Project name: AF-P76561_3916a788eff4644

Chain sequence(s)	A: MKHDHFVVQSPDKPAQQLLLLFHGVGDNPVAMGEIGNWFAPLFPDALVVSVGGAEPSGNPAGRQWFSVQGITEDNRQARVDAIMPTFIETVRYWQKQSGVGANATALIGFSQGAIMVLESIKAEPGLASRVIAFNGRYASLPETASTATTIHLIHGGEDPVIDLAHAVAAQEALISAGGDVTLDIVEDLGHAIDNRSMQFALDHLRYIPKHYFDEALSGGKPGDDDVIEMM
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                                          (00:02:14)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:15)

• Minimal score value: -3.534
• Maximal score value: 2.276
• Average score: -0.5413
• Total score value: -125.0417

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	M	A	-0.3222
2	K	A	-1.7149
3	H	A	-1.7381
4	D	A	-1.9386
5	H	A	-0.6217
6	F	A	0.9132
7	V	A	1.4374
8	V	A	0.5470
9	Q	A	-0.2897
10	S	A	-0.8303
11	P	A	-1.9607
12	D	A	-2.7346
13	K	A	-2.6737
14	P	A	-1.7863
15	A	A	-1.7714
16	Q	A	-1.3951
17	Q	A	-0.8939
18	L	A	0.0000
19	L	A	0.0000
20	L	A	0.0000
21	L	A	0.0000
22	F	A	0.0000
23	H	A	0.0000
24	G	A	0.0000
25	V	A	0.3627
26	G	A	-0.8512
27	D	A	-0.8001
28	N	A	-0.3659
29	P	A	0.0000
30	V	A	1.3361
31	A	A	0.2010
32	M	A	0.0000
33	G	A	0.0000
34	E	A	-1.3122
35	I	A	-0.3204
36	G	A	0.0000
37	N	A	-1.0663
38	W	A	-0.1208
39	F	A	0.0000
40	A	A	-0.2159
41	P	A	-0.2103
42	L	A	0.3577
43	F	A	0.0000
44	P	A	-0.9430
45	D	A	-1.8152
46	A	A	0.0000
47	L	A	-0.6797
48	V	A	0.0000
49	V	A	0.0000
50	S	A	0.0000
51	V	A	0.0000
52	G	A	0.0000
53	G	A	0.0000
54	A	A	-1.4320
55	E	A	-2.3396
56	P	A	-1.7550
57	S	A	-1.3979
58	G	A	-1.3890
59	N	A	-1.4547
60	P	A	-0.8769
61	A	A	-0.5724
62	G	A	0.0000
63	R	A	-1.6977
64	Q	A	-0.8828
65	W	A	0.0000
66	F	A	0.0000
67	S	A	-0.4877
68	V	A	0.2799
69	Q	A	-0.9047
70	G	A	-0.6906
71	I	A	-0.7807
72	T	A	-1.6254
73	E	A	-2.8170
74	D	A	-2.8608
75	N	A	-1.9140
76	R	A	-1.7715
77	Q	A	-1.6703
78	A	A	-1.4411
79	R	A	-0.9075
80	V	A	0.0000
81	D	A	-1.9014
82	A	A	-0.8852
83	I	A	-0.4051
84	M	A	0.0000
85	P	A	-0.9787
86	T	A	-0.7650
87	F	A	0.0000
88	I	A	-0.8413
89	E	A	-1.7201
90	T	A	0.0000
91	V	A	0.0000
92	R	A	-1.5623
93	Y	A	-1.1961
94	W	A	0.0000
95	Q	A	0.0000
96	K	A	-2.5155
97	Q	A	-2.1348
98	S	A	-1.6008
99	G	A	-1.6711
100	V	A	0.0000
101	G	A	-1.3022
102	A	A	-0.8783
103	N	A	-1.2991
104	A	A	0.0000
105	T	A	0.0000
106	A	A	0.0000
107	L	A	0.0000
108	I	A	0.0000
109	G	A	0.0000
110	F	A	0.4347
111	S	A	0.0000
112	Q	A	0.0000
113	G	A	0.0000
114	A	A	0.0000
115	I	A	0.0000
116	M	A	0.0000
117	V	A	0.0000
118	L	A	0.0000
119	E	A	0.0000
120	S	A	0.0000
121	I	A	0.0000
122	K	A	-0.7825
123	A	A	-0.7722
124	E	A	-0.9007
125	P	A	-0.7677
126	G	A	-0.7602
127	L	A	0.0000
128	A	A	0.0000
129	S	A	0.0000
130	R	A	-0.4822
131	V	A	0.0000
132	I	A	0.0000
133	A	A	0.0000
134	F	A	0.0000
135	N	A	0.0000
136	G	A	0.0000
137	R	A	0.0000
138	Y	A	0.0000
139	A	A	0.0000
140	S	A	-0.5470
141	L	A	0.0644
142	P	A	0.0000
143	E	A	-1.7212
144	T	A	-0.8123
145	A	A	-0.4276
146	S	A	-0.4782
147	T	A	-0.5962
148	A	A	-0.4223
149	T	A	0.0000
150	T	A	0.0000
151	I	A	0.0000
152	H	A	0.0000
153	L	A	0.0000
154	I	A	0.0000
155	H	A	0.0000
156	G	A	0.0000
157	G	A	-2.1262
158	E	A	-2.8425
159	D	A	0.0000
160	P	A	-0.4350
161	V	A	0.9265
162	I	A	0.0000
163	D	A	-1.6759
164	L	A	-0.5967
165	A	A	-0.3947
166	H	A	-0.6500
167	A	A	0.0000
168	V	A	-0.0470
169	A	A	-0.1179
170	A	A	0.0000
171	Q	A	-0.2966
172	E	A	-1.0783
173	A	A	-0.5128
174	L	A	0.0000
175	I	A	1.1006
176	S	A	-0.1528
177	A	A	-0.4134
178	G	A	0.0917
179	G	A	0.0000
180	D	A	-0.0792
181	V	A	0.1559
182	T	A	0.2887
183	L	A	0.3806
184	D	A	0.3133
185	I	A	0.3245
186	V	A	0.0000
187	E	A	-2.9014
188	D	A	-3.1177
189	L	A	0.0000
190	G	A	-1.5692
191	H	A	-0.3356
192	A	A	0.1797
193	I	A	-0.1570
194	D	A	-1.1386
195	N	A	-1.7163
196	R	A	-1.4816
197	S	A	0.0000
198	M	A	0.0000
199	Q	A	-1.2036
200	F	A	-0.2715
201	A	A	0.0000
202	L	A	0.0000
203	D	A	-0.5721
204	H	A	0.0203
205	L	A	0.0000
206	R	A	0.4295
207	Y	A	1.3246
209	I	A	2.2760
210	P	A	0.9576
211	K	A	-0.3336
212	H	A	-0.3836
213	Y	A	1.0599
214	F	A	0.8623
215	D	A	-1.5489
216	E	A	-2.0113
217	A	A	-0.5110
218	L	A	0.5681
219	S	A	-0.8345
220	G	A	-1.3781
221	G	A	-2.3836
222	K	A	-2.8915
223	P	A	-2.3716
224	G	A	-2.5283
225	D	A	-3.5340
226	D	A	-3.1019
227	D	A	-2.3104
228	V	A	0.2560
229	I	A	0.3004
230	E	A	-0.1988
231	M	A	0.6567
232	M	A	0.9248