Project name: query_structure

Chain sequence(s)	A: GSARDDSLVGDAGANSLVGLAGNDLLLGGAGDDLLLGDEGSDVLDGDAGNDVLDGGQGDDRYVFGVGYGHDRIVESGGGHDTIRINAGADQLWFARQGNDLEIRILGTDDALTVHDWYRDADHRVEIIHAANQAVDQAGIEKLVEAMAQYPD
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                                          (00:01:08)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:08)

• Minimal score value: -3.2702
• Maximal score value: 1.6015
• Average score: -1.0382
• Total score value: -157.8106

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	-0.7245
2	S	A	-1.0105
3	A	A	-1.5534
4	R	A	-3.0846
5	D	A	-3.2702
6	D	A	-1.6252
7	S	A	-0.2178
8	L	A	1.0357
9	V	A	1.6015
10	G	A	-0.0813
11	D	A	-1.4961
12	A	A	-1.2732
13	G	A	-1.3551
14	A	A	-1.3080
15	N	A	-0.6254
16	S	A	-0.0105
17	L	A	0.9647
18	V	A	0.7060
19	G	A	0.0000
20	L	A	-0.5671
21	A	A	-1.7068
22	G	A	-2.5201
23	N	A	-2.6862
24	D	A	0.0000
25	L	A	0.3145
26	L	A	0.0000
27	L	A	0.8727
28	G	A	0.0000
29	G	A	-0.8386
30	A	A	-1.3878
31	G	A	-1.8218
32	D	A	-2.4958
33	D	A	0.0000
34	L	A	0.1432
35	L	A	0.0000
36	L	A	0.4881
37	G	A	0.0000
38	D	A	-1.5373
39	E	A	-2.4196
40	G	A	-2.4387
41	S	A	-2.1912
42	D	A	0.0000
43	V	A	0.0483
44	L	A	0.0000
45	D	A	-0.1568
46	G	A	0.0000
47	D	A	-1.2701
48	A	A	-1.1158
49	G	A	-1.8878
50	N	A	-2.4829
51	D	A	0.0000
52	V	A	-0.3475
53	L	A	0.0000
54	D	A	-0.2085
55	G	A	0.0000
56	G	A	-1.6258
57	Q	A	-2.7084
58	G	A	-2.6277
59	D	A	-2.7915
60	D	A	0.0000
61	R	A	-1.4858
62	Y	A	0.0000
63	V	A	0.0000
64	F	A	0.0000
65	G	A	0.0000
66	V	A	1.0019
67	G	A	-0.1540
68	Y	A	-0.6745
69	G	A	-1.6063
70	H	A	-2.1663
71	D	A	0.0000
72	R	A	-1.3407
73	I	A	0.0000
74	V	A	-0.1357
75	E	A	0.0000
76	S	A	-1.2870
77	G	A	-1.8264
78	G	A	-2.0314
79	G	A	-2.1978
80	H	A	-1.9966
81	D	A	0.0000
82	T	A	0.0000
83	I	A	0.0000
84	R	A	-2.0608
85	I	A	0.0000
86	N	A	-1.0437
87	A	A	0.0000
88	G	A	-1.6939
89	A	A	-1.7443
90	D	A	-2.2458
91	Q	A	-1.9144
92	L	A	0.0000
93	W	A	-0.3467
94	F	A	0.0000
95	A	A	-1.7714
96	R	A	-3.1782
97	Q	A	-2.8711
98	G	A	-2.4360
99	N	A	-2.9213
100	D	A	-2.7113
101	L	A	0.0000
102	E	A	-1.8022
103	I	A	0.0000
104	R	A	-0.7703
105	I	A	0.0000
106	L	A	-0.2947
107	G	A	-0.5303
108	T	A	-0.8106
109	D	A	-1.8196
110	D	A	0.0000
111	A	A	-1.0446
112	L	A	0.0000
113	T	A	-1.2779
114	V	A	0.0000
115	H	A	-1.6352
116	D	A	-2.3503
117	W	A	0.0000
118	Y	A	-2.2973
119	R	A	-3.0136
120	D	A	-2.3583
121	A	A	-1.9111
122	D	A	-2.7233
123	H	A	-2.1037
124	R	A	-1.7464
125	V	A	0.0000
126	E	A	-1.6078
127	I	A	-1.4231
128	I	A	0.0000
129	H	A	-1.6675
130	A	A	0.0000
131	A	A	-1.5101
132	N	A	-2.0812
133	Q	A	-1.9877
134	A	A	-1.4181
135	V	A	0.0000
136	D	A	-2.3408
137	Q	A	-2.0350
138	A	A	-1.4701
139	G	A	-1.7253
140	I	A	0.0000
141	E	A	-2.3150
142	K	A	-2.5014
143	L	A	-1.2969
144	V	A	0.0000
145	E	A	-2.7210
146	A	A	-1.3249
147	M	A	-0.9455
148	A	A	-1.2931
149	Q	A	-1.1229
150	Y	A	0.0140
151	P	A	-0.7372
152	D	A	-1.6762