Project name: a04d1f909adb911

Chain sequence(s)	A: ATKAVCVLKGDGPVQGIINFEQKESNGPVKVWGSIKGLTEGLHGFHVHEFGDNTAGCTSAGPHFNPLSRKHGGPKDEERHVGDLGNVTADKDGVADVSIEDSVISLSGDHCIIGRTLVVHEKADDLGKGGNEESTKTGNAGSRLACGVIGIAQ
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                                          (00:02:42)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:43)

• Minimal score value: -3.8185
• Maximal score value: 1.3433
• Average score: -1.0339
• Total score value: -158.1793

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
2	A	A	-1.7147
3	T	A	-1.3280
4	K	A	-1.6575
5	A	A	0.0000
6	V	A	1.0502
7	C	A	0.0000
8	V	A	1.1823
9	L	A	0.0000
10	K	A	-2.1801
11	G	A	-2.5463
12	D	A	-2.7071
13	G	A	-1.8337
14	P	A	-1.8042
15	V	A	0.0000
16	Q	A	-2.2724
17	G	A	0.0000
18	I	A	1.1147
19	I	A	0.0000
20	N	A	-0.0426
21	F	A	0.0000
22	E	A	-1.9791
23	Q	A	0.0000
24	K	A	-3.3163
25	E	A	-3.3043
26	S	A	-2.2837
27	N	A	-2.3643
28	G	A	-2.1757
29	P	A	-1.9737
30	V	A	0.0000
31	K	A	-2.2861
32	V	A	0.0000
33	W	A	-0.4702
34	G	A	-0.0272
35	S	A	-1.0372
36	I	A	0.0000
37	K	A	-2.6649
38	G	A	-2.1009
39	L	A	0.0000
40	T	A	-2.4297
41	E	A	-3.0838
42	G	A	-1.6026
43	L	A	-0.4438
44	H	A	0.0000
45	G	A	0.0000
46	F	A	0.0000
47	H	A	0.0000
48	V	A	0.0000
49	H	A	0.0000
50	E	A	-1.3937
51	F	A	0.0000
52	G	A	-1.7611
53	D	A	-2.6645
54	N	A	-2.1676
55	T	A	-1.4312
56	A	A	-0.7530
57	G	A	-1.1215
58	C	A	-1.0273
59	T	A	-0.4657
60	S	A	-1.0466
61	A	A	0.0000
62	G	A	-0.7890
63	P	A	-0.9257
64	H	A	0.0000
65	F	A	0.0000
66	N	A	-0.6361
67	P	A	-0.3124
68	L	A	0.1849
69	S	A	-0.5490
70	R	A	-1.8790
71	K	A	-2.9919
72	H	A	0.0000
73	G	A	0.0000
74	G	A	0.0000
75	P	A	-1.7499
76	K	A	-2.6978
77	D	A	-3.0384
78	E	A	-3.5954
79	E	A	-3.5997
80	R	A	0.0000
81	H	A	0.0000
82	V	A	0.0000
83	G	A	0.0000
84	D	A	0.0000
85	L	A	0.0000
86	G	A	0.0000
87	N	A	-0.3836
88	V	A	0.0000
89	T	A	-0.7898
90	A	A	0.0000
91	D	A	-3.6478
92	K	A	-3.8185
93	D	A	-3.6358
94	G	A	0.0000
95	V	A	-2.6627
96	A	A	0.0000
97	D	A	-2.1229
98	V	A	0.0000
99	S	A	-1.0139
100	I	A	-1.1506
101	E	A	-2.1632
102	D	A	0.0000
103	S	A	-0.9096
104	V	A	-0.0676
105	I	A	0.0000
106	S	A	-0.9412
107	L	A	0.0000
108	S	A	-1.2402
109	G	A	-1.7145
110	D	A	-2.2227
111	H	A	-1.2048
112	C	A	-0.7636
113	I	A	0.0000
114	I	A	0.6696
115	G	A	-0.1381
116	R	A	-0.5113
117	T	A	0.0000
118	L	A	0.0000
119	V	A	0.0000
120	V	A	0.0000
121	H	A	0.0000
122	E	A	-2.8660
123	K	A	-2.6989
124	A	A	-1.0934
125	D	A	0.0000
126	D	A	-1.2941
127	L	A	-1.1189
128	G	A	-2.5357
129	K	A	-2.2976
130	G	A	-2.3066
131	G	A	-2.0042
132	N	A	-2.9032
133	E	A	-3.6133
134	E	A	-3.4049
135	S	A	0.0000
136	T	A	-3.2480
137	K	A	-3.1361
138	T	A	-1.8291
139	G	A	0.0000
140	N	A	-2.1591
141	A	A	0.0000
142	G	A	-1.6817
143	S	A	-1.6607
144	R	A	-2.0364
145	L	A	-2.0169
146	A	A	0.0000
147	C	A	0.0000
148	G	A	0.5554
149	V	A	1.3433
150	I	A	0.0000
151	G	A	0.9897
152	I	A	1.1665
153	A	A	-0.2425
154	Q	A	-0.9596