Project name: query_structure

Chain sequence(s)	A: ETCVGNKCYTPGCTCTWPVCYRNGHPICG
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                                          (00:00:23)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:23)

• Minimal score value: -1.9828
• Maximal score value: 1.1918
• Average score: -0.199
• Total score value: -5.7714

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	E	A	0.1355
2	T	A	0.2572
3	C	A	0.0000
4	V	A	1.1094
5	G	A	-0.5690
6	N	A	-1.4266
7	K	A	-1.5390
8	C	A	-0.2630
9	Y	A	0.6977
10	T	A	-0.0149
11	P	A	-0.2228
12	G	A	-0.7321
13	C	A	-0.6134
14	T	A	-0.5614
15	C	A	0.0693
16	T	A	0.4800
17	W	A	1.1918
18	P	A	0.9091
19	V	A	0.8976
20	C	A	0.0000
21	Y	A	-0.3422
22	R	A	-1.5475
23	N	A	-1.9828
24	G	A	-1.5190
25	H	A	-1.1633
26	P	A	-0.1709
27	I	A	1.0449
28	C	A	0.0000
29	G	A	0.1040