Project name: 350ab499248b367

Chain sequence(s)	B: MKTLSISRVVTPELAGQLFRVGFSSSPSTEALEASAAANPEVFTLRLVPP
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)                                                   (00:00:00)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with B 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                                          (00:00:18)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:18)

• Minimal score value: -2.3732
• Maximal score value: 1.8489
• Average score: -0.0204
• Total score value: -1.0213

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	M	B	0.2529
2	K	B	-0.9104
3	T	B	0.2414
4	L	B	1.5050
5	S	B	1.3091
6	I	B	1.6973
7	S	B	0.3940
8	R	B	-0.0785
9	V	B	1.6780
10	V	B	1.8489
11	T	B	0.4394
12	P	B	-0.7610
13	E	B	-1.7523
14	L	B	-0.6296
15	A	B	-0.6501
16	G	B	-1.0461
17	Q	B	-0.5414
18	L	B	1.6391
19	F	B	1.1779
20	R	B	-0.2258
21	V	B	0.3660
22	G	B	0.1942
23	F	B	1.5475
24	S	B	0.2873
25	S	B	0.0948
26	S	B	-0.2454
27	P	B	-0.3347
28	S	B	-1.0143
29	T	B	-1.4175
30	E	B	-2.3732
31	A	B	-1.0997
32	L	B	-0.5713
33	E	B	-2.0627
34	A	B	-0.9990
35	S	B	-0.3911
36	A	B	-0.6879
37	A	B	-0.6378
38	A	B	-0.4341
39	N	B	-0.7342
40	P	B	-0.8091
41	E	B	-1.1561
42	V	B	1.2460
43	F	B	1.7755
44	T	B	0.8846
45	L	B	0.2606
46	R	B	-0.8199
47	L	B	0.4120
48	V	B	1.5454
49	P	B	0.4062
50	P	B	0.1588