Project name: 1f0n_stab-T

Chain sequence(s)	A: SRPGLPVEYLQVPSPSMGRDIKVQFQSGGNNSPAVYLLDGLRAQDDYNGWDINTPAFEWYYQSGLSIVMPVGGQSSFYSDWYSPACGKAGCQTYKWETFLTSELPQWLSANRAVKPTGSAAIGLSMAGSSAMILAAYHPQQFIYAGSLSALLDPSQGDGPAFLDKAMGDAGGYKAADMWGPSSDPAWERNDPTQQIPKLVANNTRLWVYCGNGTPNSAGGNTPAASALENFVRSSNLKFQDAYNAAGGHNAVFNFPPNGTHSWEYWGAQLNAMKGDLQSSLGAG
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.                                          (00:03:27)

• Minimal score value: -3.2048
• Maximal score value: 1.5184
• Average score: -0.6057
• Total score value: -172.011

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	-1.1793
3	R	A	-1.9228
4	P	A	-1.2558
5	G	A	-0.9413
6	L	A	-0.4636
7	P	A	-0.0598
8	V	A	0.2451
9	E	A	-0.2611
10	Y	A	0.0361
11	L	A	0.0000
12	Q	A	-1.4250
13	V	A	0.0000
14	P	A	-1.3081
15	S	A	0.0000
16	P	A	-0.9476
17	S	A	-0.7110
18	M	A	0.0000
19	G	A	-1.3469
20	R	A	-1.8788
21	D	A	-2.1846
22	I	A	0.0000
23	K	A	-1.4105
24	V	A	0.0000
25	Q	A	0.0000
26	F	A	0.0000
27	Q	A	0.0000
28	S	A	-0.7893
29	G	A	-1.0968
30	G	A	-1.5526
31	N	A	-2.2971
32	N	A	-2.3737
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	-0.7278
42	L	A	-1.2129
43	R	A	-2.6818
44	A	A	0.0000
45	Q	A	-2.8695
46	D	A	-3.2048
47	D	A	-2.2784
48	Y	A	-0.2459
49	N	A	0.0000
50	G	A	0.0000
51	W	A	0.0000
52	D	A	0.5260
53	I	A	1.5184
54	N	A	-0.4281
55	T	A	0.0000
56	P	A	-0.5188
57	A	A	0.0000
58	F	A	0.0000
59	E	A	-0.6778
60	W	A	-0.2654
61	Y	A	0.0000
62	Y	A	-0.0469
63	Q	A	-1.0847
64	S	A	0.0000
65	G	A	-1.0220
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	-1.8284
74	G	A	-1.2510
75	Q	A	-1.6799
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	-0.4355
82	W	A	0.0000
83	Y	A	0.9446
84	S	A	0.0217
85	P	A	-0.2598
86	A	A	0.0000
87	C	A	-0.2464
88	G	A	-1.1116
89	K	A	-1.8487
90	A	A	-0.7887
91	G	A	-0.4350
92	C	A	0.2066
93	Q	A	-0.4925
94	T	A	-0.4391
95	Y	A	0.0000
96	K	A	-0.6727
97	W	A	0.0000
98	E	A	0.0000
99	T	A	-0.4389
100	F	A	0.0000
101	L	A	0.0000
102	T	A	-0.4089
103	S	A	-0.6512
104	E	A	-0.8105
105	L	A	0.0000
106	P	A	0.0000
107	Q	A	-1.4447
108	W	A	-0.6075
109	L	A	0.0000
110	S	A	-1.2983
111	A	A	-0.7504
112	N	A	-1.0536
113	R	A	-1.5323
114	A	A	-1.6645
115	V	A	0.0000
116	K	A	-1.8538
117	P	A	-1.1861
118	T	A	-0.9048
119	G	A	-0.5651
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	-0.0894
127	M	A	-0.0910
128	A	A	0.0000
129	G	A	0.0000
130	S	A	0.0154
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	-0.2010
139	H	A	-0.5641
140	P	A	-0.9930
141	Q	A	-1.4046
142	Q	A	-0.9579
143	F	A	0.0000
144	I	A	-0.4276
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	0.3520
153	L	A	0.0000
154	D	A	-1.3826
155	P	A	0.0000
156	S	A	-1.7228
157	Q	A	-2.2398
158	G	A	-1.9591
159	D	A	-2.3557
160	G	A	-1.6507
161	P	A	0.0000
162	A	A	-1.3783
163	F	A	-1.0259
164	L	A	0.0000
165	D	A	-2.5000
166	K	A	-2.7868
167	A	A	-2.0951
168	M	A	0.0000
169	G	A	-2.6675
170	D	A	-3.1028
171	A	A	0.0000
172	G	A	-1.8127
173	G	A	-2.1232
174	Y	A	0.0000
175	K	A	-2.5183
176	A	A	0.0000
177	A	A	-0.8802
178	D	A	-0.5591
179	M	A	0.0000
180	W	A	0.0000
181	G	A	-0.5126
182	P	A	-0.8428
183	S	A	-1.2395
184	S	A	-0.8347
185	D	A	-1.1156
186	P	A	-1.0770
187	A	A	0.0000
188	W	A	0.0000
189	E	A	-1.8711
190	R	A	-1.3293
191	N	A	0.0000
192	D	A	0.0000
193	P	A	0.0000
194	T	A	-1.1745
195	Q	A	-1.5232
196	Q	A	0.0000
197	I	A	0.0000
198	P	A	-0.9682
199	K	A	-1.2636
200	L	A	0.0000
201	V	A	-1.2635
202	A	A	-0.8862
203	N	A	-1.4909
204	N	A	-1.6968
205	T	A	0.0000
206	R	A	-1.2966
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	-0.6632
214	G	A	0.0000
215	T	A	-1.2125
216	P	A	-1.6142
217	N	A	-1.7903
218	S	A	-1.0484
219	A	A	-1.1736
220	G	A	-1.3561
221	G	A	-1.4198
222	N	A	-1.7412
223	T	A	-0.8642
224	P	A	-0.5011
225	A	A	-0.2831
226	A	A	0.0000
227	S	A	-0.5931
228	A	A	0.0002
229	L	A	0.3691
230	E	A	0.0000
231	N	A	-0.8182
232	F	A	0.5624
233	V	A	0.0000
234	R	A	0.0000
235	S	A	-0.3441
236	S	A	-0.5516
237	N	A	0.0000
238	L	A	-0.0643
239	K	A	-2.0690
240	F	A	0.0000
241	Q	A	0.0000
242	D	A	-2.5400
243	A	A	-1.7410
244	Y	A	0.0000
245	N	A	-2.3545
246	A	A	-1.2579
247	A	A	-0.9152
248	G	A	-1.1342
249	G	A	-1.7471
250	H	A	-1.7015
251	N	A	-1.3487
252	A	A	-0.4891
253	V	A	0.6555
254	F	A	1.0690
255	N	A	0.6326
256	F	A	1.2921
257	P	A	0.2045
258	P	A	-0.4710
259	N	A	-0.8971
260	G	A	0.0000
261	T	A	0.0000
262	H	A	-0.6289
263	S	A	-0.7745
264	W	A	-0.6836
265	E	A	-1.7209
266	Y	A	0.0000
267	W	A	0.0000
268	G	A	0.0000
269	A	A	-0.5715
270	Q	A	-0.5695
271	L	A	0.0000
272	N	A	-0.7339
273	A	A	-0.6542
274	M	A	0.0000
275	K	A	-1.2189
276	G	A	-1.3924
277	D	A	-1.5806
278	L	A	0.0000
279	Q	A	-1.2246
280	S	A	-1.0689
281	S	A	-0.7749
282	L	A	-0.5095
283	G	A	-0.7947
284	A	A	-0.9497
285	G	A	-0.9001