Project name: c5f65b8ff5e19ef

Chain sequence(s)	A: TTFKIVNRCRHTVWPGILTGADRPLLNPTGFTLTPGKSRTLRVPVAWSGRLWGRTDCSTDSTGKLTCLTADCGSGKVQCEGRGAEPPATLAEFTLNGDQGLDFYDVSLVDGYNLPMLVIPRDGKSGACSSTGCLVDLNGACPTALRVARAGSSRSVVACKSACEAFGDPRYCCSEAYNTPETCPPTEYSSYFKHVCPRSYSYAYDDKTSTFTCVGADYMIIFCPLPH
Selected Chain(s)	A
Distance of aggregation	10 Å
FoldX usage	No
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       runJob:   FoldX not utilized. Treating input pdb file as it was already optimized.    (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:00:02)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:03)

• Minimal score value: -2.7949
• Maximal score value: 1.1021
• Average score: -0.7595
• Total score value: -172.4162

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	T	A	-0.3220
3	T	A	-0.8453
4	F	A	0.0000
5	K	A	-1.0377
6	I	A	0.0000
7	V	A	0.0000
8	N	A	0.0000
9	R	A	-2.5722
10	C	A	0.0000
11	R	A	-2.6705
12	H	A	-2.0765
13	T	A	-1.4328
14	V	A	0.0000
15	W	A	-0.0411
16	P	A	0.0000
17	G	A	0.0000
18	I	A	0.0000
19	L	A	-0.4882
20	T	A	0.0000
21	G	A	-0.6972
22	A	A	-1.0620
23	D	A	-2.1741
24	R	A	-1.7229
25	P	A	-0.6087
26	L	A	0.3020
27	L	A	0.0000
28	N	A	-1.3365
29	P	A	-0.7689
30	T	A	0.0000
31	G	A	0.0000
32	F	A	0.0000
33	T	A	-0.2177
34	L	A	0.0000
35	T	A	-1.3602
36	P	A	-2.1818
37	G	A	-2.3845
38	K	A	-2.6336
39	S	A	-2.0135
40	R	A	-1.7820
41	T	A	-1.2302
42	L	A	-1.4379
43	R	A	-1.8811
44	V	A	0.0000
45	P	A	0.1387
46	V	A	1.0417
47	A	A	0.2121
48	W	A	0.0000
49	S	A	-0.1830
50	G	A	-0.3475
51	R	A	-0.6267
52	L	A	0.0000
53	W	A	0.0000
54	G	A	0.0000
55	R	A	0.0000
56	T	A	0.0000
57	D	A	-1.6466
58	C	A	-0.7813
59	S	A	-1.2416
60	T	A	-1.6801
61	D	A	-2.4033
62	S	A	-1.4683
63	T	A	-1.4331
64	G	A	-2.0840
65	K	A	-2.7247
66	L	A	-1.7809
67	T	A	-1.1947
68	C	A	-0.6363
69	L	A	-0.4775
70	T	A	0.0000
71	A	A	0.0000
72	D	A	-1.2461
73	C	A	0.0000
74	G	A	-1.7675
75	S	A	-1.7320
76	G	A	-1.9158
77	K	A	-2.3387
78	V	A	-0.9435
79	Q	A	-1.6251
80	C	A	0.0000
81	E	A	-2.2575
82	G	A	-1.3220
83	R	A	-2.2757
84	G	A	-1.5543
85	A	A	-1.4786
86	E	A	-2.1947
87	P	A	-1.3441
88	P	A	0.0000
89	A	A	0.0000
90	T	A	0.0000
91	L	A	0.0000
92	A	A	0.0000
93	E	A	-0.6658
94	F	A	0.0000
95	T	A	-0.3670
96	L	A	0.0000
97	N	A	-1.3782
98	G	A	-1.5439
99	D	A	-2.6169
100	Q	A	-2.2661
101	G	A	-1.4941
102	L	A	-1.0714
103	D	A	0.0000
104	F	A	0.0432
105	Y	A	0.0000
106	D	A	-0.4286
107	V	A	0.0000
108	S	A	0.0000
109	L	A	0.0000
110	V	A	0.3224
111	D	A	-0.5944
112	G	A	0.0000
113	Y	A	0.0000
114	N	A	0.0000
115	L	A	0.0000
116	P	A	0.0000
117	M	A	0.0000
118	L	A	0.6994
119	V	A	0.0000
120	I	A	0.4812
121	P	A	-0.5423
122	R	A	-1.8954
123	D	A	-2.7949
124	G	A	-2.2284
125	K	A	-2.3465
126	S	A	-1.1224
127	G	A	-0.3186
128	A	A	-0.2224
129	C	A	-0.4240
130	S	A	-0.0947
131	S	A	0.0307
132	T	A	0.0000
133	G	A	0.0000
134	C	A	0.0000
135	L	A	0.9801
136	V	A	0.5955
137	D	A	-1.1306
138	L	A	0.0000
139	N	A	-0.7818
140	G	A	-0.9222
141	A	A	-0.4412
142	C	A	0.0000
143	P	A	-0.3862
144	T	A	-0.3270
145	A	A	-0.1633
146	L	A	0.0000
147	R	A	-1.1793
148	V	A	-0.7190
149	A	A	-1.4410
150	R	A	-2.4372
151	A	A	-1.9223
152	G	A	-1.7571
153	S	A	-1.3993
154	S	A	-1.6726
155	R	A	-2.7319
156	S	A	-1.7811
157	V	A	-0.9262
158	V	A	-0.6897
159	A	A	0.0000
160	C	A	0.0000
161	K	A	-0.8634
162	S	A	0.0000
163	A	A	0.0000
164	C	A	-0.4041
165	E	A	-0.8317
166	A	A	-0.2363
167	F	A	0.3397
168	G	A	-0.6455
169	D	A	-1.3686
170	P	A	-1.6348
171	R	A	-2.0265
172	Y	A	-0.5544
173	C	A	-0.7890
174	C	A	0.0000
175	S	A	-1.7950
176	E	A	-2.4666
177	A	A	-1.3669
178	Y	A	-1.8328
179	N	A	-2.2271
180	T	A	-1.4774
181	P	A	-1.5251
182	E	A	-2.1113
183	T	A	-1.6507
184	C	A	0.0000
185	P	A	-0.9098
186	P	A	-0.8630
187	T	A	-1.1319
188	E	A	-1.7871
189	Y	A	-0.7178
190	S	A	0.0000
191	S	A	-0.9286
192	Y	A	-0.5604
193	F	A	0.0000
194	K	A	-0.9922
195	H	A	-1.0153
196	V	A	-0.1052
197	C	A	0.0000
198	P	A	-0.8954
199	R	A	-1.3197
200	S	A	0.0000
201	Y	A	-0.5444
202	S	A	0.0000
203	Y	A	0.2233
204	A	A	-0.0456
205	Y	A	-0.8357
206	D	A	-1.2232
207	D	A	-2.0507
208	K	A	-2.4048
209	T	A	-1.5930
210	S	A	0.0000
211	T	A	-0.8873
212	F	A	-0.1920
213	T	A	0.1501
214	C	A	0.0000
215	V	A	-1.0264
216	G	A	-1.2736
217	A	A	0.0000
218	D	A	-1.3342
219	Y	A	0.0000
220	M	A	0.0931
221	I	A	0.0000
222	I	A	0.2375
223	F	A	0.0000
224	C	A	-0.4654
225	P	A	0.0000
226	L	A	1.1021
227	P	A	0.6207
228	H	A	-0.2105