Project name: 36da62eae372af3

Chain sequence(s)	A: KKGHKGH; C: KKGHKGH; B: KKGHKGH; D: KKGHKGH
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                                          (00:01:22)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:23)

• Minimal score value: -5.2164
• Maximal score value: -2.1128
• Average score: -3.6672
• Total score value: -102.6811

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	K	A	-4.1568
2	K	A	-4.2195
3	G	A	-3.2600
4	H	A	-3.6938
5	K	A	-3.7040
6	G	A	-2.9484
7	H	A	-2.2716
1	K	B	-5.0992
2	K	B	-5.0768
3	G	B	-3.8792
4	H	B	-4.2327
5	K	B	-4.2108
6	G	B	-3.2328
7	H	B	-2.8114
1	K	C	-4.9521
2	K	C	-5.2164
3	G	C	-3.7845
4	H	C	-4.0861
5	K	C	-3.8168
6	G	C	-2.9462
7	H	C	-2.7216
1	K	D	-3.9069
2	K	D	-4.4629
3	G	D	-3.0530
4	H	D	-3.2831
5	K	D	-3.3525
6	G	D	-2.1892
7	H	D	-2.1128