| Chain sequence(s) |
A: MNNHVSSKPSTMKLKHTINPILLYFIHFLISLYTILTYIPFYFFSESRQEKSNRIKAKPVNSKPDSAYRSVNSLDGLASVLYPGCDTLDKVFTYAKNKFKNKRLLGTREVLNEEDEVQPNGKIFKKVILGQYNWLSYEDVFVRAFNFGNGLQMLGQKPKTNIAIFCETRAEWMIAAQACFMYNFQLVTLYATLGGPAIVHALNETEVTNIITSKELLQTKLKDIVSLVPRLRHIITVDGKPPTWSEFPKGIIVHTMAAVEALGAKASMENQPHSKPLPSDIAVIMYTSGSTGLPKGVMISHSNIIAGITGMAERIPELGEEDVYIGYLPLAHVLELSAELVCLSHGCRIGYSSPQTLADQSSKIKKGSKGDTSMLKPTLMAAVPEIMDRIYKNVMNKVSEMSSFQRNLFILAYNYKMEQISKGRNTPLCDSFVFRKVRSLLGGNIRLLLCGGAPLSATTQRFMNICFCCPVGQGYGLTESAGAGTISEVWDYNTGRVGAPLVCCEIKLKNWEEGGYFNTDKPHPRGEILIGGQSVTMGYYKNEAKTKADFFEDENGQRWLCTGDIGEFEPDGCLKIIDRKKDLVKLQAGEYVSLGKVEAALKNLPLVDNICAYANSYHSYVIGFVVPNQKELTELARKKGLKGTWEELCNSCEMENEVLKVLSEAAISASLEKFEIPVKIRLSPEPWTPETGLVTDAFKLKRKELKTHYQADIERMYGRK
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] (00:00:01)
[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 (00:16:10)
[INFO] Auto_mut: Residue number 25 from chain A and a score of 4.190 (phenylalanine)
selected for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 39 from chain A and a score of 3.905 (isoleucine) selected
for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 43 from chain A and a score of 3.785 (phenylalanine)
selected for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 24 from chain A and a score of 3.554 (tyrosine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 35 from chain A and a score of 3.342 (isoleucine) selected
for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 42 from chain A and a score of 3.279 (tyrosine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 28 from chain A and a score of 3.250 (phenylalanine)
selected for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 36 from chain A and a score of 3.229 (leucine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 44 from chain A and a score of 3.224 (phenylalanine)
selected for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 38 from chain A and a score of 3.098 (tyrosine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 40 from chain A and a score of 3.077 (proline) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 21 from chain A and a score of 3.008 (isoleucine) selected
for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 22 from chain A and a score of 2.953 (leucine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 26 from chain A and a score of 2.949 (isoleucine) selected
for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 29 from chain A and a score of 2.828 (leucine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 41 from chain A and a score of 2.813 (phenylalanine)
selected for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 32 from chain A and a score of 2.607 (leucine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 23 from chain A and a score of 2.405 (leucine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 33 from chain A and a score of 2.316 (tyrosine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 34 from chain A and a score of 2.302 (threonine) selected
for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 37 from chain A and a score of 2.208 (threonine) selected
for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 30 from chain A and a score of 2.189 (isoleucine) selected
for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 27 from chain A and a score of 2.076 (histidine) selected
for automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 31 from chain A and a score of 2.038 (serine) selected for
automated muatation (00:16:21)
[INFO] Auto_mut: Residue number 404 from chain A and a score of 1.393 (phenylalanine)
selected for automated muatation (00:16:21)
[INFO] Auto_mut: Mutating residue number 43 from chain A (phenylalanine) into lysine (00:16:21)
[INFO] Auto_mut: Mutating residue number 35 from chain A (isoleucine) into aspartic acid (00:16:21)
[INFO] Auto_mut: Mutating residue number 25 from chain A (phenylalanine) into glutamic acid
Mutating residue number 25 from chain A (phenylalanine) into glutamic acid (00:16:21)
[INFO] Auto_mut: Mutating residue number 35 from chain A (isoleucine) into arginine (00:24:59)
[INFO] Auto_mut: Mutating residue number 25 from chain A (phenylalanine) into lysine (00:25:03)
[INFO] Auto_mut: Mutating residue number 43 from chain A (phenylalanine) into aspartic acid
Mutating residue number 43 from chain A (phenylalanine) into aspartic acid (00:25:10)
[INFO] Auto_mut: Mutating residue number 42 from chain A (tyrosine) into glutamic acid (00:33:59)
[INFO] Auto_mut: Mutating residue number 43 from chain A (phenylalanine) into arginine (00:34:06)
[INFO] Auto_mut: Mutating residue number 25 from chain A (phenylalanine) into aspartic acid
Mutating residue number 25 from chain A (phenylalanine) into aspartic acid (00:34:35)
[INFO] Auto_mut: Mutating residue number 42 from chain A (tyrosine) into lysine (00:42:42)
[INFO] Auto_mut: Mutating residue number 24 from chain A (tyrosine) into glutamic acid (00:42:59)
[INFO] Auto_mut: Mutating residue number 25 from chain A (phenylalanine) into arginine (00:43:32)
[INFO] Auto_mut: Mutating residue number 42 from chain A (tyrosine) into aspartic acid (00:51:16)
[INFO] Auto_mut: Mutating residue number 24 from chain A (tyrosine) into lysine (00:52:07)
[INFO] Auto_mut: Mutating residue number 39 from chain A (isoleucine) into glutamic acid (00:52:21)
[INFO] Auto_mut: Mutating residue number 42 from chain A (tyrosine) into arginine (00:59:37)
[INFO] Auto_mut: Mutating residue number 39 from chain A (isoleucine) into lysine (01:00:42)
[INFO] Auto_mut: Mutating residue number 24 from chain A (tyrosine) into aspartic acid (01:00:54)
[INFO] Auto_mut: Mutating residue number 28 from chain A (phenylalanine) into glutamic acid
Mutating residue number 28 from chain A (phenylalanine) into glutamic acid (01:07:47)
[INFO] Auto_mut: Mutating residue number 39 from chain A (isoleucine) into aspartic acid (01:09:31)
[INFO] Auto_mut: Mutating residue number 24 from chain A (tyrosine) into arginine (01:09:35)
[INFO] Auto_mut: Mutating residue number 28 from chain A (phenylalanine) into lysine (01:16:30)
[INFO] Auto_mut: Mutating residue number 39 from chain A (isoleucine) into arginine (01:18:17)
[INFO] Auto_mut: Mutating residue number 35 from chain A (isoleucine) into glutamic acid (01:18:28)
[INFO] Auto_mut: Mutating residue number 28 from chain A (phenylalanine) into aspartic acid
Mutating residue number 28 from chain A (phenylalanine) into aspartic acid (01:25:26)
[INFO] Auto_mut: Mutating residue number 43 from chain A (phenylalanine) into glutamic acid
Mutating residue number 43 from chain A (phenylalanine) into glutamic acid (01:26:38)
[INFO] Auto_mut: Mutating residue number 35 from chain A (isoleucine) into lysine (01:27:04)
[INFO] Auto_mut: Mutating residue number 28 from chain A (phenylalanine) into arginine (01:33:42)
[INFO] Auto_mut: Mutating residue number 38 from chain A (tyrosine) into glutamic acid (01:34:59)
[INFO] Auto_mut: Mutating residue number 21 from chain A (isoleucine) into lysine (01:36:08)
[INFO] Auto_mut: Mutating residue number 36 from chain A (leucine) into glutamic acid (01:42:33)
[INFO] Auto_mut: Mutating residue number 38 from chain A (tyrosine) into lysine (01:43:01)
[INFO] Auto_mut: Mutating residue number 21 from chain A (isoleucine) into aspartic acid (01:44:52)
[INFO] Auto_mut: Mutating residue number 36 from chain A (leucine) into lysine (01:51:10)
[INFO] Auto_mut: Mutating residue number 38 from chain A (tyrosine) into aspartic acid (01:51:50)
[INFO] Auto_mut: Mutating residue number 21 from chain A (isoleucine) into arginine (01:53:32)
[INFO] Auto_mut: Mutating residue number 36 from chain A (leucine) into aspartic acid (01:59:42)
[INFO] Auto_mut: Mutating residue number 38 from chain A (tyrosine) into arginine (01:59:46)
[INFO] Auto_mut: Mutating residue number 22 from chain A (leucine) into glutamic acid (02:02:02)
[INFO] Auto_mut: Mutating residue number 36 from chain A (leucine) into arginine (02:07:41)
[INFO] Auto_mut: Mutating residue number 40 from chain A (proline) into glutamic acid (02:07:52)
[INFO] Auto_mut: Mutating residue number 22 from chain A (leucine) into lysine (02:10:27)
[INFO] Auto_mut: Mutating residue number 44 from chain A (phenylalanine) into glutamic acid
Mutating residue number 44 from chain A (phenylalanine) into glutamic acid (02:16:11)
[INFO] Auto_mut: Mutating residue number 40 from chain A (proline) into lysine (02:16:12)
[INFO] Auto_mut: Mutating residue number 22 from chain A (leucine) into aspartic acid (02:19:14)
[INFO] Auto_mut: Mutating residue number 40 from chain A (proline) into aspartic acid (02:24:26)
[INFO] Auto_mut: Mutating residue number 44 from chain A (phenylalanine) into lysine (02:24:29)
[INFO] Auto_mut: Mutating residue number 22 from chain A (leucine) into arginine (02:27:34)
[INFO] Auto_mut: Mutating residue number 40 from chain A (proline) into arginine (02:32:52)
[INFO] Auto_mut: Mutating residue number 44 from chain A (phenylalanine) into aspartic acid
Mutating residue number 44 from chain A (phenylalanine) into aspartic acid (02:32:59)
[INFO] Auto_mut: Mutating residue number 26 from chain A (isoleucine) into glutamic acid (02:35:59)
[INFO] Auto_mut: Mutating residue number 44 from chain A (phenylalanine) into arginine (02:41:11)
[INFO] Auto_mut: Mutating residue number 21 from chain A (isoleucine) into glutamic acid (02:41:30)
[INFO] Auto_mut: Mutating residue number 26 from chain A (isoleucine) into lysine (02:44:22)
[INFO] Auto_mut: Mutating residue number 26 from chain A (isoleucine) into aspartic acid (02:49:36)
[INFO] Auto_mut: Mutating residue number 41 from chain A (phenylalanine) into arginine (02:49:53)
[INFO] Auto_mut: Mutating residue number 33 from chain A (tyrosine) into glutamic acid (02:52:58)
[INFO] Auto_mut: Mutating residue number 26 from chain A (isoleucine) into arginine (02:57:42)
[INFO] Auto_mut: Mutating residue number 32 from chain A (leucine) into glutamic acid (02:58:13)
[INFO] Auto_mut: Mutating residue number 33 from chain A (tyrosine) into lysine (03:01:21)
[INFO] Auto_mut: Mutating residue number 29 from chain A (leucine) into glutamic acid (03:06:06)
[INFO] Auto_mut: Mutating residue number 32 from chain A (leucine) into lysine (03:06:41)
[INFO] Auto_mut: Mutating residue number 33 from chain A (tyrosine) into aspartic acid (03:11:01)
[INFO] Auto_mut: Mutating residue number 29 from chain A (leucine) into lysine (03:14:30)
[INFO] Auto_mut: Mutating residue number 32 from chain A (leucine) into aspartic acid (03:15:04)
[INFO] Auto_mut: Mutating residue number 33 from chain A (tyrosine) into arginine (03:20:14)
[INFO] Auto_mut: Mutating residue number 29 from chain A (leucine) into aspartic acid (03:23:02)
[INFO] Auto_mut: Mutating residue number 32 from chain A (leucine) into arginine (03:23:24)
[INFO] Auto_mut: Mutating residue number 34 from chain A (threonine) into glutamic acid (03:28:48)
[INFO] Auto_mut: Mutating residue number 29 from chain A (leucine) into arginine (03:31:26)
[INFO] Auto_mut: Mutating residue number 23 from chain A (leucine) into glutamic acid (03:31:40)
[INFO] Auto_mut: Mutating residue number 34 from chain A (threonine) into lysine (03:37:13)
[INFO] Auto_mut: Mutating residue number 23 from chain A (leucine) into lysine (03:40:05)
[INFO] Auto_mut: Mutating residue number 41 from chain A (phenylalanine) into glutamic acid
Mutating residue number 41 from chain A (phenylalanine) into glutamic acid (03:40:08)
[INFO] Auto_mut: Mutating residue number 34 from chain A (threonine) into aspartic acid (03:46:02)
[INFO] Auto_mut: Mutating residue number 41 from chain A (phenylalanine) into lysine (03:48:43)
[INFO] Auto_mut: Mutating residue number 23 from chain A (leucine) into aspartic acid (03:49:08)
[INFO] Auto_mut: Mutating residue number 34 from chain A (threonine) into arginine (03:54:31)
[INFO] Auto_mut: Mutating residue number 23 from chain A (leucine) into arginine (03:57:29)
[INFO] Auto_mut: Mutating residue number 41 from chain A (phenylalanine) into aspartic acid
Mutating residue number 41 from chain A (phenylalanine) into aspartic acid (03:58:00)
[INFO] Auto_mut: Mutating residue number 37 from chain A (threonine) into glutamic acid (04:03:14)
[INFO] Auto_mut: Mutating residue number 37 from chain A (threonine) into lysine (04:06:33)
[INFO] Auto_mut: Mutating residue number 27 from chain A (histidine) into aspartic acid (04:07:04)
[INFO] Auto_mut: Mutating residue number 404 from chain A (phenylalanine) into arginine (04:12:11)
[INFO] Auto_mut: Mutating residue number 37 from chain A (threonine) into aspartic acid (04:15:26)
[INFO] Auto_mut: Mutating residue number 27 from chain A (histidine) into arginine (04:15:51)
[INFO] Auto_mut: Mutating residue number 37 from chain A (threonine) into arginine (04:24:22)
[INFO] Auto_mut: Mutating residue number 31 from chain A (serine) into glutamic acid (04:25:02)
[INFO] Auto_mut: Mutating residue number 30 from chain A (isoleucine) into glutamic acid (04:33:08)
[INFO] Auto_mut: Mutating residue number 31 from chain A (serine) into lysine (04:33:53)
[INFO] Auto_mut: Mutating residue number 30 from chain A (isoleucine) into lysine (04:41:48)
[INFO] Auto_mut: Mutating residue number 31 from chain A (serine) into aspartic acid (04:42:50)
[INFO] Auto_mut: Mutating residue number 30 from chain A (isoleucine) into aspartic acid (04:51:25)
[INFO] Auto_mut: Mutating residue number 31 from chain A (serine) into arginine (04:52:05)
[INFO] Auto_mut: Mutating residue number 30 from chain A (isoleucine) into arginine (05:01:33)
[INFO] Auto_mut: Mutating residue number 404 from chain A (phenylalanine) into glutamic acid
Mutating residue number 404 from chain A (phenylalanine) into glutamic acid (05:02:10)
[INFO] Auto_mut: Mutating residue number 27 from chain A (histidine) into glutamic acid (05:11:13)
[INFO] Auto_mut: Mutating residue number 404 from chain A (phenylalanine) into lysine (05:11:25)
[INFO] Auto_mut: Mutating residue number 404 from chain A (phenylalanine) into aspartic acid
Mutating residue number 404 from chain A (phenylalanine) into aspartic acid (05:23:51)
[INFO] Auto_mut: Mutating residue number 27 from chain A (histidine) into lysine (05:24:07)
[INFO] Auto_mut: Effect of mutation residue number 25 from chain A (phenylalanine) into
glutamic acid: Energy difference: 0.8749 kcal/mol, Difference in average
score from the base case: -0.0117 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 25 from chain A (phenylalanine) into
lysine: Energy difference: 0.4585 kcal/mol, Difference in average score
from the base case: -0.0125 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 25 from chain A (phenylalanine) into
aspartic acid: Energy difference: 1.3670 kcal/mol, Difference in average
score from the base case: -0.0100 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 25 from chain A (phenylalanine) into
arginine: Energy difference: 0.8104 kcal/mol, Difference in average score
from the base case: -0.0182 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 39 from chain A (isoleucine) into
glutamic acid: Energy difference: 0.3527 kcal/mol, Difference in average
score from the base case: -0.0126 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 39 from chain A (isoleucine) into lysine:
Energy difference: 0.3004 kcal/mol, Difference in average score from the
base case: -0.0149 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 39 from chain A (isoleucine) into
aspartic acid: Energy difference: 0.6535 kcal/mol, Difference in average
score from the base case: -0.0111 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 39 from chain A (isoleucine) into
arginine: Energy difference: 0.3735 kcal/mol, Difference in average score
from the base case: -0.0227 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 43 from chain A (phenylalanine) into
glutamic acid: Energy difference: 0.4988 kcal/mol, Difference in average
score from the base case: -0.0121 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 43 from chain A (phenylalanine) into
lysine: Energy difference: -0.0937 kcal/mol, Difference in average score
from the base case: -0.0147 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 43 from chain A (phenylalanine) into
aspartic acid: Energy difference: 0.8348 kcal/mol, Difference in average
score from the base case: -0.0104 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 43 from chain A (phenylalanine) into
arginine: Energy difference: 0.0384 kcal/mol, Difference in average score
from the base case: -0.0198 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 24 from chain A (tyrosine) into glutamic
acid: Energy difference: 0.3633 kcal/mol, Difference in average score from
the base case: -0.0129 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 24 from chain A (tyrosine) into lysine:
Energy difference: 0.4568 kcal/mol, Difference in average score from the
base case: -0.0132 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 24 from chain A (tyrosine) into aspartic
acid: Energy difference: 0.5795 kcal/mol, Difference in average score from
the base case: -0.0188 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 24 from chain A (tyrosine) into arginine:
Energy difference: 0.0266 kcal/mol, Difference in average score from the
base case: -0.0134 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 35 from chain A (isoleucine) into
glutamic acid: Energy difference: 0.6455 kcal/mol, Difference in average
score from the base case: -0.0143 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 35 from chain A (isoleucine) into lysine:
Energy difference: 0.1722 kcal/mol, Difference in average score from the
base case: -0.0192 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 35 from chain A (isoleucine) into
aspartic acid: Energy difference: 1.0658 kcal/mol, Difference in average
score from the base case: -0.0166 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 35 from chain A (isoleucine) into
arginine: Energy difference: 0.0484 kcal/mol, Difference in average score
from the base case: -0.0184 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 42 from chain A (tyrosine) into glutamic
acid: Energy difference: -0.9752 kcal/mol, Difference in average score from
the base case: -0.0174 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 42 from chain A (tyrosine) into lysine:
Energy difference: -1.0945 kcal/mol, Difference in average score from the
base case: -0.0161 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 42 from chain A (tyrosine) into aspartic
acid: Energy difference: -0.4162 kcal/mol, Difference in average score from
the base case: -0.0155 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 42 from chain A (tyrosine) into arginine:
Energy difference: -1.2872 kcal/mol, Difference in average score from the
base case: -0.0164 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 28 from chain A (phenylalanine) into
glutamic acid: Energy difference: 1.2634 kcal/mol, Difference in average
score from the base case: -0.0116 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 28 from chain A (phenylalanine) into
lysine: Energy difference: 0.7833 kcal/mol, Difference in average score
from the base case: -0.0144 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 28 from chain A (phenylalanine) into
aspartic acid: Energy difference: 1.8552 kcal/mol, Difference in average
score from the base case: -0.0154 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 28 from chain A (phenylalanine) into
arginine: Energy difference: 0.7674 kcal/mol, Difference in average score
from the base case: -0.0159 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 36 from chain A (leucine) into glutamic
acid: Energy difference: 0.4855 kcal/mol, Difference in average score from
the base case: -0.0132 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 36 from chain A (leucine) into lysine:
Energy difference: 0.0688 kcal/mol, Difference in average score from the
base case: -0.0159 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 36 from chain A (leucine) into aspartic
acid: Energy difference: 0.9587 kcal/mol, Difference in average score from
the base case: -0.0124 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 36 from chain A (leucine) into arginine:
Energy difference: 0.0668 kcal/mol, Difference in average score from the
base case: -0.0185 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 44 from chain A (phenylalanine) into
glutamic acid: Energy difference: 0.5179 kcal/mol, Difference in average
score from the base case: -0.0132 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 44 from chain A (phenylalanine) into
lysine: Energy difference: 0.1604 kcal/mol, Difference in average score
from the base case: -0.0141 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 44 from chain A (phenylalanine) into
aspartic acid: Energy difference: 0.5377 kcal/mol, Difference in average
score from the base case: -0.0147 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 44 from chain A (phenylalanine) into
arginine: Energy difference: -0.5168 kcal/mol, Difference in average score
from the base case: -0.0124 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 38 from chain A (tyrosine) into glutamic
acid: Energy difference: 1.1803 kcal/mol, Difference in average score from
the base case: -0.0016 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 38 from chain A (tyrosine) into lysine:
Energy difference: 1.1522 kcal/mol, Difference in average score from the
base case: -0.0136 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 38 from chain A (tyrosine) into aspartic
acid: Energy difference: 1.2090 kcal/mol, Difference in average score from
the base case: -0.0006 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 38 from chain A (tyrosine) into arginine:
Energy difference: 1.9735 kcal/mol, Difference in average score from the
base case: -0.0012 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 40 from chain A (proline) into glutamic
acid: Energy difference: 2.4870 kcal/mol, Difference in average score from
the base case: -0.0054 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 40 from chain A (proline) into lysine:
Energy difference: 1.4034 kcal/mol, Difference in average score from the
base case: -0.0054 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 40 from chain A (proline) into aspartic
acid: Energy difference: 2.3543 kcal/mol, Difference in average score from
the base case: -0.0018 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 40 from chain A (proline) into arginine:
Energy difference: 1.0164 kcal/mol, Difference in average score from the
base case: -0.0061 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 21 from chain A (isoleucine) into
glutamic acid: Energy difference: -0.0853 kcal/mol, Difference in average
score from the base case: -0.0132 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 21 from chain A (isoleucine) into lysine:
Energy difference: 0.0442 kcal/mol, Difference in average score from the
base case: -0.0129 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 21 from chain A (isoleucine) into
aspartic acid: Energy difference: 0.1774 kcal/mol, Difference in average
score from the base case: -0.0131 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 21 from chain A (isoleucine) into
arginine: Energy difference: -0.2797 kcal/mol, Difference in average score
from the base case: -0.0123 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 22 from chain A (leucine) into glutamic
acid: Energy difference: 0.8031 kcal/mol, Difference in average score from
the base case: -0.0110 (05:36:19)
[INFO] Auto_mut: Effect of mutation residue number 22 from chain A (leucine) into lysine:
Energy difference: 0.5707 kcal/mol, Difference in average score from the
base case: -0.0090 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 22 from chain A (leucine) into aspartic
acid: Energy difference: 1.3253 kcal/mol, Difference in average score from
the base case: -0.0104 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 22 from chain A (leucine) into arginine:
Energy difference: 0.8022 kcal/mol, Difference in average score from the
base case: -0.0149 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 26 from chain A (isoleucine) into
glutamic acid: Energy difference: 2.1393 kcal/mol, Difference in average
score from the base case: -0.0013 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 26 from chain A (isoleucine) into lysine:
Energy difference: 1.5367 kcal/mol, Difference in average score from the
base case: -0.0017 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 26 from chain A (isoleucine) into
aspartic acid: Energy difference: 2.8956 kcal/mol, Difference in average
score from the base case: -0.0021 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 26 from chain A (isoleucine) into
arginine: Energy difference: 1.8263 kcal/mol, Difference in average score
from the base case: -0.0054 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 29 from chain A (leucine) into glutamic
acid: Energy difference: 0.8344 kcal/mol, Difference in average score from
the base case: -0.0083 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 29 from chain A (leucine) into lysine:
Energy difference: 0.8791 kcal/mol, Difference in average score from the
base case: -0.0089 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 29 from chain A (leucine) into aspartic
acid: Energy difference: 1.6336 kcal/mol, Difference in average score from
the base case: -0.0066 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 29 from chain A (leucine) into arginine:
Energy difference: 1.1161 kcal/mol, Difference in average score from the
base case: -0.0155 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 41 from chain A (phenylalanine) into
glutamic acid: Energy difference: 1.8966 kcal/mol, Difference in average
score from the base case: -0.0058 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 41 from chain A (phenylalanine) into
lysine: Energy difference: 1.2596 kcal/mol, Difference in average score
from the base case: -0.0032 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 41 from chain A (phenylalanine) into
aspartic acid: Energy difference: 2.4811 kcal/mol, Difference in average
score from the base case: -0.0029 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 41 from chain A (phenylalanine) into
arginine: Energy difference: 0.9993 kcal/mol, Difference in average score
from the base case: -0.0019 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 32 from chain A (leucine) into glutamic
acid: Energy difference: 1.0593 kcal/mol, Difference in average score from
the base case: -0.0066 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 32 from chain A (leucine) into lysine:
Energy difference: 0.7379 kcal/mol, Difference in average score from the
base case: -0.0072 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 32 from chain A (leucine) into aspartic
acid: Energy difference: 1.1923 kcal/mol, Difference in average score from
the base case: -0.0045 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 32 from chain A (leucine) into arginine:
Energy difference: 0.6214 kcal/mol, Difference in average score from the
base case: -0.0148 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 23 from chain A (leucine) into glutamic
acid: Energy difference: 1.2108 kcal/mol, Difference in average score from
the base case: 0.0005 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 23 from chain A (leucine) into lysine:
Energy difference: 1.9890 kcal/mol, Difference in average score from the
base case: 0.0009 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 23 from chain A (leucine) into aspartic
acid: Energy difference: 2.4702 kcal/mol, Difference in average score from
the base case: -0.0022 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 23 from chain A (leucine) into arginine:
Energy difference: 2.6518 kcal/mol, Difference in average score from the
base case: -0.0034 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 33 from chain A (tyrosine) into glutamic
acid: Energy difference: 1.2179 kcal/mol, Difference in average score from
the base case: -0.0025 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 33 from chain A (tyrosine) into lysine:
Energy difference: 1.0801 kcal/mol, Difference in average score from the
base case: -0.0039 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 33 from chain A (tyrosine) into aspartic
acid: Energy difference: 2.0393 kcal/mol, Difference in average score from
the base case: -0.0071 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 33 from chain A (tyrosine) into arginine:
Energy difference: 0.6723 kcal/mol, Difference in average score from the
base case: -0.0096 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 34 from chain A (threonine) into glutamic
acid: Energy difference: 0.0974 kcal/mol, Difference in average score from
the base case: -0.0016 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 34 from chain A (threonine) into lysine:
Energy difference: -0.2805 kcal/mol, Difference in average score from the
base case: -0.0027 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 34 from chain A (threonine) into aspartic
acid: Energy difference: -0.5229 kcal/mol, Difference in average score from
the base case: -0.0030 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 34 from chain A (threonine) into
arginine: Energy difference: -0.1965 kcal/mol, Difference in average score
from the base case: -0.0115 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 37 from chain A (threonine) into glutamic
acid: Energy difference: 0.3948 kcal/mol, Difference in average score from
the base case: 0.0027 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 37 from chain A (threonine) into lysine:
Energy difference: -0.4048 kcal/mol, Difference in average score from the
base case: -0.0025 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 37 from chain A (threonine) into aspartic
acid: Energy difference: 1.2167 kcal/mol, Difference in average score from
the base case: 0.0019 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 37 from chain A (threonine) into
arginine: Energy difference: -0.3110 kcal/mol, Difference in average score
from the base case: -0.0016 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 30 from chain A (isoleucine) into
glutamic acid: Energy difference: 1.6866 kcal/mol, Difference in average
score from the base case: -0.0022 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 30 from chain A (isoleucine) into lysine:
Energy difference: 0.5313 kcal/mol, Difference in average score from the
base case: -0.0039 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 30 from chain A (isoleucine) into
aspartic acid: Energy difference: 2.3833 kcal/mol, Difference in average
score from the base case: -0.0006 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 30 from chain A (isoleucine) into
arginine: Energy difference: 0.7800 kcal/mol, Difference in average score
from the base case: -0.0043 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 27 from chain A (histidine) into glutamic
acid: Energy difference: -0.0901 kcal/mol, Difference in average score from
the base case: -0.0044 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 27 from chain A (histidine) into lysine:
Energy difference: -0.6377 kcal/mol, Difference in average score from the
base case: -0.0006 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 27 from chain A (histidine) into aspartic
acid: Energy difference: 0.4226 kcal/mol, Difference in average score from
the base case: -0.0038 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 27 from chain A (histidine) into
arginine: Energy difference: -0.3850 kcal/mol, Difference in average score
from the base case: -0.0038 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 31 from chain A (serine) into glutamic
acid: Energy difference: -0.3326 kcal/mol, Difference in average score from
the base case: -0.0105 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 31 from chain A (serine) into lysine:
Energy difference: -0.8283 kcal/mol, Difference in average score from the
base case: -0.0132 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 31 from chain A (serine) into aspartic
acid: Energy difference: 0.1299 kcal/mol, Difference in average score from
the base case: -0.0089 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 31 from chain A (serine) into arginine:
Energy difference: -0.6708 kcal/mol, Difference in average score from the
base case: -0.0200 (05:36:20)
[INFO] Auto_mut: Effect of mutation residue number 404 from chain A (phenylalanine) into
glutamic acid: Energy difference: -0.0600 kcal/mol, Difference in average
score from the base case: -0.0129 (05:36:21)
[INFO] Auto_mut: Effect of mutation residue number 404 from chain A (phenylalanine) into
lysine: Energy difference: 0.1882 kcal/mol, Difference in average score
from the base case: -0.0161 (05:36:21)
[INFO] Auto_mut: Effect of mutation residue number 404 from chain A (phenylalanine) into
aspartic acid: Energy difference: 0.2565 kcal/mol, Difference in average
score from the base case: -0.0155 (05:36:21)
[INFO] Auto_mut: Effect of mutation residue number 404 from chain A (phenylalanine) into
arginine: Energy difference: 0.2851 kcal/mol, Difference in average score
from the base case: -0.0178 (05:36:21)
[INFO] Main: Simulation completed successfully. (05:37:19)
|
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 | -0.0231 | |
| 2 | N | A | -1.4447 | |
| 3 | N | A | -1.5961 | |
| 4 | H | A | -1.1002 | |
| 5 | V | A | 0.2768 | |
| 6 | S | A | -0.5047 | |
| 7 | S | A | -0.8540 | |
| 8 | K | A | -1.7472 | |
| 9 | P | A | -1.2470 | |
| 10 | S | A | -0.7606 | |
| 11 | T | A | -0.8257 | |
| 12 | M | A | -0.2583 | |
| 13 | K | A | -1.8838 | |
| 14 | L | A | -1.3307 | |
| 15 | K | A | -2.1052 | |
| 16 | H | A | -1.4888 | |
| 17 | T | A | -0.7366 | |
| 18 | I | A | 0.2161 | |
| 19 | N | A | -0.1718 | |
| 20 | P | A | 1.1960 | |
| 21 | I | A | 3.0080 | |
| 22 | L | A | 2.9531 | |
| 23 | L | A | 2.4048 | |
| 24 | Y | A | 3.5543 | |
| 25 | F | A | 4.1900 | |
| 26 | I | A | 2.9493 | |
| 27 | H | A | 2.0760 | |
| 28 | F | A | 3.2504 | |
| 29 | L | A | 2.8276 | |
| 30 | I | A | 2.1887 | |
| 31 | S | A | 2.0384 | |
| 32 | L | A | 2.6065 | |
| 33 | Y | A | 2.3163 | |
| 34 | T | A | 2.3021 | |
| 35 | I | A | 3.3423 | |
| 36 | L | A | 3.2291 | |
| 37 | T | A | 2.2085 | |
| 38 | Y | A | 3.0978 | |
| 39 | I | A | 3.9050 | |
| 40 | P | A | 3.0772 | |
| 41 | F | A | 2.8134 | |
| 42 | Y | A | 3.2790 | |
| 43 | F | A | 3.7848 | |
| 44 | F | A | 3.2239 | |
| 45 | S | A | 0.7215 | |
| 46 | E | A | -1.6400 | |
| 47 | S | A | -2.0644 | |
| 48 | R | A | -2.9132 | |
| 49 | Q | A | -3.0899 | |
| 50 | E | A | -3.6927 | |
| 51 | K | A | -2.6215 | |
| 52 | S | A | 0.0000 | |
| 53 | N | A | -2.5788 | |
| 54 | R | A | -1.7333 | |
| 55 | I | A | -0.0555 | |
| 56 | K | A | 0.0000 | |
| 57 | A | A | 0.0000 | |
| 58 | K | A | -0.6083 | |
| 59 | P | A | -0.8989 | |
| 60 | V | A | -0.3524 | |
| 61 | N | A | -1.5422 | |
| 62 | S | A | -1.7116 | |
| 63 | K | A | -2.4780 | |
| 64 | P | A | -1.9562 | |
| 65 | D | A | -2.1667 | |
| 66 | S | A | 0.0000 | |
| 67 | A | A | 0.0000 | |
| 68 | Y | A | -0.3155 | |
| 69 | R | A | -0.4552 | |
| 70 | S | A | 0.0000 | |
| 71 | V | A | -0.2186 | |
| 72 | N | A | -1.2900 | |
| 73 | S | A | 0.0000 | |
| 74 | L | A | -0.6302 | |
| 75 | D | A | -1.6092 | |
| 76 | G | A | -1.0572 | |
| 77 | L | A | -0.4015 | |
| 78 | A | A | -0.2688 | |
| 79 | S | A | 0.0603 | |
| 80 | V | A | 0.5326 | |
| 81 | L | A | 0.3242 | |
| 82 | Y | A | 0.1358 | |
| 83 | P | A | -0.2961 | |
| 84 | G | A | -0.6800 | |
| 85 | C | A | 0.0000 | |
| 86 | D | A | -0.6231 | |
| 87 | T | A | 0.0000 | |
| 88 | L | A | 0.0000 | |
| 89 | D | A | 0.0000 | |
| 90 | K | A | -0.9777 | |
| 91 | V | A | 0.0000 | |
| 92 | F | A | 0.0000 | |
| 93 | T | A | -0.9012 | |
| 94 | Y | A | -0.9197 | |
| 95 | A | A | 0.0000 | |
| 96 | K | A | -2.2509 | |
| 97 | N | A | -2.6152 | |
| 98 | K | A | -2.8560 | |
| 99 | F | A | 0.0000 | |
| 100 | K | A | -3.3354 | |
| 101 | N | A | -3.2112 | |
| 102 | K | A | -3.1686 | |
| 103 | R | A | -3.0197 | |
| 104 | L | A | 0.0000 | |
| 105 | L | A | 0.0000 | |
| 106 | G | A | 0.0000 | |
| 107 | T | A | -0.8323 | |
| 108 | R | A | -0.8562 | |
| 109 | E | A | -1.0020 | |
| 110 | V | A | 0.8623 | |
| 111 | L | A | 1.0893 | |
| 112 | N | A | -0.7151 | |
| 113 | E | A | -2.6234 | |
| 114 | E | A | -2.6658 | |
| 115 | D | A | -2.3711 | |
| 116 | E | A | -0.8874 | |
| 117 | V | A | 0.7388 | |
| 118 | Q | A | -0.2905 | |
| 119 | P | A | -0.8654 | |
| 120 | N | A | -1.6733 | |
| 121 | G | A | -1.0423 | |
| 122 | K | A | -1.2976 | |
| 123 | I | A | 0.5234 | |
| 124 | F | A | -0.1903 | |
| 125 | K | A | -2.3757 | |
| 126 | K | A | -2.5630 | |
| 127 | V | A | 0.0000 | |
| 128 | I | A | -0.4714 | |
| 129 | L | A | -0.0731 | |
| 130 | G | A | 0.0000 | |
| 131 | Q | A | -1.4148 | |
| 132 | Y | A | -1.3106 | |
| 133 | N | A | -1.8743 | |
| 134 | W | A | -1.0880 | |
| 135 | L | A | -1.0502 | |
| 136 | S | A | -1.9394 | |
| 137 | Y | A | 0.0000 | |
| 138 | E | A | -1.9301 | |
| 139 | D | A | -1.3916 | |
| 140 | V | A | 0.0000 | |
| 141 | F | A | -0.1111 | |
| 142 | V | A | 0.5350 | |
| 143 | R | A | -0.1466 | |
| 144 | A | A | 0.0000 | |
| 145 | F | A | 0.3153 | |
| 146 | N | A | -0.0989 | |
| 147 | F | A | 0.0000 | |
| 148 | G | A | 0.0000 | |
| 149 | N | A | 0.0000 | |
| 150 | G | A | 0.0000 | |
| 151 | L | A | 0.0000 | |
| 152 | Q | A | -1.0582 | |
| 153 | M | A | 0.0317 | |
| 154 | L | A | -0.1856 | |
| 155 | G | A | -0.8082 | |
| 156 | Q | A | 0.0000 | |
| 157 | K | A | -2.4596 | |
| 158 | P | A | 0.0000 | |
| 159 | K | A | -2.2034 | |
| 160 | T | A | -1.6751 | |
| 161 | N | A | -1.1728 | |
| 162 | I | A | 0.0000 | |
| 163 | A | A | 0.0000 | |
| 164 | I | A | 0.0000 | |
| 165 | F | A | 0.0000 | |
| 166 | C | A | 0.0000 | |
| 167 | E | A | -1.1890 | |
| 168 | T | A | -0.6511 | |
| 169 | R | A | -0.6437 | |
| 170 | A | A | 0.0000 | |
| 171 | E | A | -0.5353 | |
| 172 | W | A | 0.0000 | |
| 173 | M | A | 0.0000 | |
| 174 | I | A | 0.0000 | |
| 175 | A | A | 0.0000 | |
| 176 | A | A | 0.0000 | |
| 177 | Q | A | 0.0000 | |
| 178 | A | A | 0.0000 | |
| 179 | C | A | 0.0000 | |
| 180 | F | A | 0.0000 | |
| 181 | M | A | 0.0000 | |
| 182 | Y | A | 0.0000 | |
| 183 | N | A | 0.0000 | |
| 184 | F | A | 0.0000 | |
| 185 | Q | A | -0.8131 | |
| 186 | L | A | 0.0000 | |
| 187 | V | A | 0.0000 | |
| 188 | T | A | 0.0000 | |
| 189 | L | A | 0.0000 | |
| 190 | Y | A | 0.0000 | |
| 191 | A | A | -0.5971 | |
| 192 | T | A | -0.6855 | |
| 193 | L | A | -0.5599 | |
| 194 | G | A | -0.9111 | |
| 195 | G | A | -0.7035 | |
| 196 | P | A | 0.0304 | |
| 197 | A | A | 0.0373 | |
| 198 | I | A | 0.0000 | |
| 199 | V | A | 0.1399 | |
| 200 | H | A | -0.1202 | |
| 201 | A | A | 0.0000 | |
| 202 | L | A | 0.0000 | |
| 203 | N | A | -1.1075 | |
| 204 | E | A | -1.3606 | |
| 205 | T | A | 0.0000 | |
| 206 | E | A | -2.3331 | |
| 207 | V | A | 0.0000 | |
| 208 | T | A | -1.2198 | |
| 209 | N | A | 0.0000 | |
| 210 | I | A | 0.0000 | |
| 211 | I | A | 0.0000 | |
| 212 | T | A | 0.0000 | |
| 213 | S | A | 0.0000 | |
| 214 | K | A | -1.9933 | |
| 215 | E | A | -2.5420 | |
| 216 | L | A | 0.0000 | |
| 217 | L | A | 0.0000 | |
| 218 | Q | A | -2.0270 | |
| 219 | T | A | -1.7423 | |
| 220 | K | A | -1.9379 | |
| 221 | L | A | 0.0000 | |
| 222 | K | A | -2.3619 | |
| 223 | D | A | -2.3644 | |
| 224 | I | A | 0.0000 | |
| 225 | V | A | 0.0000 | |
| 226 | S | A | -0.3033 | |
| 227 | L | A | 0.7916 | |
| 228 | V | A | 0.0000 | |
| 229 | P | A | -0.8017 | |
| 230 | R | A | -1.6557 | |
| 231 | L | A | 0.0000 | |
| 232 | R | A | -1.2172 | |
| 233 | H | A | -0.2308 | |
| 234 | I | A | 0.0000 | |
| 235 | I | A | 0.0000 | |
| 236 | T | A | 0.0000 | |
| 237 | V | A | 0.0000 | |
| 238 | D | A | -1.4358 | |
| 239 | G | A | -1.8401 | |
| 240 | K | A | -2.1325 | |
| 241 | P | A | -1.1237 | |
| 242 | P | A | -0.9427 | |
| 243 | T | A | -0.5281 | |
| 244 | W | A | -0.5462 | |
| 245 | S | A | -0.9371 | |
| 246 | E | A | -2.0783 | |
| 247 | F | A | -1.0105 | |
| 248 | P | A | -1.2976 | |
| 249 | K | A | -2.0653 | |
| 250 | G | A | -1.2591 | |
| 251 | I | A | -0.5565 | |
| 252 | I | A | 0.8691 | |
| 253 | V | A | 0.5535 | |
| 254 | H | A | 0.0600 | |
| 255 | T | A | -0.6394 | |
| 256 | M | A | 0.0000 | |
| 257 | A | A | -0.3121 | |
| 258 | A | A | 0.1168 | |
| 259 | V | A | 0.0000 | |
| 260 | E | A | -0.1986 | |
| 261 | A | A | -0.2793 | |
| 262 | L | A | -0.0010 | |
| 263 | G | A | 0.0000 | |
| 264 | A | A | -0.4803 | |
| 265 | K | A | -1.4762 | |
| 266 | A | A | -1.1782 | |
| 267 | S | A | -1.1801 | |
| 268 | M | A | -0.8145 | |
| 269 | E | A | -2.3764 | |
| 270 | N | A | -2.4113 | |
| 271 | Q | A | -2.4671 | |
| 272 | P | A | -2.0312 | |
| 273 | H | A | -2.2968 | |
| 274 | S | A | -1.4866 | |
| 275 | K | A | -1.2076 | |
| 276 | P | A | 0.0000 | |
| 277 | L | A | 1.0376 | |
| 278 | P | A | 0.3250 | |
| 279 | S | A | 0.1848 | |
| 280 | D | A | -0.0552 | |
| 281 | I | A | 0.0140 | |
| 282 | A | A | 0.0000 | |
| 283 | V | A | 0.0000 | |
| 284 | I | A | 0.0000 | |
| 285 | M | A | 0.0000 | |
| 286 | Y | A | 0.0000 | |
| 287 | T | A | 0.0092 | |
| 288 | S | A | -0.0886 | |
| 289 | G | A | 0.0000 | |
| 290 | S | A | -0.9964 | |
| 291 | T | A | -0.5066 | |
| 292 | G | A | -0.2910 | |
| 293 | L | A | 1.1226 | |
| 294 | P | A | 0.0000 | |
| 295 | K | A | -0.3749 | |
| 296 | G | A | 0.0000 | |
| 297 | V | A | 0.0000 | |
| 298 | M | A | 0.1180 | |
| 299 | I | A | 0.0000 | |
| 300 | S | A | 0.0000 | |
| 301 | H | A | 0.0000 | |
| 302 | S | A | -0.1615 | |
| 303 | N | A | 0.0000 | |
| 304 | I | A | 0.0000 | |
| 305 | I | A | 0.0000 | |
| 306 | A | A | 0.0000 | |
| 307 | G | A | 0.0000 | |
| 308 | I | A | 0.0000 | |
| 309 | T | A | 0.0778 | |
| 310 | G | A | 0.0000 | |
| 311 | M | A | 0.0000 | |
| 312 | A | A | 0.0000 | |
| 313 | E | A | -1.1901 | |
| 314 | R | A | 0.0000 | |
| 315 | I | A | -0.3694 | |
| 316 | P | A | -0.8720 | |
| 317 | E | A | -2.1255 | |
| 318 | L | A | -1.2585 | |
| 319 | G | A | -1.4407 | |
| 320 | E | A | -2.3131 | |
| 321 | E | A | -2.4715 | |
| 322 | D | A | 0.0000 | |
| 323 | V | A | 0.0000 | |
| 324 | Y | A | 0.0000 | |
| 325 | I | A | 0.0000 | |
| 326 | G | A | 0.0000 | |
| 327 | Y | A | 0.0000 | |
| 328 | L | A | 0.0000 | |
| 329 | P | A | -0.4529 | |
| 330 | L | A | 0.0000 | |
| 331 | A | A | 0.0000 | |
| 332 | H | A | -0.1978 | |
| 333 | V | A | 0.0000 | |
| 334 | L | A | 0.1113 | |
| 335 | E | A | 0.0000 | |
| 336 | L | A | 0.0000 | |
| 337 | S | A | 0.0000 | |
| 338 | A | A | 0.0712 | |
| 339 | E | A | 0.0000 | |
| 340 | L | A | 0.0000 | |
| 341 | V | A | 0.0000 | |
| 342 | C | A | 0.0000 | |
| 343 | L | A | 0.0000 | |
| 344 | S | A | 0.0000 | |
| 345 | H | A | -0.8672 | |
| 346 | G | A | 0.0000 | |
| 347 | C | A | 0.0000 | |
| 348 | R | A | -1.5220 | |
| 349 | I | A | 0.0000 | |
| 350 | G | A | 0.0000 | |
| 351 | Y | A | 0.0000 | |
| 352 | S | A | -0.2543 | |
| 353 | S | A | -0.5407 | |
| 354 | P | A | -0.5366 | |
| 355 | Q | A | -1.1325 | |
| 356 | T | A | 0.0000 | |
| 357 | L | A | 0.0000 | |
| 358 | A | A | 0.0000 | |
| 359 | D | A | -2.1660 | |
| 360 | Q | A | -2.0602 | |
| 361 | S | A | 0.0000 | |
| 362 | S | A | -1.3804 | |
| 363 | K | A | -1.9693 | |
| 364 | I | A | 0.0000 | |
| 365 | K | A | -2.8434 | |
| 366 | K | A | -2.7306 | |
| 367 | G | A | -1.9185 | |
| 368 | S | A | -1.7467 | |
| 369 | K | A | -2.0254 | |
| 370 | G | A | 0.0000 | |
| 371 | D | A | 0.0000 | |
| 372 | T | A | 0.0000 | |
| 373 | S | A | -0.8486 | |
| 374 | M | A | -0.6052 | |
| 375 | L | A | 0.0000 | |
| 376 | K | A | -1.2816 | |
| 377 | P | A | 0.0000 | |
| 378 | T | A | -1.0865 | |
| 379 | L | A | 0.0000 | |
| 380 | M | A | 0.0000 | |
| 381 | A | A | 0.0000 | |
| 382 | A | A | 0.0000 | |
| 383 | V | A | -0.0334 | |
| 384 | P | A | 0.0000 | |
| 385 | E | A | -1.3676 | |
| 386 | I | A | 0.0000 | |
| 387 | M | A | 0.0000 | |
| 388 | D | A | -1.0206 | |
| 389 | R | A | -1.1509 | |
| 390 | I | A | 0.0000 | |
| 391 | Y | A | -0.6141 | |
| 392 | K | A | -1.2900 | |
| 393 | N | A | -1.5403 | |
| 394 | V | A | 0.0000 | |
| 395 | M | A | -1.4393 | |
| 396 | N | A | -2.4763 | |
| 397 | K | A | -2.6037 | |
| 398 | V | A | 0.0000 | |
| 399 | S | A | -2.1513 | |
| 400 | E | A | -2.7956 | |
| 401 | M | A | -1.4863 | |
| 402 | S | A | -0.4163 | |
| 403 | S | A | -0.0249 | |
| 404 | F | A | 1.3931 | |
| 405 | Q | A | -0.2553 | |
| 406 | R | A | -0.8984 | |
| 407 | N | A | -0.0405 | |
| 408 | L | A | 0.7594 | |
| 409 | F | A | 0.0000 | |
| 410 | I | A | 0.0000 | |
| 411 | L | A | 0.0000 | |
| 412 | A | A | 0.0000 | |
| 413 | Y | A | 0.0000 | |
| 414 | N | A | -0.9973 | |
| 415 | Y | A | -0.7164 | |
| 416 | K | A | 0.0000 | |
| 417 | M | A | 0.0000 | |
| 418 | E | A | -2.1063 | |
| 419 | Q | A | 0.0000 | |
| 420 | I | A | 0.0000 | |
| 421 | S | A | -1.7862 | |
| 422 | K | A | -2.1310 | |
| 423 | G | A | -2.3151 | |
| 424 | R | A | -1.6931 | |
| 425 | N | A | -1.5450 | |
| 426 | T | A | 0.0000 | |
| 427 | P | A | 0.1171 | |
| 428 | L | A | 0.8376 | |
| 429 | C | A | 0.0000 | |
| 430 | D | A | 0.0000 | |
| 431 | S | A | 0.2177 | |
| 432 | F | A | 1.3407 | |
| 433 | V | A | 0.0000 | |
| 434 | F | A | 0.0000 | |
| 435 | R | A | -2.2799 | |
| 436 | K | A | -2.4774 | |
| 437 | V | A | 0.0000 | |
| 438 | R | A | -1.9025 | |
| 439 | S | A | -1.7340 | |
| 440 | L | A | -1.0126 | |
| 441 | L | A | 0.0000 | |
| 442 | G | A | -1.1594 | |
| 443 | G | A | -1.7935 | |
| 444 | N | A | -1.6466 | |
| 445 | I | A | 0.0000 | |
| 446 | R | A | -0.6694 | |
| 447 | L | A | -0.0735 | |
| 448 | L | A | 0.0000 | |
| 449 | L | A | 0.4037 | |
| 450 | C | A | 0.0000 | |
| 451 | G | A | 0.0000 | |
| 452 | G | A | -0.1103 | |
| 453 | A | A | -0.3202 | |
| 454 | P | A | -0.3989 | |
| 455 | L | A | 0.0000 | |
| 456 | S | A | -0.3704 | |
| 457 | A | A | -0.2947 | |
| 458 | T | A | -0.0310 | |
| 459 | T | A | 0.0000 | |
| 460 | Q | A | 0.0000 | |
| 461 | R | A | -0.1949 | |
| 462 | F | A | 0.0000 | |
| 463 | M | A | 0.0000 | |
| 464 | N | A | 0.0000 | |
| 465 | I | A | 0.0000 | |
| 466 | C | A | 0.0000 | |
| 467 | F | A | 0.0000 | |
| 468 | C | A | -0.5549 | |
| 469 | C | A | 0.0000 | |
| 470 | P | A | 0.1344 | |
| 471 | V | A | 0.0000 | |
| 472 | G | A | 0.1309 | |
| 473 | Q | A | 0.0000 | |
| 474 | G | A | 0.0541 | |
| 475 | Y | A | 0.0765 | |
| 476 | G | A | -0.0100 | |
| 477 | L | A | 0.1284 | |
| 478 | T | A | 0.0399 | |
| 479 | E | A | 0.0000 | |
| 480 | S | A | 0.0000 | |
| 481 | A | A | 0.0000 | |
| 482 | G | A | -0.0412 | |
| 483 | A | A | 0.0000 | |
| 484 | G | A | 0.0000 | |
| 485 | T | A | 0.0000 | |
| 486 | I | A | 0.2680 | |
| 487 | S | A | 0.0000 | |
| 488 | E | A | 0.0000 | |
| 489 | V | A | 0.4516 | |
| 490 | W | A | -0.5001 | |
| 491 | D | A | 0.0000 | |
| 492 | Y | A | -0.3989 | |
| 493 | N | A | -0.6557 | |
| 494 | T | A | -0.4616 | |
| 495 | G | A | -0.3394 | |
| 496 | R | A | 0.0000 | |
| 497 | V | A | 0.0000 | |
| 498 | G | A | 0.0000 | |
| 499 | A | A | 0.0000 | |
| 500 | P | A | 0.0000 | |
| 501 | L | A | 0.0000 | |
| 502 | V | A | 0.0000 | |
| 503 | C | A | 0.0000 | |
| 504 | C | A | 0.0000 | |
| 505 | E | A | 0.0000 | |
| 506 | I | A | 0.0000 | |
| 507 | K | A | -1.1157 | |
| 508 | L | A | 0.0000 | |
| 509 | K | A | -1.9139 | |
| 510 | N | A | -2.2392 | |
| 511 | W | A | -2.0802 | |
| 512 | E | A | -3.0196 | |
| 513 | E | A | -3.0204 | |
| 514 | G | A | 0.0000 | |
| 515 | G | A | -1.5668 | |
| 516 | Y | A | -1.1596 | |
| 517 | F | A | -1.0632 | |
| 518 | N | A | 0.0000 | |
| 519 | T | A | -1.0684 | |
| 520 | D | A | -1.3508 | |
| 521 | K | A | -2.0643 | |
| 522 | P | A | -1.6020 | |
| 523 | H | A | -1.3326 | |
| 524 | P | A | -1.1879 | |
| 525 | R | A | -1.0300 | |
| 526 | G | A | 0.0000 | |
| 527 | E | A | 0.0000 | |
| 528 | I | A | 0.0000 | |
| 529 | L | A | 0.0000 | |
| 530 | I | A | 0.0000 | |
| 531 | G | A | 0.0000 | |
| 532 | G | A | 0.0000 | |
| 533 | Q | A | -0.7822 | |
| 534 | S | A | 0.0000 | |
| 535 | V | A | 0.0000 | |
| 536 | T | A | 0.0000 | |
| 537 | M | A | 0.2792 | |
| 538 | G | A | 0.0000 | |
| 539 | Y | A | 0.0000 | |
| 540 | Y | A | -1.2116 | |
| 541 | K | A | -2.4795 | |
| 542 | N | A | -2.5850 | |
| 543 | E | A | -3.1135 | |
| 544 | A | A | -2.0309 | |
| 545 | K | A | -2.0350 | |
| 546 | T | A | -1.9503 | |
| 547 | K | A | -2.4426 | |
| 548 | A | A | -1.1520 | |
| 549 | D | A | -0.8036 | |
| 550 | F | A | 0.0000 | |
| 551 | F | A | -0.8717 | |
| 552 | E | A | -3.0112 | |
| 553 | D | A | -2.9668 | |
| 554 | E | A | -3.3952 | |
| 555 | N | A | -3.0572 | |
| 556 | G | A | -2.6214 | |
| 557 | Q | A | -2.3068 | |
| 558 | R | A | -1.9783 | |
| 559 | W | A | 0.0000 | |
| 560 | L | A | 0.0000 | |
| 561 | C | A | 0.0045 | |
| 562 | T | A | 0.0000 | |
| 563 | G | A | 0.0000 | |
| 564 | D | A | 0.0000 | |
| 565 | I | A | 0.0000 | |
| 566 | G | A | 0.0000 | |
| 567 | E | A | -0.5259 | |
| 568 | F | A | 0.0000 | |
| 569 | E | A | -0.8588 | |
| 570 | P | A | -0.6152 | |
| 571 | D | A | -0.6524 | |
| 572 | G | A | 0.0000 | |
| 573 | C | A | 0.0000 | |
| 574 | L | A | 0.0000 | |
| 575 | K | A | -0.4585 | |
| 576 | I | A | 0.2504 | |
| 577 | I | A | -0.0066 | |
| 578 | D | A | 0.0000 | |
| 579 | R | A | -1.5682 | |
| 580 | K | A | -1.8897 | |
| 581 | K | A | -2.3026 | |
| 582 | D | A | -1.6988 | |
| 583 | L | A | 0.0000 | |
| 584 | V | A | -1.0552 | |
| 585 | K | A | -1.5672 | |
| 586 | L | A | 0.0000 | |
| 587 | Q | A | -1.3118 | |
| 588 | A | A | -0.8192 | |
| 589 | G | A | -1.1720 | |
| 590 | E | A | -1.1581 | |
| 591 | Y | A | -0.8342 | |
| 592 | V | A | 0.0000 | |
| 593 | S | A | 0.0000 | |
| 594 | L | A | 0.0000 | |
| 595 | G | A | -0.9012 | |
| 596 | K | A | -1.3746 | |
| 597 | V | A | 0.0000 | |
| 598 | E | A | 0.0000 | |
| 599 | A | A | -0.6592 | |
| 600 | A | A | -0.2735 | |
| 601 | L | A | 0.0000 | |
| 602 | K | A | -0.8507 | |
| 603 | N | A | -0.7215 | |
| 604 | L | A | -0.4956 | |
| 605 | P | A | -1.0875 | |
| 606 | L | A | 0.0000 | |
| 607 | V | A | 0.0000 | |
| 608 | D | A | -2.3431 | |
| 609 | N | A | -1.0781 | |
| 610 | I | A | 0.0000 | |
| 611 | C | A | 0.0000 | |
| 612 | A | A | 0.0000 | |
| 613 | Y | A | 0.0000 | |
| 614 | A | A | 0.0000 | |
| 615 | N | A | -0.3144 | |
| 616 | S | A | -0.4837 | |
| 617 | Y | A | 0.5322 | |
| 618 | H | A | -0.2116 | |
| 619 | S | A | -0.5506 | |
| 620 | Y | A | 0.0664 | |
| 621 | V | A | 0.0000 | |
| 622 | I | A | 0.0000 | |
| 623 | G | A | 0.0000 | |
| 624 | F | A | 0.0000 | |
| 625 | V | A | 0.0000 | |
| 626 | V | A | 0.0000 | |
| 627 | P | A | 0.0000 | |
| 628 | N | A | -2.3449 | |
| 629 | Q | A | -2.7078 | |
| 630 | K | A | -2.9091 | |
| 631 | E | A | -2.4480 | |
| 632 | L | A | 0.0000 | |
| 633 | T | A | -2.4358 | |
| 634 | E | A | -2.5842 | |
| 635 | L | A | -2.1840 | |
| 636 | A | A | 0.0000 | |
| 637 | R | A | -3.6827 | |
| 638 | K | A | -3.3350 | |
| 639 | K | A | -3.2614 | |
| 640 | G | A | -2.3862 | |
| 641 | L | A | -2.1463 | |
| 642 | K | A | -2.5436 | |
| 643 | G | A | -2.2916 | |
| 644 | T | A | -1.8544 | |
| 645 | W | A | -2.0199 | |
| 646 | E | A | -3.1350 | |
| 647 | E | A | -3.4067 | |
| 648 | L | A | 0.0000 | |
| 649 | C | A | 0.0000 | |
| 650 | N | A | -2.5365 | |
| 651 | S | A | -1.8189 | |
| 652 | C | A | -0.9966 | |
| 653 | E | A | -2.0766 | |
| 654 | M | A | 0.0000 | |
| 655 | E | A | 0.0000 | |
| 656 | N | A | -2.0534 | |
| 657 | E | A | -1.6916 | |
| 658 | V | A | 0.0000 | |
| 659 | L | A | -1.2966 | |
| 660 | K | A | -2.0205 | |
| 661 | V | A | -0.9071 | |
| 662 | L | A | 0.0000 | |
| 663 | S | A | -0.7166 | |
| 664 | E | A | -1.4208 | |
| 665 | A | A | -0.3888 | |
| 666 | A | A | 0.0000 | |
| 667 | I | A | 0.6184 | |
| 668 | S | A | 0.2220 | |
| 669 | A | A | 0.0184 | |
| 670 | S | A | -0.2082 | |
| 671 | L | A | 0.0000 | |
| 672 | E | A | -2.1799 | |
| 673 | K | A | -1.8769 | |
| 674 | F | A | -0.8142 | |
| 675 | E | A | 0.0000 | |
| 676 | I | A | 0.0000 | |
| 677 | P | A | 0.0000 | |
| 678 | V | A | 0.6310 | |
| 679 | K | A | -0.3988 | |
| 680 | I | A | 0.0000 | |
| 681 | R | A | -0.7806 | |
| 682 | L | A | 0.0000 | |
| 683 | S | A | 0.0000 | |
| 684 | P | A | -1.6436 | |
| 685 | E | A | -1.0998 | |
| 686 | P | A | -1.0983 | |
| 687 | W | A | 0.0000 | |
| 688 | T | A | -0.7670 | |
| 689 | P | A | -1.0077 | |
| 690 | E | A | -2.0166 | |
| 691 | T | A | -1.2866 | |
| 692 | G | A | -1.2049 | |
| 693 | L | A | 0.0000 | |
| 694 | V | A | 0.0000 | |
| 695 | T | A | -0.3848 | |
| 696 | D | A | -0.4671 | |
| 697 | A | A | -0.0790 | |
| 698 | F | A | 0.3146 | |
| 699 | K | A | -0.4380 | |
| 700 | L | A | -0.6088 | |
| 701 | K | A | -1.4490 | |
| 702 | R | A | -2.1631 | |
| 703 | K | A | -2.8935 | |
| 704 | E | A | -2.6728 | |
| 705 | L | A | 0.0000 | |
| 706 | K | A | -2.2139 | |
| 707 | T | A | -1.8658 | |
| 708 | H | A | -1.7838 | |
| 709 | Y | A | 0.0000 | |
| 710 | Q | A | -1.5249 | |
| 711 | A | A | -1.2538 | |
| 712 | D | A | -1.2677 | |
| 713 | I | A | 0.0000 | |
| 714 | E | A | -2.1959 | |
| 715 | R | A | -2.2608 | |
| 716 | M | A | 0.0000 | |
| 717 | Y | A | -1.2734 | |
| 718 | G | A | -2.2455 | |
| 719 | R | A | -3.2720 | |
| 720 | K | A | -2.7496 |
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 |
|||
| YR42A | -1.2872 | -0.0164 | View | CSV | PDB |
| YK42A | -1.0945 | -0.0161 | View | CSV | PDB |
| SR31A | -0.6708 | -0.02 | View | CSV | PDB |
| SK31A | -0.8283 | -0.0132 | View | CSV | PDB |
| FR44A | -0.5168 | -0.0124 | View | CSV | PDB |
| IR21A | -0.2797 | -0.0123 | View | CSV | PDB |
| FK43A | -0.0937 | -0.0147 | View | CSV | PDB |
| TR34A | -0.1965 | -0.0115 | View | CSV | PDB |
| IE21A | -0.0853 | -0.0132 | View | CSV | PDB |
| FE404A | -0.06 | -0.0129 | View | CSV | PDB |
| HR27A | -0.385 | -0.0038 | View | CSV | PDB |
| TD34A | -0.5229 | -0.003 | View | CSV | PDB |
| HE27A | -0.0901 | -0.0044 | View | CSV | PDB |
| TK37A | -0.4048 | -0.0025 | View | CSV | PDB |
| TR37A | -0.311 | -0.0016 | View | CSV | PDB |
| FR43A | 0.0384 | -0.0198 | View | CSV | PDB |
| YR24A | 0.0266 | -0.0134 | View | CSV | PDB |
| IR35A | 0.0484 | -0.0184 | View | CSV | PDB |
| LR36A | 0.0668 | -0.0185 | View | CSV | PDB |
| LK36A | 0.0688 | -0.0159 | View | CSV | PDB |
| IK35A | 0.1722 | -0.0192 | View | CSV | PDB |
| FK44A | 0.1604 | -0.0141 | View | CSV | PDB |
| FK404A | 0.1882 | -0.0161 | View | CSV | PDB |
| IR39A | 0.3735 | -0.0227 | View | CSV | PDB |
| IK39A | 0.3004 | -0.0149 | View | CSV | PDB |
| YE24A | 0.3633 | -0.0129 | View | CSV | PDB |
| FK25A | 0.4585 | -0.0125 | View | CSV | PDB |
| LR32A | 0.6214 | -0.0148 | View | CSV | PDB |
| FR25A | 0.8104 | -0.0182 | View | CSV | PDB |
| FR28A | 0.7674 | -0.0159 | View | CSV | PDB |
| LR22A | 0.8022 | -0.0149 | View | CSV | PDB |
| FK28A | 0.7833 | -0.0144 | View | CSV | PDB |
| LK22A | 0.5707 | -0.009 | View | CSV | PDB |
| YR33A | 0.6723 | -0.0096 | View | CSV | PDB |
| LR29A | 1.1161 | -0.0155 | View | CSV | PDB |
| YK38A | 1.1522 | -0.0136 | View | CSV | PDB |
| LK29A | 0.8791 | -0.0089 | View | CSV | PDB |
| LK32A | 0.7379 | -0.0072 | View | CSV | PDB |
| IK30A | 0.5313 | -0.0039 | View | CSV | PDB |
| PR40A | 1.0164 | -0.0061 | View | CSV | PDB |
| IR30A | 0.78 | -0.0043 | View | CSV | PDB |
| PK40A | 1.4034 | -0.0054 | View | CSV | PDB |
| YK33A | 1.0801 | -0.0039 | View | CSV | PDB |
| FE41A | 1.8966 | -0.0058 | View | CSV | PDB |
| IR26A | 1.8263 | -0.0054 | View | CSV | PDB |
| FK41A | 1.2596 | -0.0032 | View | CSV | PDB |
| YE38A | 1.1803 | -0.0016 | View | CSV | PDB |
| LR23A | 2.6518 | -0.0034 | View | CSV | PDB |
| IK26A | 1.5367 | -0.0017 | View | CSV | PDB |
| LD23A | 2.4702 | -0.0022 | 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