Project name: 40776959f84baff

Chain sequence(s)	A: GKDLSIIGVLRIDESNPADIARLRAILAQIAERSLETHALATAAGYTVKWSGLVIYPKGKAPRWIALDKVPASKEELQALIDAAIAADFAAPPASAALPAALRAAIEAVADSVPSPSLLVFVEGELAKVVPGLPSPEALLAAL
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                                          (00:01:30)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:31)

• Minimal score value: -3.4002
• Maximal score value: 0.8386
• Average score: -0.767
• Total score value: -109.6837

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	-1.5731
2	K	A	-2.6553
3	D	A	-2.3889
4	L	A	0.0000
5	S	A	0.0000
6	I	A	0.0000
7	I	A	0.0000
8	G	A	0.0000
9	V	A	0.0000
10	L	A	0.0000
11	R	A	-1.3721
12	I	A	0.0000
13	D	A	-2.0424
14	E	A	-2.1112
15	S	A	-1.3919
16	N	A	-1.2522
17	P	A	-0.8149
18	A	A	-0.7063
19	D	A	-1.0688
20	I	A	-0.6452
21	A	A	-0.7643
22	R	A	-0.9678
23	L	A	0.0000
24	R	A	-1.7593
25	A	A	-1.0023
26	I	A	0.0000
27	L	A	0.0000
28	A	A	-1.5654
29	Q	A	-1.4773
30	I	A	-1.0264
31	A	A	0.0000
32	E	A	-2.8925
33	R	A	0.0000
34	S	A	0.0000
35	L	A	-1.2784
36	E	A	-1.9845
37	T	A	0.0000
38	H	A	0.0000
39	A	A	-0.0999
40	L	A	-0.2360
41	A	A	0.0000
42	T	A	-0.2755
43	A	A	0.1668
44	A	A	0.1613
45	G	A	-0.6074
46	Y	A	-0.7284
47	T	A	-1.0358
48	V	A	-1.0121
49	K	A	-2.0261
50	W	A	0.0000
51	S	A	-0.6524
52	G	A	-0.2450
53	L	A	0.0000
54	V	A	0.0000
55	I	A	0.0000
56	Y	A	-1.3775
57	P	A	0.0000
58	K	A	-2.9045
59	G	A	-2.2604
60	K	A	-2.6039
61	A	A	-1.1873
62	P	A	-1.0020
63	R	A	-0.7213
64	W	A	0.0000
65	I	A	0.0928
66	A	A	0.0000
67	L	A	-0.9545
68	D	A	-2.1629
69	K	A	-2.1380
70	V	A	-0.4860
71	P	A	0.0000
72	A	A	-0.8435
73	S	A	-2.0085
74	K	A	-3.2367
75	E	A	-3.4002
76	E	A	-2.7884
77	L	A	0.0000
78	Q	A	-2.3425
79	A	A	-1.5198
80	L	A	-0.7493
81	I	A	0.0000
82	D	A	-1.6589
83	A	A	-0.5755
84	A	A	-0.5680
85	I	A	-0.8001
86	A	A	-0.5897
87	A	A	-0.8466
88	D	A	-1.7444
89	F	A	0.0000
90	A	A	-0.4767
91	A	A	-0.2070
92	P	A	-0.0837
93	P	A	-0.2906
94	A	A	-0.1810
95	S	A	-0.4325
96	A	A	-0.6325
97	A	A	-0.3304
98	L	A	0.0000
99	P	A	-0.2520
100	A	A	-0.1099
101	A	A	-0.4517
102	L	A	0.0000
103	R	A	-0.6902
104	A	A	-0.4741
105	A	A	-0.6143
106	I	A	0.0000
107	E	A	-1.4789
108	A	A	-0.7537
109	V	A	-0.4785
110	A	A	0.0000
111	D	A	-2.1020
112	S	A	-1.1503
113	V	A	0.0000
114	P	A	-0.7114
115	S	A	-0.6655
116	P	A	-0.3125
117	S	A	0.0000
118	L	A	0.0000
119	L	A	0.0000
120	V	A	0.0000
121	F	A	0.0000
122	V	A	-1.8261
123	E	A	-3.1473
124	G	A	-2.3884
125	E	A	-2.4417
126	L	A	-0.8913
127	A	A	-0.6741
128	K	A	-0.5935
129	V	A	0.2213
130	V	A	0.0000
131	P	A	-0.2979
132	G	A	-0.1515
133	L	A	0.0580
134	P	A	-0.2777
135	S	A	-0.8819
136	P	A	-1.1235
137	E	A	-1.9211
138	A	A	-0.6810
139	L	A	0.0000
140	L	A	-0.0164
141	A	A	-0.0688
142	A	A	0.1686
143	L	A	0.8386