Project name: 62109a22362b079

Chain sequence(s)	B: ESKLIQTHTLQVSAGGPLSSVTFVFNGDHTLTVPLTLPAGATVRLQARTA
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                                          (00:00:21)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:22)

• Minimal score value: -2.5221
• Maximal score value: 2.3433
• Average score: -0.6156
• Total score value: -30.7823

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	E	B	-2.4618
2	S	B	-2.0801
3	K	B	-2.4099
4	L	B	-1.2052
5	I	B	-0.7294
6	Q	B	-1.6819
7	T	B	-1.7998
8	H	B	-2.0849
9	T	B	-1.4861
10	L	B	-1.0633
11	Q	B	-1.4704
12	V	B	-0.6557
13	S	B	-0.7011
14	A	B	-0.5954
15	G	B	-0.6366
16	G	B	-0.5381
17	P	B	-0.3662
18	L	B	-0.0115
19	S	B	-0.0103
20	S	B	0.2595
21	V	B	1.0082
22	T	B	1.4294
23	F	B	2.3433
24	V	B	2.0008
25	F	B	0.9393
26	N	B	-1.2162
27	G	B	-1.2400
28	D	B	-2.2161
29	H	B	-0.8346
30	T	B	0.8249
31	L	B	2.2676
32	T	B	1.3493
33	V	B	1.1100
34	P	B	0.3725
35	L	B	0.3694
36	T	B	0.0548
37	L	B	0.0000
38	P	B	-0.5225
39	A	B	-0.6662
40	G	B	-0.8182
41	A	B	-0.6717
42	T	B	-0.8611
43	V	B	-1.0791
44	R	B	-2.2528
45	L	B	-1.7434
46	Q	B	-2.0969
47	A	B	-1.4600
48	R	B	-2.5221
49	T	B	-1.7494
50	A	B	-1.1733