| Chain sequence(s) |
C: LADKIGTEIGPKVSLIDTSSTITIPANIGLLGSKISQSTASINENVNEKCKFTLPPLKIHECNISCPGVSNLVGLPNNICLQKTSNQILKPKLISYTLPVVGQSGTCITDPLLAMDEGYFAYSHLERIGSCSRGVSKQRIIGVGEVLDRGDEVPSLFMTNVWTPPNPNTVYHCSAVYNNEFYYVLCAVSTVGDPILNSTYWSGSLMMTRLAVKPKSNGGGYNQHQLALRSIEKGRYDKVMPYGPSGIKQGDTLYFPAVGFLVRTEFKYNDSNCPITKCQYSKPENCRLSMGIRPNSHYILRSGLLKYNLSPKVVFIEISDQRLSIGSPSKIYDSLGQPVFYQASFSWDTMIKFGDVLTVNPLVVNWRNNTVISRPGQQCPRFNTCPEICWEGVYNDAFLIDRINWISAGVFLDSNQTAENPVFTVFKDNEILYRAQLASEDTNAQKTITNCFLLKNKIWCISLVEIYDTGDNVIRPKLFAVKIPEQCY
input PDB |
| Selected Chain(s) | C |
| Distance of aggregation | 10 Å |
| FoldX usage | Yes |
| Dynamic mode | No |
| Automated mutations | Yes |
| Downloads | Download all the data |
| Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:09)
[WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow
to prevent this behavior) (00:00:09)
[INFO] runJob: Starting aggrescan3d job on: input.pdb with C chain(s) selected (00:00:09)
[INFO] runJob: Creating pdb object from: input.pdb (00:00:09)
[INFO] FoldX: Starting FoldX energy minimalization (00:00:09)
[INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:04:10)
[INFO] Auto_mut: Residue number 118 from chain C and a score of 2.086 (isoleucine) selected
for automated muatation (00:04:13)
[INFO] Auto_mut: Residue number 150 from chain C and a score of 2.072 (leucine) selected for
automated muatation (00:04:13)
[INFO] Auto_mut: Residue number 124 from chain C and a score of 1.907 (isoleucine) selected
for automated muatation (00:04:13)
[INFO] Auto_mut: Residue number 112 from chain C and a score of 1.860 (isoleucine) selected
for automated muatation (00:04:13)
[INFO] Auto_mut: Residue number 120 from chain C and a score of 1.712 (isoleucine) selected
for automated muatation (00:04:13)
[INFO] Auto_mut: Residue number 205 from chain C and a score of 1.623 (tyrosine) selected
for automated muatation (00:04:13)
[INFO] Auto_mut: Mutating residue number 118 from chain C (isoleucine) into glutamic acid (00:04:13)
[INFO] Auto_mut: Mutating residue number 118 from chain C (isoleucine) into aspartic acid (00:04:13)
[INFO] Auto_mut: Mutating residue number 150 from chain C (leucine) into glutamic acid (00:04:13)
[INFO] Auto_mut: Mutating residue number 118 from chain C (isoleucine) into lysine (00:06:28)
[INFO] Auto_mut: Mutating residue number 118 from chain C (isoleucine) into arginine (00:06:29)
[INFO] Auto_mut: Mutating residue number 150 from chain C (leucine) into lysine (00:06:33)
[INFO] Auto_mut: Mutating residue number 150 from chain C (leucine) into aspartic acid (00:08:57)
[INFO] Auto_mut: Mutating residue number 124 from chain C (isoleucine) into glutamic acid (00:09:08)
[INFO] Auto_mut: Mutating residue number 124 from chain C (isoleucine) into aspartic acid (00:09:15)
[INFO] Auto_mut: Mutating residue number 150 from chain C (leucine) into arginine (00:11:14)
[INFO] Auto_mut: Mutating residue number 124 from chain C (isoleucine) into lysine (00:11:31)
[INFO] Auto_mut: Mutating residue number 124 from chain C (isoleucine) into arginine (00:11:35)
[INFO] Auto_mut: Mutating residue number 112 from chain C (isoleucine) into glutamic acid (00:13:36)
[INFO] Auto_mut: Mutating residue number 112 from chain C (isoleucine) into aspartic acid (00:14:10)
[INFO] Auto_mut: Mutating residue number 120 from chain C (isoleucine) into glutamic acid (00:14:16)
[INFO] Auto_mut: Mutating residue number 112 from chain C (isoleucine) into lysine (00:15:55)
[INFO] Auto_mut: Mutating residue number 112 from chain C (isoleucine) into arginine (00:16:36)
[INFO] Auto_mut: Mutating residue number 120 from chain C (isoleucine) into lysine (00:16:43)
[INFO] Auto_mut: Mutating residue number 120 from chain C (isoleucine) into aspartic acid (00:18:29)
[INFO] Auto_mut: Mutating residue number 205 from chain C (tyrosine) into glutamic acid (00:19:06)
[INFO] Auto_mut: Mutating residue number 205 from chain C (tyrosine) into aspartic acid (00:19:33)
[INFO] Auto_mut: Mutating residue number 120 from chain C (isoleucine) into arginine (00:20:49)
[INFO] Auto_mut: Mutating residue number 205 from chain C (tyrosine) into lysine (00:21:34)
[INFO] Auto_mut: Mutating residue number 205 from chain C (tyrosine) into arginine (00:21:55)
[INFO] Auto_mut: Effect of mutation residue number 118 from chain C (isoleucine) into
glutamic acid: Energy difference: 0.4650 kcal/mol, Difference in average
score from the base case: -0.0361 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 118 from chain C (isoleucine) into
lysine: Energy difference: 0.3132 kcal/mol, Difference in average score
from the base case: -0.0275 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 118 from chain C (isoleucine) into
aspartic acid: Energy difference: 0.7881 kcal/mol, Difference in average
score from the base case: -0.0393 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 118 from chain C (isoleucine) into
arginine: Energy difference: -0.8526 kcal/mol, Difference in average score
from the base case: -0.0324 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 150 from chain C (leucine) into glutamic
acid: Energy difference: 0.3518 kcal/mol, Difference in average score from
the base case: -0.0204 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 150 from chain C (leucine) into lysine:
Energy difference: 0.2028 kcal/mol, Difference in average score from the
base case: -0.0202 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 150 from chain C (leucine) into aspartic
acid: Energy difference: 0.5381 kcal/mol, Difference in average score from
the base case: -0.0191 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 150 from chain C (leucine) into arginine:
Energy difference: 0.0425 kcal/mol, Difference in average score from the
base case: -0.0217 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 124 from chain C (isoleucine) into
glutamic acid: Energy difference: 0.5530 kcal/mol, Difference in average
score from the base case: -0.0314 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 124 from chain C (isoleucine) into
lysine: Energy difference: 0.1955 kcal/mol, Difference in average score
from the base case: -0.0299 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 124 from chain C (isoleucine) into
aspartic acid: Energy difference: 0.9695 kcal/mol, Difference in average
score from the base case: -0.0250 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 124 from chain C (isoleucine) into
arginine: Energy difference: 0.2150 kcal/mol, Difference in average score
from the base case: -0.0329 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 112 from chain C (isoleucine) into
glutamic acid: Energy difference: 0.2618 kcal/mol, Difference in average
score from the base case: -0.0319 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 112 from chain C (isoleucine) into
lysine: Energy difference: -0.2796 kcal/mol, Difference in average score
from the base case: -0.0299 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 112 from chain C (isoleucine) into
aspartic acid: Energy difference: 0.8792 kcal/mol, Difference in average
score from the base case: -0.0288 (00:24:29)
[INFO] Auto_mut: Effect of mutation residue number 112 from chain C (isoleucine) into
arginine: Energy difference: -0.1846 kcal/mol, Difference in average score
from the base case: -0.0370 (00:24:30)
[INFO] Auto_mut: Effect of mutation residue number 120 from chain C (isoleucine) into
glutamic acid: Energy difference: 0.3787 kcal/mol, Difference in average
score from the base case: -0.0316 (00:24:30)
[INFO] Auto_mut: Effect of mutation residue number 120 from chain C (isoleucine) into
lysine: Energy difference: -0.0253 kcal/mol, Difference in average score
from the base case: -0.0390 (00:24:30)
[INFO] Auto_mut: Effect of mutation residue number 120 from chain C (isoleucine) into
aspartic acid: Energy difference: 0.8641 kcal/mol, Difference in average
score from the base case: -0.0335 (00:24:30)
[INFO] Auto_mut: Effect of mutation residue number 120 from chain C (isoleucine) into
arginine: Energy difference: -0.6893 kcal/mol, Difference in average score
from the base case: -0.0366 (00:24:30)
[INFO] Auto_mut: Effect of mutation residue number 205 from chain C (tyrosine) into glutamic
acid: Energy difference: -2.3302 kcal/mol, Difference in average score from
the base case: -0.0143 (00:24:30)
[INFO] Auto_mut: Effect of mutation residue number 205 from chain C (tyrosine) into lysine:
Energy difference: -0.3351 kcal/mol, Difference in average score from the
base case: -0.0174 (00:24:30)
[INFO] Auto_mut: Effect of mutation residue number 205 from chain C (tyrosine) into aspartic
acid: Energy difference: -0.1578 kcal/mol, Difference in average score from
the base case: -0.0159 (00:24:30)
[INFO] Auto_mut: Effect of mutation residue number 205 from chain C (tyrosine) into
arginine: Energy difference: -0.4115 kcal/mol, Difference in average score
from the base case: -0.0186 (00:24:30)
[INFO] Main: Simulation completed successfully. (00:24:37)
|
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 | |
| 97 | L | C | 0.7708 | |
| 98 | A | C | -0.2161 | |
| 99 | D | C | -1.6755 | |
| 100 | K | C | -1.1616 | |
| 101 | I | C | 0.2529 | |
| 102 | G | C | -1.0301 | |
| 103 | T | C | -1.5397 | |
| 104 | E | C | -1.8894 | |
| 105 | I | C | -0.3478 | |
| 106 | G | C | -0.1361 | |
| 107 | P | C | -0.1828 | |
| 108 | K | C | -0.5817 | |
| 109 | V | C | 1.0334 | |
| 110 | S | C | 0.6944 | |
| 111 | L | C | 1.5517 | |
| 112 | I | C | 1.8602 | |
| 113 | D | C | 0.0661 | |
| 114 | T | C | 0.9310 | |
| 115 | S | C | 1.4452 | |
| 116 | S | C | 0.9025 | |
| 117 | T | C | 0.7477 | |
| 118 | I | C | 2.0856 | |
| 119 | T | C | 1.2281 | |
| 120 | I | C | 1.7118 | |
| 121 | P | C | 1.6046 | |
| 122 | A | C | 1.3541 | |
| 123 | N | C | 0.7228 | |
| 124 | I | C | 1.9074 | |
| 125 | G | C | 0.0000 | |
| 126 | L | C | 0.7809 | |
| 127 | L | C | 1.5950 | |
| 128 | G | C | 1.2165 | |
| 129 | S | C | 0.0000 | |
| 130 | K | C | 0.0684 | |
| 131 | I | C | 1.5545 | |
| 132 | S | C | 0.6045 | |
| 133 | Q | C | -0.1095 | |
| 134 | S | C | 0.1066 | |
| 135 | T | C | 0.0420 | |
| 136 | A | C | -0.5317 | |
| 137 | S | C | -0.3779 | |
| 138 | I | C | 0.2294 | |
| 139 | N | C | -1.9051 | |
| 140 | E | C | -3.0439 | |
| 141 | N | C | -2.4771 | |
| 142 | V | C | -1.5833 | |
| 143 | N | C | -3.1034 | |
| 144 | E | C | -3.7049 | |
| 145 | K | C | -3.0619 | |
| 146 | C | C | -1.2501 | |
| 147 | K | C | -1.7055 | |
| 148 | F | C | 0.9394 | |
| 149 | T | C | 1.2799 | |
| 150 | L | C | 2.0718 | |
| 151 | P | C | 1.0230 | |
| 152 | P | C | 0.4712 | |
| 153 | L | C | 1.1491 | |
| 154 | K | C | -0.8013 | |
| 155 | I | C | 0.5278 | |
| 156 | H | C | -1.2324 | |
| 157 | E | C | -2.1034 | |
| 158 | C | C | -0.5742 | |
| 159 | N | C | -0.8619 | |
| 160 | I | C | 0.8675 | |
| 161 | S | C | 0.2897 | |
| 162 | C | C | 0.8968 | |
| 163 | P | C | 0.0504 | |
| 177 | G | C | -1.2050 | |
| 178 | V | C | -1.2758 | |
| 179 | S | C | -1.0230 | |
| 180 | N | C | -0.5290 | |
| 181 | L | C | 0.0000 | |
| 182 | V | C | 0.7548 | |
| 183 | G | C | 0.1247 | |
| 184 | L | C | 0.2582 | |
| 185 | P | C | -0.1946 | |
| 186 | N | C | -1.2840 | |
| 187 | N | C | -2.1354 | |
| 188 | I | C | 0.0000 | |
| 189 | C | C | 0.0000 | |
| 190 | L | C | -1.3344 | |
| 191 | Q | C | -1.8727 | |
| 192 | K | C | -2.4169 | |
| 193 | T | C | -1.6220 | |
| 194 | S | C | -1.5927 | |
| 195 | N | C | -1.9510 | |
| 196 | Q | C | -2.1019 | |
| 197 | I | C | -1.3244 | |
| 198 | L | C | 0.0000 | |
| 199 | K | C | -2.4129 | |
| 200 | P | C | -1.1759 | |
| 201 | K | C | -0.6632 | |
| 202 | L | C | 0.7625 | |
| 203 | I | C | 0.0000 | |
| 204 | S | C | 0.8173 | |
| 205 | Y | C | 1.6234 | |
| 206 | T | C | 0.9315 | |
| 207 | L | C | 0.0000 | |
| 208 | P | C | 0.6124 | |
| 209 | V | C | 0.0000 | |
| 210 | V | C | 1.2710 | |
| 211 | G | C | -0.3830 | |
| 212 | Q | C | -1.1097 | |
| 213 | S | C | -1.2768 | |
| 214 | G | C | -0.9000 | |
| 215 | T | C | 0.0000 | |
| 216 | C | C | 0.0000 | |
| 217 | I | C | 0.0000 | |
| 218 | T | C | 0.0000 | |
| 219 | D | C | -1.5193 | |
| 220 | P | C | 0.0000 | |
| 221 | L | C | 0.0000 | |
| 222 | L | C | 0.0000 | |
| 223 | A | C | 0.0000 | |
| 224 | M | C | -0.4676 | |
| 225 | D | C | -1.2299 | |
| 226 | E | C | -2.2418 | |
| 227 | G | C | -0.9640 | |
| 228 | Y | C | -0.6153 | |
| 229 | F | C | 0.0000 | |
| 230 | A | C | 0.0000 | |
| 231 | Y | C | 0.0000 | |
| 232 | S | C | 0.0000 | |
| 233 | H | C | 0.0000 | |
| 234 | L | C | 0.0000 | |
| 235 | E | C | -0.7142 | |
| 236 | R | C | -0.3773 | |
| 237 | I | C | 0.4177 | |
| 238 | G | C | -0.0222 | |
| 239 | S | C | -0.5611 | |
| 240 | C | C | -0.5776 | |
| 241 | S | C | -0.8381 | |
| 242 | R | C | -1.4867 | |
| 243 | G | C | -0.1642 | |
| 244 | V | C | 0.7940 | |
| 245 | S | C | -0.6524 | |
| 246 | K | C | -1.3582 | |
| 247 | Q | C | -1.2897 | |
| 248 | R | C | 0.0000 | |
| 249 | I | C | 0.0000 | |
| 250 | I | C | 0.0000 | |
| 251 | G | C | 0.0000 | |
| 252 | V | C | 0.0000 | |
| 253 | G | C | 0.0000 | |
| 254 | E | C | -0.3071 | |
| 255 | V | C | 0.0000 | |
| 256 | L | C | -0.8037 | |
| 257 | D | C | -3.0863 | |
| 258 | R | C | -3.0309 | |
| 259 | G | C | -2.7275 | |
| 260 | D | C | -3.4857 | |
| 261 | E | C | -3.6367 | |
| 262 | V | C | 0.0000 | |
| 263 | P | C | 0.0000 | |
| 264 | S | C | 0.0000 | |
| 265 | L | C | 0.0000 | |
| 266 | F | C | 0.6363 | |
| 267 | M | C | 0.6401 | |
| 268 | T | C | 0.0000 | |
| 269 | N | C | 0.0000 | |
| 270 | V | C | 1.2585 | |
| 271 | W | C | 0.3296 | |
| 272 | T | C | -0.0475 | |
| 273 | P | C | 0.0000 | |
| 274 | P | C | -0.9606 | |
| 275 | N | C | -1.8087 | |
| 276 | P | C | -1.4922 | |
| 277 | N | C | -1.5911 | |
| 278 | T | C | -0.8445 | |
| 279 | V | C | 0.0000 | |
| 280 | Y | C | -0.3739 | |
| 281 | H | C | -0.3688 | |
| 282 | C | C | -0.1106 | |
| 283 | S | C | 0.0000 | |
| 284 | A | C | 0.0000 | |
| 285 | V | C | 0.0000 | |
| 286 | Y | C | 0.0000 | |
| 287 | N | C | 0.0000 | |
| 288 | N | C | -2.2779 | |
| 289 | E | C | -1.8315 | |
| 290 | F | C | -0.8756 | |
| 291 | Y | C | 0.0000 | |
| 292 | Y | C | 0.0000 | |
| 293 | V | C | 0.0000 | |
| 294 | L | C | 0.0000 | |
| 295 | C | C | 0.0000 | |
| 296 | A | C | 0.0000 | |
| 297 | V | C | 0.2727 | |
| 298 | S | C | 0.0000 | |
| 299 | T | C | -0.0143 | |
| 300 | V | C | 0.3946 | |
| 301 | G | C | -0.0900 | |
| 302 | D | C | -0.2560 | |
| 303 | P | C | 0.0000 | |
| 304 | I | C | 0.0000 | |
| 305 | L | C | 1.1955 | |
| 306 | N | C | 0.3269 | |
| 307 | S | C | 0.1556 | |
| 308 | T | C | 0.3666 | |
| 309 | Y | C | 1.2644 | |
| 310 | W | C | 0.0000 | |
| 311 | S | C | 0.1596 | |
| 312 | G | C | -0.3340 | |
| 313 | S | C | -0.4708 | |
| 314 | L | C | 0.0000 | |
| 315 | M | C | -0.0746 | |
| 316 | M | C | 0.0000 | |
| 317 | T | C | 0.0000 | |
| 318 | R | C | -0.8962 | |
| 319 | L | C | 0.0000 | |
| 320 | A | C | 0.0000 | |
| 321 | V | C | 0.0000 | |
| 322 | K | C | -0.8094 | |
| 323 | P | C | 0.0000 | |
| 324 | K | C | -1.9857 | |
| 325 | S | C | -1.6027 | |
| 326 | N | C | -1.9729 | |
| 327 | G | C | 0.0000 | |
| 328 | G | C | -1.4641 | |
| 329 | G | C | -1.2703 | |
| 330 | Y | C | -1.0018 | |
| 331 | N | C | -1.1473 | |
| 332 | Q | C | -1.1331 | |
| 333 | H | C | -1.4174 | |
| 334 | Q | C | -0.9912 | |
| 335 | L | C | -0.2577 | |
| 336 | A | C | -0.2502 | |
| 337 | L | C | 0.0000 | |
| 338 | R | C | -2.1482 | |
| 339 | S | C | -1.7014 | |
| 340 | I | C | -1.5693 | |
| 341 | E | C | -2.1482 | |
| 342 | K | C | -2.0238 | |
| 343 | G | C | -1.8862 | |
| 344 | R | C | -2.2320 | |
| 345 | Y | C | 0.0000 | |
| 346 | D | C | -1.4520 | |
| 347 | K | C | -1.0574 | |
| 348 | V | C | 0.0000 | |
| 349 | M | C | 0.0000 | |
| 350 | P | C | 0.0000 | |
| 351 | Y | C | 0.0000 | |
| 352 | G | C | 0.0000 | |
| 353 | P | C | 0.0000 | |
| 354 | S | C | 0.0000 | |
| 355 | G | C | -0.2598 | |
| 356 | I | C | 0.0000 | |
| 357 | K | C | -1.6619 | |
| 358 | Q | C | -1.8022 | |
| 359 | G | C | -1.9105 | |
| 360 | D | C | -2.4421 | |
| 361 | T | C | -1.6298 | |
| 362 | L | C | 0.0000 | |
| 363 | Y | C | 0.0000 | |
| 364 | F | C | 0.0000 | |
| 365 | P | C | 0.0000 | |
| 366 | A | C | 0.0000 | |
| 367 | V | C | 0.0000 | |
| 368 | G | C | 0.0000 | |
| 369 | F | C | 0.0000 | |
| 370 | L | C | 0.0000 | |
| 371 | V | C | -1.0393 | |
| 372 | R | C | -1.4633 | |
| 373 | T | C | -1.3728 | |
| 374 | E | C | -2.3894 | |
| 375 | F | C | 0.0000 | |
| 376 | K | C | -2.4480 | |
| 377 | Y | C | -1.9970 | |
| 378 | N | C | -2.4096 | |
| 379 | D | C | -2.3577 | |
| 380 | S | C | -1.5754 | |
| 381 | N | C | -2.0167 | |
| 382 | C | C | 0.0000 | |
| 383 | P | C | -0.9865 | |
| 384 | I | C | -1.0570 | |
| 385 | T | C | -1.2668 | |
| 386 | K | C | -1.7109 | |
| 387 | C | C | -1.0249 | |
| 388 | Q | C | -1.0599 | |
| 389 | Y | C | 0.1677 | |
| 390 | S | C | -0.8655 | |
| 391 | K | C | -1.8901 | |
| 392 | P | C | -1.8106 | |
| 393 | E | C | -1.9633 | |
| 394 | N | C | -1.1651 | |
| 395 | C | C | 0.0000 | |
| 396 | R | C | -1.0401 | |
| 397 | L | C | -0.6661 | |
| 398 | S | C | 0.0000 | |
| 399 | M | C | 0.0000 | |
| 400 | G | C | 0.0000 | |
| 401 | I | C | -0.4626 | |
| 402 | R | C | -2.0151 | |
| 403 | P | C | -1.4914 | |
| 404 | N | C | -2.0709 | |
| 405 | S | C | -1.5059 | |
| 406 | H | C | -1.5608 | |
| 407 | Y | C | 0.0000 | |
| 408 | I | C | 0.0000 | |
| 409 | L | C | 0.0000 | |
| 410 | R | C | -0.5713 | |
| 411 | S | C | 0.0000 | |
| 412 | G | C | 0.0000 | |
| 413 | L | C | 0.0000 | |
| 414 | L | C | 0.0000 | |
| 415 | K | C | -0.9811 | |
| 416 | Y | C | 0.0000 | |
| 417 | N | C | -1.3747 | |
| 418 | L | C | -0.7007 | |
| 419 | S | C | -0.6901 | |
| 424 | P | C | -0.8815 | |
| 425 | K | C | -1.7892 | |
| 426 | V | C | 0.0000 | |
| 427 | V | C | -0.8222 | |
| 428 | F | C | 0.0000 | |
| 429 | I | C | 0.0000 | |
| 430 | E | C | -1.6180 | |
| 431 | I | C | 0.0000 | |
| 432 | S | C | -1.6847 | |
| 433 | D | C | -2.5581 | |
| 434 | Q | C | -2.4092 | |
| 435 | R | C | -1.8672 | |
| 436 | L | C | -1.4437 | |
| 437 | S | C | -0.6136 | |
| 438 | I | C | 0.0000 | |
| 439 | G | C | 0.0000 | |
| 440 | S | C | 0.0000 | |
| 441 | P | C | -0.0105 | |
| 442 | S | C | 0.0000 | |
| 443 | K | C | 0.0000 | |
| 444 | I | C | 0.0000 | |
| 445 | Y | C | 0.0000 | |
| 446 | D | C | -0.7625 | |
| 447 | S | C | 0.0000 | |
| 448 | L | C | 0.2276 | |
| 449 | G | C | -0.4618 | |
| 450 | Q | C | -0.4879 | |
| 451 | P | C | -0.4340 | |
| 452 | V | C | 0.0000 | |
| 453 | F | C | 0.0000 | |
| 454 | Y | C | 0.0000 | |
| 455 | Q | C | 0.0000 | |
| 456 | A | C | 0.0000 | |
| 457 | S | C | 0.0000 | |
| 458 | F | C | 0.2233 | |
| 459 | S | C | 0.0000 | |
| 460 | W | C | -0.0978 | |
| 461 | D | C | -0.0640 | |
| 462 | T | C | 0.0000 | |
| 463 | M | C | 0.1828 | |
| 464 | I | C | 0.0000 | |
| 465 | K | C | 0.0000 | |
| 466 | F | C | 0.0000 | |
| 467 | G | C | 0.0000 | |
| 468 | D | C | -0.3622 | |
| 469 | V | C | 0.0000 | |
| 470 | L | C | 0.9867 | |
| 471 | T | C | 0.2890 | |
| 472 | V | C | -0.2591 | |
| 473 | N | C | -1.3249 | |
| 474 | P | C | -0.9507 | |
| 475 | L | C | 0.0000 | |
| 476 | V | C | -0.3402 | |
| 477 | V | C | 0.0000 | |
| 478 | N | C | -1.3117 | |
| 479 | W | C | -1.1404 | |
| 480 | R | C | -1.6028 | |
| 481 | N | C | -1.8329 | |
| 482 | N | C | 0.0000 | |
| 483 | T | C | -0.6832 | |
| 484 | V | C | -0.2332 | |
| 485 | I | C | 0.0000 | |
| 486 | S | C | 0.0000 | |
| 487 | R | C | 0.0000 | |
| 488 | P | C | 0.0000 | |
| 489 | G | C | 0.0000 | |
| 490 | Q | C | -2.3441 | |
| 492 | Q | C | -1.7468 | |
| 493 | C | C | 0.0000 | |
| 494 | P | C | -1.4862 | |
| 495 | R | C | -0.9291 | |
| 496 | F | C | 0.7547 | |
| 497 | N | C | -0.0468 | |
| 498 | T | C | -0.0930 | |
| 499 | C | C | -0.3850 | |
| 500 | P | C | 0.0000 | |
| 501 | E | C | -0.6963 | |
| 502 | I | C | -0.4607 | |
| 503 | C | C | -0.3961 | |
| 504 | W | C | -0.0937 | |
| 505 | E | C | -0.3005 | |
| 506 | G | C | -0.3588 | |
| 507 | V | C | -0.1115 | |
| 508 | Y | C | 0.0000 | |
| 509 | N | C | 0.0000 | |
| 510 | D | C | 0.0000 | |
| 511 | A | C | 0.0000 | |
| 512 | F | C | 0.0000 | |
| 513 | L | C | 0.0000 | |
| 514 | I | C | 0.0000 | |
| 515 | D | C | 0.0000 | |
| 516 | R | C | 0.1342 | |
| 517 | I | C | 1.2510 | |
| 518 | N | C | -0.4468 | |
| 519 | W | C | -0.3283 | |
| 520 | I | C | 0.0000 | |
| 521 | S | C | 0.0000 | |
| 522 | A | C | 0.0000 | |
| 523 | G | C | 0.0000 | |
| 524 | V | C | 0.0000 | |
| 525 | F | C | 0.0000 | |
| 526 | L | C | 0.0000 | |
| 527 | D | C | -1.4864 | |
| 528 | S | C | -1.6787 | |
| 529 | N | C | -2.1492 | |
| 530 | Q | C | -2.5358 | |
| 531 | T | C | -1.6707 | |
| 532 | A | C | -1.2400 | |
| 533 | E | C | -2.1216 | |
| 534 | N | C | -2.1112 | |
| 535 | P | C | 0.0000 | |
| 536 | V | C | 0.0000 | |
| 537 | F | C | 0.0000 | |
| 538 | T | C | 0.0000 | |
| 539 | V | C | 0.0000 | |
| 540 | F | C | 0.0000 | |
| 541 | K | C | -1.7212 | |
| 542 | D | C | -1.7721 | |
| 543 | N | C | -1.9524 | |
| 544 | E | C | -1.3924 | |
| 545 | I | C | -0.8793 | |
| 546 | L | C | 0.0000 | |
| 547 | Y | C | 0.0000 | |
| 548 | R | C | -1.9513 | |
| 549 | A | C | 0.0000 | |
| 550 | Q | C | -1.9356 | |
| 551 | L | C | -1.0654 | |
| 552 | A | C | -1.1653 | |
| 553 | S | C | -1.9847 | |
| 554 | E | C | -3.2490 | |
| 555 | D | C | -3.0546 | |
| 556 | T | C | -2.4153 | |
| 557 | N | C | -2.2198 | |
| 558 | A | C | 0.0000 | |
| 559 | Q | C | -0.7777 | |
| 560 | K | C | -0.7136 | |
| 561 | T | C | 0.0000 | |
| 562 | I | C | 0.0000 | |
| 563 | T | C | 0.0000 | |
| 564 | N | C | 0.0000 | |
| 565 | C | C | 0.0000 | |
| 566 | F | C | 0.0000 | |
| 567 | L | C | 0.0000 | |
| 568 | L | C | 0.0000 | |
| 569 | K | C | -2.7119 | |
| 570 | N | C | -2.5106 | |
| 571 | K | C | -2.5161 | |
| 572 | I | C | 0.0000 | |
| 573 | W | C | 0.0000 | |
| 574 | C | C | 0.0000 | |
| 575 | I | C | 0.0000 | |
| 576 | S | C | 0.0000 | |
| 577 | L | C | 0.0000 | |
| 578 | V | C | 0.0000 | |
| 579 | E | C | 0.0000 | |
| 580 | I | C | 0.0000 | |
| 581 | Y | C | -1.7012 | |
| 582 | D | C | -2.8387 | |
| 583 | T | C | -2.2254 | |
| 584 | G | C | -2.2920 | |
| 585 | D | C | -3.0889 | |
| 586 | N | C | -2.8967 | |
| 587 | V | C | -1.7082 | |
| 588 | I | C | 0.0000 | |
| 589 | R | C | -0.4518 | |
| 590 | P | C | 0.0000 | |
| 591 | K | C | -0.1817 | |
| 592 | L | C | 0.0000 | |
| 593 | F | C | 0.0000 | |
| 594 | A | C | 0.0000 | |
| 595 | V | C | 0.0000 | |
| 596 | K | C | -1.5891 | |
| 597 | I | C | 0.0000 | |
| 598 | P | C | -1.4373 | |
| 599 | E | C | -2.1797 | |
| 600 | Q | C | -1.3802 | |
| 601 | C | C | -0.7602 | |
| 602 | Y | C | 0.4221 |
Automated mutations analysis
In the automated mutations mode, the server selects aggregation prone resides
and each selected residue is mutated to glutamic acid, lysine, aspartic acid and arginine.
The table below shows 2 best scored mutants for each mutated residue. Protein variants
are ordered according to the mutation effect they had on protein stability
(energetic effect) together with the difference in the average per-residue aggregation score
between the wild type and the mutant (in the table green values indicate a positive change,
grey are neutral, and orange/red mean destabilizing or more aggregation prone mutants).
Summary for all the mutants can be found in this
CSV file.
Mutant |
Energetic effect |
Score comparison |
|||
| IR118C | -0.8526 | -0.0324 | View | CSV | PDB |
| IR120C | -0.6893 | -0.0366 | View | CSV | PDB |
| YE205C | -2.3302 | -0.0143 | View | CSV | PDB |
| IR112C | -0.1846 | -0.037 | View | CSV | PDB |
| IK112C | -0.2796 | -0.0299 | View | CSV | PDB |
| IK120C | -0.0253 | -0.039 | View | CSV | PDB |
| YR205C | -0.4115 | -0.0186 | View | CSV | PDB |
| LR150C | 0.0425 | -0.0217 | View | CSV | PDB |
| IR124C | 0.215 | -0.0329 | View | CSV | PDB |
| IK124C | 0.1955 | -0.0299 | View | CSV | PDB |
| LK150C | 0.2028 | -0.0202 | View | CSV | PDB |
| IK118C | 0.3132 | -0.0275 | View | CSV | PDB |