Project name: query_structure

Chain sequence(s)	A: GSARDDVLIGDAGANVLRGLAGNDVLSGGAGDDWLWGDEGSDLLSGDAGNDVLCGGQGDDTYLFGVGYGHDSIRESGGGHDTIRINAGADQLWFARQGNDLEIRILGTDDALTVHDWYRDADHRVEIIHAANQAVDQAGIEKLVEAMAQYPD
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                                          (00:01:16)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:17)

• Minimal score value: -3.04
• Maximal score value: 2.185
• Average score: -1.0034
• Total score value: -152.5118

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	G	A	-0.7707
2	S	A	-1.0051
3	A	A	-1.5396
4	R	A	-2.8374
5	D	A	-2.7718
6	D	A	-0.6792
7	V	A	1.7852
8	L	A	1.7821
9	I	A	2.1850
10	G	A	0.3117
11	D	A	-1.4745
12	A	A	-1.2288
13	G	A	-1.0459
14	A	A	-0.7620
15	N	A	0.2005
16	V	A	1.5161
17	L	A	1.0101
18	R	A	-0.4648
19	G	A	0.0000
20	L	A	-0.8906
21	A	A	-1.8752
22	G	A	-2.4942
23	N	A	-2.4685
24	D	A	0.0000
25	V	A	1.2700
26	L	A	0.0000
27	S	A	1.0933
28	G	A	0.0000
29	G	A	-0.6455
30	A	A	-1.2127
31	G	A	-1.5969
32	D	A	-2.0105
33	D	A	0.0000
34	W	A	0.6990
35	L	A	0.0000
36	W	A	-0.0733
37	G	A	0.0000
38	D	A	-1.7168
39	E	A	-2.6822
40	G	A	-2.5823
41	S	A	-2.1274
42	D	A	0.0000
43	L	A	0.5398
44	L	A	0.0000
45	S	A	0.0000
46	G	A	0.0000
47	D	A	-0.5346
48	A	A	-0.6556
49	G	A	-1.5128
50	N	A	-1.8648
51	D	A	0.0000
52	V	A	-0.2227
53	L	A	0.0000
54	C	A	-0.6211
55	G	A	0.0000
56	G	A	-1.8033
57	Q	A	-2.7684
58	G	A	-2.6327
59	D	A	-2.8553
60	D	A	0.0000
61	T	A	-0.5334
62	Y	A	0.0000
63	L	A	-0.5640
64	F	A	0.0000
65	G	A	0.0000
66	V	A	0.9662
67	G	A	0.0254
68	Y	A	-0.2017
69	G	A	-1.1551
70	H	A	-1.7473
71	D	A	0.0000
72	S	A	-0.7134
73	I	A	0.0000
74	R	A	-1.7696
75	E	A	0.0000
76	S	A	-1.5802
77	G	A	-1.9281
78	G	A	-2.0695
79	G	A	-2.3239
80	H	A	-2.2696
81	D	A	0.0000
82	T	A	-1.4058
83	I	A	0.0000
84	R	A	-2.3516
85	I	A	0.0000
86	N	A	-1.5330
87	A	A	0.0000
88	G	A	-1.8041
89	A	A	-1.7527
90	D	A	-2.2295
91	Q	A	-2.0033
92	L	A	0.0000
93	W	A	-0.5106
94	F	A	0.0000
95	A	A	-1.5996
96	R	A	-2.8276
97	Q	A	-2.6181
98	G	A	-2.3923
99	N	A	-3.0400
100	D	A	-2.5884
101	L	A	0.0000
102	E	A	-1.5427
103	I	A	0.0000
104	R	A	-1.4186
105	I	A	0.0000
106	L	A	-0.3133
107	G	A	-0.5402
108	T	A	-0.8707
109	D	A	-1.8826
110	D	A	0.0000
111	A	A	0.0000
112	L	A	0.0000
113	T	A	-1.1616
114	V	A	0.0000
115	H	A	-2.0970
116	D	A	-2.8970
117	W	A	0.0000
118	Y	A	-2.2982
119	R	A	-3.0366
120	D	A	-2.2107
121	A	A	-1.8626
122	D	A	-2.8235
123	H	A	-2.5939
124	R	A	-2.2879
125	V	A	0.0000
126	E	A	-2.6094
127	I	A	-1.6371
128	I	A	0.0000
129	H	A	-1.9099
130	A	A	0.0000
131	A	A	-1.8012
132	N	A	-2.2161
133	Q	A	-2.0962
134	A	A	-1.3722
135	V	A	-1.3828
136	D	A	-2.4917
137	Q	A	-2.2450
138	A	A	-1.5239
139	G	A	-1.6060
140	I	A	0.0000
141	E	A	-2.2056
142	K	A	-2.4074
143	L	A	-1.0933
144	V	A	0.0000
145	E	A	-2.6264
146	A	A	-1.2643
147	M	A	-0.8660
148	A	A	-1.2314
149	Q	A	-1.1298
150	Y	A	0.0147
151	P	A	-0.7388
152	D	A	-1.6797