Project name: 80d9efbdbc3e60f

Chain sequence(s)	O: AALAAARAALERRLAELRAEIEALRKKKSEADQEKAKRLEAVRDQVETLLALMAAELEHRQVSGS
Selected Chain(s)	O
Distance of aggregation	10 Å
FoldX usage	No
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 O chain(s) selected             (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:00)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:01)

• Minimal score value: -4.2644
• Maximal score value: 2.5312
• Average score: -1.2048
• Total score value: -78.3105

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
8	A	O	0.2927
9	A	O	0.4256
10	L	O	0.6136
11	A	O	0.2934
12	A	O	0.0501
13	A	O	-0.2523
14	R	O	-1.1436
15	A	O	-1.3809
16	A	O	-1.4086
17	L	O	-1.4984
18	E	O	-2.9700
19	R	O	-3.4152
20	R	O	-2.8203
21	L	O	-1.4799
22	A	O	-1.7408
23	E	O	-1.8906
24	L	O	-0.3431
25	R	O	-0.9701
26	A	O	-0.8730
27	E	O	-1.3308
28	I	O	-0.6684
29	E	O	-1.8154
30	A	O	-1.2439
31	L	O	-0.7410
32	R	O	-2.9759
33	K	O	-3.1793
34	K	O	-2.9824
35	K	O	-3.3979
36	S	O	-2.8397
37	E	O	-3.6538
38	A	O	-2.2923
39	D	O	-3.3141
40	Q	O	-4.0143
41	E	O	-4.2644
42	K	O	-3.9853
43	A	O	-2.6817
44	K	O	-3.4902
45	R	O	-2.8773
46	L	O	-0.7233
47	E	O	-1.4959
48	A	O	-0.9542
49	V	O	0.3127
50	R	O	-1.3225
51	D	O	-0.9564
52	Q	O	-0.3423
53	V	O	0.9419
54	E	O	0.4620
55	T	O	1.0964
56	L	O	2.3940
57	L	O	2.5312
58	A	O	1.4109
59	L	O	1.9227
60	M	O	1.8158
61	A	O	0.4937
62	A	O	-0.0751
63	E	O	-1.4212
64	L	O	-0.9031
65	E	O	-1.8311
66	H	O	-2.0141
67	R	O	-2.4065
68	Q	O	-1.9183
69	V	O	-0.1221
70	S	O	-0.7604
71	G	O	-1.0740
72	S	O	-1.1118