Project name: CM142-148 (2)

Chain sequence(s)	A: VSHWMY; C: VSHWMY; B: VSHWMY; E: VSHWMY; D: VSHWMY; G: VSHWMY; F: VSHWMY; I: VSHWMY; H: VSHWMY; J: VSHWMY
Selected Chain(s)	A,C,B,E,D,G,F,I,H,J
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:22)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:27)

• Minimal score value: 0.0
• Maximal score value: 2.5146
• Average score: 1.3171
• Total score value: 79.0254

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	V	E	2.0580
2	S	E	1.1509
3	H	E	0.4649
4	W	E	0.0000
5	M	E	1.0364
6	Y	E	1.3608
1	V	G	1.5546
2	S	G	0.9654
3	H	G	0.5473
4	W	G	0.9673
5	M	G	1.5471
6	Y	G	2.2983
1	V	B	1.5570
2	S	B	0.5613
3	H	B	0.5851
4	W	B	1.2868
5	M	B	1.9376
6	Y	B	2.3975
1	V	D	2.5146
2	S	D	1.5486
3	H	D	0.8687
4	W	D	0.0000
5	M	D	1.0398
6	Y	D	1.3638
1	V	A	2.2081
2	S	A	0.9241
3	H	A	0.0689
4	W	A	0.8374
5	M	A	1.5438
6	Y	A	2.0066
1	V	C	1.5194
2	S	C	0.7867
3	H	C	0.5411
4	W	C	1.0087
5	M	C	1.7241
6	Y	C	2.4089
1	V	F	1.4001
2	S	F	0.6060
3	H	F	0.3823
4	W	F	1.0541
5	M	F	1.7979
6	Y	F	2.4096
1	V	H	2.1116
2	S	H	1.4506
3	H	H	0.8804
4	W	H	0.0000
5	M	H	1.2583
6	Y	H	1.6569
1	V	J	2.2963
2	S	J	0.9305
3	H	J	0.8118
4	W	J	1.5079
5	M	J	2.2791
6	Y	J	2.2693
1	V	I	2.1764
2	S	I	0.8557
3	H	I	0.1431
4	W	I	1.1714
5	M	I	2.0860
6	Y	I	2.3005