Project name: query_structure

Chain sequence(s)	E: ELQEKLIAVNRVSKTVKGGRIFSFTALTVVGDGNGRVGFGYGKAREVPAAIQKAMEKARRNMINVALNNGTLQHPVKGVHTGSRVFMQPASEGTGIIAGGAMRAVLEVAGVHNVLAKAYGSTNPINVVRATIDGLENMNSPEMVAAKRGKSVEEILG
Selected Chain(s)	E
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 E 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                                          (00:01:56)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:56)

• Minimal score value: -3.8987
• Maximal score value: 1.5009
• Average score: -1.0547
• Total score value: -165.5943

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
10	E	E	-2.2751
11	L	E	-2.2942
12	Q	E	-2.7286
13	E	E	-2.9578
14	K	E	-1.5665
15	L	E	0.3825
16	I	E	0.3925
17	A	E	0.4553
18	V	E	0.1359
19	N	E	-1.5983
20	R	E	-2.0514
21	V	E	-0.9896
22	S	E	-0.7125
23	K	E	-1.4503
24	T	E	-1.3380
25	V	E	-0.9217
26	K	E	-1.7544
27	G	E	-1.4327
28	G	E	-1.5597
29	R	E	-1.8663
30	I	E	-0.5036
31	F	E	-0.2933
32	S	E	0.0000
33	F	E	-1.4947
34	T	E	0.0000
35	A	E	0.0000
36	L	E	0.0000
37	T	E	0.0000
38	V	E	0.0000
39	V	E	0.0000
40	G	E	0.0000
41	D	E	-2.1348
42	G	E	-2.0018
43	N	E	-2.1777
44	G	E	0.0000
45	R	E	-2.1719
46	V	E	0.0000
47	G	E	0.0000
48	F	E	-0.8686
49	G	E	0.0000
50	Y	E	-0.2650
51	G	E	0.0000
52	K	E	-2.5839
53	A	E	-2.4644
54	R	E	-2.6961
55	E	E	-2.6807
56	V	E	-1.5176
57	P	E	-1.0597
58	A	E	-1.7016
59	A	E	0.0000
60	I	E	-0.9573
61	Q	E	-2.2467
62	K	E	-2.9584
63	A	E	0.0000
64	M	E	-2.4400
65	E	E	-3.4347
66	K	E	-3.5454
67	A	E	0.0000
68	R	E	-3.8987
69	R	E	-3.7489
70	N	E	-2.7302
71	M	E	-1.8318
72	I	E	-1.4121
73	N	E	-2.0649
74	V	E	0.0000
75	A	E	-1.2690
76	L	E	-1.0140
77	N	E	-1.3192
78	N	E	-2.0755
79	G	E	-1.8439
80	T	E	-1.2466
81	L	E	0.0000
82	Q	E	-0.8775
83	H	E	-1.0140
84	P	E	-0.8501
85	V	E	0.0000
86	K	E	-2.2786
87	G	E	0.0000
88	V	E	-0.8527
89	H	E	-0.9523
90	T	E	-0.7381
91	G	E	-0.8427
92	S	E	0.0000
93	R	E	-1.9853
94	V	E	0.0000
95	F	E	-0.9035
96	M	E	0.0000
97	Q	E	-0.8049
98	P	E	-0.7404
99	A	E	-0.6051
100	S	E	-1.3335
101	E	E	-2.5344
102	G	E	-1.6257
103	T	E	-0.6820
104	G	E	-0.3715
105	I	E	0.4095
106	I	E	1.5009
107	A	E	0.0900
108	G	E	-0.7237
109	G	E	-0.7334
110	A	E	0.0000
111	M	E	0.0000
112	R	E	-0.9704
113	A	E	0.0000
114	V	E	0.0000
115	L	E	0.0000
116	E	E	-1.9271
117	V	E	0.0000
118	A	E	0.0000
119	G	E	-1.5675
120	V	E	0.0000
121	H	E	-1.6506
122	N	E	0.0000
123	V	E	0.0000
124	L	E	0.5759
125	A	E	-0.3618
126	K	E	-1.4633
127	A	E	-1.0940
128	Y	E	-0.2413
129	G	E	-0.7181
130	S	E	-0.8789
131	T	E	-0.7975
132	N	E	-0.8958
133	P	E	-0.4081
134	I	E	-0.0693
135	N	E	-0.9409
136	V	E	0.0000
137	V	E	0.0000
138	R	E	-1.2977
139	A	E	0.0000
140	T	E	0.0000
141	I	E	0.0000
142	D	E	-2.2711
143	G	E	0.0000
144	L	E	0.0000
145	E	E	-3.1299
146	N	E	-2.6969
147	M	E	0.0000
148	N	E	-1.2022
149	S	E	0.0000
150	P	E	-0.8037
151	E	E	-2.2491
152	M	E	-1.0648
153	V	E	-1.4280
154	A	E	0.0000
155	A	E	-2.0019
156	K	E	-2.9697
157	R	E	-3.2984
158	G	E	-2.8078
159	K	E	-3.2369
160	S	E	-2.1298
161	V	E	-1.3152
162	E	E	-2.3223
163	E	E	-2.4588
164	I	E	-0.9865
165	L	E	0.4447
166	G	E	-0.7270