Project name: 24b5733132a4f42

Chain sequence(s)	A: SGHKGHK; C: SGHKGHK; B: SGHKGHK; E: SGHKGHK; D: SGHKGHK; G: SGHKGHK; F: SGHKGHK; H: SGHKGHK
Selected Chain(s)	A,C,B,E,D,G,F,H
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                                          (00:03:41)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:43)

• Minimal score value: -3.8092
• Maximal score value: 0.0
• Average score: -2.3892
• Total score value: -133.7924

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	S	A	-1.8468
2	G	A	-1.4421
3	H	A	-2.4555
4	K	A	-3.1269
5	G	A	0.0000
6	H	A	-3.5103
7	K	A	-3.1961
1	S	B	-1.6045
2	G	B	-1.7350
3	H	B	-2.6642
4	K	B	-3.1498
5	G	B	-2.7381
6	H	B	-3.3702
7	K	B	-3.1575
1	S	C	-1.7293
2	G	C	-1.5170
3	H	C	-2.5272
4	K	C	-2.7789
5	G	C	0.0000
6	H	C	-3.3818
7	K	C	-3.7737
1	S	D	-2.0901
2	G	D	-1.1995
3	H	D	0.0000
4	K	D	-2.4228
5	G	D	0.0000
6	H	D	-3.1580
7	K	D	-3.8092
1	S	E	-2.0784
2	G	E	-1.7700
3	H	E	0.0000
4	K	E	-3.0657
5	G	E	0.0000
6	H	E	-3.4551
7	K	E	-3.7995
1	S	F	-1.5595
2	G	F	-1.9405
3	H	F	-3.0703
4	K	F	-3.5550
5	G	F	-3.3621
6	H	F	-3.1967
7	K	F	-3.2864
1	S	G	-1.9420
2	G	G	-1.4797
3	H	G	-2.6468
4	K	G	-3.1424
5	G	G	-3.5401
6	H	G	-3.2945
7	K	G	-3.3442
1	S	H	-2.0344
2	G	H	-1.6332
3	H	H	0.0000
4	K	H	-3.1500
5	G	H	-3.5665
6	H	H	-3.6943
7	K	H	-3.8006