Project name: 3d817e83bc2a09e

Chain sequence(s)	A: KVFGRCELAAAMKRHGLDNYRGYSLGNWVCAAKFESNFNTQATNRNTDGSTDYGILQINSRWWCNDGRTPGSRNLCNIPCSALLSSDITASVNCAKKIVSDGNGMNAWVAWRNRCKGTDVQAWIRGCRLKVFGRCELAAAM
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                                          (00:00:55)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:56)

• Minimal score value: -3.4712
• Maximal score value: 1.2726
• Average score: -1.0517
• Total score value: -148.2833

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	-1.0520
2	V	A	0.2804
3	F	A	0.0000
4	G	A	-1.0673
5	R	A	-1.3440
6	C	A	-1.3672
7	E	A	-1.6883
8	L	A	0.0000
9	A	A	0.0000
10	A	A	-1.4412
11	A	A	-1.4883
12	M	A	0.0000
13	K	A	-2.0741
14	R	A	-2.4594
15	H	A	-1.9346
16	G	A	-1.8806
17	L	A	0.0000
18	D	A	-2.3166
19	N	A	-2.3212
20	Y	A	-1.7958
21	R	A	-2.4039
22	G	A	-1.8301
23	Y	A	-1.2455
24	S	A	-1.3516
25	L	A	0.0000
26	G	A	0.0000
27	N	A	-1.0434
28	W	A	0.0000
29	V	A	0.0000
30	C	A	0.0000
31	A	A	0.0000
32	A	A	0.0000
33	K	A	-1.1323
34	F	A	-0.5939
35	E	A	-0.6480
36	S	A	0.0000
37	N	A	-1.3720
38	F	A	0.0000
39	N	A	-0.9913
40	T	A	0.0000
41	Q	A	-1.3130
42	A	A	-1.1486
43	T	A	-1.5570
44	N	A	-2.4466
45	R	A	-3.1253
46	N	A	-2.4470
47	T	A	-1.6374
48	D	A	-2.4872
49	G	A	-2.1042
50	S	A	0.0000
51	T	A	0.0000
52	D	A	-1.5272
53	Y	A	-0.8780
54	G	A	0.0000
55	I	A	0.0000
56	L	A	0.0000
57	Q	A	0.0000
58	I	A	0.0000
59	N	A	-1.2353
60	S	A	0.0000
61	R	A	-2.5404
62	W	A	-1.0903
63	W	A	-1.0678
64	C	A	0.0000
65	N	A	-2.5152
66	D	A	-2.0568
67	G	A	-1.9561
68	R	A	-2.6803
69	T	A	-2.3580
70	P	A	-1.7287
71	G	A	-1.4888
72	S	A	-2.2400
73	R	A	-2.4764
74	N	A	-1.8865
75	L	A	-0.8785
76	C	A	-1.0750
77	N	A	-1.4945
78	I	A	-0.8035
79	P	A	-1.0570
80	C	A	0.0000
81	S	A	-0.5652
82	A	A	-0.4063
83	L	A	0.0000
84	L	A	-0.8967
85	S	A	-1.2500
86	S	A	-1.4454
87	D	A	-2.0545
88	I	A	0.0000
89	T	A	-1.0131
90	A	A	-0.7267
91	S	A	0.0000
92	V	A	0.0000
93	N	A	-1.7193
94	C	A	0.0000
95	A	A	0.0000
96	K	A	-1.8542
97	K	A	-2.0517
98	I	A	0.0000
99	V	A	0.0000
100	S	A	-2.1775
101	D	A	-2.7444
102	G	A	-2.1827
103	N	A	-2.1737
104	G	A	-1.9322
105	M	A	0.0000
106	N	A	-1.5434
107	A	A	-0.7313
108	W	A	0.0000
109	V	A	0.4191
110	A	A	-0.9876
111	W	A	0.0000
112	R	A	-3.1290
113	N	A	-3.0216
114	R	A	-3.1176
115	C	A	0.0000
116	K	A	-3.4712
117	G	A	-2.2978
118	T	A	-2.0855
119	D	A	-2.4772
120	V	A	0.0000
121	Q	A	-2.0489
122	A	A	-1.5260
123	W	A	-1.0193
124	I	A	-1.1760
125	R	A	-2.2414
126	G	A	-1.5139
127	C	A	-1.4569
128	R	A	-1.8351
129	L	A	-0.7518
1	K	A	-0.6408
2	V	A	1.0960
3	F	A	0.7884
4	G	A	-0.4045
5	R	A	-1.2272
6	C	A	-0.1467
7	E	A	-0.2259
8	L	A	0.6858
9	A	A	0.3937
10	A	A	0.3512
11	A	A	0.8429
12	M	A	1.2726