Project name: f0ad689f66d6526

Chain sequence(s)	A: SQPQQPISQQQQQQQQQQQQQQQQI
Selected Chain(s)	A
Distance of aggregation	5 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 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                                          (00:00:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:16)

• Minimal score value: -1.6276
• Maximal score value: 1.8795
• Average score: -0.9563
• Total score value: -22.9506

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	-0.3988
2	Q	A	-1.1286
3	P	A	-0.6508
4	Q	A	-1.2439
5	Q	A	0.0000
6	P	A	0.1347
7	I	A	1.8795
8	S	A	-0.0249
9	Q	A	-1.1929
10	Q	A	-0.6601
11	Q	A	-1.2618
12	Q	A	-1.5405
13	Q	A	-0.7977
14	Q	A	-1.1630
15	Q	A	-1.5249
16	Q	A	-1.3717
17	Q	A	-1.5194
18	Q	A	-1.5292
19	Q	A	-1.3562
20	Q	A	-1.3489
21	Q	A	-1.5849
22	Q	A	-1.6276
23	Q	A	-1.6269
24	Q	A	-1.4121