Project name: pradeep

Chain sequence(s)	A: DAEFRHDSGYEVHHQKLVFFAEDVGSNKGAIIGLMVGGVVIA
Selected Chain(s)	A
Distance of aggregation	5 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                                          (00:00:38)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:38)

• Minimal score value: -2.0082
• Maximal score value: 2.4563
• Average score: 0.0006
• Total score value: 0.0257

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	D	A	-1.7787
2	A	A	-0.5972
3	E	A	-1.4559
4	F	A	1.2718
5	R	A	-1.6684
6	H	A	-1.6509
7	D	A	-2.0082
8	S	A	-0.6234
9	G	A	-0.2678
10	Y	A	0.9090
11	E	A	-1.2942
12	V	A	0.7763
13	H	A	-1.0633
14	H	A	-1.3883
15	Q	A	-1.5501
16	K	A	-0.8523
17	L	A	1.6811
18	V	A	2.2570
19	F	A	2.0099
20	F	A	2.1043
21	A	A	0.0750
22	E	A	-1.9508
23	D	A	-1.4363
24	V	A	-0.0829
25	G	A	-0.6402
26	S	A	-0.4954
27	N	A	-1.3521
28	K	A	-1.7057
29	G	A	-0.7259
30	A	A	0.0485
31	I	A	0.3946
32	I	A	0.8350
33	G	A	-0.0458
34	L	A	1.5462
35	M	A	1.3479
36	V	A	2.0310
37	G	A	0.1487
38	G	A	-0.1989
39	V	A	2.2041
40	V	A	2.4563
41	I	A	2.3408
42	A	A	0.4209