Project name: query_structure

Chain sequence(s)	A: GFPTCGETCTLGTCNTPGCTCSWPICTRN
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             (00:00:02)
[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                                          (00:00:13)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:14)

• Minimal score value: -1.9993
• Maximal score value: 1.5014
• Average score: -0.1413
• Total score value: -4.0972

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	G	A	0.4136
2	F	A	1.3527
3	P	A	-0.1738
4	T	A	-0.1135
5	C	A	-0.5936
6	G	A	-0.4271
7	E	A	-0.6637
8	T	A	0.1792
9	C	A	0.0000
10	T	A	0.8886
11	L	A	1.5014
12	G	A	0.5848
13	T	A	0.1096
14	C	A	-0.4602
15	N	A	-1.3858
16	T	A	-1.0929
17	P	A	-0.9243
18	G	A	-1.3037
19	C	A	-1.2745
20	T	A	-0.5316
21	C	A	0.3578
22	S	A	0.5991
23	W	A	1.4453
24	P	A	0.9742
25	I	A	0.8107
26	C	A	0.0000
27	T	A	-0.5652
28	R	A	-1.8050
29	N	A	-1.9993