Project name: query_structure

Chain sequence(s)	A: INMLAPNMLPNALINMLAPNMLPNAL
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]                                                (00:00:00)
[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 A 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                                          (00:00:08)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:08)

• Minimal score value: -0.837
• Maximal score value: 2.0338
• Average score: 0.774
• Total score value: 20.1227

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	I	A	1.9397
2	N	A	0.7488
3	M	A	1.7921
4	L	A	2.0050
5	A	A	1.1165
6	P	A	0.2693
7	N	A	-0.4850
8	M	A	1.1725
9	L	A	1.6310
10	P	A	0.6595
11	N	A	-0.0398
12	A	A	0.9494
13	L	A	2.0338
14	I	A	1.9057
15	N	A	0.1500
16	M	A	1.1854
17	L	A	1.2899
18	A	A	0.5573
19	P	A	-0.3065
20	N	A	-0.8370
21	M	A	0.4711
22	L	A	0.7906
23	P	A	-0.0509
24	N	A	-0.6776
25	A	A	0.4075
26	L	A	1.4444