Project name: 14116b12231f8b9

Chain sequence(s)	A: NKTKVIGIGINLEELSPEKIEKKIEEKLEEIDKEYAALKAEGVKHIRFNINIDINDANAENALYALEKLAYRCKELGVDVRLSINLNTDAETTDKVLERLLEIALEFDNVELSVHVNYADAGLVALDKVLEFAEKGIKVGLTITVSYAEDAPAVIEKTIETVKELREKGITGQHIIIVITCELTEEQLQLLRELIEEAKKALEASGKGNSVLVICEGPSKGAKELNEESAKMAQLGSGPDSGSGSG
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                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:03:32)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:33)

• Minimal score value: -4.8955
• Maximal score value: 0.4324
• Average score: -1.3822
• Total score value: -340.0275

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	N	A	-2.5498
2	K	A	-2.7409
3	T	A	-1.9244
4	K	A	-1.4678
5	V	A	-0.2765
6	I	A	-0.1954
7	G	A	-0.6675
8	I	A	0.0000
9	G	A	-1.1508
10	I	A	0.0000
11	N	A	-1.9013
12	L	A	0.0000
13	E	A	-2.5710
14	E	A	-2.5939
15	L	A	-2.1846
16	S	A	-1.9778
17	P	A	-2.5777
18	E	A	-3.6784
19	K	A	-3.9455
20	I	A	0.0000
21	E	A	-4.5279
22	K	A	-4.8955
23	K	A	-3.8397
24	I	A	0.0000
25	E	A	-4.7695
26	E	A	-4.4576
27	K	A	-3.3158
28	L	A	-3.1290
29	E	A	-4.0704
30	E	A	-3.5157
31	I	A	0.0000
32	D	A	-2.4295
33	K	A	-3.1971
34	E	A	-2.2715
35	Y	A	-1.7325
36	A	A	-1.7283
37	A	A	-1.6313
38	L	A	0.0000
39	K	A	-2.8989
40	A	A	-1.7398
41	E	A	-2.6439
42	G	A	-2.2460
43	V	A	-2.4538
44	K	A	-2.9946
45	H	A	-2.3106
46	I	A	0.0000
47	R	A	-0.7691
48	F	A	0.0000
49	N	A	-0.9440
50	I	A	0.0000
51	N	A	-1.5241
52	I	A	0.0000
53	D	A	-1.7927
54	I	A	0.0000
55	N	A	-2.0789
56	D	A	-2.4487
57	A	A	-1.6534
58	N	A	0.0000
59	A	A	0.0000
60	E	A	-2.2489
61	N	A	-1.4805
62	A	A	0.0000
63	L	A	0.0000
64	Y	A	-0.2587
65	A	A	0.0000
66	L	A	0.0000
67	E	A	-0.6621
68	K	A	-1.1378
69	L	A	0.0000
70	A	A	0.0000
71	Y	A	-1.3184
72	R	A	-1.6261
73	C	A	0.0000
74	K	A	-2.8722
75	E	A	-2.5161
76	L	A	-1.3790
77	G	A	-1.4771
78	V	A	-1.3787
79	D	A	-1.5728
80	V	A	0.0000
81	R	A	-1.5567
82	L	A	0.0000
83	S	A	-1.1172
84	I	A	0.0000
85	N	A	-1.2445
86	L	A	0.0000
87	N	A	-1.6723
88	T	A	0.0000
89	D	A	-2.3754
90	A	A	-2.2055
91	E	A	-3.0312
92	T	A	-2.8104
93	T	A	0.0000
94	D	A	-2.9740
95	K	A	-3.0729
96	V	A	0.0000
97	L	A	0.0000
98	E	A	-3.2697
99	R	A	-2.4567
100	L	A	0.0000
101	L	A	0.0000
102	E	A	-1.6538
103	I	A	0.0000
104	A	A	0.0000
105	L	A	-0.1797
106	E	A	-1.4718
107	F	A	-1.8492
108	D	A	-2.5608
109	N	A	-2.8761
110	V	A	0.0000
111	E	A	-2.6047
112	L	A	0.0000
113	S	A	-1.0314
114	V	A	0.0000
115	H	A	-0.6854
116	V	A	0.0000
117	N	A	-0.6685
118	Y	A	-0.2563
119	A	A	0.0000
120	D	A	-1.6503
121	A	A	0.0000
122	G	A	0.0000
123	L	A	-0.6838
124	V	A	-1.1317
125	A	A	0.0000
126	L	A	0.0000
127	D	A	-2.3220
128	K	A	-2.0442
129	V	A	0.0000
130	L	A	-2.1426
131	E	A	-2.9752
132	F	A	0.0000
133	A	A	0.0000
134	E	A	-3.2586
135	K	A	-2.2642
136	G	A	-2.1022
137	I	A	0.0000
138	K	A	-2.5726
139	V	A	0.0000
140	G	A	-0.8355
141	L	A	0.0000
142	T	A	-0.1084
143	I	A	0.0000
144	T	A	0.3126
145	V	A	0.0000
146	S	A	-0.1328
147	Y	A	0.3126
148	A	A	-0.9172
149	E	A	-1.7250
150	D	A	-1.2724
151	A	A	0.0000
152	P	A	-1.2938
153	A	A	-1.1647
154	V	A	0.0000
155	I	A	0.0000
156	E	A	-2.0917
157	K	A	-1.9101
158	T	A	0.0000
159	I	A	-2.0836
160	E	A	-3.0698
161	T	A	0.0000
162	V	A	0.0000
163	K	A	-3.1893
164	E	A	-3.2955
165	L	A	0.0000
166	R	A	-3.1825
167	E	A	-3.5827
168	K	A	-3.5304
169	G	A	-2.3698
170	I	A	-1.7542
171	T	A	-1.3542
172	G	A	-1.1342
173	Q	A	0.0000
174	H	A	-0.5592
175	I	A	0.0000
176	I	A	0.4324
177	I	A	0.0000
178	V	A	0.1124
179	I	A	0.0000
180	T	A	-0.7903
181	C	A	-1.1268
182	E	A	-2.4082
183	L	A	0.0000
184	T	A	-2.4308
185	E	A	-3.3210
186	E	A	-2.9087
187	Q	A	-2.4813
188	L	A	0.0000
189	Q	A	-2.5713
190	L	A	-2.2404
191	L	A	0.0000
192	R	A	-3.2271
193	E	A	-3.1328
194	L	A	0.0000
195	I	A	0.0000
196	E	A	-3.3220
197	E	A	0.0000
198	A	A	-2.1193
199	K	A	-2.5698
200	K	A	-2.9942
201	A	A	0.0000
202	L	A	-2.1680
203	E	A	-2.8088
204	A	A	-2.0336
205	S	A	-1.7151
206	G	A	-1.8851
207	K	A	-2.2024
208	G	A	-1.4106
209	N	A	-0.9116
210	S	A	0.0000
211	V	A	0.0000
212	L	A	-0.0981
213	V	A	0.0000
214	I	A	-0.2702
215	C	A	0.0000
216	E	A	-2.2418
217	G	A	-1.8235
218	P	A	-1.8948
219	S	A	0.0000
220	K	A	-2.8792
221	G	A	-2.3467
222	A	A	0.0000
223	K	A	-3.8652
224	E	A	-3.9680
225	L	A	0.0000
226	N	A	-3.0557
227	E	A	-4.0447
228	E	A	-3.7775
229	S	A	0.0000
230	A	A	-2.1234
231	K	A	-2.7324
232	M	A	0.0000
233	A	A	0.0000
234	Q	A	-1.4237
235	L	A	-0.7704
236	G	A	0.0000
237	S	A	-1.2779
238	G	A	-1.5465
239	P	A	-1.4858
240	D	A	-2.2789
241	S	A	-1.7355
242	G	A	-1.5804
243	S	A	-1.1726
244	G	A	-0.8391
245	S	A	-0.7830
246	G	A	-0.7332