Project name: 1f0n_sv2

Chain sequence(s)	A: SRPGLPVEYLQVPSPSMGRDIKVQFQSGGNNSPAVYLLDGLRAQDDVNEWARYTPAFEWYYQSGLSIVMPVGGQSSFYSDWLKPACGKAGCQTYKWETFLTSELPQWLSANRAVKPTGSAAIGLSMAGSSAMILAAYHPQQFIYAGSLSALLDPSQGDGPALVDKAMGDAGGYKAADMWGPSSDPAWERNDPTQQIPKLVANNTRLWVYCGNGTPNELGGATPGNSAAAAAVRSSNLKFQDAYNAAGGHNAVFNFPPNGTHSWEYWGAQLNAMKGDLQSSLGAG
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                                          (00:03:43)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:44)

• Minimal score value: -3.1858
• Maximal score value: 0.9729
• Average score: -0.6736
• Total score value: -191.3021

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	-1.4059
3	R	A	-2.2653
4	P	A	-1.4211
5	G	A	-1.0549
6	L	A	-0.6378
7	P	A	-0.1647
8	V	A	0.0790
9	E	A	-0.2407
10	Y	A	0.0783
11	L	A	0.0000
12	Q	A	-1.3699
13	V	A	0.0000
14	P	A	-1.2966
15	S	A	0.0000
16	P	A	-0.9420
17	S	A	-0.6990
18	M	A	0.0000
19	G	A	-1.3437
20	R	A	-1.8721
21	D	A	-2.1665
22	I	A	0.0000
23	K	A	-1.5060
24	V	A	0.0000
25	Q	A	-0.2178
26	F	A	0.0000
27	Q	A	0.0000
28	S	A	-0.8180
29	G	A	-1.1471
30	G	A	-1.5959
31	N	A	-2.3567
32	N	A	-2.5039
33	S	A	0.0000
34	P	A	0.0000
35	A	A	0.0000
36	V	A	0.0000
37	Y	A	0.0000
38	L	A	0.0000
39	L	A	0.0000
40	D	A	0.0000
41	G	A	0.0000
42	L	A	-1.1313
43	R	A	-2.5374
44	A	A	0.0000
45	Q	A	-2.5117
46	D	A	-3.1858
47	D	A	-2.6989
48	V	A	-1.6463
49	N	A	0.0000
50	E	A	-1.2500
51	W	A	0.0000
52	A	A	0.0000
53	R	A	-1.5462
54	Y	A	-0.3983
55	T	A	0.0000
56	P	A	-0.9352
57	A	A	0.0000
58	F	A	0.0000
59	E	A	-1.2111
60	W	A	-0.6069
61	Y	A	0.0000
62	Y	A	-0.3052
63	Q	A	-1.1935
64	S	A	0.0000
65	G	A	-1.0326
66	L	A	0.0000
67	S	A	0.0000
68	I	A	0.0000
69	V	A	0.0000
70	M	A	0.0000
71	P	A	0.0000
72	V	A	0.0000
73	G	A	-1.7989
74	G	A	-1.1150
75	Q	A	-1.5235
76	S	A	0.0000
77	S	A	0.0000
78	F	A	0.0000
79	Y	A	0.0000
80	S	A	0.0000
81	D	A	-0.6468
82	W	A	0.0000
83	L	A	0.0334
84	K	A	-1.6137
85	P	A	-1.0898
86	A	A	0.0000
87	C	A	-0.6968
88	G	A	-1.2043
89	K	A	-1.9135
90	A	A	-0.8649
91	G	A	-0.5803
92	C	A	0.0285
93	Q	A	-0.7812
94	T	A	-0.7827
95	Y	A	0.0000
96	K	A	-0.8167
97	W	A	0.0000
98	E	A	0.0000
99	T	A	-0.4177
100	F	A	0.0000
101	L	A	0.0000
102	T	A	-0.3992
103	S	A	-0.6520
104	E	A	-0.8099
105	L	A	0.0000
106	P	A	0.0000
107	Q	A	-1.4879
108	W	A	-0.6070
109	L	A	0.0000
110	S	A	-1.3953
111	A	A	-0.7890
112	N	A	-1.0540
113	R	A	-1.5781
114	A	A	-1.7521
115	V	A	0.0000
116	K	A	-2.2062
117	P	A	-1.3567
118	T	A	-1.0182
119	G	A	-0.6455
120	S	A	0.0000
121	A	A	0.0000
122	A	A	0.0000
123	I	A	0.0000
124	G	A	0.0000
125	L	A	0.0000
126	S	A	-0.1106
127	M	A	-0.0543
128	A	A	0.0000
129	G	A	0.0000
130	S	A	0.0321
131	S	A	0.0000
132	A	A	0.0000
133	M	A	0.0000
134	I	A	0.0000
135	L	A	0.0000
136	A	A	0.0000
137	A	A	0.0000
138	Y	A	-0.1363
139	H	A	-0.5321
140	P	A	-0.9773
141	Q	A	-1.3942
142	Q	A	-0.9951
143	F	A	0.0000
144	I	A	-0.4081
145	Y	A	0.0000
146	A	A	0.0000
147	G	A	0.0000
148	S	A	0.0000
149	L	A	0.0000
150	S	A	0.0000
151	A	A	0.0000
152	L	A	0.1455
153	L	A	0.0000
154	D	A	-1.4344
155	P	A	0.0000
156	S	A	-1.8037
157	Q	A	-2.2923
158	G	A	-1.9382
159	D	A	-2.2945
160	G	A	-1.5642
161	P	A	0.0000
162	A	A	-1.2569
163	L	A	-0.7367
164	V	A	0.0000
165	D	A	-2.3178
166	K	A	-2.6132
167	A	A	-1.9482
168	M	A	0.0000
169	G	A	-2.4462
170	D	A	-3.0110
171	A	A	0.0000
172	G	A	-1.7764
173	G	A	-2.0550
174	Y	A	0.0000
175	K	A	-2.2957
176	A	A	0.0000
177	A	A	-0.9350
178	D	A	-0.9606
179	M	A	0.0000
180	W	A	0.0000
181	G	A	0.0000
182	P	A	-0.7693
183	S	A	-1.2666
184	S	A	-0.8641
185	D	A	-1.1686
186	P	A	-1.1499
187	A	A	-0.8572
188	W	A	0.0000
189	E	A	-2.0916
190	R	A	-1.4560
191	N	A	0.0000
192	D	A	0.0000
193	P	A	0.0000
194	T	A	-1.2702
195	Q	A	-1.6569
196	Q	A	0.0000
197	I	A	0.0000
198	P	A	-1.0357
199	K	A	-1.3884
200	L	A	0.0000
201	V	A	-1.2795
202	A	A	-0.8995
203	N	A	-1.4473
204	N	A	-1.6374
205	T	A	0.0000
206	R	A	-1.2600
207	L	A	0.0000
208	W	A	0.0000
209	V	A	0.0000
210	Y	A	0.0000
211	C	A	0.0000
212	G	A	0.0000
213	N	A	-0.5634
214	G	A	0.0000
215	T	A	-0.7310
216	P	A	-1.3349
217	N	A	-2.1619
218	E	A	-2.2525
219	L	A	-1.0132
220	G	A	-0.9551
221	G	A	-0.7540
222	A	A	-0.6890
223	T	A	-0.4428
224	P	A	-0.6078
225	G	A	-0.7556
226	N	A	-0.6208
227	S	A	-0.5380
228	A	A	-0.3236
229	A	A	-0.3531
230	A	A	0.0000
231	A	A	-0.4403
232	A	A	-0.1981
233	V	A	0.0000
234	R	A	-0.7149
235	S	A	-0.7387
236	S	A	-1.0096
237	N	A	0.0000
238	L	A	-0.6560
239	K	A	-2.3394
240	F	A	0.0000
241	Q	A	-1.4793
242	D	A	-2.6868
243	A	A	-1.8355
244	Y	A	0.0000
245	N	A	-2.4146
246	A	A	-1.2837
247	A	A	-0.9288
248	G	A	-1.1353
249	G	A	-1.7698
250	H	A	-1.6968
251	N	A	-1.3443
252	A	A	-0.3884
253	V	A	0.7241
254	F	A	0.9729
255	N	A	0.3354
256	F	A	0.3577
257	P	A	-0.1431
258	P	A	-0.5680
259	N	A	-0.6989
260	G	A	0.0000
261	T	A	0.0000
262	H	A	-0.4727
263	S	A	0.0000
264	W	A	0.1367
265	E	A	-0.2760
266	Y	A	0.0000
267	W	A	0.0000
268	G	A	0.0000
269	A	A	-0.1921
270	Q	A	0.0000
271	L	A	0.0000
272	N	A	-0.7405
273	A	A	-0.7428
274	M	A	0.0000
275	K	A	-1.4649
276	G	A	-1.7500
277	D	A	-2.2814
278	L	A	0.0000
279	Q	A	-1.4479
280	S	A	-1.3134
281	S	A	-0.9741
282	L	A	-0.6136
283	G	A	-0.8738
284	A	A	-1.0219
285	G	A	-0.8945