Project name: b54ebb03d9c5177

Chain sequence(s)	A: SLWGEHILALKNLKLDKMVGWLLQQSAATLLANRLTEKCCVETKMKMLFLANLECETLCQAALLLCSWRAAL
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]                                                (00:00:01)
[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 A 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                                          (00:01:02)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:02)

• Minimal score value: -2.6526
• Maximal score value: 2.4793
• Average score: -0.2116
• Total score value: -15.233

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	A	-0.1532
2	L	A	1.0719
3	W	A	0.2415
4	G	A	0.0000
5	E	A	-1.7650
6	H	A	-1.6312
7	I	A	0.0000
8	L	A	-1.1077
9	A	A	-1.0456
10	L	A	-1.2563
11	K	A	-2.1118
12	N	A	-2.1420
13	L	A	-1.4805
14	K	A	-2.5076
15	L	A	-1.0379
16	D	A	-2.3647
17	K	A	-1.9912
18	M	A	0.0000
19	V	A	-0.1731
20	G	A	-0.5814
21	W	A	-0.2707
22	L	A	0.0000
23	L	A	0.9044
24	Q	A	-0.4100
25	Q	A	0.0810
26	S	A	0.4961
27	A	A	0.3777
28	A	A	0.2831
29	T	A	0.0000
30	L	A	0.4125
31	L	A	0.8189
32	A	A	-0.2444
33	N	A	-1.4639
34	R	A	-1.5095
35	L	A	0.1333
36	T	A	-1.2471
37	E	A	-2.6526
38	K	A	-2.2258
39	C	A	-1.2072
40	C	A	0.0400
41	V	A	0.8528
42	E	A	-0.2080
43	T	A	-0.5166
44	K	A	-0.7403
45	M	A	0.3569
46	K	A	0.1184
47	M	A	0.3561
48	L	A	1.0043
49	F	A	0.8866
50	L	A	0.5866
51	A	A	0.1970
52	N	A	-0.6390
53	L	A	-0.3388
54	E	A	-1.4556
55	C	A	-0.7926
56	E	A	-2.0345
57	T	A	-1.1537
58	L	A	-0.1680
59	C	A	-0.0683
60	Q	A	-0.4075
61	A	A	0.5166
62	A	A	0.0000
63	L	A	2.3554
64	L	A	2.4793
65	L	A	1.7025
66	C	A	0.9866
67	S	A	1.7285
68	W	A	2.1939
69	R	A	0.9244
70	A	A	0.8338
71	A	A	1.1576
72	L	A	1.7726