Project name: c38c32a7408243cb7e0f7e30c15d359a

Chain sequence(s)	B: SAVAEAAWEAAWPAVNAAARKYGPSAEIYQAARDALVEEAGPAAGEYVVVPDPSSAPPAPAEAVAAVAAASRAAARAVVAGSGC
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with B chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:49)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:50)

• Minimal score value: -2.8722
• Maximal score value: 1.1765
• Average score: -0.7356
• Total score value: -61.7906

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	S	B	-0.5282
2	A	B	-0.2399
3	V	B	0.0202
4	A	B	0.0000
5	E	B	-1.7695
6	A	B	-0.8460
7	A	B	0.0000
8	W	B	-1.1220
9	E	B	-1.8288
10	A	B	-0.8193
11	A	B	0.0000
12	W	B	-0.2590
13	P	B	-0.4002
14	A	B	-0.0142
15	V	B	0.0000
16	N	B	-1.0015
17	A	B	-1.1395
18	A	B	0.0000
19	A	B	-1.5275
20	R	B	-2.6869
21	K	B	-2.4318
22	Y	B	-1.0183
23	G	B	-1.1237
24	P	B	-1.1755
25	S	B	-1.0006
26	A	B	-0.9328
27	E	B	-1.0701
28	I	B	0.0000
29	Y	B	-0.6363
30	Q	B	-1.7195
31	A	B	-1.4528
32	A	B	0.0000
33	R	B	-2.1008
34	D	B	-2.8722
35	A	B	0.0000
36	L	B	0.0000
37	V	B	-1.5299
38	E	B	-2.6274
39	E	B	-1.7986
40	A	B	-0.9705
41	G	B	-0.6252
42	P	B	-1.0289
43	A	B	-0.6825
44	A	B	0.0000
45	G	B	0.0000
46	E	B	-1.5711
47	Y	B	-0.7702
48	V	B	0.0000
49	V	B	1.1765
50	V	B	0.2008
51	P	B	-0.6849
52	D	B	-1.7375
53	P	B	-1.4158
54	S	B	-0.9979
55	S	B	-0.4441
56	A	B	-0.3320
57	P	B	-0.4170
58	P	B	-0.5194
59	A	B	-0.6482
60	P	B	-0.6341
61	A	B	-0.8491
62	E	B	-1.6753
63	A	B	-0.8499
64	V	B	-0.5124
65	A	B	-0.4269
66	A	B	-0.3313
67	V	B	0.0000
68	A	B	-0.7954
69	A	B	-0.0174
70	A	B	-0.1980
71	S	B	0.0000
72	R	B	-1.5961
73	A	B	-0.7381
74	A	B	-0.6928
75	A	B	0.0000
76	R	B	-1.9596
77	A	B	-0.6891
78	V	B	-0.4272
79	V	B	0.1212
80	A	B	-0.2507
81	G	B	-0.2874
82	S	B	-0.1394
83	G	B	-0.1225
84	C	B	0.4014