Project name: query_structure

Chain sequence(s)	A: CGADQFRCGNGSCVPRAWRCDGVDDCGDGSDEAPEICETPTCQSNEFRCRSGRCIPQHWLCDGLNDCGDGSDESQQCSAPASEPPGSLCGEGLFTCRSTNICISHAWVCDGVDDCEDNSDENNCSAPASEPPGSL
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                                          (00:01:07)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:08)

• Minimal score value: -3.1942
• Maximal score value: 1.3369
• Average score: -1.1869
• Total score value: -160.2377

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	C	A	-0.2463
2	G	A	-0.9993
3	A	A	-1.0825
4	D	A	-2.3361
5	Q	A	-1.7481
6	F	A	-1.3991
7	R	A	-2.2863
8	C	A	0.0000
9	G	A	-2.0572
10	N	A	-2.5246
11	G	A	-1.7184
12	S	A	-1.3211
13	C	A	-0.7819
14	V	A	0.0000
15	P	A	-1.0827
16	R	A	-1.7030
17	A	A	-0.7649
18	W	A	-0.4842
19	R	A	-1.1243
20	C	A	-1.1397
21	D	A	-1.7145
22	G	A	-0.9440
23	V	A	-0.1582
24	D	A	-2.2641
25	D	A	-1.7491
26	C	A	0.0000
27	G	A	-2.2584
28	D	A	-3.1342
29	G	A	-2.1640
30	S	A	-2.2224
31	D	A	0.0000
32	E	A	-1.8006
33	A	A	-1.6776
34	P	A	-1.7758
35	E	A	-2.3991
36	I	A	-1.1576
37	C	A	-1.6358
38	E	A	-2.4875
39	T	A	-1.5492
40	P	A	-1.5413
41	T	A	-0.9795
42	C	A	-1.6256
43	Q	A	-2.0715
44	S	A	-1.6165
45	N	A	-2.2853
46	E	A	-2.1817
47	F	A	-1.6543
48	R	A	-2.5137
49	C	A	0.0000
50	R	A	-3.1714
51	S	A	-2.6099
52	G	A	-2.5882
53	R	A	-3.0428
54	C	A	-1.9135
55	I	A	0.0000
56	P	A	-1.3046
57	Q	A	-1.8655
58	H	A	-1.4826
59	W	A	-0.6029
60	L	A	-0.6363
61	C	A	-0.8896
62	D	A	-1.6101
63	G	A	-0.7411
64	L	A	0.1146
65	N	A	-1.5351
66	D	A	-1.2848
67	C	A	0.0000
68	G	A	-2.1930
69	D	A	-3.0600
70	G	A	-1.9530
71	S	A	0.0000
72	D	A	0.0000
73	E	A	-1.4918
74	S	A	-1.7709
75	Q	A	-1.8782
76	Q	A	-1.8201
77	C	A	-1.1218
78	S	A	-1.0252
79	A	A	-0.6647
80	P	A	-0.3960
81	A	A	-0.3026
82	S	A	-0.7596
83	E	A	-1.1352
84	P	A	-0.7165
85	P	A	-0.6467
86	G	A	-0.5500
87	S	A	-0.4556
88	L	A	0.1416
89	C	A	0.0000
90	G	A	-0.8843
91	E	A	-1.9629
92	G	A	-0.9322
93	L	A	0.4078
94	F	A	0.3173
95	T	A	-0.0729
96	C	A	0.0000
97	R	A	-2.6078
98	S	A	-1.9694
99	T	A	-1.5137
100	N	A	-1.2498
101	I	A	-0.1112
102	C	A	0.7335
103	I	A	0.0000
104	S	A	0.1388
105	H	A	-0.5318
106	A	A	-0.1053
107	W	A	0.2136
108	V	A	-0.3613
109	C	A	-0.9258
110	D	A	-1.3655
111	G	A	-0.8772
112	V	A	-0.2469
113	D	A	-2.2943
114	D	A	-1.5042
115	C	A	0.0000
116	E	A	-2.9328
117	D	A	-3.0141
118	N	A	-3.1942
119	S	A	0.0000
120	D	A	0.0000
121	E	A	-1.9062
122	N	A	-2.5464
123	N	A	-1.7400
124	C	A	-0.5549
125	S	A	-0.4835
126	A	A	-0.2872
127	P	A	-0.6085
128	A	A	-0.5674
129	S	A	-1.3036
130	E	A	-2.2340
131	P	A	-1.5236
132	P	A	-1.1639
133	G	A	-0.7047
134	S	A	0.2202
135	L	A	1.3369