Project name: 202(1)

Chain sequence(s)	A: KWCFRVCYRAICYRRCR
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: -2.5835
• Maximal score value: 1.9854
• Average score: -0.4842
• Total score value: -8.2308

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	-1.5072
2	W	A	-0.1908
3	C	A	-0.9406
4	F	A	-0.9271
5	R	A	-1.9217
6	V	A	0.0883
7	C	A	1.1672
8	Y	A	1.4724
9	R	A	-0.6268
10	A	A	0.4356
11	I	A	1.9854
12	C	A	1.1232
13	Y	A	0.2483
14	R	A	-2.3646
15	R	A	-2.5835
16	C	A	-1.7135
17	R	A	-1.9754