Project name: 4d3f3a46a2abf6

Chain sequence(s)	B: QRTESIIARALYYDLIS
Selected Chain(s)	B
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 B 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                                          (00:00:07)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:07)

• Minimal score value: -2.7801
• Maximal score value: 3.193
• Average score: 1.0513
• Total score value: 17.8724

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	Q	B	-2.3301
2	R	B	-2.7801
3	T	B	-1.9309
4	E	B	-2.0520
5	S	B	0.2030
6	I	B	2.2198
7	I	B	3.1276
8	A	B	1.8416
9	R	B	1.4444
10	A	B	2.1989
11	L	B	3.1440
12	Y	B	3.1930
13	Y	B	2.4229
14	D	B	0.6668
15	L	B	2.5509
16	I	B	2.8462
17	S	B	1.1064