Project name: ff8787ce7674827

Chain sequence(s)	A: AALAAYRTALAATRAAADAFMAAVRADLGDSPEVRELEALRARLRATTDELLAALDAKEWDRALALAREVRALVKELVAKVRSIIGTLSAEAQALAAALLAATAATLAALDALEAAIAAL
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                                          (00:01:28)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:29)

• Minimal score value: -3.7059
• Maximal score value: 1.7226
• Average score: -0.9837
• Total score value: -118.038

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	A	A	0.1263
2	A	A	-0.0165
3	L	A	-0.0102
4	A	A	-0.0395
5	A	A	-0.0627
6	Y	A	0.0000
7	R	A	-0.6806
8	T	A	-0.3568
9	A	A	-0.1705
10	L	A	0.0000
11	A	A	-0.2496
12	A	A	-0.3058
13	T	A	-0.3632
14	R	A	-1.1100
15	A	A	-0.6669
16	A	A	-0.4591
17	A	A	-0.9905
18	D	A	-1.8751
19	A	A	-0.7473
20	F	A	0.0000
21	M	A	-0.8597
22	A	A	-0.6769
23	A	A	-0.9324
24	V	A	0.0000
25	R	A	-1.5359
26	A	A	-0.8513
27	D	A	-1.3861
28	L	A	-0.9891
29	G	A	-1.6846
30	D	A	-2.6263
31	S	A	-2.2197
32	P	A	-2.2749
33	E	A	-2.7646
34	V	A	0.0000
35	R	A	-3.7059
36	E	A	-3.3266
37	L	A	0.0000
38	E	A	-2.2736
39	A	A	-2.2814
40	L	A	0.0000
41	R	A	-2.8456
42	A	A	-2.2134
43	R	A	-2.7937
44	L	A	-2.6380
45	R	A	-3.2567
46	A	A	-2.4823
47	T	A	-2.4477
48	T	A	0.0000
49	D	A	-2.7532
50	E	A	-2.9175
51	L	A	0.0000
52	L	A	-1.4972
53	A	A	-1.8204
54	A	A	0.0000
55	L	A	0.0000
56	D	A	-2.3783
57	A	A	-1.8534
58	K	A	-3.0223
59	E	A	-3.0531
60	W	A	-1.9314
61	D	A	-2.6915
62	R	A	-2.9268
63	A	A	0.0000
64	L	A	-1.5007
65	A	A	-1.7307
66	L	A	0.0000
67	A	A	0.0000
68	R	A	-2.8567
69	E	A	-2.8155
70	V	A	0.0000
71	R	A	-2.1760
72	A	A	-2.1685
73	L	A	-2.1457
74	V	A	0.0000
75	K	A	-2.5388
76	E	A	-2.3828
77	L	A	-1.6115
78	V	A	-0.8770
79	A	A	-1.3682
80	K	A	-1.6586
81	V	A	0.0000
82	R	A	-1.8313
83	S	A	-1.1911
84	I	A	0.0000
85	I	A	-0.8403
86	G	A	-0.8444
87	T	A	-0.5886
88	L	A	0.0000
89	S	A	-0.9697
90	A	A	-1.0243
91	E	A	-1.9765
92	A	A	0.0000
93	Q	A	-1.1286
94	A	A	-0.5896
95	L	A	-0.3591
96	A	A	0.0000
97	A	A	0.0408
98	A	A	0.2578
99	L	A	0.0000
100	L	A	0.5820
101	A	A	0.3030
102	A	A	0.2143
103	T	A	0.0000
104	A	A	0.2925
105	A	A	0.1144
106	T	A	0.0000
107	L	A	-0.0915
108	A	A	-0.2468
109	A	A	-0.3406
110	L	A	0.0000
111	D	A	-1.1992
112	A	A	-0.4777
113	L	A	0.0000
114	E	A	-0.3847
115	A	A	-0.0577
116	A	A	0.3605
117	I	A	0.3081
118	A	A	0.7261
119	A	A	0.9018
120	L	A	1.7226