Project name: b79839688c165b2

Chain sequence(s)	B: ALTQPASVSGSLGQSITISCTGSSNDFGDYNYVSWYQQHPGKAPKLMIYDVDNRPSGVSNRFSGSKSGNTASLTISGVLAEDEADYFCSSYTSSSTLYVFGSGTKVTVL
Selected Chain(s)	B
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 B 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                                          (00:00:39)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:40)

• Minimal score value: -3.0324
• Maximal score value: 2.1555
• Average score: -0.5396
• Total score value: -58.8146

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
3	A	B	-0.0506
4	L	B	0.0000
5	T	B	-0.0219
6	Q	B	0.0000
7	P	B	-0.4176
8	A	B	-0.5585
9	S	B	-0.8899
11	V	B	-0.3522
12	S	B	-0.2616
13	G	B	0.0000
14	S	B	0.8249
15	L	B	1.4836
16	G	B	-0.2682
17	Q	B	-1.0423
18	S	B	-0.8663
19	I	B	0.0000
20	T	B	-0.1706
21	I	B	0.0000
22	S	B	-0.2297
23	C	B	0.0000
24	T	B	-0.4937
25	G	B	0.0000
26	S	B	-1.1719
27	S	B	-1.7346
28	N	B	-3.0324
29	D	B	-2.9498
30	F	B	0.0000
31	G	B	-2.0154
35	D	B	-2.9705
36	Y	B	0.0000
37	N	B	-1.4572
38	Y	B	0.1531
39	V	B	0.0000
40	S	B	0.0000
41	W	B	0.0000
42	Y	B	-0.0056
43	Q	B	0.0000
44	Q	B	-1.7510
45	H	B	-1.9445
46	P	B	-1.4138
47	G	B	-1.5088
48	K	B	-2.3729
49	A	B	-1.4069
50	P	B	-1.3873
51	K	B	-1.6534
52	L	B	-0.1554
53	M	B	0.0000
54	I	B	0.0000
55	Y	B	-0.9444
56	D	B	-1.8339
57	V	B	0.0000
65	D	B	-2.9070
66	N	B	-2.6412
67	R	B	-2.0076
68	P	B	-0.7457
69	S	B	-0.6788
70	G	B	-0.7410
71	V	B	-0.7284
72	S	B	-0.9890
74	N	B	-1.6503
75	R	B	-0.9953
76	F	B	0.0000
77	S	B	-1.3787
78	G	B	-1.5526
79	S	B	-1.4721
80	K	B	-1.7326
83	S	B	-1.1975
84	G	B	-1.6385
85	N	B	-2.1719
86	T	B	-1.0085
87	A	B	0.0000
88	S	B	-0.5877
89	L	B	0.0000
90	T	B	-0.2913
91	I	B	0.0000
92	S	B	-0.7968
93	G	B	-0.4188
94	V	B	0.0000
95	L	B	0.2641
96	A	B	-0.2930
97	E	B	-2.0306
98	D	B	0.0000
99	E	B	-2.0684
100	A	B	0.0000
101	D	B	-1.4601
102	Y	B	0.0000
103	F	B	0.1745
104	C	B	0.0000
105	S	B	0.0000
106	S	B	0.0000
107	Y	B	1.8470
108	T	B	0.5910
109	S	B	-0.9038
110	S	B	-0.1691
113	S	B	0.4084
114	T	B	0.8821
115	L	B	2.1555
116	Y	B	1.9721
117	V	B	1.9023
118	F	B	1.9144
119	G	B	0.0000
120	S	B	0.1338
121	G	B	-0.3550
122	T	B	0.0000
123	K	B	-2.1162
124	V	B	0.0000
125	T	B	-0.5737
126	V	B	0.2808
127	L	B	1.8318