Project name: 202(6)

Chain sequence(s)	A: KWCFVVCYRGICYRRCR
Selected Chain(s)	A
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 A 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                                          (00:00:19)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:19)

• Minimal score value: -1.7094
• Maximal score value: 2.5704
• Average score: 0.6344
• Total score value: 10.7846

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	-1.4197
2	W	A	0.1531
3	C	A	0.3296
4	F	A	0.8131
5	V	A	1.4384
6	V	A	2.0995
7	C	A	2.3654
8	Y	A	1.7281
9	R	A	-0.5322
10	G	A	0.3760
11	I	A	2.5704
12	C	A	2.4994
13	Y	A	1.8057
14	R	A	-0.4363
15	R	A	-0.6659
16	C	A	-0.6306
17	R	A	-1.7094