Project name: bc5a312de58cadb

Chain sequence(s)	A: GREEEILERARELRERAEEAIRFLDENADEPWAAGPLGQMLRDIAEAIIRIAEAVELLLEPPTEERVERALELIAEAWALALAAILELLLVKKVEVKRKQNGDDSPPTQEEIEAAREEAEKMREEFEKLLEEVKKEGPLTEVEHVLKLLEKFLKYLDKIIELAEELASIDPDNELAKNILEAAKKLKELFEKLIEELKKSPEWLLVLAETVLEAAETLYDLIVKPALEAYKA
Selected Chain(s)	A
Distance of aggregation	5 Å
FoldX usage	No
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]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:00)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:00)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:02)

• Minimal score value: -2.4487
• Maximal score value: 0.6932
• Average score: -0.5749
• Total score value: -133.3836

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	G	A	-0.6395
2	R	A	-1.3152
3	E	A	-2.1107
4	E	A	-2.4487
5	E	A	-2.1553
6	I	A	0.0000
7	L	A	0.1108
8	E	A	-1.8270
9	R	A	-0.8141
10	A	A	0.0000
11	R	A	-2.2246
12	E	A	-2.1205
13	L	A	0.0000
14	R	A	-1.0487
15	E	A	-2.0269
16	R	A	-0.9357
17	A	A	0.0000
18	E	A	-0.9574
19	E	A	-1.9345
20	A	A	0.0000
21	I	A	-0.0665
22	R	A	-1.6987
23	F	A	-0.1133
24	L	A	0.0000
25	D	A	-1.8146
26	E	A	-2.1341
27	N	A	-0.5408
28	A	A	-0.4828
29	D	A	-1.9178
30	E	A	-1.1249
31	P	A	-0.3603
32	W	A	0.1260
33	A	A	0.0478
34	A	A	0.0375
35	G	A	-0.1173
36	P	A	-0.0362
37	L	A	0.1805
38	G	A	0.0000
39	Q	A	-0.7558
40	M	A	0.0000
41	L	A	0.0000
42	R	A	-0.4060
43	D	A	-0.3462
44	I	A	0.0000
45	A	A	0.0000
46	E	A	-0.5071
47	A	A	0.0000
48	I	A	0.0000
49	I	A	0.0075
50	R	A	-1.0042
51	I	A	0.0000
52	A	A	0.0000
53	E	A	-0.9245
54	A	A	0.0000
55	V	A	0.0000
56	E	A	-0.2287
57	L	A	0.1995
58	L	A	0.0000
59	L	A	0.0411
60	E	A	-1.1219
61	P	A	-0.5059
62	P	A	-0.3089
63	T	A	-0.4225
64	E	A	-2.1404
65	E	A	-2.2210
66	R	A	-1.2774
67	V	A	0.0000
68	E	A	0.0000
69	R	A	-0.7806
70	A	A	0.0000
71	L	A	0.0000
72	E	A	-0.2131
73	L	A	0.6932
74	I	A	0.0000
75	A	A	0.0000
76	E	A	-0.8287
77	A	A	0.0000
78	W	A	0.0000
79	A	A	0.0000
80	L	A	0.0000
81	A	A	0.0000
82	L	A	0.0000
83	A	A	0.0000
84	A	A	0.0000
85	I	A	0.0000
86	L	A	0.0000
87	E	A	0.0000
88	L	A	0.0000
89	L	A	0.0000
90	L	A	0.1809
91	V	A	0.0000
92	K	A	-0.2969
93	K	A	-0.3648
94	V	A	0.2666
95	E	A	-0.1930
96	V	A	-0.0643
97	K	A	-1.0364
98	R	A	-0.6550
99	K	A	-0.9894
100	Q	A	-1.5620
101	N	A	-1.5478
102	G	A	-0.8346
103	D	A	-2.1503
104	D	A	-2.1386
105	S	A	-0.4944
106	P	A	-0.2774
107	P	A	0.0000
108	T	A	-0.2701
109	Q	A	-1.5154
110	E	A	-2.1410
111	E	A	-0.8408
112	I	A	-0.1222
113	E	A	-0.8720
114	A	A	-0.0961
115	A	A	0.0000
116	R	A	-1.4420
117	E	A	-2.2389
118	E	A	-1.1758
119	A	A	0.0000
120	E	A	-1.2670
121	K	A	-1.8316
122	M	A	0.0000
123	R	A	-0.6902
124	E	A	-1.4262
125	E	A	-1.0916
126	F	A	0.0000
127	E	A	-0.6847
128	K	A	-1.7294
129	L	A	-0.1019
130	L	A	0.0000
131	E	A	-2.1533
132	E	A	-2.1533
133	V	A	0.0000
134	K	A	-1.4860
135	K	A	-2.2485
136	E	A	-2.1421
137	G	A	-0.4142
138	P	A	-0.1128
139	L	A	0.0000
140	T	A	-0.1960
141	E	A	-0.9189
142	V	A	-0.1128
143	E	A	-1.6911
144	H	A	0.0000
145	V	A	0.0000
146	L	A	0.0448
147	K	A	-0.6152
148	L	A	0.0000
149	L	A	0.0000
150	E	A	-1.3745
151	K	A	-0.7131
152	F	A	0.0000
153	L	A	-0.2794
154	K	A	-1.6981
155	Y	A	0.0000
156	L	A	0.0000
157	D	A	-0.7189
158	K	A	-0.7954
159	I	A	0.0000
160	I	A	-0.0948
161	E	A	-1.7464
162	L	A	-0.1797
163	A	A	0.0000
164	E	A	-1.3085
165	E	A	-0.9650
166	L	A	0.0000
167	A	A	-0.0561
168	S	A	-0.2021
169	I	A	0.3352
170	D	A	-0.3898
171	P	A	-0.6588
172	D	A	-1.8607
173	N	A	-0.7977
174	E	A	-1.8092
175	L	A	-0.1392
176	A	A	0.0000
177	K	A	-0.9069
178	N	A	-0.4634
179	I	A	0.0000
180	L	A	-0.1179
181	E	A	-1.5410
182	A	A	0.0000
183	A	A	0.0000
184	K	A	-1.2358
185	K	A	-0.7695
186	L	A	0.0000
187	K	A	-0.7958
188	E	A	-1.9046
189	L	A	0.0000
190	F	A	0.0000
191	E	A	-1.4575
192	K	A	-1.9107
193	L	A	0.0000
194	I	A	-0.0831
195	E	A	-1.8551
196	E	A	-0.7774
197	L	A	0.0000
198	K	A	-2.0109
199	K	A	-2.0166
200	S	A	-0.3876
201	P	A	-0.5717
202	E	A	-1.7313
203	W	A	-0.1180
204	L	A	0.3126
205	L	A	0.2331
206	V	A	0.2279
207	L	A	0.0000
208	A	A	0.0000
209	E	A	-0.4710
210	T	A	-0.0948
211	V	A	0.0000
212	L	A	0.0000
213	E	A	-0.7800
214	A	A	0.0000
215	A	A	0.0000
216	E	A	-0.3616
217	T	A	-0.0591
218	L	A	0.0000
219	Y	A	0.0000
220	D	A	-1.3108
221	L	A	0.2203
222	I	A	0.0000
223	V	A	0.0000
224	K	A	-0.6202
225	P	A	-0.1701
226	A	A	-0.0043
227	L	A	0.0000
228	E	A	-1.2077
229	A	A	-0.0824
230	Y	A	0.1600
231	K	A	-1.6055
232	A	A	-0.2542