Project name: query_structure

Chain sequence(s)	A: CGETCVGGTCNTPGCTCSWPVCTRNGLPV
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:16)

• Minimal score value: -1.6312
• Maximal score value: 1.8461
• Average score: -0.0
• Total score value: -0.0003

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	C	A	-0.1281
2	G	A	-0.2976
3	E	A	-0.2598
4	T	A	0.4945
5	C	A	0.0000
6	V	A	1.8461
7	G	A	0.4523
8	G	A	0.2779
9	T	A	-0.0417
10	C	A	-0.4425
11	N	A	-1.3551
12	T	A	-1.0974
13	P	A	-0.9343
14	G	A	-1.2203
15	C	A	-0.8862
16	T	A	-0.4089
17	C	A	0.5327
18	S	A	0.9678
19	W	A	1.7432
20	P	A	1.4729
21	V	A	1.2954
22	C	A	0.0000
23	T	A	-0.0881
24	R	A	-1.2946
25	N	A	-1.6312
26	G	A	-0.7147
27	L	A	0.6390
28	P	A	0.3378
29	V	A	0.7406