| Chain sequence(s) |
A: IQLTQSPSSLAVSVGEKITMSCKSSQSLLYSGNQKNYLAWYQQKSGQSPKLLIYWTSTRKSGVPDRFTGSGSGTDFTLTISSVKAEDLAIYYCHQYYTYPWTFGGGTKLEIGGGGSGGGGSGGGGSVQLQQSGPELVKPGASVKMSCKASGYIFTDYYMKWVKQSHGRSLEWIGDINLNNGDTFYNQKFKGRATLTVDKSSSTAYMQLNSLTSEDSAVYYCARSDDYDYGMDYWGQGTTVTVS
input PDB |
| Selected Chain(s) | A |
| 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] (00:00:00)
[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 (00:02:13)
[INFO] Auto_mut: Residue number 154 from chain A and a score of 1.497 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 100 from chain A and a score of 1.078 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 98 from chain A and a score of 1.001 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 137 from chain A and a score of 0.954 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 99 from chain A and a score of 0.708 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 153 from chain A and a score of 0.502 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 185 from chain A and a score of 0.425 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 38 from chain A and a score of 0.412 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 101 from chain A and a score of 0.339 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 228 from chain A and a score of 0.246 (tyrosine) selected
for automated muatation (00:02:14)
[INFO] Auto_mut: Residue number 31 from chain A and a score of 0.163 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 30 from chain A and a score of 0.060 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 230 from chain A and a score of 0.003 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 4 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 13 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 19 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 21 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 23 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 25 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 29 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 37 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 39 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 40 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 41 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 42 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 43 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 44 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 50 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 52 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 53 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 54 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 57 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 68 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 70 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 77 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 79 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 81 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 84 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 88 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 90 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 92 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 93 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:14)
[INFO] Auto_mut: Residue number 94 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 95 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 96 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 97 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 102 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 104 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 105 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 107 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 108 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 110 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 130 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 132 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 144 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 146 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 148 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 150 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 155 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 158 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 160 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 161 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 162 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 163 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 171 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 173 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 174 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 175 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 176 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 177 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 179 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 187 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 190 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 194 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 196 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 204 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 205 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 207 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 209 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 212 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 216 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 220 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 221 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 222 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 223 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 224 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 225 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 231 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 233 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 235 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 236 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 239 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 241 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 243 from chain A and a score of 0.000 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 136 from chain A and a score of -0.079 omitted from
automated muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 219 from chain A and a score of -0.088 omitted from
automated muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 55 from chain A and a score of -0.093 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 242 from chain A and a score of -0.134 omitted from
automated muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 56 from chain A and a score of -0.139 omitted from automated
muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 240 from chain A and a score of -0.149 omitted from
automated muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Residue number 103 from chain A and a score of -0.160 omitted from
automated muatation (excluded by the user). (00:02:15)
[INFO] Auto_mut: Mutating residue number 228 from chain A (tyrosine) into glutamic acid (00:02:15)
[INFO] Auto_mut: Mutating residue number 228 from chain A (tyrosine) into lysine (00:02:15)
[INFO] Auto_mut: Mutating residue number 228 from chain A (tyrosine) into aspartic acid (00:02:15)
[INFO] Auto_mut: Mutating residue number 228 from chain A (tyrosine) into arginine (00:03:41)
[INFO] Auto_mut: Effect of mutation residue number 228 from chain A (tyrosine) into glutamic
acid: Energy difference: 1.0987 kcal/mol, Difference in average score from
the base case: -0.0384 (00:05:19)
[INFO] Auto_mut: Effect of mutation residue number 228 from chain A (tyrosine) into lysine:
Energy difference: 0.2194 kcal/mol, Difference in average score from the
base case: -0.0370 (00:05:19)
[INFO] Auto_mut: Effect of mutation residue number 228 from chain A (tyrosine) into aspartic
acid: Energy difference: 1.3785 kcal/mol, Difference in average score from
the base case: -0.0381 (00:05:19)
[INFO] Auto_mut: Effect of mutation residue number 228 from chain A (tyrosine) into
arginine: Energy difference: -0.4617 kcal/mol, Difference in average score
from the base case: -0.0230 (00:05:19)
[INFO] Main: Simulation completed successfully. (00:05:21)
|
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 | |
| 2 | I | A | -0.2938 | |
| 3 | Q | A | -1.5523 | |
| 4 | L | A | 0.0000 | |
| 5 | T | A | -1.2986 | |
| 6 | Q | A | -1.0008 | |
| 7 | S | A | -0.8305 | |
| 8 | P | A | -0.5659 | |
| 9 | S | A | -0.7319 | |
| 10 | S | A | -0.9652 | |
| 11 | L | A | -0.6550 | |
| 12 | A | A | -0.7283 | |
| 13 | V | A | 0.0000 | |
| 14 | S | A | -1.3565 | |
| 15 | V | A | -1.6439 | |
| 16 | G | A | -1.7030 | |
| 17 | E | A | -2.1552 | |
| 18 | K | A | -2.4352 | |
| 19 | I | A | 0.0000 | |
| 20 | T | A | -0.4738 | |
| 21 | M | A | 0.0000 | |
| 22 | S | A | -0.9610 | |
| 23 | C | A | 0.0000 | |
| 24 | K | A | -2.6403 | |
| 25 | S | A | 0.0000 | |
| 26 | S | A | -1.5388 | |
| 27 | Q | A | -1.6206 | |
| 28 | S | A | -0.6837 | |
| 29 | L | A | 0.0000 | |
| 30 | L | A | 0.0601 | |
| 31 | Y | A | 0.1631 | |
| 32 | S | A | -0.6331 | |
| 33 | G | A | -0.9868 | |
| 34 | N | A | -1.4397 | |
| 35 | Q | A | -1.7579 | |
| 36 | K | A | -1.3731 | |
| 37 | N | A | 0.0000 | |
| 38 | Y | A | 0.4123 | |
| 39 | L | A | 0.0000 | |
| 40 | A | A | 0.0000 | |
| 41 | W | A | 0.0000 | |
| 42 | Y | A | 0.0000 | |
| 43 | Q | A | 0.0000 | |
| 44 | Q | A | 0.0000 | |
| 45 | K | A | -1.5440 | |
| 46 | S | A | -0.9169 | |
| 47 | G | A | -1.4284 | |
| 48 | Q | A | -2.1666 | |
| 49 | S | A | -1.6346 | |
| 50 | P | A | 0.0000 | |
| 51 | K | A | -1.8774 | |
| 52 | L | A | 0.0000 | |
| 53 | L | A | 0.0000 | |
| 54 | I | A | 0.0000 | |
| 55 | Y | A | -0.0935 | |
| 56 | W | A | -0.1386 | |
| 57 | T | A | 0.0000 | |
| 58 | S | A | -0.4974 | |
| 59 | T | A | -0.6319 | |
| 60 | R | A | -1.3576 | |
| 61 | K | A | -1.1200 | |
| 62 | S | A | -0.7410 | |
| 63 | G | A | -1.1748 | |
| 64 | V | A | -1.0763 | |
| 65 | P | A | -1.2848 | |
| 66 | D | A | -2.1511 | |
| 67 | R | A | -1.4349 | |
| 68 | F | A | 0.0000 | |
| 69 | T | A | -0.7766 | |
| 70 | G | A | 0.0000 | |
| 71 | S | A | -0.6018 | |
| 72 | G | A | -1.1042 | |
| 73 | S | A | -1.1379 | |
| 74 | G | A | -1.0051 | |
| 75 | T | A | -1.6374 | |
| 76 | D | A | -2.4196 | |
| 77 | F | A | 0.0000 | |
| 78 | T | A | -0.8103 | |
| 79 | L | A | 0.0000 | |
| 80 | T | A | -0.5043 | |
| 81 | I | A | 0.0000 | |
| 82 | S | A | -1.5010 | |
| 83 | S | A | -1.4368 | |
| 84 | V | A | 0.0000 | |
| 85 | K | A | -1.6694 | |
| 86 | A | A | -1.2985 | |
| 87 | E | A | -1.8422 | |
| 88 | D | A | 0.0000 | |
| 89 | L | A | -0.7838 | |
| 90 | A | A | 0.0000 | |
| 91 | I | A | -0.5084 | |
| 92 | Y | A | 0.0000 | |
| 93 | Y | A | 0.0000 | |
| 94 | C | A | 0.0000 | |
| 95 | H | A | 0.0000 | |
| 96 | Q | A | 0.0000 | |
| 97 | Y | A | 0.0000 | |
| 98 | Y | A | 1.0008 | |
| 99 | T | A | 0.7079 | |
| 100 | Y | A | 1.0781 | |
| 101 | P | A | 0.3388 | |
| 102 | W | A | 0.0000 | |
| 103 | T | A | -0.1603 | |
| 104 | F | A | 0.0000 | |
| 105 | G | A | 0.0000 | |
| 106 | G | A | -1.3670 | |
| 107 | G | A | 0.0000 | |
| 108 | T | A | 0.0000 | |
| 109 | K | A | -1.4542 | |
| 110 | L | A | 0.0000 | |
| 111 | E | A | -1.6998 | |
| 112 | I | A | -1.3179 | |
| 113 | G | A | -0.9786 | |
| 114 | G | A | -1.1267 | |
| 115 | G | A | -1.3284 | |
| 116 | G | A | -1.1633 | |
| 117 | S | A | -1.1033 | |
| 118 | G | A | -1.2084 | |
| 119 | G | A | -1.2035 | |
| 120 | G | A | -1.0641 | |
| 121 | G | A | -1.2216 | |
| 122 | S | A | -0.8624 | |
| 123 | G | A | -1.1040 | |
| 124 | G | A | -1.1538 | |
| 125 | G | A | -1.1032 | |
| 126 | G | A | -1.1685 | |
| 127 | S | A | -0.8952 | |
| 128 | V | A | -0.5192 | |
| 129 | Q | A | -1.8637 | |
| 130 | L | A | 0.0000 | |
| 131 | Q | A | -2.1650 | |
| 132 | Q | A | 0.0000 | |
| 133 | S | A | -1.1026 | |
| 134 | G | A | -0.9417 | |
| 135 | P | A | -0.3025 | |
| 136 | E | A | -0.0790 | |
| 137 | L | A | 0.9542 | |
| 138 | V | A | -0.2043 | |
| 139 | K | A | -1.6483 | |
| 140 | P | A | -1.4698 | |
| 141 | G | A | -1.2291 | |
| 142 | A | A | -1.0256 | |
| 143 | S | A | -1.3047 | |
| 144 | V | A | 0.0000 | |
| 145 | K | A | -2.0613 | |
| 146 | M | A | 0.0000 | |
| 147 | S | A | -0.8855 | |
| 148 | C | A | 0.0000 | |
| 149 | K | A | -1.5107 | |
| 150 | A | A | 0.0000 | |
| 151 | S | A | -0.7003 | |
| 152 | G | A | -0.3588 | |
| 153 | Y | A | 0.5018 | |
| 154 | I | A | 1.4968 | |
| 155 | F | A | 0.0000 | |
| 156 | T | A | -1.4488 | |
| 157 | D | A | -1.8930 | |
| 158 | Y | A | 0.0000 | |
| 159 | Y | A | -1.0542 | |
| 160 | M | A | 0.0000 | |
| 161 | K | A | 0.0000 | |
| 162 | W | A | 0.0000 | |
| 163 | V | A | 0.0000 | |
| 164 | K | A | -0.5854 | |
| 165 | Q | A | -0.9774 | |
| 166 | S | A | -1.5112 | |
| 167 | H | A | -1.7278 | |
| 168 | G | A | -1.9600 | |
| 169 | R | A | -2.6470 | |
| 170 | S | A | -1.6239 | |
| 171 | L | A | 0.0000 | |
| 172 | E | A | -1.1882 | |
| 173 | W | A | 0.0000 | |
| 174 | I | A | 0.0000 | |
| 175 | G | A | 0.0000 | |
| 176 | D | A | 0.0000 | |
| 177 | I | A | 0.0000 | |
| 178 | N | A | -1.7278 | |
| 179 | L | A | 0.0000 | |
| 180 | N | A | -3.0366 | |
| 181 | N | A | -2.9552 | |
| 182 | G | A | -2.3886 | |
| 183 | D | A | -2.2904 | |
| 184 | T | A | -0.6152 | |
| 185 | F | A | 0.4253 | |
| 186 | Y | A | -0.3561 | |
| 187 | N | A | 0.0000 | |
| 188 | Q | A | -2.4632 | |
| 189 | K | A | -2.9421 | |
| 190 | F | A | 0.0000 | |
| 191 | K | A | -2.7786 | |
| 192 | G | A | -2.1298 | |
| 193 | R | A | -2.0051 | |
| 194 | A | A | 0.0000 | |
| 195 | T | A | -1.0082 | |
| 196 | L | A | 0.0000 | |
| 197 | T | A | -0.6449 | |
| 198 | V | A | -1.2394 | |
| 199 | D | A | -1.6576 | |
| 200 | K | A | -2.4683 | |
| 201 | S | A | -1.2389 | |
| 202 | S | A | -1.0404 | |
| 203 | S | A | -0.8375 | |
| 204 | T | A | 0.0000 | |
| 205 | A | A | 0.0000 | |
| 206 | Y | A | -0.5223 | |
| 207 | M | A | 0.0000 | |
| 208 | Q | A | -1.6085 | |
| 209 | L | A | 0.0000 | |
| 210 | N | A | -1.4590 | |
| 211 | S | A | -1.1184 | |
| 212 | L | A | 0.0000 | |
| 213 | T | A | -1.3406 | |
| 214 | S | A | -1.4643 | |
| 215 | E | A | -1.9577 | |
| 216 | D | A | 0.0000 | |
| 217 | S | A | -0.5798 | |
| 218 | A | A | -0.4648 | |
| 219 | V | A | -0.0882 | |
| 220 | Y | A | 0.0000 | |
| 221 | Y | A | 0.0000 | |
| 222 | C | A | 0.0000 | |
| 223 | A | A | 0.0000 | |
| 224 | R | A | 0.0000 | |
| 225 | S | A | 0.0000 | |
| 226 | D | A | 0.0000 | |
| 227 | D | A | -1.4504 | |
| 228 | Y | A | 0.2465 | |
| 229 | D | A | -0.3726 | |
| 230 | Y | A | 0.0030 | |
| 231 | G | A | 0.0000 | |
| 232 | M | A | 0.0000 | |
| 233 | D | A | 0.0000 | |
| 234 | Y | A | -0.4603 | |
| 235 | W | A | 0.0000 | |
| 236 | G | A | 0.0000 | |
| 237 | Q | A | -1.9548 | |
| 238 | G | A | -1.0503 | |
| 239 | T | A | 0.0000 | |
| 240 | T | A | -0.1488 | |
| 241 | V | A | 0.0000 | |
| 242 | T | A | -0.1340 | |
| 243 | V | A | 0.0000 | |
| 244 | S | A | -0.5092 |
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 |
|||
| YR228A | -0.4617 | -0.023 | View | CSV | PDB |
| YK228A | 0.2194 | -0.037 | View | CSV | PDB |
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