| Chain sequence(s) |
A: TTEECDMKKMHYVDPDRVKRAQKYAQQVLQKECRPKFAKTSMALLFEHRYSVDLLPFVQKAPKDSEAESKYDPPFGFRKFSSKVQTLLELLPEHDLPEHLKAKTCRRCVVIGSGGILHGLELGHTLNQFDVVIRLNSAPVEGYSEHVGNKTTIRMTYPEGAPLSDLEYYSNDLFVAVLFKSVDFNWLQAMVKKETLPFWVRLFFWKQVAEKIPLQPKHFRILNPVIIKETAFDILQYSEPQSRFWGRDKNVPTIGVIAVVLATHLCDEVSLAGFGYDLNQPRTPLHYFDSQCMAAMNFQTMHNVTTETKFLLKLVKEGVVKDLSGGIDREF
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] (00:00:02)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:02)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:02)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:02)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:02)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:10:41)
[INFO] Main: Simulation completed successfully. (00:10:45)
|
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 | T | A | -0.8816 | |
| 2 | T | A | -1.6226 | |
| 3 | E | A | -3.2541 | |
| 4 | E | A | -3.3333 | |
| 5 | C | A | 0.0000 | |
| 6 | D | A | -2.7112 | |
| 7 | M | A | -1.8333 | |
| 8 | K | A | -2.4848 | |
| 9 | K | A | -2.5685 | |
| 10 | M | A | -1.1162 | |
| 11 | H | A | -1.4367 | |
| 12 | Y | A | -0.1255 | |
| 13 | V | A | -0.4005 | |
| 14 | D | A | -1.9573 | |
| 15 | P | A | -1.7939 | |
| 16 | D | A | -2.4957 | |
| 17 | R | A | -2.1760 | |
| 18 | V | A | -2.1761 | |
| 19 | K | A | -3.0928 | |
| 20 | R | A | -2.5288 | |
| 21 | A | A | 0.0000 | |
| 22 | Q | A | -2.4887 | |
| 23 | K | A | -2.8451 | |
| 24 | Y | A | -1.9588 | |
| 25 | A | A | 0.0000 | |
| 26 | Q | A | -2.6092 | |
| 27 | Q | A | -2.4185 | |
| 28 | V | A | -1.7882 | |
| 29 | L | A | -1.8139 | |
| 30 | Q | A | -2.5931 | |
| 31 | K | A | -2.9850 | |
| 32 | E | A | -2.8552 | |
| 33 | C | A | -2.0113 | |
| 34 | R | A | -2.0768 | |
| 35 | P | A | -1.7590 | |
| 36 | K | A | -2.0398 | |
| 37 | F | A | -0.9925 | |
| 38 | A | A | 0.0000 | |
| 39 | K | A | -0.6414 | |
| 40 | T | A | -0.1979 | |
| 41 | S | A | -0.1592 | |
| 42 | M | A | 0.0000 | |
| 43 | A | A | -0.0397 | |
| 44 | L | A | 0.8344 | |
| 45 | L | A | -0.0469 | |
| 46 | F | A | 0.0000 | |
| 47 | E | A | -1.8783 | |
| 48 | H | A | -1.9835 | |
| 49 | R | A | -1.8664 | |
| 50 | Y | A | 0.0000 | |
| 51 | S | A | -0.8328 | |
| 52 | V | A | -0.3907 | |
| 53 | D | A | -1.1292 | |
| 54 | L | A | 0.0064 | |
| 55 | L | A | 0.3657 | |
| 56 | P | A | -0.0531 | |
| 57 | F | A | 0.0000 | |
| 58 | V | A | 0.0000 | |
| 59 | Q | A | -2.1632 | |
| 60 | K | A | -2.6036 | |
| 61 | A | A | -1.9766 | |
| 62 | P | A | 0.0000 | |
| 63 | K | A | -3.5189 | |
| 64 | D | A | -3.6283 | |
| 65 | S | A | -2.1436 | |
| 66 | E | A | -2.1816 | |
| 67 | A | A | -1.5221 | |
| 68 | E | A | -1.8227 | |
| 69 | S | A | -2.9960 | |
| 70 | K | A | -2.9549 | |
| 71 | Y | A | -1.8206 | |
| 72 | D | A | -1.7399 | |
| 73 | P | A | -0.9628 | |
| 74 | P | A | 0.0000 | |
| 75 | F | A | 0.0000 | |
| 76 | G | A | 0.0000 | |
| 77 | F | A | 0.0000 | |
| 78 | R | A | -3.1938 | |
| 79 | K | A | -2.9907 | |
| 80 | F | A | -1.4968 | |
| 81 | S | A | -2.0004 | |
| 82 | S | A | -0.9980 | |
| 83 | K | A | -1.2179 | |
| 84 | V | A | 0.0000 | |
| 85 | Q | A | -1.7985 | |
| 86 | T | A | -1.2142 | |
| 87 | L | A | 0.0000 | |
| 88 | L | A | 0.0000 | |
| 89 | E | A | -2.1632 | |
| 90 | L | A | -1.2708 | |
| 91 | L | A | 0.0000 | |
| 92 | P | A | -1.5313 | |
| 93 | E | A | -2.0818 | |
| 94 | H | A | -1.9368 | |
| 95 | D | A | -2.0090 | |
| 96 | L | A | 0.0000 | |
| 97 | P | A | -2.2232 | |
| 98 | E | A | -3.0510 | |
| 99 | H | A | -2.4382 | |
| 100 | L | A | 0.0000 | |
| 101 | K | A | -2.7448 | |
| 102 | A | A | -1.8247 | |
| 103 | K | A | -1.7141 | |
| 104 | T | A | -0.9523 | |
| 105 | C | A | -1.3268 | |
| 106 | R | A | -1.2805 | |
| 107 | R | A | -0.9385 | |
| 108 | C | A | 0.0000 | |
| 109 | V | A | 0.0000 | |
| 110 | V | A | 0.0000 | |
| 111 | I | A | 0.0000 | |
| 112 | G | A | 0.0000 | |
| 113 | S | A | -0.1028 | |
| 114 | G | A | 0.0643 | |
| 115 | G | A | 0.0000 | |
| 116 | I | A | 0.4896 | |
| 117 | L | A | 0.0000 | |
| 118 | H | A | -0.5233 | |
| 119 | G | A | -0.7624 | |
| 120 | L | A | 0.0000 | |
| 121 | E | A | -2.3947 | |
| 122 | L | A | 0.0000 | |
| 123 | G | A | 0.0000 | |
| 124 | H | A | -2.3727 | |
| 125 | T | A | 0.0000 | |
| 126 | L | A | 0.0000 | |
| 127 | N | A | -1.7560 | |
| 128 | Q | A | -1.8295 | |
| 129 | F | A | 0.0000 | |
| 130 | D | A | -0.9869 | |
| 131 | V | A | 0.0000 | |
| 132 | V | A | 0.0000 | |
| 133 | I | A | 0.0000 | |
| 134 | R | A | 0.0000 | |
| 135 | L | A | 0.0000 | |
| 136 | N | A | -0.2765 | |
| 137 | S | A | 0.0486 | |
| 138 | A | A | 0.0000 | |
| 139 | P | A | -0.6003 | |
| 140 | V | A | 0.0000 | |
| 141 | E | A | -2.0699 | |
| 142 | G | A | -1.6185 | |
| 143 | Y | A | -1.4573 | |
| 144 | S | A | -2.3469 | |
| 145 | E | A | -2.8677 | |
| 146 | H | A | 0.0000 | |
| 147 | V | A | 0.0000 | |
| 148 | G | A | 0.0000 | |
| 149 | N | A | -2.4137 | |
| 150 | K | A | -1.6637 | |
| 151 | T | A | 0.0000 | |
| 152 | T | A | -0.4230 | |
| 153 | I | A | 0.0000 | |
| 154 | R | A | 0.0000 | |
| 155 | M | A | 0.0000 | |
| 156 | T | A | 0.0000 | |
| 157 | Y | A | 0.2189 | |
| 158 | P | A | 0.0000 | |
| 159 | E | A | 0.0000 | |
| 160 | G | A | 0.0000 | |
| 161 | A | A | 0.0000 | |
| 162 | P | A | 0.0000 | |
| 163 | L | A | 0.5687 | |
| 164 | S | A | -0.1193 | |
| 165 | D | A | -0.9216 | |
| 166 | L | A | 0.5937 | |
| 167 | E | A | 0.0000 | |
| 168 | Y | A | 0.0000 | |
| 169 | Y | A | -0.1094 | |
| 170 | S | A | -0.6895 | |
| 171 | N | A | -1.3897 | |
| 172 | D | A | 0.0000 | |
| 173 | L | A | 0.0000 | |
| 174 | F | A | 0.0000 | |
| 175 | V | A | 0.0000 | |
| 176 | A | A | 0.0000 | |
| 177 | V | A | 0.0000 | |
| 178 | L | A | 0.0000 | |
| 179 | F | A | 0.0706 | |
| 180 | K | A | -0.2378 | |
| 181 | S | A | -0.3786 | |
| 182 | V | A | 0.2594 | |
| 183 | D | A | 0.0000 | |
| 184 | F | A | 0.0000 | |
| 185 | N | A | -0.7734 | |
| 186 | W | A | 0.0000 | |
| 187 | L | A | 0.0000 | |
| 188 | Q | A | -1.4146 | |
| 189 | A | A | 0.0000 | |
| 190 | M | A | 0.0000 | |
| 191 | V | A | 0.0000 | |
| 192 | K | A | -2.8468 | |
| 193 | K | A | -3.4691 | |
| 194 | E | A | -3.4548 | |
| 195 | T | A | -1.8447 | |
| 196 | L | A | 0.0000 | |
| 197 | P | A | 0.7416 | |
| 198 | F | A | 2.6443 | |
| 199 | W | A | 2.6619 | |
| 200 | V | A | 1.8335 | |
| 201 | R | A | 1.1254 | |
| 202 | L | A | 2.8078 | |
| 203 | F | A | 2.9917 | |
| 204 | F | A | 0.0000 | |
| 205 | W | A | 1.1644 | |
| 206 | K | A | -0.5111 | |
| 207 | Q | A | -1.2848 | |
| 208 | V | A | -0.9525 | |
| 209 | A | A | 0.0000 | |
| 210 | E | A | -2.9916 | |
| 211 | K | A | -3.3102 | |
| 212 | I | A | 0.0000 | |
| 213 | P | A | -1.0539 | |
| 214 | L | A | 0.0000 | |
| 215 | Q | A | -1.5751 | |
| 216 | P | A | -1.3661 | |
| 217 | K | A | -1.7678 | |
| 218 | H | A | -1.4044 | |
| 219 | F | A | 0.0000 | |
| 220 | R | A | 0.0000 | |
| 221 | I | A | 0.0000 | |
| 222 | L | A | 0.0000 | |
| 223 | N | A | 0.0000 | |
| 224 | P | A | 0.0000 | |
| 225 | V | A | -0.0604 | |
| 226 | I | A | 0.0000 | |
| 227 | I | A | 0.0000 | |
| 228 | K | A | -0.4543 | |
| 229 | E | A | 0.0000 | |
| 230 | T | A | 0.0000 | |
| 231 | A | A | 0.0000 | |
| 232 | F | A | 0.0000 | |
| 233 | D | A | -1.2890 | |
| 234 | I | A | 0.0000 | |
| 235 | L | A | 0.0000 | |
| 236 | Q | A | -1.6007 | |
| 237 | Y | A | 0.0000 | |
| 238 | S | A | -1.6881 | |
| 239 | E | A | -1.8995 | |
| 240 | P | A | -2.2663 | |
| 241 | Q | A | -2.4045 | |
| 242 | S | A | -1.4787 | |
| 243 | R | A | -1.5378 | |
| 244 | F | A | 1.1322 | |
| 245 | W | A | 0.7645 | |
| 246 | G | A | -1.2420 | |
| 247 | R | A | -2.9047 | |
| 248 | D | A | -3.3523 | |
| 249 | K | A | -2.4536 | |
| 250 | N | A | 0.0000 | |
| 251 | V | A | -0.7156 | |
| 252 | P | A | 0.0000 | |
| 253 | T | A | 0.1365 | |
| 254 | I | A | 0.1849 | |
| 255 | G | A | 0.0051 | |
| 256 | V | A | 0.0000 | |
| 257 | I | A | 0.0000 | |
| 258 | A | A | 0.0000 | |
| 259 | V | A | 0.0000 | |
| 260 | V | A | 0.0000 | |
| 261 | L | A | 0.0000 | |
| 262 | A | A | 0.0000 | |
| 263 | T | A | 0.0000 | |
| 264 | H | A | 0.0000 | |
| 265 | L | A | 0.0000 | |
| 266 | C | A | 0.0000 | |
| 267 | D | A | 0.0000 | |
| 268 | E | A | -1.0861 | |
| 269 | V | A | 0.0000 | |
| 270 | S | A | 0.0000 | |
| 271 | L | A | 0.0000 | |
| 272 | A | A | 0.0000 | |
| 273 | G | A | 0.0000 | |
| 274 | F | A | 0.0000 | |
| 275 | G | A | 0.1198 | |
| 276 | Y | A | 0.0596 | |
| 277 | D | A | -1.2072 | |
| 278 | L | A | -1.0328 | |
| 279 | N | A | -1.9417 | |
| 280 | Q | A | -2.2310 | |
| 281 | P | A | -1.8435 | |
| 282 | R | A | -3.3743 | |
| 283 | T | A | -2.2516 | |
| 284 | P | A | 0.0000 | |
| 285 | L | A | 0.0000 | |
| 286 | H | A | -0.3384 | |
| 287 | Y | A | 0.0000 | |
| 288 | F | A | -0.1756 | |
| 289 | D | A | -0.4815 | |
| 290 | S | A | -1.5116 | |
| 291 | Q | A | -2.0341 | |
| 292 | C | A | 0.0000 | |
| 293 | M | A | 0.0000 | |
| 294 | A | A | -1.1013 | |
| 295 | A | A | -0.1665 | |
| 296 | M | A | 0.0290 | |
| 297 | N | A | -0.2583 | |
| 298 | F | A | 1.2710 | |
| 299 | Q | A | 0.2156 | |
| 300 | T | A | -0.4337 | |
| 301 | M | A | -0.4539 | |
| 302 | H | A | -0.6995 | |
| 303 | N | A | -0.8563 | |
| 304 | V | A | -0.5352 | |
| 305 | T | A | -0.5204 | |
| 306 | T | A | -0.8564 | |
| 307 | E | A | 0.0000 | |
| 308 | T | A | -0.7783 | |
| 309 | K | A | -1.7594 | |
| 310 | F | A | 0.0000 | |
| 311 | L | A | 0.0000 | |
| 312 | L | A | -1.4215 | |
| 313 | K | A | -2.1322 | |
| 314 | L | A | 0.0000 | |
| 315 | V | A | -1.9239 | |
| 316 | K | A | -3.0212 | |
| 317 | E | A | -2.7824 | |
| 318 | G | A | -1.6280 | |
| 319 | V | A | 0.0000 | |
| 320 | V | A | 0.0000 | |
| 321 | K | A | -0.9404 | |
| 322 | D | A | 0.0000 | |
| 323 | L | A | 0.0000 | |
| 324 | S | A | 0.0000 | |
| 325 | G | A | 0.0000 | |
| 326 | G | A | -0.7600 | |
| 327 | I | A | -1.2462 | |
| 328 | D | A | -2.2321 | |
| 329 | R | A | -2.8932 | |
| 330 | E | A | -2.9662 | |
| 331 | F | A | -1.8642 |
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