Project name: 948406683bf0992

Chain sequence(s)	A: GGGHKGF; C: GGGHKGF; B: GGGHKGF; D: GGGHKGF
Selected Chain(s)	A,C,B,D
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

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 all 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                                          (00:00:31)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:32)

• Minimal score value: -2.8865
• Maximal score value: 1.7007
• Average score: -1.3032
• Total score value: -36.4884

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
1	G	A	-1.2152
2	G	A	-1.6655
3	G	A	-2.4102
4	H	A	-2.6201
5	K	A	-1.8079
6	G	A	-0.4138
7	F	A	1.7007
1	G	B	-1.1584
2	G	B	-1.7811
3	G	B	-2.2724
4	H	B	-2.8853
5	K	B	-2.1927
6	G	B	-0.4889
7	F	B	1.5816
1	G	C	-1.1541
2	G	C	-1.7808
3	G	C	-2.2559
4	H	C	-2.8865
5	K	C	-2.2331
6	G	C	-0.6997
7	F	C	1.0941
1	G	D	-1.2186
2	G	D	-1.6659
3	G	D	-2.3934
4	H	D	-2.5906
5	K	D	-2.0292
6	G	D	-0.4841
7	F	D	1.4386