Project name: RFC11

Chain sequence(s)	A: KLYVYTIDDDPEAEAKKEKEKAEIDKKKAEAKKVPGATITTRSFSLTTINHKPVKVEVEPPKPGSGAKVTLKTETINGQNVNYKPGDKPKTQKFEVFEYDIKT
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                                          (00:05:40)
[INFO]       Main:     Simulation completed successfully.                                          (00:05:41)

• Minimal score value: -4.5654
• Maximal score value: 1.0795
• Average score: -1.6659
• Total score value: -171.5867

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	K	A	-1.7800
2	L	A	-0.7374
3	Y	A	0.1473
4	V	A	1.0795
5	Y	A	-0.0013
6	T	A	-0.6696
7	I	A	0.0000
8	D	A	-2.6204
9	D	A	-3.2632
10	D	A	-3.0486
11	P	A	-2.7167
12	E	A	-3.4701
13	A	A	-2.8578
14	E	A	-3.4284
15	A	A	-3.2848
16	K	A	-3.7632
17	K	A	-3.3856
18	E	A	-4.4362
19	K	A	-4.5487
20	E	A	-4.0954
21	K	A	-4.1824
22	A	A	-4.1172
23	E	A	-4.5654
24	I	A	0.0000
25	D	A	-4.4642
26	K	A	-4.5433
27	K	A	-4.0126
28	K	A	-3.4422
29	A	A	-3.4248
30	E	A	-3.9285
31	A	A	0.0000
32	K	A	-3.0734
33	K	A	-2.8756
34	V	A	-1.3550
35	P	A	-0.8664
36	G	A	-1.0668
37	A	A	-1.3350
38	T	A	-0.8239
39	I	A	-0.5530
40	T	A	-0.8316
41	T	A	-1.3291
42	R	A	-2.1100
43	S	A	-0.9102
44	F	A	-0.1651
45	S	A	-0.1013
46	L	A	0.1241
47	T	A	0.1497
48	T	A	0.3656
49	I	A	0.7382
50	N	A	-1.0080
51	H	A	-1.5635
52	K	A	-1.3787
53	P	A	-1.2060
54	V	A	-1.0733
55	K	A	-1.5818
56	V	A	-0.7136
57	E	A	-1.7699
58	V	A	-1.1568
59	E	A	-2.7129
60	P	A	-2.1692
61	P	A	-2.2283
62	K	A	-2.5199
63	P	A	-1.4185
64	G	A	-1.2352
65	S	A	-1.5671
66	G	A	-2.0353
67	A	A	-2.0214
68	K	A	-2.5532
69	V	A	-0.8722
70	T	A	-0.8556
71	L	A	-0.1815
72	K	A	-1.4653
73	T	A	-1.1145
74	E	A	-1.5374
75	T	A	-0.7406
76	I	A	-0.1172
77	N	A	-1.4770
78	G	A	-1.4620
79	Q	A	-1.9779
80	N	A	-1.7560
81	V	A	-0.5069
82	N	A	-1.3378
83	Y	A	-0.8092
84	K	A	-2.0475
85	P	A	-1.6133
86	G	A	-1.7224
87	D	A	-2.3796
88	K	A	-2.5514
89	P	A	-1.6162
90	K	A	-1.8931
91	T	A	-0.9210
92	Q	A	0.0000
93	K	A	-0.9228
94	F	A	0.0000
95	E	A	-0.0807
96	V	A	0.0000
97	F	A	-0.5760
98	E	A	-1.4546
99	Y	A	0.0000
100	D	A	-1.8879
101	I	A	-1.3461
102	K	A	-1.6619
103	T	A	-1.2085