Project name: Ins_Chain_B

Chain sequence(s)	B: FVNQHLCGSHLVVEALYLVCGERRGFFYTPKA
Selected Chain(s)	B
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)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with B 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                                          (00:00:06)
[CRITICAL]   pyMol:    Pymol encountered an error: /bin/sh: pymol: command not found Movie         
                       creation failed.                                                            (00:00:06)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:07)

• Minimal score value: -2.4021
• Maximal score value: 2.8569
• Average score: 0.1624
• Total score value: 4.8723

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	F	B	1.5506
2	V	B	1.1087
3	N	B	-0.9146
4	Q	B	-1.3345
5	H	B	-1.1855
6	L	B	-0.2192
7	C	B	0.0860
8	G	B	-0.1257
9	S	B	-0.6729
10	H	B	-0.6471
11	L	B	0.2807
12	V	B	0.9012
13	E	B	-0.3078
14	A	B	0.0000
15	L	B	2.0967
16	Y	B	1.7273
17	L	B	2.1263
18	V	B	2.0397
19	C	B	0.5702
20	G	B	-0.6305
21	E	B	-2.3922
22	R	B	-2.4021
23	G	B	-0.2316
24	F	B	1.7799
25	F	B	2.8569
26	Y	B	1.7766
27	T	B	0.2203
28	P	B	-0.6614
29	K	B	-1.7363
30	A	B	-0.7874