Project name: 12f6543393fe072

Chain sequence(s)	A: LNLIAAACTSNGKMGIGINGNLPWRLRQEMAYFERLTKTSQMEGMKNAVVMGRKTWFSIPEKFRPLKDRVNVVLSSSLTECPPGADHLCSSLSEAVKLLSSPPLSQTVDMVWITGGSSVYKDGIDSPLCHRIYLTRIMKEIECDTFFPEFDLDRFKLVTDDAVSQDIQEEKGIQYKFEIYESS
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                                          (00:02:45)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:46)

• Minimal score value: -3.4082
• Maximal score value: 1.2085
• Average score: -0.9197
• Total score value: -168.3122

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	L	A	0.2004
2	N	A	-0.2668
3	L	A	0.0000
4	I	A	0.0000
5	A	A	0.0000
6	A	A	0.0000
7	A	A	0.0000
8	C	A	0.0000
9	T	A	-1.7137
10	S	A	0.0000
11	N	A	-2.5859
12	G	A	-1.8038
13	K	A	-2.0296
14	M	A	-1.1242
15	G	A	0.0000
16	I	A	0.0000
17	G	A	0.0000
18	I	A	-1.4918
19	N	A	-1.8780
20	G	A	-1.4738
21	N	A	-1.3457
22	L	A	-0.5986
23	P	A	-0.8548
24	W	A	0.0000
25	R	A	-2.4664
26	L	A	0.0000
27	R	A	-2.7016
28	Q	A	-2.0935
29	E	A	0.0000
30	M	A	-1.1168
31	A	A	-1.2073
32	Y	A	0.0000
33	F	A	-0.9450
34	E	A	-2.1836
35	R	A	-2.1788
36	L	A	-1.0738
37	T	A	0.0000
38	K	A	-2.8087
39	T	A	-1.9058
40	S	A	-1.6522
41	Q	A	-1.4846
42	M	A	-0.7680
43	E	A	-1.9749
44	G	A	-1.5193
45	M	A	-1.2508
46	K	A	-1.8970
47	N	A	0.0000
48	A	A	0.0000
49	V	A	0.0000
50	V	A	0.0000
51	M	A	0.0000
52	G	A	-0.7297
53	R	A	-1.0680
54	K	A	-1.4351
55	T	A	-0.6727
56	W	A	0.0000
57	F	A	0.7661
58	S	A	-0.3819
59	I	A	-0.0519
60	P	A	-0.6240
61	E	A	-1.9995
62	K	A	-1.7923
63	F	A	0.0444
64	R	A	-0.8160
65	P	A	-1.4591
66	L	A	-1.2157
67	K	A	-2.5295
68	D	A	-3.1449
69	R	A	0.0000
70	V	A	0.0000
71	N	A	0.0000
72	V	A	0.0000
73	V	A	0.0000
74	L	A	-0.4956
75	S	A	-0.6859
76	S	A	-0.3665
77	S	A	-0.4900
78	L	A	-0.4349
79	T	A	-0.8073
80	E	A	-1.6847
81	C	A	-1.0510
82	P	A	0.0000
83	P	A	-1.0253
84	G	A	-1.3164
85	A	A	-1.2003
86	D	A	-1.9630
87	H	A	-1.1200
88	L	A	-0.6903
89	C	A	0.0000
90	S	A	-0.5333
91	S	A	-0.8365
92	L	A	0.0000
93	S	A	-1.2771
94	E	A	-1.7480
95	A	A	0.0000
96	V	A	-0.7263
97	K	A	-1.9094
98	L	A	-0.8270
99	L	A	-0.6601
100	S	A	-0.9772
101	S	A	-0.7530
102	P	A	-0.7246
103	P	A	-0.7805
104	L	A	0.0000
105	S	A	-1.0247
106	Q	A	-1.5637
107	T	A	-1.0811
108	V	A	0.0000
109	D	A	-0.9041
110	M	A	-0.1868
111	V	A	0.2149
112	W	A	0.0000
113	I	A	0.0000
114	T	A	-0.0123
115	G	A	0.0000
116	G	A	-0.8691
117	S	A	-0.8285
118	S	A	-1.3037
119	V	A	0.0000
120	Y	A	0.0000
121	K	A	-3.4082
122	D	A	-3.3555
123	G	A	0.0000
124	I	A	0.0000
125	D	A	-2.9322
126	S	A	0.0000
127	P	A	-0.4910
128	L	A	0.4027
129	C	A	0.0000
130	H	A	-1.0538
131	R	A	-0.8183
132	I	A	0.0000
133	Y	A	0.0000
134	L	A	0.0000
135	T	A	0.0000
136	R	A	-0.4263
137	I	A	0.0000
138	M	A	-0.3671
139	K	A	-1.7729
140	E	A	-2.7598
141	I	A	-1.8225
142	E	A	-2.7357
143	C	A	0.0000
144	D	A	-2.3875
145	T	A	-1.2801
146	F	A	-0.5367
147	F	A	0.0000
148	P	A	0.0000
149	E	A	-2.3350
150	F	A	-2.1129
151	D	A	-2.6778
152	L	A	-1.1944
153	D	A	-2.4107
154	R	A	-2.0423
155	F	A	0.0000
156	K	A	-0.9579
157	L	A	1.2085
158	V	A	0.6264
159	T	A	-0.4278
160	D	A	-1.3859
161	D	A	-2.1417
162	A	A	-1.0436
163	V	A	-1.1896
164	S	A	-1.5582
165	Q	A	-2.2942
166	D	A	-2.0952
167	I	A	-0.5778
168	Q	A	-1.5963
169	E	A	-2.6828
170	E	A	-2.8657
171	K	A	-2.8893
172	G	A	-2.0204
173	I	A	-1.7698
174	Q	A	-1.5591
175	Y	A	0.0000
176	K	A	-1.2533
177	F	A	0.0000
178	E	A	-0.2986
179	I	A	0.0000
180	Y	A	0.0000
181	E	A	-0.7588
182	S	A	-1.1797
183	S	A	-1.1359