Project name: 27dcaaf5b2ba34a

Chain sequence(s)	A: IRTFLFQPSVIPSGSMIPTLLVGDYTTTNKYSYGYSKYSFPFSYNLFNGRIFNNQPRRGDVVVFRYPKDPSIDYVKRVIGLPGDRISLEKGIIYINGAPVVRHMEGYFSYHYKEDWSSNVPIFQEKLSNGVLYNVLSQDFLAPSSNISEFLVPKGHYFMMGDNRDKSKDSRWVEVGFVPEENLVGRASFVLFSIGGDTPFSKTWQWTPNMRWDRLFKIL
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                                          (00:03:25)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:26)

• Minimal score value: -2.8969
• Maximal score value: 2.7699
• Average score: -0.1538
• Total score value: -33.6858

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	I	A	1.1457
2	R	A	-0.2765
3	T	A	0.9352
4	F	A	2.2862
5	L	A	2.0926
6	F	A	1.4802
7	Q	A	0.3655
8	P	A	0.2830
9	S	A	0.5291
10	V	A	1.5691
11	I	A	0.0000
12	P	A	0.0102
13	S	A	-0.4089
14	G	A	0.0000
15	S	A	-0.6435
16	M	A	0.0000
17	I	A	0.0000
18	P	A	0.0207
19	T	A	0.1644
20	L	A	0.0000
21	L	A	0.3530
22	V	A	0.0326
23	G	A	0.3654
24	D	A	0.0000
25	Y	A	1.2136
26	T	A	0.0000
27	T	A	0.0000
28	T	A	0.0000
29	N	A	0.7449
30	K	A	0.0000
31	Y	A	1.8540
32	S	A	0.1997
33	Y	A	0.0000
34	G	A	0.0000
35	Y	A	0.0000
36	S	A	0.0000
37	K	A	-0.1513
38	Y	A	0.0272
39	S	A	0.0000
40	F	A	1.0444
41	P	A	0.9939
42	F	A	2.0618
43	S	A	1.2510
44	Y	A	1.6825
45	N	A	0.0891
46	L	A	1.2142
47	F	A	0.3626
48	N	A	-1.1981
49	G	A	-1.1743
50	R	A	-0.5092
51	I	A	0.7414
52	F	A	1.5514
53	N	A	-0.6822
54	N	A	-1.2823
55	Q	A	-1.9468
56	P	A	0.0000
57	R	A	-2.2749
58	R	A	-1.4029
59	G	A	0.0000
60	D	A	-0.9063
61	V	A	0.0000
62	V	A	0.0000
63	V	A	0.0000
64	F	A	0.0000
65	R	A	-0.8637
66	Y	A	0.0000
67	P	A	-1.3113
68	K	A	-2.2111
69	D	A	-1.7094
70	P	A	-0.9146
71	S	A	-0.4440
72	I	A	0.0904
73	D	A	-0.6016
74	Y	A	-0.1234
75	V	A	-0.0270
76	K	A	0.0000
77	R	A	0.0000
78	V	A	0.0000
79	I	A	0.0000
80	G	A	0.0000
81	L	A	-0.6031
82	P	A	-0.8075
83	G	A	-0.6284
84	D	A	0.0000
85	R	A	-1.2655
86	I	A	0.0000
87	S	A	-1.3215
88	L	A	0.0000
89	E	A	-2.2439
90	K	A	-1.6207
91	G	A	-1.0862
92	I	A	-0.2187
93	I	A	0.0000
94	Y	A	-0.5076
95	I	A	0.0000
96	N	A	-1.7056
97	G	A	-1.3575
98	A	A	-0.4062
99	P	A	-0.1400
100	V	A	0.0000
101	V	A	1.0652
102	R	A	-0.3583
103	H	A	-1.2737
104	M	A	-0.7790
105	E	A	-1.6398
106	G	A	-0.3538
107	Y	A	0.7620
108	F	A	0.3655
109	S	A	-0.1582
110	Y	A	0.0000
111	H	A	-1.4037
112	Y	A	-1.7879
113	K	A	-2.8969
114	E	A	-2.8228
115	D	A	-1.5573
116	W	A	-0.2386
117	S	A	-0.1020
118	S	A	-0.4717
119	N	A	-0.8477
120	V	A	-0.3121
121	P	A	0.0000
122	I	A	-0.2729
123	F	A	0.0000
124	Q	A	-0.9232
125	E	A	0.0000
126	K	A	-0.8355
127	L	A	0.0000
128	S	A	-0.8159
129	N	A	-1.7175
130	G	A	-0.8848
131	V	A	-0.0966
132	L	A	0.6694
133	Y	A	0.0000
134	N	A	-0.7059
135	V	A	0.0000
136	L	A	0.0000
137	S	A	0.0000
138	Q	A	-1.7408
139	D	A	-1.5711
140	F	A	-0.6937
141	L	A	0.4975
142	A	A	-0.2062
143	P	A	-0.4244
144	S	A	-0.6960
145	S	A	0.0000
146	N	A	-1.3437
147	I	A	-1.0290
148	S	A	-1.4175
149	E	A	-2.0102
150	F	A	-0.2476
151	L	A	0.5747
152	V	A	0.0000
153	P	A	-0.6130
154	K	A	-1.7891
155	G	A	-1.4184
156	H	A	-0.9711
157	Y	A	0.0000
158	F	A	0.0000
159	M	A	0.0000
160	M	A	0.0000
161	G	A	0.0000
162	D	A	0.0000
163	N	A	0.0000
164	R	A	0.0000
165	D	A	-2.1362
166	K	A	-1.7311
167	S	A	0.0000
168	K	A	-1.1135
169	D	A	0.0000
170	S	A	0.0000
171	R	A	0.2985
172	W	A	1.0170
173	V	A	1.7232
174	E	A	-0.0913
175	V	A	0.0000
176	G	A	0.4840
177	F	A	0.7445
178	V	A	0.0000
179	P	A	-0.8071
180	E	A	-1.4291
181	E	A	-1.5132
182	N	A	0.0000
183	L	A	0.0000
184	V	A	0.0000
185	G	A	0.0000
186	R	A	-0.3272
187	A	A	0.0000
188	S	A	0.0000
189	F	A	2.0719
190	V	A	0.0000
191	L	A	1.6789
192	F	A	1.2327
193	S	A	0.0000
194	I	A	0.0000
195	G	A	0.0000
196	G	A	-1.3788
197	D	A	-1.5680
198	T	A	0.0000
199	P	A	0.1977
200	F	A	1.7114
201	S	A	0.4998
202	K	A	0.1306
203	T	A	0.5355
204	W	A	0.9446
205	Q	A	0.0862
206	W	A	0.2433
207	T	A	0.0891
208	P	A	-0.3750
209	N	A	-0.4688
210	M	A	-0.1173
211	R	A	-0.2189
212	W	A	0.4998
213	D	A	-1.0029
214	R	A	0.0000
215	L	A	1.4854
216	F	A	2.6608
217	K	A	1.5974
218	I	A	2.7699
219	L	A	1.6044