Project name: f18177a43310b13

Chain sequence(s)	A: SKGEELFTGVVPILVELDGDVNGHKFSVSGEGEGDATYGKLTLKFICTTGKLPVPWPTLVTTFTTTVQCFSRYPDHMKRHDFFKSAMPEGYVQERTIFFKDDGNYKTRAEVKFEGDTLVNRIELKGIDFKEDGNILGHKLEYNYNSHNVYIMADKQKNGIKVNFKIRHNIEDGSVQLADHYQQNTPIGDGPVLLPDNHYLSTQSALSKDPNEKRDHMVLLEFVTAAGI
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:05:43)
[INFO]       Main:     Simulation completed successfully.                                          (00:05:45)

• Minimal score value: -3.9904
• Maximal score value: 1.2396
• Average score: -0.9342
• Total score value: -210.204

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
2	S	A	-1.7480
3	K	A	-1.9266
4	G	A	0.0000
5	E	A	-2.6551
6	E	A	-2.5822
7	L	A	-1.1964
8	F	A	0.0000
9	T	A	-0.6278
10	G	A	0.4512
11	V	A	1.2396
12	V	A	0.0000
13	P	A	-0.9752
14	I	A	0.0000
15	L	A	-0.9862
16	V	A	0.0000
17	E	A	-1.9305
18	L	A	0.0000
19	D	A	-3.3361
20	G	A	0.0000
21	D	A	-2.4363
22	V	A	0.0000
23	N	A	-2.0751
24	G	A	-1.6314
25	H	A	-2.1611
26	K	A	-2.8459
27	F	A	0.0000
28	S	A	-1.6658
29	V	A	0.0000
30	S	A	-0.9663
31	G	A	0.0000
32	E	A	-2.1402
33	G	A	-1.4854
34	E	A	-1.5504
35	G	A	0.0000
36	D	A	0.0545
37	A	A	0.0000
38	T	A	0.2714
39	Y	A	0.9402
40	G	A	0.0000
41	K	A	-0.3884
42	L	A	0.0000
43	T	A	-0.7581
44	L	A	0.0000
45	K	A	-0.9364
46	F	A	0.0000
47	I	A	-1.0400
48	C	A	0.0000
49	T	A	-0.7814
50	T	A	-1.2946
51	G	A	-1.6006
52	K	A	-2.2497
53	L	A	0.0000
54	P	A	-1.1990
55	V	A	0.0000
56	P	A	0.0000
57	W	A	0.0000
58	P	A	0.0000
59	T	A	0.0000
60	L	A	0.0000
61	V	A	0.0000
62	T	A	-0.0037
63	T	A	0.0000
64	F	A	0.0000
68	V	A	-0.0527
69	Q	A	-0.2169
70	C	A	0.0000
71	F	A	0.0000
72	S	A	0.0000
73	R	A	-1.1774
74	Y	A	0.0000
75	P	A	-1.8004
76	D	A	-3.0657
77	H	A	-2.2846
78	M	A	0.0000
79	K	A	-3.3140
80	R	A	-3.0544
81	H	A	-1.7645
82	D	A	0.0000
83	F	A	0.0000
84	F	A	0.0000
85	K	A	-1.1575
86	S	A	0.0000
87	A	A	0.0000
88	M	A	0.0000
89	P	A	-1.8367
90	E	A	-2.5061
91	G	A	0.0000
92	Y	A	0.0000
93	V	A	-0.9173
94	Q	A	0.0000
95	E	A	-2.5636
96	R	A	0.0000
97	T	A	-0.5103
98	I	A	0.0000
99	F	A	0.3706
100	F	A	0.0000
101	K	A	-1.5851
102	D	A	-2.5554
103	D	A	-2.4961
104	G	A	0.0000
105	N	A	-0.7386
106	Y	A	0.0000
107	K	A	-1.8764
108	T	A	0.0000
109	R	A	-3.1202
110	A	A	0.0000
111	E	A	-2.2195
112	V	A	0.0000
113	K	A	-1.9659
114	F	A	-2.0041
115	E	A	-2.7630
116	G	A	-2.2840
117	D	A	-2.5449
118	T	A	-1.7283
119	L	A	0.0000
120	V	A	0.0000
121	N	A	0.0000
122	R	A	-2.8747
123	I	A	0.0000
124	E	A	-3.9529
125	L	A	0.0000
126	K	A	-2.7094
127	G	A	0.0000
128	I	A	-1.1789
129	D	A	-2.3003
130	F	A	0.0000
131	K	A	-3.9622
132	E	A	-3.9904
133	D	A	-3.6067
134	G	A	-2.8039
135	N	A	-2.1472
136	I	A	0.0000
137	L	A	-1.9260
138	G	A	-2.2856
139	H	A	-2.2238
140	K	A	-2.5262
141	L	A	0.0000
142	E	A	-1.8498
143	Y	A	-0.6819
144	N	A	-0.6203
145	Y	A	-0.7041
146	N	A	-0.9709
147	S	A	-1.0619
148	H	A	0.0000
149	N	A	-1.0828
150	V	A	0.0000
151	Y	A	0.0634
152	I	A	0.0000
153	M	A	-0.9507
154	A	A	-1.7151
155	D	A	0.0000
156	K	A	-3.1149
157	Q	A	-3.1357
158	K	A	-3.4573
159	N	A	-2.6641
160	G	A	0.0000
161	I	A	0.0000
162	K	A	-1.5315
163	V	A	0.0000
164	N	A	-0.3613
165	F	A	0.0000
166	K	A	-1.1632
167	I	A	0.0000
168	R	A	-0.8515
169	H	A	0.0000
170	N	A	-1.1601
171	I	A	0.0000
172	E	A	-3.2753
173	D	A	-2.9818
174	G	A	-1.8027
175	S	A	-0.7058
176	V	A	0.4094
177	Q	A	0.0000
178	L	A	-0.4014
179	A	A	0.0000
180	D	A	0.0000
181	H	A	0.0000
182	Y	A	0.1868
183	Q	A	0.0000
184	Q	A	-1.7438
185	N	A	0.0000
186	T	A	-0.9755
187	P	A	-0.8470
188	I	A	-0.4057
189	G	A	-1.3325
190	D	A	-2.0301
191	G	A	-1.3720
192	P	A	-0.8415
193	V	A	-0.5890
194	L	A	-0.6668
195	L	A	-0.7930
196	P	A	0.0000
197	D	A	-2.2076
198	N	A	-1.6201
199	H	A	0.0000
200	Y	A	0.1242
201	L	A	0.0000
202	S	A	-0.6276
203	T	A	-0.8347
204	Q	A	-1.3131
205	S	A	-0.5628
206	A	A	-0.0198
207	L	A	-0.0167
208	S	A	-0.6496
209	K	A	-1.7214
210	D	A	-2.1751
211	P	A	-1.8352
212	N	A	-2.4809
213	E	A	-2.7245
214	K	A	-3.1977
215	R	A	-3.4038
216	D	A	-2.3139
217	H	A	0.0000
218	M	A	0.0000
219	V	A	-0.1304
220	L	A	0.0000
221	L	A	0.2860
222	E	A	-0.2495
223	F	A	-0.0424
224	V	A	0.0000
225	T	A	-0.4465
226	A	A	0.0000
227	A	A	0.0830
228	G	A	0.3013
229	I	A	1.1944