| Chain sequence(s) |
A: TIAFEFDGQQVEAQETIWAVAKRLGTHIPHLCHKPDPGYRPDGNCRACMVEIEGERVLAASCKRTPAIGMKVKSATERATKARAMVLELLVADQPERATSHDPSSHFWVQADVLDVTESRFPAAERWTSDVSHPAMSVNLDACIQCNLCVRACREVQVNDVIGMAYRAAGSKVVFDFDDPMGGSTCVACGECVQACPTGALMPAAYLDANQTRTVYPDREVKSLCPYCGVGCQVSYKVKDERIVYAEGVNGPANQNRLCVKGRFGFDYVHHPHRLTVPLIRLENVPKDANDQVDPANPWTHFREATWEEALDRAAGGLKAIRDTNGRKALAGFGSAKGSNEEAYLFQKLVRLGFGTNNVDHCTRLCHASSVAALMEGLNSGAVTAPFSAALDAEVIVVIGANPTVNHPVAATFLKNAVKQRGAKLIIMDPRRQTLSRHAYRHLAFRPGSDVAMLNAMLNVIVTEGLYDEQYIAGYTENFEALREKIVDFTPEKMASVCGIDAETLREVARLYARAKSSLIFWGMGVSQHVHGTDNSRCLIALALITGQIGRPGTGLHPLRGQNNVQGASDAGLIPMVYPDYQSVEKDAVRELFEEFWGQSLDPQKGLTVVEIMRAIHAGEIRGMFVEGENPAMSDPDLNHARHALAMLDHLVVQDLFLTETAFHADVVLPASAFAEKAGTFTNTDRRVQIAQPVVAPPGDARQDWWIIQELARRLDLDWNYGGPADIFAEMAQVMPSLNNITWERLEREGAVTYPVDAPDQPGNEIIFYAGFPTESGRAKIVPAAIVPPDEVPDDEFPMVLSTGRVLEHWHTGSMTRRAGVLDALEPEAVAFMAPKELYRLGLRPGGSMRLETRRGAVVLKVRSDRDVPIGMIFMPFCYAEAAANLLTNPALDPLGKIPEFKFCAARVVPA
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 (00:07:35)
[INFO] Auto_mut: Residue number 138 from chain A and a score of 1.521 (isoleucine) selected
for automated muatation (00:07:44)
[INFO] Auto_mut: Residue number 201 from chain A and a score of 1.334 (valine) selected for
automated muatation (00:07:44)
[INFO] Auto_mut: Residue number 839 from chain A and a score of 1.217 (tyrosine) selected
for automated muatation (00:07:44)
[INFO] Auto_mut: Residue number 856 from chain A and a score of 1.180 (isoleucine) selected
for automated muatation (00:07:44)
[INFO] Auto_mut: Residue number 159 from chain A and a score of 1.130 (leucine) selected for
automated muatation (00:07:44)
[INFO] Auto_mut: Residue number 247 from chain A and a score of 0.959 (phenylalanine)
selected for automated muatation (00:07:44)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into glutamic acid (00:07:44)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into aspartic acid (00:07:44)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into glutamic acid (00:07:44)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into arginine (00:11:24)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into lysine (00:11:27)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into lysine (00:11:28)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into aspartic acid (00:15:01)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into glutamic acid (00:15:02)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into aspartic acid (00:15:08)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into arginine (00:18:38)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into lysine (00:18:45)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into arginine (00:18:49)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into glutamic acid (00:22:09)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into aspartic acid (00:22:41)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into glutamic acid (00:22:41)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into lysine (00:25:47)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into lysine (00:26:20)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into arginine (00:26:21)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into aspartic acid (00:29:33)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into glutamic acid
Mutating residue number 247 from chain A (phenylalanine) into glutamic acid (00:30:06)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into aspartic acid
Mutating residue number 247 from chain A (phenylalanine) into aspartic acid (00:30:12)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into arginine (00:33:13)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into lysine (00:33:43)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into arginine (00:33:49)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
glutamic acid: Energy difference: -0.4317 kcal/mol, Difference in average
score from the base case: -0.0178 (00:37:29)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
lysine: Energy difference: -0.0769 kcal/mol, Difference in average score
from the base case: -0.0171 (00:37:29)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
aspartic acid: Energy difference: 0.4773 kcal/mol, Difference in average
score from the base case: -0.0169 (00:37:29)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
arginine: Energy difference: 0.0511 kcal/mol, Difference in average score
from the base case: -0.0167 (00:37:29)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into glutamic
acid: Energy difference: -0.2463 kcal/mol, Difference in average score from
the base case: -0.0161 (00:37:29)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into lysine:
Energy difference: 0.1422 kcal/mol, Difference in average score from the
base case: -0.0154 (00:37:29)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into aspartic
acid: Energy difference: 0.3831 kcal/mol, Difference in average score from
the base case: -0.0167 (00:37:29)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into arginine:
Energy difference: -0.0067 kcal/mol, Difference in average score from the
base case: -0.0150 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into glutamic
acid: Energy difference: -0.0623 kcal/mol, Difference in average score from
the base case: -0.0163 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into lysine:
Energy difference: -0.2886 kcal/mol, Difference in average score from the
base case: -0.0144 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into aspartic
acid: Energy difference: 0.2278 kcal/mol, Difference in average score from
the base case: -0.0161 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into
arginine: Energy difference: -0.7383 kcal/mol, Difference in average score
from the base case: -0.0172 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
glutamic acid: Energy difference: 1.9432 kcal/mol, Difference in average
score from the base case: -0.0091 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
lysine: Energy difference: 1.3337 kcal/mol, Difference in average score
from the base case: -0.0091 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
aspartic acid: Energy difference: 2.1484 kcal/mol, Difference in average
score from the base case: -0.0129 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
arginine: Energy difference: 1.2791 kcal/mol, Difference in average score
from the base case: -0.0117 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into glutamic
acid: Energy difference: 1.1598 kcal/mol, Difference in average score from
the base case: -0.0126 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into lysine:
Energy difference: 0.3311 kcal/mol, Difference in average score from the
base case: -0.0154 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into aspartic
acid: Energy difference: 2.3004 kcal/mol, Difference in average score from
the base case: -0.0162 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into arginine:
Energy difference: 0.6153 kcal/mol, Difference in average score from the
base case: -0.0170 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
glutamic acid: Energy difference: 0.5620 kcal/mol, Difference in average
score from the base case: -0.0140 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
lysine: Energy difference: -0.4835 kcal/mol, Difference in average score
from the base case: -0.0150 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
aspartic acid: Energy difference: -0.4283 kcal/mol, Difference in average
score from the base case: -0.0171 (00:37:30)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
arginine: Energy difference: -0.5531 kcal/mol, Difference in average score
from the base case: -0.0148 (00:37:30)
[INFO] Main: Simulation completed successfully. (00:37:49)
[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 (00:07:43)
[INFO] Auto_mut: Residue number 138 from chain A and a score of 1.521 (isoleucine) selected
for automated muatation (00:07:51)
[INFO] Auto_mut: Residue number 201 from chain A and a score of 1.334 (valine) selected for
automated muatation (00:07:51)
[INFO] Auto_mut: Residue number 839 from chain A and a score of 1.217 (tyrosine) selected
for automated muatation (00:07:51)
[INFO] Auto_mut: Residue number 856 from chain A and a score of 1.180 (isoleucine) selected
for automated muatation (00:07:51)
[INFO] Auto_mut: Residue number 159 from chain A and a score of 1.130 (leucine) selected for
automated muatation (00:07:51)
[INFO] Auto_mut: Residue number 247 from chain A and a score of 0.959 (phenylalanine)
selected for automated muatation (00:07:51)
[INFO] Auto_mut: Residue number 965 from chain A and a score of 0.922 (leucine) selected for
automated muatation (00:07:51)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into glutamic acid (00:07:51)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into arginine (00:07:51)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into aspartic acid (00:07:51)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into glutamic acid (00:11:30)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into lysine (00:11:36)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into arginine (00:11:36)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into lysine (00:15:11)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into glutamic acid (00:15:14)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into aspartic acid (00:15:18)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into lysine (00:18:52)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into glutamic acid (00:18:59)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into arginine (00:19:00)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into lysine (00:22:41)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into glutamic acid (00:22:46)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into aspartic acid (00:22:50)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into lysine (00:26:30)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into aspartic acid (00:26:33)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into arginine (00:26:40)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into aspartic acid (00:30:16)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into lysine (00:30:24)
[INFO] Auto_mut: Mutating residue number 965 from chain A (leucine) into glutamic acid (00:30:34)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into arginine (00:34:03)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into aspartic acid
Mutating residue number 247 from chain A (phenylalanine) into aspartic acid (00:34:13)
[INFO] Auto_mut: Mutating residue number 965 from chain A (leucine) into lysine (00:34:25)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into arginine (00:37:53)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into glutamic acid
Mutating residue number 247 from chain A (phenylalanine) into glutamic acid (00:37:55)
[INFO] Auto_mut: Mutating residue number 965 from chain A (leucine) into aspartic acid (00:38:26)
[INFO] Auto_mut: Mutating residue number 965 from chain A (leucine) into arginine (00:41:33)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
glutamic acid: Energy difference: -0.4317 kcal/mol, Difference in average
score from the base case: -0.0178 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
lysine: Energy difference: -0.0769 kcal/mol, Difference in average score
from the base case: -0.0171 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
aspartic acid: Energy difference: 0.4773 kcal/mol, Difference in average
score from the base case: -0.0169 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
arginine: Energy difference: 0.0511 kcal/mol, Difference in average score
from the base case: -0.0167 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into glutamic
acid: Energy difference: -0.2463 kcal/mol, Difference in average score from
the base case: -0.0161 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into lysine:
Energy difference: 0.1422 kcal/mol, Difference in average score from the
base case: -0.0154 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into aspartic
acid: Energy difference: 0.3831 kcal/mol, Difference in average score from
the base case: -0.0167 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into arginine:
Energy difference: -0.0067 kcal/mol, Difference in average score from the
base case: -0.0150 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into glutamic
acid: Energy difference: -0.0623 kcal/mol, Difference in average score from
the base case: -0.0163 (00:45:23)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into lysine:
Energy difference: -0.2886 kcal/mol, Difference in average score from the
base case: -0.0144 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into aspartic
acid: Energy difference: 0.2278 kcal/mol, Difference in average score from
the base case: -0.0161 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into
arginine: Energy difference: -0.7383 kcal/mol, Difference in average score
from the base case: -0.0172 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
glutamic acid: Energy difference: 1.9432 kcal/mol, Difference in average
score from the base case: -0.0091 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
lysine: Energy difference: 1.3337 kcal/mol, Difference in average score
from the base case: -0.0091 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
aspartic acid: Energy difference: 2.1484 kcal/mol, Difference in average
score from the base case: -0.0129 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
arginine: Energy difference: 1.2791 kcal/mol, Difference in average score
from the base case: -0.0117 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into glutamic
acid: Energy difference: 1.1598 kcal/mol, Difference in average score from
the base case: -0.0126 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into lysine:
Energy difference: 0.3311 kcal/mol, Difference in average score from the
base case: -0.0154 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into aspartic
acid: Energy difference: 2.3004 kcal/mol, Difference in average score from
the base case: -0.0162 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into arginine:
Energy difference: 0.6153 kcal/mol, Difference in average score from the
base case: -0.0170 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
glutamic acid: Energy difference: 0.5620 kcal/mol, Difference in average
score from the base case: -0.0140 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
lysine: Energy difference: -0.4835 kcal/mol, Difference in average score
from the base case: -0.0150 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
aspartic acid: Energy difference: -0.4283 kcal/mol, Difference in average
score from the base case: -0.0171 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
arginine: Energy difference: -0.5531 kcal/mol, Difference in average score
from the base case: -0.0148 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 965 from chain A (leucine) into glutamic
acid: Energy difference: 1.1751 kcal/mol, Difference in average score from
the base case: -0.0117 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 965 from chain A (leucine) into lysine:
Energy difference: 0.2838 kcal/mol, Difference in average score from the
base case: -0.0101 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 965 from chain A (leucine) into aspartic
acid: Energy difference: 1.7077 kcal/mol, Difference in average score from
the base case: -0.0119 (00:45:24)
[INFO] Auto_mut: Effect of mutation residue number 965 from chain A (leucine) into arginine:
Energy difference: 0.2572 kcal/mol, Difference in average score from the
base case: -0.0087 (00:45:24)
[INFO] Main: Simulation completed successfully. (00:45:44)
[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 (00:08:09)
[INFO] Auto_mut: Residue number 138 from chain A and a score of 1.521 (isoleucine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 201 from chain A and a score of 1.334 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 839 from chain A and a score of 1.217 (tyrosine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 856 from chain A and a score of 1.180 (isoleucine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 159 from chain A and a score of 1.130 (leucine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 247 from chain A and a score of 0.959 (phenylalanine)
selected for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 965 from chain A and a score of 0.922 (leucine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 160 from chain A and a score of 0.896 (leucine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 940 from chain A and a score of 0.856 (isoleucine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 929 from chain A and a score of 0.839 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 838 from chain A and a score of 0.760 (phenylalanine)
selected for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 857 from chain A and a score of 0.755 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 862 from chain A and a score of 0.735 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 137 from chain A and a score of 0.635 (alanine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 257 from chain A and a score of 0.624 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 840 from chain A and a score of 0.603 (alanine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 179 from chain A and a score of 0.484 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 941 from chain A and a score of 0.475 (glycine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 837 from chain A and a score of 0.438 (isoleucine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 156 from chain A and a score of 0.398 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 855 from chain A and a score of 0.394 (alanine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 236 from chain A and a score of 0.363 (tyrosine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 870 from chain A and a score of 0.361 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 369 from chain A and a score of 0.341 (tryptophan) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 127 from chain A and a score of 0.332 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 235 from chain A and a score of 0.313 (alanine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 620 from chain A and a score of 0.309 (glycine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 964 from chain A and a score of 0.277 (proline) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 139 from chain A and a score of 0.273 (glycine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 202 from chain A and a score of 0.255 (serine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 441 from chain A and a score of 0.238 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 877 from chain A and a score of 0.237 (leucine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 841 from chain A and a score of 0.233 (glycine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 475 from chain A and a score of 0.222 (valine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 204 from chain A and a score of 0.216 (proline) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 155 from chain A and a score of 0.189 (methionine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 370 from chain A and a score of 0.176 (threonine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 947 from chain A and a score of 0.167 (phenylalanine)
selected for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 442 from chain A and a score of 0.152 (alanine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 274 from chain A and a score of 0.150 (alanine) selected for
automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 510 from chain A and a score of 0.141 (tyrosine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 436 from chain A and a score of 0.135 (cysteine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 836 from chain A and a score of 0.117 (isoleucine) selected
for automated muatation (00:08:18)
[INFO] Auto_mut: Residue number 858 from chain A and a score of 0.110 (proline) selected for
automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 234 from chain A and a score of 0.102 (methionine) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 474 from chain A and a score of 0.095 (threonine) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 233 from chain A and a score of 0.083 (glycine) selected for
automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 183 from chain A and a score of 0.047 (valine) selected for
automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 285 from chain A and a score of 0.047 (valine) selected for
automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 775 from chain A and a score of 0.045 (tryptophan) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 256 from chain A and a score of 0.044 (cysteine) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 651 from chain A and a score of 0.030 (tyrosine) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 594 from chain A and a score of 0.019 (methionine) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 876 from chain A and a score of 0.016 (valine) selected for
automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 854 from chain A and a score of 0.014 (alanine) selected for
automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 726 from chain A and a score of 0.002 (leucine) selected for
automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 452 from chain A and a score of -0.011 (alanine) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 704 from chain A and a score of -0.015 (serine) selected for
automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 981 from chain A and a score of -0.022 (alanine) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Residue number 275 from chain A and a score of -0.025 (alanine) selected
for automated muatation (00:08:19)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into glutamic acid (00:08:19)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into glutamic acid
Mutating residue number 247 from chain A (phenylalanine) into glutamic acid (00:08:19)
[INFO] Auto_mut: Mutating residue number 838 from chain A (phenylalanine) into glutamic acid
Mutating residue number 838 from chain A (phenylalanine) into glutamic acid (00:08:19)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into lysine (00:12:00)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into lysine (00:12:03)
[INFO] Auto_mut: Mutating residue number 838 from chain A (phenylalanine) into lysine (00:12:07)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into aspartic acid (00:15:48)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into aspartic acid
Mutating residue number 247 from chain A (phenylalanine) into aspartic acid (00:15:50)
[INFO] Auto_mut: Mutating residue number 838 from chain A (phenylalanine) into aspartic acid
Mutating residue number 838 from chain A (phenylalanine) into aspartic acid (00:16:01)
[INFO] Auto_mut: Mutating residue number 138 from chain A (isoleucine) into arginine (00:19:31)
[INFO] Auto_mut: Mutating residue number 838 from chain A (phenylalanine) into arginine (00:19:37)
[INFO] Auto_mut: Mutating residue number 247 from chain A (phenylalanine) into arginine (00:19:42)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into glutamic acid (00:23:10)
[INFO] Auto_mut: Mutating residue number 857 from chain A (valine) into glutamic acid (00:23:23)
[INFO] Auto_mut: Mutating residue number 965 from chain A (leucine) into glutamic acid (00:23:37)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into lysine (00:26:57)
[INFO] Auto_mut: Mutating residue number 857 from chain A (valine) into lysine (00:27:14)
[INFO] Auto_mut: Mutating residue number 965 from chain A (leucine) into lysine (00:27:27)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into aspartic acid (00:30:36)
[INFO] Auto_mut: Mutating residue number 857 from chain A (valine) into aspartic acid (00:31:22)
[INFO] Auto_mut: Mutating residue number 965 from chain A (leucine) into aspartic acid (00:31:23)
[INFO] Auto_mut: Mutating residue number 201 from chain A (valine) into arginine (00:34:21)
[INFO] Auto_mut: Mutating residue number 857 from chain A (valine) into arginine (00:35:08)
[INFO] Auto_mut: Mutating residue number 965 from chain A (leucine) into arginine (00:35:11)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into glutamic acid (00:38:01)
[INFO] Auto_mut: Mutating residue number 862 from chain A (valine) into glutamic acid (00:39:02)
[INFO] Auto_mut: Mutating residue number 160 from chain A (leucine) into glutamic acid (00:39:04)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into lysine (00:41:41)
[INFO] Auto_mut: Mutating residue number 160 from chain A (leucine) into lysine (00:42:42)
[INFO] Auto_mut: Mutating residue number 862 from chain A (valine) into lysine (00:42:49)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into aspartic acid (00:45:44)
[INFO] Auto_mut: Mutating residue number 160 from chain A (leucine) into aspartic acid (00:46:33)
[INFO] Auto_mut: Mutating residue number 862 from chain A (valine) into aspartic acid (00:46:34)
[INFO] Auto_mut: Mutating residue number 839 from chain A (tyrosine) into arginine (00:49:25)
[INFO] Auto_mut: Mutating residue number 862 from chain A (valine) into arginine (00:50:15)
[INFO] Auto_mut: Mutating residue number 160 from chain A (leucine) into arginine (00:50:16)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into glutamic acid (00:53:10)
[INFO] Auto_mut: Mutating residue number 940 from chain A (isoleucine) into glutamic acid (00:53:57)
[INFO] Auto_mut: Mutating residue number 137 from chain A (alanine) into glutamic acid (00:54:06)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into lysine (00:56:49)
[INFO] Auto_mut: Mutating residue number 137 from chain A (alanine) into lysine (00:57:45)
[INFO] Auto_mut: Mutating residue number 940 from chain A (isoleucine) into lysine (00:57:50)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into aspartic acid (01:00:34)
[INFO] Auto_mut: Mutating residue number 137 from chain A (alanine) into aspartic acid (01:01:27)
[INFO] Auto_mut: Mutating residue number 940 from chain A (isoleucine) into aspartic acid (01:02:01)
[INFO] Auto_mut: Mutating residue number 856 from chain A (isoleucine) into arginine (01:04:13)
[INFO] Auto_mut: Mutating residue number 137 from chain A (alanine) into arginine (01:05:08)
[INFO] Auto_mut: Mutating residue number 940 from chain A (isoleucine) into arginine (01:05:50)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into glutamic acid (01:07:55)
[INFO] Auto_mut: Mutating residue number 257 from chain A (valine) into glutamic acid (01:08:52)
[INFO] Auto_mut: Mutating residue number 929 from chain A (valine) into glutamic acid (01:09:48)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into lysine (01:11:38)
[INFO] Auto_mut: Mutating residue number 257 from chain A (valine) into lysine (01:12:41)
[INFO] Auto_mut: Mutating residue number 929 from chain A (valine) into lysine (01:13:34)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into aspartic acid (01:15:30)
[INFO] Auto_mut: Mutating residue number 257 from chain A (valine) into aspartic acid (01:17:00)
[INFO] Auto_mut: Mutating residue number 929 from chain A (valine) into aspartic acid (01:17:24)
[INFO] Auto_mut: Mutating residue number 159 from chain A (leucine) into arginine (01:19:21)
[INFO] Auto_mut: Mutating residue number 257 from chain A (valine) into arginine (01:20:52)
[INFO] Auto_mut: Mutating residue number 929 from chain A (valine) into arginine (01:21:05)
[INFO] Auto_mut: Mutating residue number 840 from chain A (alanine) into glutamic acid (01:23:04)
[INFO] Auto_mut: Mutating residue number 855 from chain A (alanine) into glutamic acid (01:24:44)
[INFO] Auto_mut: Mutating residue number 235 from chain A (alanine) into glutamic acid (01:24:57)
[INFO] Auto_mut: Mutating residue number 840 from chain A (alanine) into lysine (01:26:46)
[INFO] Auto_mut: Mutating residue number 855 from chain A (alanine) into lysine (01:28:17)
[INFO] Auto_mut: Mutating residue number 235 from chain A (alanine) into lysine (01:28:40)
[INFO] Auto_mut: Mutating residue number 840 from chain A (alanine) into aspartic acid (01:30:36)
[INFO] Auto_mut: Mutating residue number 855 from chain A (alanine) into aspartic acid (01:32:20)
[INFO] Auto_mut: Mutating residue number 235 from chain A (alanine) into aspartic acid (01:32:25)
[INFO] Auto_mut: Mutating residue number 840 from chain A (alanine) into arginine (01:34:15)
[INFO] Auto_mut: Mutating residue number 855 from chain A (alanine) into arginine (01:35:51)
[INFO] Auto_mut: Mutating residue number 235 from chain A (alanine) into arginine (01:36:07)
[INFO] Auto_mut: Mutating residue number 179 from chain A (valine) into glutamic acid (01:37:56)
[INFO] Auto_mut: Mutating residue number 236 from chain A (tyrosine) into glutamic acid (01:39:37)
[INFO] Auto_mut: Mutating residue number 620 from chain A (glycine) into glutamic acid (01:39:50)
[INFO] Auto_mut: Mutating residue number 179 from chain A (valine) into lysine (01:41:33)
[INFO] Auto_mut: Mutating residue number 236 from chain A (tyrosine) into lysine (01:43:15)
[INFO] Auto_mut: Mutating residue number 620 from chain A (glycine) into lysine (01:43:42)
[INFO] Auto_mut: Mutating residue number 179 from chain A (valine) into aspartic acid (01:45:38)
[INFO] Auto_mut: Mutating residue number 236 from chain A (tyrosine) into aspartic acid (01:47:07)
[INFO] Auto_mut: Mutating residue number 620 from chain A (glycine) into aspartic acid (01:48:26)
[INFO] Auto_mut: Mutating residue number 179 from chain A (valine) into arginine (01:49:30)
[INFO] Auto_mut: Mutating residue number 236 from chain A (tyrosine) into arginine (01:50:53)
[INFO] Auto_mut: Mutating residue number 620 from chain A (glycine) into arginine (01:52:07)
[INFO] Auto_mut: Mutating residue number 941 from chain A (glycine) into glutamic acid (01:53:17)
[INFO] Auto_mut: Mutating residue number 870 from chain A (valine) into glutamic acid (01:54:36)
[INFO] Auto_mut: Mutating residue number 964 from chain A (proline) into glutamic acid (01:56:05)
[INFO] Auto_mut: Mutating residue number 941 from chain A (glycine) into lysine (01:56:58)
[INFO] Auto_mut: Mutating residue number 870 from chain A (valine) into lysine (01:58:14)
[INFO] Auto_mut: Mutating residue number 964 from chain A (proline) into lysine (01:59:50)
[INFO] Auto_mut: Mutating residue number 941 from chain A (glycine) into aspartic acid (02:00:55)
[INFO] Auto_mut: Mutating residue number 870 from chain A (valine) into aspartic acid (02:02:01)
[INFO] Auto_mut: Mutating residue number 964 from chain A (proline) into aspartic acid (02:03:44)
[INFO] Auto_mut: Mutating residue number 941 from chain A (glycine) into arginine (02:04:38)
[INFO] Auto_mut: Mutating residue number 870 from chain A (valine) into arginine (02:05:42)
[INFO] Auto_mut: Mutating residue number 964 from chain A (proline) into arginine (02:07:24)
[INFO] Auto_mut: Mutating residue number 837 from chain A (isoleucine) into glutamic acid (02:08:39)
[INFO] Auto_mut: Mutating residue number 369 from chain A (tryptophan) into glutamic acid (02:09:27)
[INFO] Auto_mut: Mutating residue number 139 from chain A (glycine) into glutamic acid (02:11:29)
[INFO] Auto_mut: Mutating residue number 837 from chain A (isoleucine) into lysine (02:12:19)
[INFO] Auto_mut: Mutating residue number 369 from chain A (tryptophan) into lysine (02:13:10)
[INFO] Auto_mut: Mutating residue number 139 from chain A (glycine) into lysine (02:15:04)
[INFO] Auto_mut: Mutating residue number 837 from chain A (isoleucine) into aspartic acid (02:16:19)
[INFO] Auto_mut: Mutating residue number 369 from chain A (tryptophan) into aspartic acid (02:17:04)
[INFO] Auto_mut: Mutating residue number 139 from chain A (glycine) into aspartic acid (02:18:50)
[INFO] Auto_mut: Mutating residue number 837 from chain A (isoleucine) into arginine (02:20:07)
[INFO] Auto_mut: Mutating residue number 369 from chain A (tryptophan) into arginine (02:20:46)
[INFO] Auto_mut: Mutating residue number 139 from chain A (glycine) into arginine (02:22:35)
[INFO] Auto_mut: Mutating residue number 156 from chain A (valine) into glutamic acid (02:23:52)
[INFO] Auto_mut: Mutating residue number 127 from chain A (valine) into glutamic acid (02:24:28)
[INFO] Auto_mut: Mutating residue number 202 from chain A (serine) into glutamic acid (02:26:18)
[INFO] Auto_mut: Mutating residue number 156 from chain A (valine) into lysine (02:27:27)
[INFO] Auto_mut: Mutating residue number 127 from chain A (valine) into lysine (02:28:10)
[INFO] Auto_mut: Mutating residue number 202 from chain A (serine) into lysine (02:29:54)
[INFO] Auto_mut: Mutating residue number 156 from chain A (valine) into aspartic acid (02:31:07)
[INFO] Auto_mut: Mutating residue number 127 from chain A (valine) into aspartic acid (02:32:02)
[INFO] Auto_mut: Mutating residue number 202 from chain A (serine) into aspartic acid (02:33:41)
[INFO] Auto_mut: Mutating residue number 156 from chain A (valine) into arginine (02:34:48)
[INFO] Auto_mut: Mutating residue number 127 from chain A (valine) into arginine (02:35:38)
[INFO] Auto_mut: Mutating residue number 202 from chain A (serine) into arginine (02:37:25)
[INFO] Auto_mut: Mutating residue number 441 from chain A (valine) into glutamic acid (02:38:31)
[INFO] Auto_mut: Mutating residue number 155 from chain A (methionine) into glutamic acid (02:39:26)
[INFO] Auto_mut: Mutating residue number 510 from chain A (tyrosine) into glutamic acid (02:41:08)
[INFO] Auto_mut: Mutating residue number 441 from chain A (valine) into lysine (02:42:21)
[INFO] Auto_mut: Mutating residue number 155 from chain A (methionine) into lysine (02:43:28)
[INFO] Auto_mut: Mutating residue number 510 from chain A (tyrosine) into lysine (02:44:48)
[INFO] Auto_mut: Mutating residue number 441 from chain A (valine) into aspartic acid (02:46:40)
[INFO] Auto_mut: Mutating residue number 155 from chain A (methionine) into aspartic acid (02:47:32)
[INFO] Auto_mut: Mutating residue number 510 from chain A (tyrosine) into aspartic acid (02:48:54)
[INFO] Auto_mut: Mutating residue number 441 from chain A (valine) into arginine (02:50:31)
[INFO] Auto_mut: Mutating residue number 155 from chain A (methionine) into arginine (02:51:22)
[INFO] Auto_mut: Mutating residue number 510 from chain A (tyrosine) into arginine (02:52:53)
[INFO] Auto_mut: Mutating residue number 877 from chain A (leucine) into glutamic acid (02:54:25)
[INFO] Auto_mut: Mutating residue number 370 from chain A (threonine) into glutamic acid (02:55:06)
[INFO] Auto_mut: Mutating residue number 436 from chain A (cysteine) into glutamic acid (02:56:56)
[INFO] Auto_mut: Mutating residue number 877 from chain A (leucine) into lysine (02:58:18)
[INFO] Auto_mut: Mutating residue number 370 from chain A (threonine) into lysine (02:58:54)
[INFO] Auto_mut: Mutating residue number 436 from chain A (cysteine) into lysine (03:00:49)
[INFO] Auto_mut: Mutating residue number 877 from chain A (leucine) into aspartic acid (03:02:43)
[INFO] Auto_mut: Mutating residue number 370 from chain A (threonine) into aspartic acid (03:02:51)
[INFO] Auto_mut: Mutating residue number 436 from chain A (cysteine) into aspartic acid (03:04:59)
[INFO] Auto_mut: Mutating residue number 877 from chain A (leucine) into arginine (03:06:29)
[INFO] Auto_mut: Mutating residue number 370 from chain A (threonine) into arginine (03:06:36)
[INFO] Auto_mut: Mutating residue number 436 from chain A (cysteine) into arginine (03:08:50)
[INFO] Auto_mut: Mutating residue number 947 from chain A (phenylalanine) into glutamic acid
Mutating residue number 947 from chain A (phenylalanine) into glutamic acid (03:10:19)
[INFO] Auto_mut: Mutating residue number 841 from chain A (glycine) into glutamic acid (03:10:27)
[INFO] Auto_mut: Mutating residue number 836 from chain A (isoleucine) into glutamic acid (03:12:50)
[INFO] Auto_mut: Mutating residue number 841 from chain A (glycine) into lysine (03:14:06)
[INFO] Auto_mut: Mutating residue number 947 from chain A (phenylalanine) into lysine (03:14:14)
[INFO] Auto_mut: Mutating residue number 836 from chain A (isoleucine) into lysine (03:16:34)
[INFO] Auto_mut: Mutating residue number 947 from chain A (phenylalanine) into aspartic acid
Mutating residue number 947 from chain A (phenylalanine) into aspartic acid (03:17:59)
[INFO] Auto_mut: Mutating residue number 841 from chain A (glycine) into aspartic acid (03:18:00)
[INFO] Auto_mut: Mutating residue number 836 from chain A (isoleucine) into aspartic acid (03:20:19)
[INFO] Auto_mut: Mutating residue number 841 from chain A (glycine) into arginine (03:21:39)
[INFO] Auto_mut: Mutating residue number 947 from chain A (phenylalanine) into arginine (03:21:40)
[INFO] Auto_mut: Mutating residue number 836 from chain A (isoleucine) into arginine (03:24:04)
[INFO] Auto_mut: Mutating residue number 475 from chain A (valine) into glutamic acid (03:25:26)
[INFO] Auto_mut: Mutating residue number 442 from chain A (alanine) into glutamic acid (03:25:27)
[INFO] Auto_mut: Mutating residue number 858 from chain A (proline) into glutamic acid (03:27:46)
[INFO] Auto_mut: Mutating residue number 442 from chain A (alanine) into lysine (03:29:04)
[INFO] Auto_mut: Mutating residue number 475 from chain A (valine) into lysine (03:29:21)
[INFO] Auto_mut: Mutating residue number 858 from chain A (proline) into lysine (03:31:25)
[INFO] Auto_mut: Mutating residue number 442 from chain A (alanine) into aspartic acid (03:32:47)
[INFO] Auto_mut: Mutating residue number 475 from chain A (valine) into aspartic acid (03:33:26)
[INFO] Auto_mut: Mutating residue number 858 from chain A (proline) into aspartic acid (03:35:16)
[INFO] Auto_mut: Mutating residue number 442 from chain A (alanine) into arginine (03:36:31)
[INFO] Auto_mut: Mutating residue number 475 from chain A (valine) into arginine (03:37:09)
[INFO] Auto_mut: Mutating residue number 858 from chain A (proline) into arginine (03:38:57)
[INFO] Auto_mut: Mutating residue number 274 from chain A (alanine) into glutamic acid (03:40:16)
[INFO] Auto_mut: Mutating residue number 204 from chain A (proline) into glutamic acid (03:41:05)
[INFO] Auto_mut: Mutating residue number 234 from chain A (methionine) into glutamic acid (03:42:45)
[INFO] Auto_mut: Mutating residue number 274 from chain A (alanine) into lysine (03:43:54)
[INFO] Auto_mut: Mutating residue number 204 from chain A (proline) into lysine (03:44:38)
[INFO] Auto_mut: Mutating residue number 234 from chain A (methionine) into lysine (03:46:23)
[INFO] Auto_mut: Mutating residue number 274 from chain A (alanine) into aspartic acid (03:47:40)
[INFO] Auto_mut: Mutating residue number 204 from chain A (proline) into aspartic acid (03:48:20)
[INFO] Auto_mut: Mutating residue number 234 from chain A (methionine) into aspartic acid (03:50:14)
[INFO] Auto_mut: Mutating residue number 274 from chain A (alanine) into arginine (03:51:20)
[INFO] Auto_mut: Mutating residue number 204 from chain A (proline) into arginine (03:52:00)
[INFO] Auto_mut: Mutating residue number 234 from chain A (methionine) into arginine (03:53:56)
[INFO] Auto_mut: Mutating residue number 474 from chain A (threonine) into glutamic acid (03:55:10)
[INFO] Auto_mut: Mutating residue number 256 from chain A (cysteine) into glutamic acid (03:55:36)
[INFO] Auto_mut: Mutating residue number 726 from chain A (leucine) into glutamic acid (03:57:36)
[INFO] Auto_mut: Mutating residue number 474 from chain A (threonine) into lysine (03:59:04)
[INFO] Auto_mut: Mutating residue number 256 from chain A (cysteine) into lysine (03:59:19)
[INFO] Auto_mut: Mutating residue number 726 from chain A (leucine) into lysine (04:01:30)
[INFO] Auto_mut: Mutating residue number 474 from chain A (threonine) into aspartic acid (04:02:50)
[INFO] Auto_mut: Mutating residue number 256 from chain A (cysteine) into aspartic acid (04:03:12)
[INFO] Auto_mut: Mutating residue number 726 from chain A (leucine) into aspartic acid (04:05:27)
[INFO] Auto_mut: Mutating residue number 474 from chain A (threonine) into arginine (04:06:43)
[INFO] Auto_mut: Mutating residue number 256 from chain A (cysteine) into arginine (04:06:53)
[INFO] Auto_mut: Mutating residue number 726 from chain A (leucine) into arginine (04:09:12)
[INFO] Auto_mut: Mutating residue number 651 from chain A (tyrosine) into glutamic acid (04:10:31)
[INFO] Auto_mut: Mutating residue number 233 from chain A (glycine) into glutamic acid (04:10:39)
[INFO] Auto_mut: Mutating residue number 452 from chain A (alanine) into glutamic acid (04:13:01)
[INFO] Auto_mut: Mutating residue number 651 from chain A (tyrosine) into lysine (04:14:14)
[INFO] Auto_mut: Mutating residue number 233 from chain A (glycine) into lysine (04:14:22)
[INFO] Auto_mut: Mutating residue number 452 from chain A (alanine) into lysine (04:16:45)
[INFO] Auto_mut: Mutating residue number 651 from chain A (tyrosine) into aspartic acid (04:18:04)
[INFO] Auto_mut: Mutating residue number 233 from chain A (glycine) into aspartic acid (04:18:08)
[INFO] Auto_mut: Mutating residue number 452 from chain A (alanine) into aspartic acid (04:20:24)
[INFO] Auto_mut: Mutating residue number 651 from chain A (tyrosine) into arginine (04:21:49)
[INFO] Auto_mut: Mutating residue number 233 from chain A (glycine) into arginine (04:22:00)
[INFO] Auto_mut: Mutating residue number 452 from chain A (alanine) into arginine (04:24:04)
[INFO] Auto_mut: Mutating residue number 183 from chain A (valine) into glutamic acid (04:25:49)
[INFO] Auto_mut: Mutating residue number 594 from chain A (methionine) into glutamic acid (04:25:53)
[INFO] Auto_mut: Mutating residue number 704 from chain A (serine) into glutamic acid (04:27:47)
[INFO] Auto_mut: Mutating residue number 183 from chain A (valine) into lysine (04:29:24)
[INFO] Auto_mut: Mutating residue number 594 from chain A (methionine) into lysine (04:29:54)
[INFO] Auto_mut: Mutating residue number 704 from chain A (serine) into lysine (04:31:32)
[INFO] Auto_mut: Mutating residue number 183 from chain A (valine) into aspartic acid (04:33:13)
[INFO] Auto_mut: Mutating residue number 594 from chain A (methionine) into aspartic acid (04:34:01)
[INFO] Auto_mut: Mutating residue number 704 from chain A (serine) into aspartic acid (04:35:14)
[INFO] Auto_mut: Mutating residue number 183 from chain A (valine) into arginine (04:36:52)
[INFO] Auto_mut: Mutating residue number 594 from chain A (methionine) into arginine (04:37:45)
[INFO] Auto_mut: Mutating residue number 704 from chain A (serine) into arginine (04:38:53)
[INFO] Auto_mut: Mutating residue number 285 from chain A (valine) into glutamic acid (04:40:29)
[INFO] Auto_mut: Mutating residue number 876 from chain A (valine) into glutamic acid (04:41:32)
[INFO] Auto_mut: Mutating residue number 981 from chain A (alanine) into glutamic acid (04:42:40)
[INFO] Auto_mut: Mutating residue number 285 from chain A (valine) into lysine (04:43:58)
[INFO] Auto_mut: Mutating residue number 876 from chain A (valine) into lysine (04:45:13)
[INFO] Auto_mut: Mutating residue number 981 from chain A (alanine) into lysine (04:46:22)
[INFO] Auto_mut: Mutating residue number 285 from chain A (valine) into aspartic acid (04:47:41)
[INFO] Auto_mut: Mutating residue number 876 from chain A (valine) into aspartic acid (04:48:52)
[INFO] Auto_mut: Mutating residue number 981 from chain A (alanine) into aspartic acid (04:50:00)
[INFO] Auto_mut: Mutating residue number 285 from chain A (valine) into arginine (04:51:17)
[INFO] Auto_mut: Mutating residue number 876 from chain A (valine) into arginine (04:52:27)
[INFO] Auto_mut: Mutating residue number 981 from chain A (alanine) into arginine (04:53:43)
[INFO] Auto_mut: Mutating residue number 775 from chain A (tryptophan) into glutamic acid (04:54:59)
[INFO] Auto_mut: Mutating residue number 854 from chain A (alanine) into glutamic acid (04:56:10)
[INFO] Auto_mut: Mutating residue number 275 from chain A (alanine) into glutamic acid (04:57:22)
[INFO] Auto_mut: Mutating residue number 775 from chain A (tryptophan) into lysine (04:58:38)
[INFO] Auto_mut: Mutating residue number 854 from chain A (alanine) into lysine (04:59:39)
[INFO] Auto_mut: Mutating residue number 275 from chain A (alanine) into lysine (05:00:55)
[INFO] Auto_mut: Mutating residue number 775 from chain A (tryptophan) into aspartic acid (05:02:16)
[INFO] Auto_mut: Mutating residue number 854 from chain A (alanine) into aspartic acid (05:04:17)
[INFO] Auto_mut: Mutating residue number 275 from chain A (alanine) into aspartic acid (05:04:45)
[INFO] Auto_mut: Mutating residue number 775 from chain A (tryptophan) into arginine (05:05:55)
[INFO] Auto_mut: Mutating residue number 854 from chain A (alanine) into arginine (05:07:57)
[INFO] Auto_mut: Mutating residue number 275 from chain A (alanine) into arginine (05:08:30)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
glutamic acid: Energy difference: -0.4317 kcal/mol, Difference in average
score from the base case: -0.0178 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
lysine: Energy difference: -0.0769 kcal/mol, Difference in average score
from the base case: -0.0171 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
aspartic acid: Energy difference: 0.4773 kcal/mol, Difference in average
score from the base case: -0.0169 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 138 from chain A (isoleucine) into
arginine: Energy difference: 0.0511 kcal/mol, Difference in average score
from the base case: -0.0167 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into glutamic
acid: Energy difference: -0.2463 kcal/mol, Difference in average score from
the base case: -0.0161 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into lysine:
Energy difference: 0.1422 kcal/mol, Difference in average score from the
base case: -0.0154 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into aspartic
acid: Energy difference: 0.3831 kcal/mol, Difference in average score from
the base case: -0.0167 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 201 from chain A (valine) into arginine:
Energy difference: -0.0067 kcal/mol, Difference in average score from the
base case: -0.0150 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into glutamic
acid: Energy difference: -0.0623 kcal/mol, Difference in average score from
the base case: -0.0163 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into lysine:
Energy difference: -0.2886 kcal/mol, Difference in average score from the
base case: -0.0144 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into aspartic
acid: Energy difference: 0.2278 kcal/mol, Difference in average score from
the base case: -0.0161 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 839 from chain A (tyrosine) into
arginine: Energy difference: -0.7383 kcal/mol, Difference in average score
from the base case: -0.0172 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
glutamic acid: Energy difference: 1.9432 kcal/mol, Difference in average
score from the base case: -0.0091 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
lysine: Energy difference: 1.3337 kcal/mol, Difference in average score
from the base case: -0.0091 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
aspartic acid: Energy difference: 2.1484 kcal/mol, Difference in average
score from the base case: -0.0129 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 856 from chain A (isoleucine) into
arginine: Energy difference: 1.2791 kcal/mol, Difference in average score
from the base case: -0.0117 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into glutamic
acid: Energy difference: 1.1598 kcal/mol, Difference in average score from
the base case: -0.0126 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into lysine:
Energy difference: 0.3311 kcal/mol, Difference in average score from the
base case: -0.0154 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into aspartic
acid: Energy difference: 2.3004 kcal/mol, Difference in average score from
the base case: -0.0162 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 159 from chain A (leucine) into arginine:
Energy difference: 0.6153 kcal/mol, Difference in average score from the
base case: -0.0170 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
glutamic acid: Energy difference: 0.5620 kcal/mol, Difference in average
score from the base case: -0.0140 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
lysine: Energy difference: -0.4835 kcal/mol, Difference in average score
from the base case: -0.0150 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
aspartic acid: Energy difference: -0.4283 kcal/mol, Difference in average
score from the base case: -0.0171 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 247 from chain A (phenylalanine) into
arginine: Energy difference: -0.5531 kcal/mol, Difference in average score
from the base case: -0.0148 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 965 from chain A (leucine) into glutamic
acid: Energy difference: 1.1751 kcal/mol, Difference in average score from
the base case: -0.0117 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 965 from chain A (leucine) into lysine:
Energy difference: 0.2838 kcal/mol, Difference in average score from the
base case: -0.0101 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 965 from chain A (leucine) into aspartic
acid: Energy difference: 1.7077 kcal/mol, Difference in average score from
the base case: -0.0119 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 965 from chain A (leucine) into arginine:
Energy difference: 0.2572 kcal/mol, Difference in average score from the
base case: -0.0087 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 160 from chain A (leucine) into glutamic
acid: Energy difference: 3.2933 kcal/mol, Difference in average score from
the base case: -0.0021 (05:12:10)
[INFO] Auto_mut: Effect of mutation residue number 160 from chain A (leucine) into lysine:
Energy difference: 2.1158 kcal/mol, Difference in average score from the
base case: -0.0052 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 160 from chain A (leucine) into aspartic
acid: Energy difference: 4.1714 kcal/mol, Difference in average score from
the base case: -0.0046 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 160 from chain A (leucine) into arginine:
Energy difference: 2.3246 kcal/mol, Difference in average score from the
base case: -0.0056 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 940 from chain A (isoleucine) into
glutamic acid: Energy difference: 0.2479 kcal/mol, Difference in average
score from the base case: -0.0098 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 940 from chain A (isoleucine) into
lysine: Energy difference: 0.2743 kcal/mol, Difference in average score
from the base case: -0.0088 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 940 from chain A (isoleucine) into
aspartic acid: Energy difference: 1.0559 kcal/mol, Difference in average
score from the base case: -0.0106 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 940 from chain A (isoleucine) into
arginine: Energy difference: 0.3603 kcal/mol, Difference in average score
from the base case: -0.0094 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 929 from chain A (valine) into glutamic
acid: Energy difference: 0.4486 kcal/mol, Difference in average score from
the base case: -0.0145 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 929 from chain A (valine) into lysine:
Energy difference: -0.0806 kcal/mol, Difference in average score from the
base case: -0.0144 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 929 from chain A (valine) into aspartic
acid: Energy difference: 1.2558 kcal/mol, Difference in average score from
the base case: -0.0154 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 929 from chain A (valine) into arginine:
Energy difference: 0.1949 kcal/mol, Difference in average score from the
base case: -0.0149 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 838 from chain A (phenylalanine) into
glutamic acid: Energy difference: 4.2843 kcal/mol, Difference in average
score from the base case: -0.0050 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 838 from chain A (phenylalanine) into
lysine: Energy difference: 2.9239 kcal/mol, Difference in average score
from the base case: -0.0053 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 838 from chain A (phenylalanine) into
aspartic acid: Energy difference: 4.2608 kcal/mol, Difference in average
score from the base case: -0.0018 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 838 from chain A (phenylalanine) into
arginine: Energy difference: 2.9777 kcal/mol, Difference in average score
from the base case: -0.0061 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 857 from chain A (valine) into glutamic
acid: Energy difference: 0.3155 kcal/mol, Difference in average score from
the base case: -0.0108 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 857 from chain A (valine) into lysine:
Energy difference: -0.7875 kcal/mol, Difference in average score from the
base case: -0.0094 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 857 from chain A (valine) into aspartic
acid: Energy difference: 0.8698 kcal/mol, Difference in average score from
the base case: -0.0099 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 857 from chain A (valine) into arginine:
Energy difference: -0.8746 kcal/mol, Difference in average score from the
base case: -0.0085 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 862 from chain A (valine) into glutamic
acid: Energy difference: -0.0266 kcal/mol, Difference in average score from
the base case: -0.0145 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 862 from chain A (valine) into lysine:
Energy difference: -0.8784 kcal/mol, Difference in average score from the
base case: -0.0135 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 862 from chain A (valine) into aspartic
acid: Energy difference: 1.3839 kcal/mol, Difference in average score from
the base case: -0.0144 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 862 from chain A (valine) into arginine:
Energy difference: -0.6393 kcal/mol, Difference in average score from the
base case: -0.0144 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 137 from chain A (alanine) into glutamic
acid: Energy difference: -0.4402 kcal/mol, Difference in average score from
the base case: -0.0102 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 137 from chain A (alanine) into lysine:
Energy difference: -0.4738 kcal/mol, Difference in average score from the
base case: -0.0076 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 137 from chain A (alanine) into aspartic
acid: Energy difference: -0.4690 kcal/mol, Difference in average score from
the base case: -0.0099 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 137 from chain A (alanine) into arginine:
Energy difference: -0.2545 kcal/mol, Difference in average score from the
base case: -0.0104 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 257 from chain A (valine) into glutamic
acid: Energy difference: 0.9632 kcal/mol, Difference in average score from
the base case: -0.0034 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 257 from chain A (valine) into lysine:
Energy difference: -0.1106 kcal/mol, Difference in average score from the
base case: -0.0093 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 257 from chain A (valine) into aspartic
acid: Energy difference: 0.6069 kcal/mol, Difference in average score from
the base case: -0.0075 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 257 from chain A (valine) into arginine:
Energy difference: -0.7923 kcal/mol, Difference in average score from the
base case: -0.0104 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 840 from chain A (alanine) into glutamic
acid: Energy difference: 0.0812 kcal/mol, Difference in average score from
the base case: -0.0107 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 840 from chain A (alanine) into lysine:
Energy difference: -0.3800 kcal/mol, Difference in average score from the
base case: -0.0105 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 840 from chain A (alanine) into aspartic
acid: Energy difference: 0.2068 kcal/mol, Difference in average score from
the base case: -0.0103 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 840 from chain A (alanine) into arginine:
Energy difference: -0.3412 kcal/mol, Difference in average score from the
base case: -0.0109 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 179 from chain A (valine) into glutamic
acid: Energy difference: -0.2409 kcal/mol, Difference in average score from
the base case: -0.0076 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 179 from chain A (valine) into lysine:
Energy difference: -0.4919 kcal/mol, Difference in average score from the
base case: -0.0100 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 179 from chain A (valine) into aspartic
acid: Energy difference: 0.1530 kcal/mol, Difference in average score from
the base case: -0.0115 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 179 from chain A (valine) into arginine:
Energy difference: -0.2755 kcal/mol, Difference in average score from the
base case: -0.0120 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 941 from chain A (glycine) into glutamic
acid: Energy difference: 2.3495 kcal/mol, Difference in average score from
the base case: -0.0080 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 941 from chain A (glycine) into lysine:
Energy difference: 1.4198 kcal/mol, Difference in average score from the
base case: -0.0067 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 941 from chain A (glycine) into aspartic
acid: Energy difference: 4.0176 kcal/mol, Difference in average score from
the base case: -0.0064 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 941 from chain A (glycine) into arginine:
Energy difference: 0.8640 kcal/mol, Difference in average score from the
base case: -0.0073 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 837 from chain A (isoleucine) into
glutamic acid: Energy difference: 2.1752 kcal/mol, Difference in average
score from the base case: -0.0050 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 837 from chain A (isoleucine) into
lysine: Energy difference: 1.5672 kcal/mol, Difference in average score
from the base case: -0.0062 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 837 from chain A (isoleucine) into
aspartic acid: Energy difference: 2.1619 kcal/mol, Difference in average
score from the base case: -0.0055 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 837 from chain A (isoleucine) into
arginine: Energy difference: 1.7503 kcal/mol, Difference in average score
from the base case: -0.0078 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 156 from chain A (valine) into glutamic
acid: Energy difference: 1.5424 kcal/mol, Difference in average score from
the base case: -0.0032 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 156 from chain A (valine) into lysine:
Energy difference: 0.4617 kcal/mol, Difference in average score from the
base case: -0.0048 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 156 from chain A (valine) into aspartic
acid: Energy difference: 2.4455 kcal/mol, Difference in average score from
the base case: -0.0055 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 156 from chain A (valine) into arginine:
Energy difference: -0.8672 kcal/mol, Difference in average score from the
base case: -0.0066 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 855 from chain A (alanine) into glutamic
acid: Energy difference: -0.5419 kcal/mol, Difference in average score from
the base case: -0.0060 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 855 from chain A (alanine) into lysine:
Energy difference: -0.3587 kcal/mol, Difference in average score from the
base case: -0.0040 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 855 from chain A (alanine) into aspartic
acid: Energy difference: -1.3316 kcal/mol, Difference in average score from
the base case: -0.0061 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 855 from chain A (alanine) into arginine:
Energy difference: -0.9517 kcal/mol, Difference in average score from the
base case: -0.0116 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 236 from chain A (tyrosine) into glutamic
acid: Energy difference: 2.5086 kcal/mol, Difference in average score from
the base case: -0.0152 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 236 from chain A (tyrosine) into lysine:
Energy difference: 2.1782 kcal/mol, Difference in average score from the
base case: -0.0160 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 236 from chain A (tyrosine) into aspartic
acid: Energy difference: 2.6766 kcal/mol, Difference in average score from
the base case: -0.0173 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 236 from chain A (tyrosine) into
arginine: Energy difference: 2.2259 kcal/mol, Difference in average score
from the base case: -0.0138 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 870 from chain A (valine) into glutamic
acid: Energy difference: 2.4244 kcal/mol, Difference in average score from
the base case: -0.0045 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 870 from chain A (valine) into lysine:
Energy difference: 0.9429 kcal/mol, Difference in average score from the
base case: -0.0045 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 870 from chain A (valine) into aspartic
acid: Energy difference: 3.1840 kcal/mol, Difference in average score from
the base case: -0.0042 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 870 from chain A (valine) into arginine:
Energy difference: 1.1459 kcal/mol, Difference in average score from the
base case: -0.0037 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 369 from chain A (tryptophan) into
glutamic acid: Energy difference: -0.0958 kcal/mol, Difference in average
score from the base case: -0.0165 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 369 from chain A (tryptophan) into
lysine: Energy difference: 0.2421 kcal/mol, Difference in average score
from the base case: -0.0150 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 369 from chain A (tryptophan) into
aspartic acid: Energy difference: 0.9727 kcal/mol, Difference in average
score from the base case: -0.0184 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 369 from chain A (tryptophan) into
arginine: Energy difference: 0.5943 kcal/mol, Difference in average score
from the base case: -0.0163 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 127 from chain A (valine) into glutamic
acid: Energy difference: 0.0986 kcal/mol, Difference in average score from
the base case: -0.0122 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 127 from chain A (valine) into lysine:
Energy difference: -0.0064 kcal/mol, Difference in average score from the
base case: -0.0150 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 127 from chain A (valine) into aspartic
acid: Energy difference: -0.1059 kcal/mol, Difference in average score from
the base case: -0.0161 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 127 from chain A (valine) into arginine:
Energy difference: 0.1299 kcal/mol, Difference in average score from the
base case: -0.0150 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 235 from chain A (alanine) into glutamic
acid: Energy difference: -1.0178 kcal/mol, Difference in average score from
the base case: -0.0101 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 235 from chain A (alanine) into lysine:
Energy difference: -1.1282 kcal/mol, Difference in average score from the
base case: -0.0079 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 235 from chain A (alanine) into aspartic
acid: Energy difference: -1.0088 kcal/mol, Difference in average score from
the base case: -0.0086 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 235 from chain A (alanine) into arginine:
Energy difference: -0.7822 kcal/mol, Difference in average score from the
base case: -0.0097 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 620 from chain A (glycine) into glutamic
acid: Energy difference: 8.5163 kcal/mol, Difference in average score from
the base case: -0.0041 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 620 from chain A (glycine) into lysine:
Energy difference: 7.5787 kcal/mol, Difference in average score from the
base case: -0.0051 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 620 from chain A (glycine) into aspartic
acid: Energy difference: 10.1908 kcal/mol, Difference in average score from
the base case: -0.0033 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 620 from chain A (glycine) into arginine:
Energy difference: 7.9586 kcal/mol, Difference in average score from the
base case: -0.0058 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 964 from chain A (proline) into glutamic
acid: Energy difference: 1.7337 kcal/mol, Difference in average score from
the base case: -0.0074 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 964 from chain A (proline) into lysine:
Energy difference: 1.4252 kcal/mol, Difference in average score from the
base case: -0.0070 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 964 from chain A (proline) into aspartic
acid: Energy difference: 2.0438 kcal/mol, Difference in average score from
the base case: -0.0067 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 964 from chain A (proline) into arginine:
Energy difference: 0.9389 kcal/mol, Difference in average score from the
base case: -0.0085 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 139 from chain A (glycine) into glutamic
acid: Energy difference: 2.1556 kcal/mol, Difference in average score from
the base case: -0.0045 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 139 from chain A (glycine) into lysine:
Energy difference: 1.5438 kcal/mol, Difference in average score from the
base case: -0.0085 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 139 from chain A (glycine) into aspartic
acid: Energy difference: 1.8814 kcal/mol, Difference in average score from
the base case: -0.0076 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 139 from chain A (glycine) into arginine:
Energy difference: 1.2303 kcal/mol, Difference in average score from the
base case: -0.0094 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 202 from chain A (serine) into glutamic
acid: Energy difference: 1.5797 kcal/mol, Difference in average score from
the base case: -0.0050 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 202 from chain A (serine) into lysine:
Energy difference: 0.7269 kcal/mol, Difference in average score from the
base case: -0.0079 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 202 from chain A (serine) into aspartic
acid: Energy difference: 1.9522 kcal/mol, Difference in average score from
the base case: -0.0085 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 202 from chain A (serine) into arginine:
Energy difference: 0.5938 kcal/mol, Difference in average score from the
base case: -0.0072 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 441 from chain A (valine) into glutamic
acid: Energy difference: 0.2385 kcal/mol, Difference in average score from
the base case: -0.0016 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 441 from chain A (valine) into lysine:
Energy difference: 1.1294 kcal/mol, Difference in average score from the
base case: -0.0052 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 441 from chain A (valine) into aspartic
acid: Energy difference: 0.4653 kcal/mol, Difference in average score from
the base case: -0.0042 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 441 from chain A (valine) into arginine:
Energy difference: 1.2858 kcal/mol, Difference in average score from the
base case: -0.0058 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 877 from chain A (leucine) into glutamic
acid: Energy difference: 1.8003 kcal/mol, Difference in average score from
the base case: -0.0055 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 877 from chain A (leucine) into lysine:
Energy difference: 0.6830 kcal/mol, Difference in average score from the
base case: -0.0058 (05:12:11)
[INFO] Auto_mut: Effect of mutation residue number 877 from chain A (leucine) into aspartic
acid: Energy difference: 2.8980 kcal/mol, Difference in average score from
the base case: -0.0045 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 877 from chain A (leucine) into arginine:
Energy difference: 0.6915 kcal/mol, Difference in average score from the
base case: -0.0065 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 841 from chain A (glycine) into glutamic
acid: Energy difference: 3.2632 kcal/mol, Difference in average score from
the base case: -0.0056 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 841 from chain A (glycine) into lysine:
Energy difference: 2.5629 kcal/mol, Difference in average score from the
base case: -0.0102 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 841 from chain A (glycine) into aspartic
acid: Energy difference: 5.1869 kcal/mol, Difference in average score from
the base case: -0.0037 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 841 from chain A (glycine) into arginine:
Energy difference: 2.6290 kcal/mol, Difference in average score from the
base case: -0.0108 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 475 from chain A (valine) into glutamic
acid: Energy difference: 0.6277 kcal/mol, Difference in average score from
the base case: -0.0075 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 475 from chain A (valine) into lysine:
Energy difference: -0.0382 kcal/mol, Difference in average score from the
base case: -0.0074 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 475 from chain A (valine) into aspartic
acid: Energy difference: 1.2324 kcal/mol, Difference in average score from
the base case: -0.0078 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 475 from chain A (valine) into arginine:
Energy difference: 0.3487 kcal/mol, Difference in average score from the
base case: -0.0065 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 204 from chain A (proline) into glutamic
acid: Energy difference: 1.5134 kcal/mol, Difference in average score from
the base case: -0.0051 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 204 from chain A (proline) into lysine:
Energy difference: 1.1890 kcal/mol, Difference in average score from the
base case: -0.0074 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 204 from chain A (proline) into aspartic
acid: Energy difference: 1.9952 kcal/mol, Difference in average score from
the base case: -0.0083 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 204 from chain A (proline) into arginine:
Energy difference: 1.3221 kcal/mol, Difference in average score from the
base case: -0.0072 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 155 from chain A (methionine) into
glutamic acid: Energy difference: 1.1503 kcal/mol, Difference in average
score from the base case: -0.0070 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 155 from chain A (methionine) into
lysine: Energy difference: 0.7598 kcal/mol, Difference in average score
from the base case: -0.0085 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 155 from chain A (methionine) into
aspartic acid: Energy difference: 2.9068 kcal/mol, Difference in average
score from the base case: -0.0074 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 155 from chain A (methionine) into
arginine: Energy difference: 1.2035 kcal/mol, Difference in average score
from the base case: -0.0118 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 370 from chain A (threonine) into
glutamic acid: Energy difference: -0.0209 kcal/mol, Difference in average
score from the base case: -0.0063 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 370 from chain A (threonine) into lysine:
Energy difference: -0.6653 kcal/mol, Difference in average score from the
base case: -0.0079 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 370 from chain A (threonine) into
aspartic acid: Energy difference: 0.5561 kcal/mol, Difference in average
score from the base case: -0.0107 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 370 from chain A (threonine) into
arginine: Energy difference: -0.3929 kcal/mol, Difference in average score
from the base case: -0.0087 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 947 from chain A (phenylalanine) into
glutamic acid: Energy difference: 1.0476 kcal/mol, Difference in average
score from the base case: -0.0051 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 947 from chain A (phenylalanine) into
lysine: Energy difference: 1.4501 kcal/mol, Difference in average score
from the base case: -0.0053 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 947 from chain A (phenylalanine) into
aspartic acid: Energy difference: 1.6883 kcal/mol, Difference in average
score from the base case: -0.0053 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 947 from chain A (phenylalanine) into
arginine: Energy difference: 1.8065 kcal/mol, Difference in average score
from the base case: -0.0047 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 442 from chain A (alanine) into glutamic
acid: Energy difference: 0.3988 kcal/mol, Difference in average score from
the base case: -0.0039 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 442 from chain A (alanine) into lysine:
Energy difference: 0.0965 kcal/mol, Difference in average score from the
base case: -0.0064 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 442 from chain A (alanine) into aspartic
acid: Energy difference: 2.2391 kcal/mol, Difference in average score from
the base case: -0.0019 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 442 from chain A (alanine) into arginine:
Energy difference: -0.0778 kcal/mol, Difference in average score from the
base case: -0.0064 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 274 from chain A (alanine) into glutamic
acid: Energy difference: 0.7179 kcal/mol, Difference in average score from
the base case: -0.0036 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 274 from chain A (alanine) into lysine:
Energy difference: 0.1121 kcal/mol, Difference in average score from the
base case: -0.0075 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 274 from chain A (alanine) into aspartic
acid: Energy difference: 0.9872 kcal/mol, Difference in average score from
the base case: -0.0068 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 274 from chain A (alanine) into arginine:
Energy difference: -0.1920 kcal/mol, Difference in average score from the
base case: -0.0085 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 510 from chain A (tyrosine) into glutamic
acid: Energy difference: 1.4725 kcal/mol, Difference in average score from
the base case: -0.0084 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 510 from chain A (tyrosine) into lysine:
Energy difference: 1.6993 kcal/mol, Difference in average score from the
base case: -0.0111 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 510 from chain A (tyrosine) into aspartic
acid: Energy difference: 1.7676 kcal/mol, Difference in average score from
the base case: -0.0105 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 510 from chain A (tyrosine) into
arginine: Energy difference: 1.4912 kcal/mol, Difference in average score
from the base case: -0.0095 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 436 from chain A (cysteine) into glutamic
acid: Energy difference: -1.5639 kcal/mol, Difference in average score from
the base case: -0.0043 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 436 from chain A (cysteine) into lysine:
Energy difference: 0.9499 kcal/mol, Difference in average score from the
base case: -0.0036 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 436 from chain A (cysteine) into aspartic
acid: Energy difference: 0.8371 kcal/mol, Difference in average score from
the base case: -0.0039 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 436 from chain A (cysteine) into
arginine: Energy difference: 1.8248 kcal/mol, Difference in average score
from the base case: -0.0039 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 836 from chain A (isoleucine) into
glutamic acid: Energy difference: 1.3549 kcal/mol, Difference in average
score from the base case: -0.0076 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 836 from chain A (isoleucine) into
lysine: Energy difference: 0.9166 kcal/mol, Difference in average score
from the base case: -0.0062 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 836 from chain A (isoleucine) into
aspartic acid: Energy difference: 2.2585 kcal/mol, Difference in average
score from the base case: -0.0088 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 836 from chain A (isoleucine) into
arginine: Energy difference: 1.2642 kcal/mol, Difference in average score
from the base case: -0.0088 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 858 from chain A (proline) into glutamic
acid: Energy difference: 0.8110 kcal/mol, Difference in average score from
the base case: -0.0090 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 858 from chain A (proline) into lysine:
Energy difference: 0.5542 kcal/mol, Difference in average score from the
base case: -0.0096 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 858 from chain A (proline) into aspartic
acid: Energy difference: 1.2738 kcal/mol, Difference in average score from
the base case: -0.0091 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 858 from chain A (proline) into arginine:
Energy difference: 0.5594 kcal/mol, Difference in average score from the
base case: -0.0114 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 234 from chain A (methionine) into
glutamic acid: Energy difference: 2.3220 kcal/mol, Difference in average
score from the base case: -0.0069 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 234 from chain A (methionine) into
lysine: Energy difference: 1.7652 kcal/mol, Difference in average score
from the base case: -0.0067 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 234 from chain A (methionine) into
aspartic acid: Energy difference: 2.2781 kcal/mol, Difference in average
score from the base case: -0.0114 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 234 from chain A (methionine) into
arginine: Energy difference: 2.3888 kcal/mol, Difference in average score
from the base case: -0.0081 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 474 from chain A (threonine) into
glutamic acid: Energy difference: -0.0579 kcal/mol, Difference in average
score from the base case: -0.0047 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 474 from chain A (threonine) into lysine:
Energy difference: 2.3152 kcal/mol, Difference in average score from the
base case: -0.0052 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 474 from chain A (threonine) into
aspartic acid: Energy difference: -0.7756 kcal/mol, Difference in average
score from the base case: -0.0047 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 474 from chain A (threonine) into
arginine: Energy difference: 1.1119 kcal/mol, Difference in average score
from the base case: -0.0065 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 233 from chain A (glycine) into glutamic
acid: Energy difference: -0.3526 kcal/mol, Difference in average score from
the base case: -0.0029 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 233 from chain A (glycine) into lysine:
Energy difference: -0.6630 kcal/mol, Difference in average score from the
base case: -0.0050 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 233 from chain A (glycine) into aspartic
acid: Energy difference: -0.1557 kcal/mol, Difference in average score from
the base case: -0.0059 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 233 from chain A (glycine) into arginine:
Energy difference: -0.7256 kcal/mol, Difference in average score from the
base case: -0.0059 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 183 from chain A (valine) into glutamic
acid: Energy difference: 1.0013 kcal/mol, Difference in average score from
the base case: -0.0100 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 183 from chain A (valine) into lysine:
Energy difference: 0.2278 kcal/mol, Difference in average score from the
base case: -0.0119 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 183 from chain A (valine) into aspartic
acid: Energy difference: 1.3570 kcal/mol, Difference in average score from
the base case: -0.0111 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 183 from chain A (valine) into arginine:
Energy difference: -0.2054 kcal/mol, Difference in average score from the
base case: -0.0141 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 285 from chain A (valine) into glutamic
acid: Energy difference: 1.9751 kcal/mol, Difference in average score from
the base case: -0.0010 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 285 from chain A (valine) into lysine:
Energy difference: 0.5571 kcal/mol, Difference in average score from the
base case: -0.0052 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 285 from chain A (valine) into aspartic
acid: Energy difference: 1.8971 kcal/mol, Difference in average score from
the base case: 0.0001 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 285 from chain A (valine) into arginine:
Energy difference: 0.9589 kcal/mol, Difference in average score from the
base case: -0.0036 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 775 from chain A (tryptophan) into
glutamic acid: Energy difference: 2.9328 kcal/mol, Difference in average
score from the base case: -0.0055 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 775 from chain A (tryptophan) into
lysine: Energy difference: 2.0170 kcal/mol, Difference in average score
from the base case: -0.0045 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 775 from chain A (tryptophan) into
aspartic acid: Energy difference: 2.0711 kcal/mol, Difference in average
score from the base case: -0.0055 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 775 from chain A (tryptophan) into
arginine: Energy difference: 2.9942 kcal/mol, Difference in average score
from the base case: -0.0045 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 256 from chain A (cysteine) into glutamic
acid: Energy difference: 0.6611 kcal/mol, Difference in average score from
the base case: -0.0054 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 256 from chain A (cysteine) into lysine:
Energy difference: 0.9193 kcal/mol, Difference in average score from the
base case: -0.0047 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 256 from chain A (cysteine) into aspartic
acid: Energy difference: 0.4226 kcal/mol, Difference in average score from
the base case: -0.0057 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 256 from chain A (cysteine) into
arginine: Energy difference: 1.3853 kcal/mol, Difference in average score
from the base case: -0.0033 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 651 from chain A (tyrosine) into glutamic
acid: Energy difference: 4.1780 kcal/mol, Difference in average score from
the base case: -0.0077 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 651 from chain A (tyrosine) into lysine:
Energy difference: 1.9312 kcal/mol, Difference in average score from the
base case: -0.0056 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 651 from chain A (tyrosine) into aspartic
acid: Energy difference: 4.3616 kcal/mol, Difference in average score from
the base case: -0.0090 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 651 from chain A (tyrosine) into
arginine: Energy difference: 2.5323 kcal/mol, Difference in average score
from the base case: -0.0075 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 594 from chain A (methionine) into
glutamic acid: Energy difference: -0.2827 kcal/mol, Difference in average
score from the base case: -0.0043 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 594 from chain A (methionine) into
lysine: Energy difference: 3.0694 kcal/mol, Difference in average score
from the base case: -0.0032 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 594 from chain A (methionine) into
aspartic acid: Energy difference: 0.6171 kcal/mol, Difference in average
score from the base case: -0.0053 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 594 from chain A (methionine) into
arginine: Energy difference: 4.2787 kcal/mol, Difference in average score
from the base case: -0.0033 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 876 from chain A (valine) into glutamic
acid: Energy difference: 1.7012 kcal/mol, Difference in average score from
the base case: -0.0061 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 876 from chain A (valine) into lysine:
Energy difference: 0.9233 kcal/mol, Difference in average score from the
base case: -0.0038 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 876 from chain A (valine) into aspartic
acid: Energy difference: 3.0984 kcal/mol, Difference in average score from
the base case: -0.0050 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 876 from chain A (valine) into arginine:
Energy difference: 0.8969 kcal/mol, Difference in average score from the
base case: -0.0052 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 854 from chain A (alanine) into glutamic
acid: Energy difference: 6.0563 kcal/mol, Difference in average score from
the base case: 0.0006 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 854 from chain A (alanine) into lysine:
Energy difference: 7.2549 kcal/mol, Difference in average score from the
base case: -0.0040 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 854 from chain A (alanine) into aspartic
acid: Energy difference: 5.7182 kcal/mol, Difference in average score from
the base case: -0.0007 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 854 from chain A (alanine) into arginine:
Energy difference: 8.7558 kcal/mol, Difference in average score from the
base case: -0.0003 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 726 from chain A (leucine) into glutamic
acid: Energy difference: 2.9500 kcal/mol, Difference in average score from
the base case: -0.0038 (05:12:12)
[INFO] Auto_mut: Effect of mutation residue number 726 from chain A (leucine) into lysine:
Energy difference: 1.1731 kcal/mol, Difference in average score from the
base case: -0.0042 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 726 from chain A (leucine) into aspartic
acid: Energy difference: 3.5210 kcal/mol, Difference in average score from
the base case: -0.0043 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 726 from chain A (leucine) into arginine:
Energy difference: 0.5924 kcal/mol, Difference in average score from the
base case: -0.0029 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 452 from chain A (alanine) into glutamic
acid: Energy difference: 0.5430 kcal/mol, Difference in average score from
the base case: -0.0048 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 452 from chain A (alanine) into lysine:
Energy difference: -0.4350 kcal/mol, Difference in average score from the
base case: -0.0046 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 452 from chain A (alanine) into aspartic
acid: Energy difference: 0.3545 kcal/mol, Difference in average score from
the base case: -0.0046 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 452 from chain A (alanine) into arginine:
Energy difference: -0.3784 kcal/mol, Difference in average score from the
base case: -0.0050 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 704 from chain A (serine) into glutamic
acid: Energy difference: 0.6370 kcal/mol, Difference in average score from
the base case: -0.0042 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 704 from chain A (serine) into lysine:
Energy difference: -1.0048 kcal/mol, Difference in average score from the
base case: -0.0029 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 704 from chain A (serine) into aspartic
acid: Energy difference: 1.4096 kcal/mol, Difference in average score from
the base case: -0.0036 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 704 from chain A (serine) into arginine:
Energy difference: 0.8144 kcal/mol, Difference in average score from the
base case: -0.0029 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 981 from chain A (alanine) into glutamic
acid: Energy difference: 0.7935 kcal/mol, Difference in average score from
the base case: -0.0109 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 981 from chain A (alanine) into lysine:
Energy difference: 0.2213 kcal/mol, Difference in average score from the
base case: -0.0114 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 981 from chain A (alanine) into aspartic
acid: Energy difference: 0.6274 kcal/mol, Difference in average score from
the base case: -0.0100 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 981 from chain A (alanine) into arginine:
Energy difference: 0.6220 kcal/mol, Difference in average score from the
base case: -0.0114 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 275 from chain A (alanine) into glutamic
acid: Energy difference: -0.2009 kcal/mol, Difference in average score from
the base case: -0.0020 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 275 from chain A (alanine) into lysine:
Energy difference: -0.4846 kcal/mol, Difference in average score from the
base case: -0.0062 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 275 from chain A (alanine) into aspartic
acid: Energy difference: 0.2703 kcal/mol, Difference in average score from
the base case: -0.0068 (05:12:13)
[INFO] Auto_mut: Effect of mutation residue number 275 from chain A (alanine) into arginine:
Energy difference: 0.0196 kcal/mol, Difference in average score from the
base case: -0.0036 (05:12:13)
[INFO] Main: Simulation completed successfully. (05:13:57)
|
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 | |
| 69 | T | A | -0.4568 | |
| 70 | I | A | -0.0267 | |
| 71 | A | A | -0.6580 | |
| 72 | F | A | 0.0000 | |
| 73 | E | A | -2.3250 | |
| 74 | F | A | 0.0000 | |
| 75 | D | A | -1.9648 | |
| 76 | G | A | -1.9352 | |
| 77 | Q | A | -2.3630 | |
| 78 | Q | A | -2.5631 | |
| 79 | V | A | 0.0000 | |
| 80 | E | A | -2.1017 | |
| 81 | A | A | 0.0000 | |
| 82 | Q | A | -1.8121 | |
| 85 | E | A | -1.5738 | |
| 86 | T | A | -1.4306 | |
| 87 | I | A | 0.0000 | |
| 88 | W | A | 0.0000 | |
| 89 | A | A | -1.3783 | |
| 90 | V | A | 0.0000 | |
| 91 | A | A | 0.0000 | |
| 92 | K | A | -1.9669 | |
| 93 | R | A | -2.2008 | |
| 94 | L | A | -1.0599 | |
| 95 | G | A | -1.1957 | |
| 96 | T | A | -1.0101 | |
| 97 | H | A | -0.8830 | |
| 98 | I | A | 0.0000 | |
| 99 | P | A | 0.0000 | |
| 100 | H | A | 0.0000 | |
| 101 | L | A | 0.0000 | |
| 102 | C | A | 0.0000 | |
| 103 | H | A | -1.5533 | |
| 104 | K | A | -1.4489 | |
| 105 | P | A | -1.5282 | |
| 106 | D | A | -2.4237 | |
| 107 | P | A | -1.8313 | |
| 108 | G | A | -1.9294 | |
| 109 | Y | A | 0.0000 | |
| 110 | R | A | -2.9666 | |
| 111 | P | A | -2.2818 | |
| 112 | D | A | -2.2582 | |
| 113 | G | A | -2.2298 | |
| 114 | N | A | -2.1110 | |
| 115 | C | A | -1.2285 | |
| 116 | R | A | -1.6507 | |
| 117 | A | A | 0.0000 | |
| 118 | C | A | 0.0000 | |
| 119 | M | A | 0.0000 | |
| 120 | V | A | 0.0000 | |
| 121 | E | A | -1.7945 | |
| 122 | I | A | 0.0000 | |
| 123 | E | A | -2.9362 | |
| 124 | G | A | -2.3222 | |
| 125 | E | A | -2.3839 | |
| 126 | R | A | -1.9347 | |
| 127 | V | A | 0.3316 | |
| 128 | L | A | -0.1572 | |
| 129 | A | A | -0.6185 | |
| 130 | A | A | 0.0000 | |
| 131 | S | A | 0.0000 | |
| 132 | C | A | 0.0000 | |
| 133 | K | A | -3.0238 | |
| 134 | R | A | -2.3413 | |
| 135 | T | A | -1.4140 | |
| 136 | P | A | 0.0000 | |
| 137 | A | A | 0.6351 | |
| 138 | I | A | 1.5208 | |
| 139 | G | A | 0.2733 | |
| 140 | M | A | -0.5943 | |
| 141 | K | A | -2.2987 | |
| 142 | V | A | 0.0000 | |
| 143 | K | A | -2.2959 | |
| 144 | S | A | 0.0000 | |
| 145 | A | A | -1.2851 | |
| 146 | T | A | -2.1008 | |
| 147 | E | A | -3.3347 | |
| 148 | R | A | -3.3982 | |
| 149 | A | A | 0.0000 | |
| 150 | T | A | -2.0303 | |
| 151 | K | A | -2.7597 | |
| 152 | A | A | -1.5326 | |
| 153 | R | A | 0.0000 | |
| 154 | A | A | -0.3730 | |
| 155 | M | A | 0.1889 | |
| 156 | V | A | 0.3982 | |
| 157 | L | A | 0.0000 | |
| 158 | E | A | 0.0000 | |
| 159 | L | A | 1.1302 | |
| 160 | L | A | 0.8960 | |
| 161 | V | A | 0.0000 | |
| 162 | A | A | -0.5427 | |
| 163 | D | A | -0.8334 | |
| 164 | Q | A | -0.8273 | |
| 165 | P | A | -1.3921 | |
| 166 | E | A | -2.4162 | |
| 167 | R | A | -1.5807 | |
| 168 | A | A | -0.8914 | |
| 169 | T | A | -1.0179 | |
| 170 | S | A | 0.0000 | |
| 171 | H | A | 0.0000 | |
| 172 | D | A | -0.5084 | |
| 173 | P | A | -0.6510 | |
| 174 | S | A | -0.1471 | |
| 175 | S | A | 0.0000 | |
| 176 | H | A | -0.1791 | |
| 177 | F | A | 0.0000 | |
| 178 | W | A | 0.0000 | |
| 179 | V | A | 0.4845 | |
| 180 | Q | A | 0.0000 | |
| 181 | A | A | 0.0000 | |
| 182 | D | A | -1.4341 | |
| 183 | V | A | 0.0474 | |
| 184 | L | A | -0.6679 | |
| 185 | D | A | -2.0594 | |
| 186 | V | A | -1.2795 | |
| 187 | T | A | -1.7120 | |
| 188 | E | A | -2.4433 | |
| 189 | S | A | -1.3143 | |
| 190 | R | A | -1.7497 | |
| 191 | F | A | -0.1866 | |
| 192 | P | A | -0.3794 | |
| 193 | A | A | -0.5625 | |
| 194 | A | A | -1.0368 | |
| 195 | E | A | -2.1083 | |
| 196 | R | A | -1.4374 | |
| 197 | W | A | -0.6455 | |
| 198 | T | A | -0.3581 | |
| 199 | S | A | -0.1876 | |
| 200 | D | A | 0.2299 | |
| 201 | V | A | 1.3342 | |
| 202 | S | A | 0.2551 | |
| 203 | H | A | 0.0000 | |
| 204 | P | A | 0.2156 | |
| 205 | A | A | 0.0000 | |
| 206 | M | A | 0.0000 | |
| 207 | S | A | 0.0000 | |
| 208 | V | A | 0.0000 | |
| 209 | N | A | 0.0000 | |
| 210 | L | A | 0.0000 | |
| 211 | D | A | -1.0331 | |
| 212 | A | A | 0.0000 | |
| 213 | C | A | 0.0000 | |
| 214 | I | A | 0.0000 | |
| 215 | Q | A | -0.3678 | |
| 216 | C | A | 0.0000 | |
| 217 | N | A | -0.4368 | |
| 218 | L | A | 0.0000 | |
| 219 | C | A | 0.0000 | |
| 220 | V | A | -0.4665 | |
| 221 | R | A | 0.0000 | |
| 222 | A | A | 0.0000 | |
| 223 | C | A | 0.0000 | |
| 224 | R | A | -1.9721 | |
| 225 | E | A | -2.9675 | |
| 226 | V | A | 0.0000 | |
| 227 | Q | A | 0.0000 | |
| 228 | V | A | 0.0000 | |
| 229 | N | A | -0.8152 | |
| 230 | D | A | -1.0348 | |
| 231 | V | A | 0.0000 | |
| 232 | I | A | 0.0000 | |
| 233 | G | A | 0.0827 | |
| 234 | M | A | 0.1015 | |
| 235 | A | A | 0.3130 | |
| 236 | Y | A | 0.3635 | |
| 237 | R | A | -1.2496 | |
| 238 | A | A | -0.6741 | |
| 239 | A | A | -0.4197 | |
| 240 | G | A | -0.5403 | |
| 241 | S | A | -0.4175 | |
| 242 | K | A | -0.3370 | |
| 243 | V | A | 0.0000 | |
| 244 | V | A | 0.0000 | |
| 245 | F | A | 0.0000 | |
| 246 | D | A | -0.3008 | |
| 247 | F | A | 0.9594 | |
| 248 | D | A | -0.4734 | |
| 249 | D | A | -1.0260 | |
| 250 | P | A | -0.7237 | |
| 251 | M | A | 0.0000 | |
| 252 | G | A | -0.4437 | |
| 253 | G | A | -0.9972 | |
| 254 | S | A | -0.5458 | |
| 255 | T | A | -0.3505 | |
| 256 | C | A | 0.0439 | |
| 257 | V | A | 0.6240 | |
| 258 | A | A | 0.0000 | |
| 259 | C | A | 0.0000 | |
| 260 | G | A | 0.0000 | |
| 261 | E | A | 0.0000 | |
| 262 | C | A | 0.0000 | |
| 263 | V | A | 0.0000 | |
| 264 | Q | A | -0.3013 | |
| 265 | A | A | 0.0000 | |
| 266 | C | A | -0.0707 | |
| 267 | P | A | 0.0000 | |
| 268 | T | A | 0.0000 | |
| 269 | G | A | 0.0000 | |
| 270 | A | A | 0.0000 | |
| 271 | L | A | 0.0000 | |
| 272 | M | A | 0.0000 | |
| 273 | P | A | 0.0000 | |
| 274 | A | A | 0.1501 | |
| 275 | A | A | -0.0255 | |
| 276 | Y | A | 0.0000 | |
| 277 | L | A | -0.7221 | |
| 278 | D | A | -1.4625 | |
| 279 | A | A | -0.9243 | |
| 280 | N | A | -1.7083 | |
| 281 | Q | A | -0.9748 | |
| 282 | T | A | -0.9972 | |
| 283 | R | A | -0.5986 | |
| 284 | T | A | -0.1739 | |
| 285 | V | A | 0.0474 | |
| 286 | Y | A | -0.1233 | |
| 287 | P | A | -2.1525 | |
| 288 | D | A | -3.3884 | |
| 289 | R | A | -2.9118 | |
| 290 | E | A | -2.8724 | |
| 291 | V | A | -1.6446 | |
| 292 | K | A | -1.7230 | |
| 293 | S | A | 0.0000 | |
| 294 | L | A | 0.0000 | |
| 295 | C | A | 0.0000 | |
| 296 | P | A | 0.0000 | |
| 297 | Y | A | 0.0000 | |
| 298 | C | A | 0.0000 | |
| 299 | G | A | 0.0000 | |
| 300 | V | A | 0.0000 | |
| 301 | G | A | 0.0000 | |
| 302 | C | A | 0.0000 | |
| 303 | Q | A | 0.0000 | |
| 304 | V | A | 0.0000 | |
| 305 | S | A | -1.2705 | |
| 306 | Y | A | 0.0000 | |
| 307 | K | A | -2.1863 | |
| 308 | V | A | 0.0000 | |
| 309 | K | A | -3.4822 | |
| 310 | D | A | -3.9074 | |
| 311 | E | A | -3.9397 | |
| 312 | R | A | -3.3823 | |
| 313 | I | A | 0.0000 | |
| 314 | V | A | -0.8135 | |
| 315 | Y | A | 0.0000 | |
| 316 | A | A | 0.0000 | |
| 317 | E | A | -0.7780 | |
| 318 | G | A | 0.0000 | |
| 319 | V | A | -0.9032 | |
| 320 | N | A | -1.6846 | |
| 321 | G | A | 0.0000 | |
| 322 | P | A | -0.5706 | |
| 323 | A | A | 0.0000 | |
| 324 | N | A | 0.0000 | |
| 325 | Q | A | -1.3992 | |
| 326 | N | A | -1.1930 | |
| 327 | R | A | 0.0000 | |
| 328 | L | A | 0.0000 | |
| 329 | C | A | 0.0000 | |
| 330 | V | A | 0.0000 | |
| 331 | K | A | 0.0000 | |
| 332 | G | A | 0.0000 | |
| 333 | R | A | 0.0000 | |
| 334 | F | A | 0.0000 | |
| 335 | G | A | 0.0000 | |
| 336 | F | A | 0.0000 | |
| 337 | D | A | -0.6730 | |
| 338 | Y | A | 0.0000 | |
| 339 | V | A | 0.0000 | |
| 340 | H | A | -0.8956 | |
| 341 | H | A | -0.6863 | |
| 342 | P | A | -0.5562 | |
| 343 | H | A | -0.6498 | |
| 344 | R | A | 0.0000 | |
| 345 | L | A | 0.0000 | |
| 346 | T | A | -0.7992 | |
| 347 | V | A | -0.5965 | |
| 348 | P | A | 0.0000 | |
| 349 | L | A | 0.0000 | |
| 350 | I | A | 0.0000 | |
| 351 | R | A | 0.0000 | |
| 352 | L | A | -1.0751 | |
| 353 | E | A | -2.2938 | |
| 354 | N | A | -1.9518 | |
| 355 | V | A | -1.0625 | |
| 356 | P | A | -1.2716 | |
| 357 | K | A | -2.0201 | |
| 358 | D | A | -2.8631 | |
| 359 | A | A | -2.5691 | |
| 360 | N | A | -2.8113 | |
| 361 | D | A | -2.6180 | |
| 362 | Q | A | -2.3832 | |
| 363 | V | A | 0.0000 | |
| 364 | D | A | -1.4239 | |
| 365 | P | A | -0.8263 | |
| 366 | A | A | -0.5512 | |
| 367 | N | A | -0.6261 | |
| 368 | P | A | -0.4392 | |
| 369 | W | A | 0.3414 | |
| 370 | T | A | 0.1758 | |
| 371 | H | A | -0.4776 | |
| 372 | F | A | 0.0000 | |
| 373 | R | A | -1.2797 | |
| 374 | E | A | -1.7863 | |
| 375 | A | A | -1.3169 | |
| 376 | T | A | -1.3256 | |
| 377 | W | A | -1.7252 | |
| 378 | E | A | -2.6080 | |
| 379 | E | A | -2.4331 | |
| 380 | A | A | 0.0000 | |
| 381 | L | A | 0.0000 | |
| 382 | D | A | -3.1306 | |
| 383 | R | A | -2.8748 | |
| 384 | A | A | 0.0000 | |
| 385 | A | A | 0.0000 | |
| 386 | G | A | -1.6480 | |
| 387 | G | A | -1.4048 | |
| 388 | L | A | 0.0000 | |
| 389 | K | A | -1.9960 | |
| 390 | A | A | -1.2822 | |
| 391 | I | A | 0.0000 | |
| 392 | R | A | -2.6404 | |
| 393 | D | A | -2.6523 | |
| 394 | T | A | -1.7867 | |
| 395 | N | A | -2.5350 | |
| 396 | G | A | -2.8296 | |
| 397 | R | A | -3.2833 | |
| 398 | K | A | -3.0633 | |
| 399 | A | A | 0.0000 | |
| 400 | L | A | 0.0000 | |
| 401 | A | A | 0.0000 | |
| 402 | G | A | 0.0000 | |
| 403 | F | A | 0.0000 | |
| 404 | G | A | 0.0000 | |
| 405 | S | A | 0.0000 | |
| 406 | A | A | 0.0000 | |
| 407 | K | A | -0.3125 | |
| 408 | G | A | 0.0000 | |
| 409 | S | A | 0.0000 | |
| 410 | N | A | 0.0000 | |
| 411 | E | A | 0.0000 | |
| 412 | E | A | 0.0000 | |
| 413 | A | A | 0.0000 | |
| 414 | Y | A | 0.0000 | |
| 415 | L | A | 0.0000 | |
| 416 | F | A | 0.0000 | |
| 417 | Q | A | 0.0000 | |
| 418 | K | A | 0.0000 | |
| 419 | L | A | 0.0000 | |
| 420 | V | A | 0.0000 | |
| 421 | R | A | 0.0000 | |
| 422 | L | A | 0.0000 | |
| 423 | G | A | 0.0000 | |
| 424 | F | A | 0.0000 | |
| 425 | G | A | -1.0676 | |
| 426 | T | A | 0.0000 | |
| 427 | N | A | 0.0000 | |
| 428 | N | A | 0.0000 | |
| 429 | V | A | 0.0000 | |
| 430 | D | A | 0.0000 | |
| 431 | H | A | 0.0000 | |
| 432 | C | A | 0.0000 | |
| 433 | T | A | 0.0000 | |
| 434 | R | A | 0.0000 | |
| 435 | L | A | 0.0000 | |
| 436 | C | A | 0.1345 | |
| 437 | H | A | 0.0000 | |
| 438 | A | A | 0.0000 | |
| 439 | S | A | 0.0000 | |
| 440 | S | A | 0.0000 | |
| 441 | V | A | 0.2378 | |
| 442 | A | A | 0.1521 | |
| 443 | A | A | 0.0000 | |
| 444 | L | A | 0.0000 | |
| 445 | M | A | -0.3420 | |
| 446 | E | A | -0.7207 | |
| 447 | G | A | 0.0000 | |
| 448 | L | A | 0.0000 | |
| 449 | N | A | -1.3618 | |
| 450 | S | A | 0.0000 | |
| 451 | G | A | -0.1073 | |
| 452 | A | A | -0.0109 | |
| 453 | V | A | 0.0000 | |
| 454 | T | A | 0.0000 | |
| 455 | A | A | 0.0000 | |
| 456 | P | A | 0.0000 | |
| 457 | F | A | 0.0000 | |
| 458 | S | A | -0.3479 | |
| 459 | A | A | 0.0000 | |
| 460 | A | A | 0.0000 | |
| 461 | L | A | -1.0916 | |
| 462 | D | A | -2.0315 | |
| 463 | A | A | 0.0000 | |
| 464 | E | A | -1.9355 | |
| 465 | V | A | 0.0000 | |
| 466 | I | A | 0.0000 | |
| 467 | V | A | 0.0000 | |
| 468 | V | A | 0.0000 | |
| 469 | I | A | 0.0000 | |
| 470 | G | A | 0.0000 | |
| 471 | A | A | 0.0000 | |
| 472 | N | A | -0.3468 | |
| 473 | P | A | 0.0000 | |
| 474 | T | A | 0.0948 | |
| 475 | V | A | 0.2222 | |
| 476 | N | A | -0.1287 | |
| 477 | H | A | 0.0000 | |
| 478 | P | A | 0.0000 | |
| 479 | V | A | 0.0000 | |
| 480 | A | A | 0.0000 | |
| 481 | A | A | 0.0000 | |
| 482 | T | A | 0.0000 | |
| 483 | F | A | 0.0000 | |
| 484 | L | A | 0.0000 | |
| 485 | K | A | 0.0000 | |
| 486 | N | A | -1.7035 | |
| 487 | A | A | 0.0000 | |
| 488 | V | A | -1.4700 | |
| 489 | K | A | -2.7715 | |
| 490 | Q | A | -2.9390 | |
| 491 | R | A | -3.1919 | |
| 492 | G | A | -1.9578 | |
| 493 | A | A | 0.0000 | |
| 494 | K | A | -0.9307 | |
| 495 | L | A | 0.0000 | |
| 496 | I | A | 0.0000 | |
| 497 | I | A | 0.0000 | |
| 498 | M | A | 0.0000 | |
| 499 | D | A | 0.0000 | |
| 500 | P | A | -1.1570 | |
| 501 | R | A | -1.4633 | |
| 502 | R | A | -2.1871 | |
| 503 | Q | A | 0.0000 | |
| 504 | T | A | -0.9817 | |
| 505 | L | A | 0.0000 | |
| 506 | S | A | -1.3582 | |
| 507 | R | A | -2.0115 | |
| 508 | H | A | -1.1367 | |
| 509 | A | A | -0.4795 | |
| 510 | Y | A | 0.1405 | |
| 511 | R | A | -0.5074 | |
| 512 | H | A | -0.6371 | |
| 513 | L | A | 0.0000 | |
| 514 | A | A | -0.9935 | |
| 515 | F | A | 0.0000 | |
| 516 | R | A | -1.9961 | |
| 517 | P | A | -1.0966 | |
| 518 | G | A | -0.2341 | |
| 519 | S | A | 0.0000 | |
| 520 | D | A | 0.0000 | |
| 521 | V | A | 0.0000 | |
| 522 | A | A | 0.0000 | |
| 523 | M | A | 0.0000 | |
| 524 | L | A | 0.0000 | |
| 525 | N | A | 0.0000 | |
| 526 | A | A | 0.0000 | |
| 527 | M | A | 0.0000 | |
| 528 | L | A | 0.0000 | |
| 529 | N | A | 0.0000 | |
| 530 | V | A | 0.0000 | |
| 531 | I | A | 0.0000 | |
| 532 | V | A | 0.0000 | |
| 533 | T | A | -0.4623 | |
| 534 | E | A | -1.1519 | |
| 535 | G | A | -1.0559 | |
| 536 | L | A | -1.1816 | |
| 537 | Y | A | -1.2636 | |
| 538 | D | A | -2.0600 | |
| 539 | E | A | -2.6398 | |
| 540 | Q | A | -2.1178 | |
| 541 | Y | A | -1.0832 | |
| 542 | I | A | -1.0993 | |
| 543 | A | A | -0.9824 | |
| 544 | G | A | -0.6018 | |
| 545 | Y | A | -0.1907 | |
| 546 | T | A | 0.0000 | |
| 547 | E | A | -1.7685 | |
| 548 | N | A | -1.9806 | |
| 549 | F | A | 0.0000 | |
| 550 | E | A | -3.2712 | |
| 551 | A | A | -2.5314 | |
| 552 | L | A | 0.0000 | |
| 553 | R | A | -2.9850 | |
| 554 | E | A | -3.4642 | |
| 555 | K | A | -2.9562 | |
| 556 | I | A | 0.0000 | |
| 557 | V | A | -0.3080 | |
| 558 | D | A | -1.6228 | |
| 559 | F | A | -0.8045 | |
| 560 | T | A | -1.0633 | |
| 561 | P | A | 0.0000 | |
| 562 | E | A | -3.0553 | |
| 563 | K | A | -2.6144 | |
| 564 | M | A | 0.0000 | |
| 565 | A | A | -1.9349 | |
| 566 | S | A | -1.3037 | |
| 567 | V | A | -0.4265 | |
| 568 | C | A | 0.0000 | |
| 569 | G | A | -1.3699 | |
| 570 | I | A | 0.0000 | |
| 571 | D | A | -2.9937 | |
| 572 | A | A | -2.8660 | |
| 573 | E | A | -2.9336 | |
| 574 | T | A | -1.9368 | |
| 575 | L | A | 0.0000 | |
| 576 | R | A | -1.9679 | |
| 577 | E | A | -1.6040 | |
| 578 | V | A | 0.0000 | |
| 579 | A | A | 0.0000 | |
| 580 | R | A | -1.7077 | |
| 581 | L | A | -1.3324 | |
| 582 | Y | A | 0.0000 | |
| 583 | A | A | -1.3977 | |
| 584 | R | A | -2.5223 | |
| 585 | A | A | 0.0000 | |
| 586 | K | A | -2.5155 | |
| 587 | S | A | 0.0000 | |
| 588 | S | A | 0.0000 | |
| 589 | L | A | 0.0000 | |
| 590 | I | A | 0.0000 | |
| 591 | F | A | 0.0000 | |
| 592 | W | A | 0.0000 | |
| 593 | G | A | 0.0000 | |
| 594 | M | A | 0.0192 | |
| 595 | G | A | -0.1347 | |
| 596 | V | A | 0.0000 | |
| 597 | S | A | 0.0000 | |
| 598 | Q | A | 0.0000 | |
| 599 | H | A | 0.0000 | |
| 600 | V | A | -0.0916 | |
| 601 | H | A | 0.0000 | |
| 602 | G | A | 0.0000 | |
| 603 | T | A | 0.0000 | |
| 604 | D | A | 0.1330 | |
| 605 | N | A | 0.0000 | |
| 606 | S | A | 0.0000 | |
| 607 | R | A | -0.4278 | |
| 608 | C | A | 0.0000 | |
| 609 | L | A | 0.0000 | |
| 610 | I | A | 0.0000 | |
| 611 | A | A | 0.0000 | |
| 612 | L | A | 0.0000 | |
| 613 | A | A | 0.0000 | |
| 614 | L | A | 0.0000 | |
| 615 | I | A | 0.0000 | |
| 616 | T | A | 0.0000 | |
| 617 | G | A | 0.0000 | |
| 618 | Q | A | 0.0000 | |
| 619 | I | A | 0.0000 | |
| 620 | G | A | 0.3089 | |
| 621 | R | A | -0.9216 | |
| 622 | P | A | -0.8600 | |
| 623 | G | A | 0.0000 | |
| 624 | T | A | 0.0000 | |
| 625 | G | A | 0.0000 | |
| 626 | L | A | 0.0000 | |
| 627 | H | A | 0.0000 | |
| 628 | P | A | 0.0000 | |
| 629 | L | A | 0.0000 | |
| 630 | R | A | 0.0000 | |
| 631 | G | A | -0.0841 | |
| 632 | Q | A | 0.0000 | |
| 633 | N | A | 0.0000 | |
| 634 | N | A | 0.0000 | |
| 635 | V | A | 0.0000 | |
| 636 | Q | A | 0.0000 | |
| 637 | G | A | 0.0000 | |
| 638 | A | A | 0.0000 | |
| 639 | S | A | 0.0000 | |
| 640 | D | A | 0.0000 | |
| 641 | A | A | 0.0000 | |
| 642 | G | A | 0.0000 | |
| 643 | L | A | 0.0000 | |
| 644 | I | A | 0.0000 | |
| 645 | P | A | 0.0000 | |
| 646 | M | A | -0.6063 | |
| 647 | V | A | 0.0000 | |
| 648 | Y | A | 0.0000 | |
| 649 | P | A | 0.0000 | |
| 650 | D | A | -0.2364 | |
| 651 | Y | A | 0.0303 | |
| 652 | Q | A | -0.5876 | |
| 653 | S | A | -1.6075 | |
| 654 | V | A | 0.0000 | |
| 655 | E | A | -3.2347 | |
| 656 | K | A | -3.6040 | |
| 657 | D | A | -3.3748 | |
| 658 | A | A | -1.9964 | |
| 659 | V | A | 0.0000 | |
| 660 | R | A | -2.5050 | |
| 661 | E | A | -2.8089 | |
| 662 | L | A | -0.7675 | |
| 663 | F | A | 0.0000 | |
| 664 | E | A | -1.7619 | |
| 665 | E | A | -2.1172 | |
| 666 | F | A | -0.6831 | |
| 667 | W | A | -0.7132 | |
| 668 | G | A | -1.3855 | |
| 669 | Q | A | -1.5302 | |
| 670 | S | A | -1.3525 | |
| 671 | L | A | 0.0000 | |
| 672 | D | A | -1.5079 | |
| 673 | P | A | -2.5321 | |
| 674 | Q | A | -2.5373 | |
| 675 | K | A | -2.3182 | |
| 676 | G | A | -1.1486 | |
| 677 | L | A | -0.4971 | |
| 678 | T | A | -0.3454 | |
| 679 | V | A | 0.0000 | |
| 680 | V | A | 0.0000 | |
| 681 | E | A | -0.9074 | |
| 682 | I | A | 0.0000 | |
| 683 | M | A | 0.0000 | |
| 684 | R | A | -2.0226 | |
| 685 | A | A | -1.4929 | |
| 686 | I | A | 0.0000 | |
| 687 | H | A | -1.5442 | |
| 688 | A | A | -1.2156 | |
| 689 | G | A | -1.6452 | |
| 690 | E | A | -2.4427 | |
| 691 | I | A | 0.0000 | |
| 692 | R | A | -1.7066 | |
| 693 | G | A | 0.0000 | |
| 694 | M | A | 0.0000 | |
| 695 | F | A | 0.0000 | |
| 696 | V | A | 0.0000 | |
| 697 | E | A | 0.0000 | |
| 698 | G | A | -0.3635 | |
| 699 | E | A | -0.3636 | |
| 700 | N | A | 0.0000 | |
| 701 | P | A | 0.0000 | |
| 702 | A | A | 0.0000 | |
| 703 | M | A | 0.0000 | |
| 704 | S | A | -0.0150 | |
| 705 | D | A | 0.0000 | |
| 706 | P | A | 0.0000 | |
| 707 | D | A | 0.0000 | |
| 708 | L | A | 0.0000 | |
| 709 | N | A | -1.8253 | |
| 710 | H | A | -1.9839 | |
| 711 | A | A | 0.0000 | |
| 712 | R | A | -1.7078 | |
| 713 | H | A | -2.0187 | |
| 714 | A | A | 0.0000 | |
| 715 | L | A | 0.0000 | |
| 716 | A | A | -1.4821 | |
| 717 | M | A | -0.8881 | |
| 718 | L | A | 0.0000 | |
| 719 | D | A | -1.9199 | |
| 720 | H | A | 0.0000 | |
| 721 | L | A | 0.0000 | |
| 722 | V | A | 0.0000 | |
| 723 | V | A | 0.0000 | |
| 724 | Q | A | 0.0000 | |
| 725 | D | A | -0.2050 | |
| 726 | L | A | 0.0018 | |
| 727 | F | A | 0.0000 | |
| 728 | L | A | 0.0000 | |
| 729 | T | A | 0.0000 | |
| 730 | E | A | -0.7651 | |
| 731 | T | A | 0.0000 | |
| 732 | A | A | 0.0000 | |
| 733 | F | A | -0.9710 | |
| 734 | H | A | 0.0000 | |
| 735 | A | A | 0.0000 | |
| 736 | D | A | -0.9547 | |
| 737 | V | A | 0.0000 | |
| 738 | V | A | 0.0000 | |
| 739 | L | A | 0.0000 | |
| 740 | P | A | 0.0000 | |
| 741 | A | A | 0.0000 | |
| 742 | S | A | 0.0000 | |
| 743 | A | A | 0.0000 | |
| 744 | F | A | 0.0000 | |
| 745 | A | A | 0.0000 | |
| 746 | E | A | 0.0000 | |
| 747 | K | A | 0.0000 | |
| 748 | A | A | -0.4300 | |
| 749 | G | A | 0.0000 | |
| 750 | T | A | 0.0000 | |
| 751 | F | A | 0.0000 | |
| 752 | T | A | 0.0000 | |
| 753 | N | A | 0.0000 | |
| 754 | T | A | 0.0000 | |
| 755 | D | A | 0.0000 | |
| 756 | R | A | 0.0000 | |
| 757 | R | A | 0.0000 | |
| 758 | V | A | 0.0000 | |
| 759 | Q | A | 0.0000 | |
| 760 | I | A | -0.8649 | |
| 761 | A | A | 0.0000 | |
| 762 | Q | A | -1.3640 | |
| 763 | P | A | -0.6990 | |
| 764 | V | A | 0.0000 | |
| 765 | V | A | 0.0000 | |
| 766 | A | A | -0.7635 | |
| 767 | P | A | -0.7019 | |
| 768 | P | A | -0.7835 | |
| 769 | G | A | -1.2198 | |
| 770 | D | A | -1.7820 | |
| 771 | A | A | 0.0000 | |
| 772 | R | A | -1.1565 | |
| 773 | Q | A | -0.5780 | |
| 774 | D | A | 0.0000 | |
| 775 | W | A | 0.0453 | |
| 776 | W | A | -0.1203 | |
| 777 | I | A | 0.0000 | |
| 778 | I | A | 0.0000 | |
| 779 | Q | A | 0.0000 | |
| 780 | E | A | -1.1912 | |
| 781 | L | A | 0.0000 | |
| 782 | A | A | 0.0000 | |
| 783 | R | A | -2.4400 | |
| 784 | R | A | -2.0946 | |
| 785 | L | A | 0.0000 | |
| 786 | D | A | -2.6470 | |
| 787 | L | A | -2.1931 | |
| 788 | D | A | -2.8178 | |
| 789 | W | A | 0.0000 | |
| 790 | N | A | -2.0062 | |
| 791 | Y | A | -1.2884 | |
| 792 | G | A | -1.0621 | |
| 793 | G | A | 0.0000 | |
| 794 | P | A | -0.4839 | |
| 795 | A | A | -1.0222 | |
| 796 | D | A | -1.8028 | |
| 797 | I | A | 0.0000 | |
| 798 | F | A | 0.0000 | |
| 799 | A | A | -0.8256 | |
| 800 | E | A | -0.8542 | |
| 801 | M | A | 0.0000 | |
| 802 | A | A | -0.9945 | |
| 803 | Q | A | -1.4137 | |
| 804 | V | A | 0.0000 | |
| 805 | M | A | 0.0000 | |
| 806 | P | A | -1.0414 | |
| 807 | S | A | -0.9913 | |
| 808 | L | A | 0.0000 | |
| 809 | N | A | -2.0958 | |
| 810 | N | A | -1.8796 | |
| 811 | I | A | 0.0000 | |
| 812 | T | A | -1.1372 | |
| 813 | W | A | -1.8293 | |
| 814 | E | A | -3.0717 | |
| 815 | R | A | 0.0000 | |
| 816 | L | A | 0.0000 | |
| 817 | E | A | -3.8630 | |
| 818 | R | A | -3.9252 | |
| 819 | E | A | -3.2803 | |
| 820 | G | A | -2.1693 | |
| 821 | A | A | -1.0189 | |
| 822 | V | A | 0.0000 | |
| 823 | T | A | 0.0000 | |
| 824 | Y | A | 0.0000 | |
| 825 | P | A | -1.1115 | |
| 826 | V | A | 0.0000 | |
| 827 | D | A | -2.8343 | |
| 828 | A | A | -2.2964 | |
| 829 | P | A | -2.1749 | |
| 830 | D | A | -2.8641 | |
| 831 | Q | A | -2.7523 | |
| 832 | P | A | -1.8345 | |
| 833 | G | A | -1.4945 | |
| 834 | N | A | -0.9913 | |
| 835 | E | A | -0.6259 | |
| 836 | I | A | 0.1175 | |
| 837 | I | A | 0.4381 | |
| 838 | F | A | 0.7596 | |
| 839 | Y | A | 1.2166 | |
| 840 | A | A | 0.6028 | |
| 841 | G | A | 0.2331 | |
| 842 | F | A | 0.0000 | |
| 843 | P | A | -1.0524 | |
| 844 | T | A | -1.6861 | |
| 845 | E | A | -2.2395 | |
| 846 | S | A | -1.5067 | |
| 847 | G | A | -1.3155 | |
| 848 | R | A | -1.3555 | |
| 849 | A | A | 0.0000 | |
| 850 | K | A | -1.5646 | |
| 851 | I | A | 0.0000 | |
| 852 | V | A | -0.3342 | |
| 853 | P | A | -0.8151 | |
| 854 | A | A | 0.0144 | |
| 855 | A | A | 0.3937 | |
| 856 | I | A | 1.1802 | |
| 857 | V | A | 0.7553 | |
| 858 | P | A | 0.1103 | |
| 859 | P | A | -0.3657 | |
| 860 | D | A | -1.3260 | |
| 861 | E | A | 0.0000 | |
| 862 | V | A | 0.7354 | |
| 863 | P | A | -0.9178 | |
| 864 | D | A | -2.9178 | |
| 865 | D | A | -3.6378 | |
| 866 | E | A | -3.5544 | |
| 867 | F | A | -2.2757 | |
| 868 | P | A | -1.6661 | |
| 869 | M | A | -0.4007 | |
| 870 | V | A | 0.3606 | |
| 871 | L | A | 0.0000 | |
| 872 | S | A | 0.0000 | |
| 873 | T | A | 0.0000 | |
| 874 | G | A | -0.2436 | |
| 875 | R | A | -0.3153 | |
| 876 | V | A | 0.0162 | |
| 877 | L | A | 0.2367 | |
| 878 | E | A | -0.0817 | |
| 879 | H | A | 0.0000 | |
| 880 | W | A | 0.0000 | |
| 881 | H | A | -0.1511 | |
| 882 | T | A | 0.0000 | |
| 883 | G | A | 0.0000 | |
| 884 | S | A | -0.1647 | |
| 885 | M | A | -0.2054 | |
| 886 | T | A | 0.0000 | |
| 887 | R | A | -0.8888 | |
| 888 | R | A | -0.7871 | |
| 889 | A | A | 0.0000 | |
| 890 | G | A | -0.7095 | |
| 891 | V | A | -0.2325 | |
| 892 | L | A | 0.0000 | |
| 893 | D | A | -0.9456 | |
| 894 | A | A | -0.4129 | |
| 895 | L | A | -0.0521 | |
| 896 | E | A | 0.0000 | |
| 897 | P | A | -0.9900 | |
| 898 | E | A | -1.8644 | |
| 899 | A | A | 0.0000 | |
| 900 | V | A | 0.0000 | |
| 901 | A | A | 0.0000 | |
| 902 | F | A | -0.8832 | |
| 903 | M | A | 0.0000 | |
| 904 | A | A | 0.0000 | |
| 905 | P | A | 0.0000 | |
| 906 | K | A | -1.6617 | |
| 907 | E | A | 0.0000 | |
| 908 | L | A | 0.0000 | |
| 909 | Y | A | -0.6088 | |
| 910 | R | A | -1.6011 | |
| 911 | L | A | -0.7899 | |
| 912 | G | A | -1.0573 | |
| 913 | L | A | 0.0000 | |
| 914 | R | A | -2.1679 | |
| 915 | P | A | -1.7537 | |
| 916 | G | A | -1.5893 | |
| 917 | G | A | -1.5271 | |
| 918 | S | A | -0.8224 | |
| 919 | M | A | 0.0000 | |
| 920 | R | A | -0.5242 | |
| 921 | L | A | 0.0000 | |
| 922 | E | A | -1.1098 | |
| 923 | T | A | 0.0000 | |
| 924 | R | A | -2.3500 | |
| 925 | R | A | -1.5329 | |
| 926 | G | A | -0.9455 | |
| 927 | A | A | -0.4339 | |
| 928 | V | A | 0.0000 | |
| 929 | V | A | 0.8386 | |
| 930 | L | A | 0.0000 | |
| 931 | K | A | -1.6124 | |
| 932 | V | A | 0.0000 | |
| 933 | R | A | -2.0433 | |
| 934 | S | A | -2.0617 | |
| 935 | D | A | -2.2890 | |
| 936 | R | A | -2.8628 | |
| 937 | D | A | -2.2969 | |
| 938 | V | A | 0.0000 | |
| 939 | P | A | -0.6275 | |
| 940 | I | A | 0.8560 | |
| 941 | G | A | 0.4754 | |
| 942 | M | A | 0.0000 | |
| 943 | I | A | 0.0000 | |
| 944 | F | A | 0.0000 | |
| 945 | M | A | 0.0000 | |
| 946 | P | A | 0.0000 | |
| 947 | F | A | 0.1674 | |
| 948 | C | A | 0.0000 | |
| 949 | Y | A | 0.0000 | |
| 950 | A | A | -0.9771 | |
| 951 | E | A | -1.7125 | |
| 952 | A | A | 0.0000 | |
| 953 | A | A | 0.0000 | |
| 954 | A | A | 0.0000 | |
| 955 | N | A | 0.0000 | |
| 956 | L | A | -0.5125 | |
| 957 | L | A | 0.0000 | |
| 958 | T | A | 0.0000 | |
| 959 | N | A | 0.0000 | |
| 960 | P | A | -0.2948 | |
| 961 | A | A | -0.3632 | |
| 962 | L | A | -0.0451 | |
| 963 | D | A | 0.0000 | |
| 964 | P | A | 0.2773 | |
| 965 | L | A | 0.9217 | |
| 966 | G | A | 0.0000 | |
| 967 | K | A | -0.0917 | |
| 968 | I | A | 0.0000 | |
| 969 | P | A | 0.0000 | |
| 970 | E | A | 0.0000 | |
| 971 | F | A | 0.0000 | |
| 972 | K | A | -0.1961 | |
| 973 | F | A | 0.0000 | |
| 974 | C | A | 0.0000 | |
| 975 | A | A | 0.0000 | |
| 976 | A | A | 0.0000 | |
| 977 | R | A | -1.7887 | |
| 978 | V | A | -0.1946 | |
| 979 | V | A | -0.0305 | |
| 980 | P | A | -0.3111 | |
| 981 | A | A | -0.0224 |
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 |
|||
| YR839A | -0.7383 | -0.0172 | View | CSV | PDB |
| VK862A | -0.8784 | -0.0135 | View | CSV | PDB |
| AR855A | -0.9517 | -0.0116 | View | CSV | PDB |
| IE138A | -0.4317 | -0.0178 | View | CSV | PDB |
| VR862A | -0.6393 | -0.0144 | View | CSV | PDB |
| FD247A | -0.4283 | -0.0171 | View | CSV | PDB |
| FR247A | -0.5531 | -0.0148 | View | CSV | PDB |
| AE235A | -1.0178 | -0.0101 | View | CSV | PDB |
| VR257A | -0.7923 | -0.0104 | View | CSV | PDB |
| AD235A | -1.0088 | -0.0086 | View | CSV | PDB |
| VK857A | -0.7875 | -0.0094 | View | CSV | PDB |
| VE201A | -0.2463 | -0.0161 | View | CSV | PDB |
| VR857A | -0.8746 | -0.0085 | View | CSV | PDB |
| YK839A | -0.2886 | -0.0144 | View | CSV | PDB |
| AD855A | -1.3316 | -0.0061 | View | CSV | PDB |
| VR183A | -0.2054 | -0.0141 | View | CSV | PDB |
| VK179A | -0.4919 | -0.01 | View | CSV | PDB |
| IK138A | -0.0769 | -0.0171 | View | CSV | PDB |
| WE369A | -0.0958 | -0.0165 | View | CSV | PDB |
| VD127A | -0.1059 | -0.0161 | View | CSV | PDB |
| AD137A | -0.469 | -0.0099 | View | CSV | PDB |
| AE137A | -0.4402 | -0.0102 | View | CSV | PDB |
| VR179A | -0.2755 | -0.012 | View | CSV | PDB |
| AK840A | -0.38 | -0.0105 | View | CSV | PDB |
| TK370A | -0.6653 | -0.0079 | View | CSV | PDB |
| AR840A | -0.3412 | -0.0109 | View | CSV | PDB |
| VR156A | -0.8672 | -0.0066 | View | CSV | PDB |
| CE436A | -1.5639 | -0.0043 | View | CSV | PDB |
| VK929A | -0.0806 | -0.0144 | View | CSV | PDB |
| TR370A | -0.3929 | -0.0087 | View | CSV | PDB |
| VR201A | -0.0067 | -0.015 | View | CSV | PDB |
| VK127A | -0.0064 | -0.015 | View | CSV | PDB |
| GR233A | -0.7256 | -0.0059 | View | CSV | PDB |
| AK275A | -0.4846 | -0.0062 | View | CSV | PDB |
| TD474A | -0.7756 | -0.0047 | View | CSV | PDB |
| AR274A | -0.192 | -0.0085 | View | CSV | PDB |
| GK233A | -0.663 | -0.005 | View | CSV | PDB |
| VK257A | -0.1106 | -0.0093 | View | CSV | PDB |
| AR452A | -0.3784 | -0.005 | View | CSV | PDB |
| SK704A | -1.0048 | -0.0029 | View | CSV | PDB |
| AK452A | -0.435 | -0.0046 | View | CSV | PDB |
| VK475A | -0.0382 | -0.0074 | View | CSV | PDB |
| AR442A | -0.0778 | -0.0064 | View | CSV | PDB |
| ME594A | -0.2827 | -0.0043 | View | CSV | PDB |
| TE474A | -0.0579 | -0.0047 | View | CSV | PDB |
| AE275A | -0.2009 | -0.002 | View | CSV | PDB |
| VR929A | 0.1949 | -0.0149 | View | CSV | PDB |
| AK274A | 0.1121 | -0.0075 | View | CSV | PDB |
| AK442A | 0.0965 | -0.0064 | View | CSV | PDB |
| WK369A | 0.2421 | -0.015 | View | CSV | PDB |
| VK183A | 0.2278 | -0.0119 | View | CSV | PDB |
| AK981A | 0.2213 | -0.0114 | View | CSV | PDB |
| LK159A | 0.3311 | -0.0154 | View | CSV | PDB |
| IE940A | 0.2479 | -0.0098 | View | CSV | PDB |
| LK965A | 0.2838 | -0.0101 | View | CSV | PDB |
| LR965A | 0.2572 | -0.0087 | View | CSV | PDB |
| IK940A | 0.2743 | -0.0088 | View | CSV | PDB |
| LR159A | 0.6153 | -0.017 | View | CSV | PDB |
| PR858A | 0.5594 | -0.0114 | View | CSV | PDB |
| VR475A | 0.3487 | -0.0065 | View | CSV | PDB |
| AR981A | 0.622 | -0.0114 | View | CSV | PDB |
| PK858A | 0.5542 | -0.0096 | View | CSV | PDB |
| CD256A | 0.4226 | -0.0057 | View | CSV | PDB |
| SR202A | 0.5938 | -0.0072 | View | CSV | PDB |
| MK155A | 0.7598 | -0.0085 | View | CSV | PDB |
| SK202A | 0.7269 | -0.0079 | View | CSV | PDB |
| VK156A | 0.4617 | -0.0048 | View | CSV | PDB |
| MR155A | 1.2035 | -0.0118 | View | CSV | PDB |
| LR877A | 0.6915 | -0.0065 | View | CSV | PDB |
| VK285A | 0.5571 | -0.0052 | View | CSV | PDB |
| IR856A | 1.2791 | -0.0117 | View | CSV | PDB |
| PR964A | 0.9389 | -0.0085 | View | CSV | PDB |
| VD441A | 0.4653 | -0.0042 | View | CSV | PDB |
| MD594A | 0.6171 | -0.0053 | View | CSV | PDB |
| LK877A | 0.683 | -0.0058 | View | CSV | PDB |
| GR941A | 0.864 | -0.0073 | View | CSV | PDB |
| CE256A | 0.6611 | -0.0054 | View | CSV | PDB |
| GR139A | 1.2303 | -0.0094 | View | CSV | PDB |
| YK236A | 2.1782 | -0.016 | View | CSV | PDB |
| IR836A | 1.2642 | -0.0088 | View | CSV | PDB |
| IK856A | 1.3337 | -0.0091 | View | CSV | PDB |
| IK836A | 0.9166 | -0.0062 | View | CSV | PDB |
| VE441A | 0.2385 | -0.0016 | View | CSV | PDB |
| SE704A | 0.637 | -0.0042 | View | CSV | PDB |
| YK510A | 1.6993 | -0.0111 | View | CSV | PDB |
| YD236A | 2.6766 | -0.0173 | View | CSV | PDB |
| YR510A | 1.4912 | -0.0095 | View | CSV | PDB |
| PK204A | 1.189 | -0.0074 | View | CSV | PDB |
| VR876A | 0.8969 | -0.0052 | View | CSV | PDB |
| GK139A | 1.5438 | -0.0085 | View | CSV | PDB |
| PR204A | 1.3221 | -0.0072 | View | CSV | PDB |
| MD234A | 2.2781 | -0.0114 | View | CSV | PDB |
| PK964A | 1.4252 | -0.007 | View | CSV | PDB |
| LR726A | 0.5924 | -0.0029 | View | CSV | PDB |
| FE947A | 1.0476 | -0.0051 | View | CSV | PDB |
| VK870A | 0.9429 | -0.0045 | View | CSV | PDB |
| GK941A | 1.4198 | -0.0067 | View | CSV | PDB |
| CD436A | 0.8371 | -0.0039 | View | CSV | PDB |
| IR837A | 1.7503 | -0.0078 | View | CSV | PDB |
| VK876A | 0.9233 | -0.0038 | View | CSV | PDB |
| GR841A | 2.629 | -0.0108 | View | CSV | PDB |
| GK841A | 2.5629 | -0.0102 | View | CSV | PDB |
| IK837A | 1.5672 | -0.0062 | View | CSV | PDB |
| MK234A | 1.7652 | -0.0067 | View | CSV | PDB |
| VR285A | 0.9589 | -0.0036 | View | CSV | PDB |
| FK947A | 1.4501 | -0.0053 | View | CSV | PDB |
| LK726A | 1.1731 | -0.0042 | View | CSV | PDB |
| VR870A | 1.1459 | -0.0037 | View | CSV | PDB |
| YR651A | 2.5323 | -0.0075 | View | CSV | PDB |
| YK651A | 1.9312 | -0.0056 | View | CSV | PDB |
| WD775A | 2.0711 | -0.0055 | View | CSV | PDB |
| LK160A | 2.1158 | -0.0052 | View | CSV | PDB |
| LR160A | 2.3246 | -0.0056 | View | CSV | PDB |
| WK775A | 2.017 | -0.0045 | View | CSV | PDB |
| FR838A | 2.9777 | -0.0061 | View | CSV | PDB |
| FK838A | 2.9239 | -0.0053 | View | CSV | PDB |
| GR620A | 7.9586 | -0.0058 | View | CSV | PDB |
| GK620A | 7.5787 | -0.0051 | View | CSV | PDB |
| AK854A | 7.2549 | -0.004 | View | CSV | PDB |
| AD854A | 5.7182 | -0.0007 | 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