Project name: query_structure

Chain sequence(s)	A: CGEGLFTCRSTNICISHAWVCDGVDDCEDNSDENNCSAPASEPPGSLCGADQFRCGNGSCVPRAWRCDGVDDCGDGSDEAPEICETPTCQSNEFRCRSGRCIPQHWLCDGLNDCGDGSDESQQCSAPASEPPGSL
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                                          (00:00:50)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:51)

• Minimal score value: -3.7906
• Maximal score value: 1.3165
• Average score: -1.2288
• Total score value: -165.8851

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	0.4046
2	G	A	-0.8188
3	E	A	-1.9931
4	G	A	-1.1843
5	L	A	0.1800
6	F	A	0.0439
7	T	A	-0.2031
8	C	A	0.0000
9	R	A	-2.8710
10	S	A	-2.1903
11	T	A	-1.7237
12	N	A	-1.3517
13	I	A	-0.0711
14	C	A	0.6589
15	I	A	0.0000
16	S	A	0.1802
17	H	A	-0.6409
18	A	A	0.0798
19	W	A	0.5557
20	V	A	-0.1733
21	C	A	-0.6356
22	D	A	-0.2573
23	G	A	-0.5186
24	V	A	-0.0555
25	D	A	-2.2301
26	D	A	-1.5250
27	C	A	0.0000
28	E	A	-3.2801
29	D	A	-3.7906
30	N	A	-3.5121
31	S	A	0.0000
32	D	A	0.0000
33	E	A	-1.8935
34	N	A	-2.7076
35	N	A	-1.8966
36	C	A	-0.7998
37	S	A	-0.6271
38	A	A	-0.6534
39	P	A	-0.6652
40	A	A	-0.7582
41	S	A	-1.2332
42	E	A	-2.2274
43	P	A	-1.3957
44	P	A	-0.9267
45	G	A	-1.0416
46	S	A	-1.0105
47	L	A	0.0066
48	C	A	-0.7507
49	G	A	-1.1481
50	A	A	-1.2778
51	D	A	-2.5649
52	Q	A	-2.1885
53	F	A	-1.5681
54	R	A	-1.6800
55	C	A	0.0000
56	G	A	-1.8792
57	N	A	-2.4175
58	G	A	-1.6098
59	S	A	-1.2506
60	C	A	-0.8711
61	V	A	0.0000
62	P	A	-1.6119
63	R	A	-2.5867
64	A	A	-1.3050
65	W	A	-1.0985
66	R	A	-1.4953
67	C	A	-1.3194
68	D	A	-1.8569
69	G	A	-0.9474
70	V	A	-0.1288
71	D	A	-2.1873
72	D	A	-1.7099
73	C	A	0.0000
74	G	A	-2.2273
75	D	A	-3.1256
76	G	A	-2.1308
77	S	A	0.0000
78	D	A	0.0000
79	E	A	-1.8013
80	A	A	0.0000
81	P	A	-1.7603
82	E	A	-2.4008
83	I	A	-1.1737
84	C	A	-1.8600
85	E	A	-2.8332
86	T	A	-1.4479
87	P	A	-1.3003
88	T	A	-1.0283
89	C	A	-1.6796
90	Q	A	-2.1253
91	S	A	-1.6808
92	N	A	-2.5134
93	E	A	-2.3584
94	F	A	-1.8511
95	R	A	-2.6617
96	C	A	0.0000
97	R	A	-3.0537
98	S	A	-2.6288
99	G	A	-2.5192
100	R	A	-2.9436
101	C	A	-1.9914
102	I	A	0.0000
103	P	A	-1.5086
104	Q	A	-2.2615
105	H	A	-1.6141
106	W	A	-0.5244
107	L	A	-0.6953
108	C	A	-0.7612
109	D	A	-1.5320
110	G	A	-0.6710
111	L	A	0.1683
112	N	A	-1.5107
113	D	A	-1.2897
114	C	A	0.0000
115	G	A	-2.1905
116	D	A	-2.8574
117	G	A	-1.9082
118	S	A	0.0000
119	D	A	0.0000
120	E	A	-1.3616
121	S	A	-1.6486
122	Q	A	-1.8209
123	Q	A	-1.7100
124	C	A	-1.0831
125	S	A	-0.9354
126	A	A	-0.3968
127	P	A	-0.6051
128	A	A	-0.5149
129	S	A	-1.2943
130	E	A	-2.2492
131	P	A	-1.5333
132	P	A	-1.0719
133	G	A	-0.7408
134	S	A	0.2235
135	L	A	1.3165