Project name: 6f2b272e6f24f4d

Chain sequence(s)	A: TTVHQQTHQDQTCPDGYTRTNYYCRRDGCGSWCNGAERQQPCIRGPCCCDLTYRTAYEYHVDTW
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                                          (00:00:49)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:49)

• Minimal score value: -5.527
• Maximal score value: 0.849
• Average score: -1.2182
• Total score value: -77.9644

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	T	A	0.2251
2	T	A	0.3635
3	V	A	0.6910
4	H	A	-1.0313
5	Q	A	-1.8800
6	Q	A	-2.4279
7	T	A	-1.9064
8	H	A	-2.7237
9	Q	A	-2.7756
10	D	A	-2.7357
11	Q	A	-2.4873
12	T	A	-1.5235
13	C	A	0.0000
14	P	A	-1.5910
15	D	A	-1.9962
16	G	A	-0.6692
17	Y	A	-0.7048
18	T	A	-1.2788
19	R	A	-1.8329
20	T	A	-1.1494
21	N	A	-1.8154
22	Y	A	-1.4204
23	Y	A	-1.2013
24	C	A	0.0000
25	R	A	-3.9836
26	R	A	-5.5270
27	D	A	-4.6030
28	G	A	-2.2448
29	C	A	0.0000
30	G	A	-0.6753
31	S	A	-0.2127
32	W	A	0.1986
33	C	A	0.0000
34	N	A	-1.0328
35	G	A	-2.4908
36	A	A	-3.5374
37	E	A	-5.2201
38	R	A	-5.0546
39	Q	A	-4.1025
40	Q	A	-2.9104
41	P	A	-2.0667
42	C	A	-0.5732
43	I	A	0.8423
44	R	A	-1.0979
45	G	A	-0.6603
46	P	A	-0.8622
47	C	A	0.0000
48	C	A	0.0000
49	C	A	0.0000
50	D	A	-0.5221
51	L	A	0.8285
52	T	A	0.1555
53	Y	A	0.0989
54	R	A	-1.1201
55	T	A	-0.5822
56	A	A	-0.0158
57	Y	A	0.3869
58	E	A	-0.4714
59	Y	A	0.5441
60	H	A	-0.3269
61	V	A	0.6103
62	D	A	-0.7116
63	T	A	-0.0019
64	W	A	0.8490