | -1.1295 | |
| 234 | I | A | -1.0551 | |
| 235 | N | A | -1.7949 | |
| 236 | G | A | -1.5164 | |
| 237 | L | A | 0.0000 | |
| 238 | A | A | 0.0000 | |
| 239 | Q | A | -0.5919 | |
| 240 | G | A | -0.2158 | |
| 241 | Y | A | 0.0000 | |
| 242 | A | A | -0.2399 | |
| 243 | Y | A | 0.0000 | |
| 244 | S | A | 0.0000 | |
| 245 | P | A | 0.0472 | |
| 246 | T | A | 0.0000 | |
| 247 | L | A | 0.0000 | |
| 248 | F | A | 0.0000 | |
| 249 | A | A | 0.0000 | |
| 250 | W | A | 0.0000 | |
| 251 | Y | A | 0.0000 | |
| 252 | V | A | 0.0000 | |
| 253 | D | A | 0.0000 | |
| 254 | Q | A | -0.6760 | |
| 255 | L | A | 0.0000 | |
| 256 | V | A | 0.0000 | |
| 257 | G | A | 0.0000 | |
| 258 | Q | A | -2.0447 | |
| 259 | H | A | -1.9118 | |
| 260 | M | A | -1.7068 | |
| 261 | D | A | -2.3363 | |
| 262 | F | A | 0.0000 | |
| 263 | T | A | 0.0000 | |
| 264 | I | A | 0.0000 | |
| 265 | Y | A | 0.1582 | |
| 266 | A | A | 0.0000 | |
| 267 | D | A | -0.8315 | |
| 268 | N | A | -0.5541 | |
| 269 | F | A | 0.0000 | |
| 270 | A | A | 0.0000 | |
| 271 | G | A | 0.0000 | |
| 272 | V | A | 0.0000 | |
| 273 | F | A | -0.5535 | |
| 274 | L | A | -0.6296 | |
| 275 | T | A | -0.8612 | |
| 276 | Q | A | -1.4952 | |
| 277 | Q | A | -1.6536 | |
| 278 | D | A | -1.1074 | |
| 279 | A | A | 0.0000 | |
| 280 | Q | A | -1.0990 | |
| 281 | F | A | -0.0761 | |
| 282 | A | A | 0.0000 | |
| 283 | V | A | 0.0000 | |
| 284 | K | A | -1.8143 | |
| 285 | E | A | -1.5153 | |
| 286 | A | A | 0.0000 | |
| 287 | Q | A | -1.3417 | |
| 288 | T | A | -1.4682 | |
| 289 | L | A | -1.1140 | |
| 290 | L | A | 0.0000 | |
| 291 | Q | A | -1.9028 | |
| 292 | K | A | -2.3820 | |
| 293 | S | A | 0.0000 | |
| 294 | G | A | -1.4414 | |
| 295 | L | A | 0.0000 | |
| 296 | L | A | -0.5134 | |
| 297 | I | A | 0.0000 | |
| 298 | A | A | -0.4702 | |
| 299 | P | A | -0.5710 | |
| 300 | S | A | -0.6658 | |
| 301 | S | A | -0.6923 | |
| 302 | I | A | -0.5584 | |
| 303 | K | A | -1.4338 | |
| 304 | M | A | -0.4980 | |
| 305 | H | A | -0.5008 | |
| 306 | L | A | 0.0265 | |
| 307 | L | A | 0.0000 | |
| 308 | D | A | -2.2753 | |
| 309 | K | A | -3.0370 | |
| 310 | N | A | -2.8457 | |
| 311 | Q | A | -2.6893 | |
| 312 | H | A | -2.3214 | |
| 313 | S | A | -1.6422 | |
| 314 | E | A | -2.0099 | |
| 315 | L | A | -1.3191 | |
| 316 | N | A | -1.9593 | |
| 317 | W | A | 0.0000 | |
| 318 | L | A | -0.4456 | |
| 319 | G | A | -1.4603 | |
| 320 | H | A | 0.0000 | |
| 321 | K | A | -2.0236 | |
| 322 | V | A | 0.0000 | |
| 323 | L | A | -1.1508 | |
| 324 | F | A | 0.0000 | |
| 325 | P | A | -1.6479 | |
| 326 | S | A | -0.5092 | |
| 327 | C | A | 0.0000 | |
| 328 | T | A | -0.6230 | |
| 329 | V | A | -0.9153 | |
| 330 | K | A | -2.0972 | |
| 331 | L | A | -1.4011 | |
| 332 | Q | A | -2.5130 | |
| 333 | H | A | -2.3006 | |
| 334 | H | A | -1.7452 | |
| 335 | Q | A | -0.6398 | |
| 336 | L | A | 1.7218 | |
| 337 | L | A | 2.3006 | |
| 338 | V | A | 1.9579 | |
| 339 | N | A | -0.0989 | |
| 340 | Q | A | -1.4034 | |
| 341 | H | A | -1.7967 | |
| 342 | S | A | -0.9413 | |
| 343 | P | A | -1.4615 | |
| 344 | Q | A | -1.2540 | |
| 345 | V | A | -0.4710 | |
| 346 | W | A | 0.0000 | |
| 347 | T | A | -1.7098 | |
| 348 | I | A | -1.0189 | |
| 349 | Q | A | -2.0157 | |
| 350 | K | A | -1.9926 | |
| 351 | W | A | 0.0000 | |
| 352 | D | A | -1.9668 | |
| 353 | K | A | -2.8139 | |
| 354 | M | A | -1.6484 | |
| 355 | L | A | 0.0000 | |
| 356 | R | A | -2.5223 | |
| 357 | T | A | -1.1463 | |
| 358 | L | A | -0.1618 | |
| 359 | G | A | -0.7614 | |
| 360 | W | A | 0.0000 | |
| 361 | V | A | -0.2475 | |
| 362 | Q | A | -0.9810 | |
| 363 | L | A | -0.0754 | |
| 364 | A | A | 0.0000 | |
| 365 | L | A | -0.3749 | |
| 366 | N | A | -1.4663 | |
| 367 | A | A | -1.4002 | |
| 368 | D | A | -2.6613 | |
| 369 | W | A | 0.0000 | |
| 370 | R | A | -2.4758 | |
| 371 | R | A | -3.0691 | |
| 372 | F | A | -1.7355 |
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