Project name: f56c52dbc271a3e

Chain sequence(s)	A: YPQSIDWRAKGAVTPVKNQGACGSCWAFSTIATVEGINKIVTGNLLELSEQELVDCDKHSYGCKGGYQTTSLQYVANNGVHTSKVYPYQAKQYKCRATDKPGPKVKITGYKRVPSNCETSFLGALANQPLSVLVEAGGKPFQLYKSGVFDGPCGTKLDHAVTAVGYGTSDGKNYIIIKNSWGPNWGEKGYMRLKRQSGNSQGTCGVYKSSYYPFKGFA
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                                          (00:02:01)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:02)

• Minimal score value: -2.5836
• Maximal score value: 1.692
• Average score: -0.6147
• Total score value: -133.9947

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	Y	A	0.7082
2	P	A	-0.1847
3	Q	A	-1.1253
4	S	A	-0.7219
5	I	A	0.0000
6	D	A	-1.0626
7	W	A	0.0000
8	R	A	-1.4784
9	A	A	-1.3205
10	K	A	-2.0206
11	G	A	-1.3323
12	A	A	0.0000
13	V	A	-0.5169
14	T	A	0.0000
15	P	A	-0.6216
16	V	A	-0.7989
17	K	A	-0.9608
18	N	A	-1.5704
19	Q	A	0.0000
20	G	A	-1.1070
21	A	A	-0.5672
22	C	A	0.0000
23	G	A	-0.8391
24	S	A	0.0000
25	C	A	-0.4278
26	W	A	0.0000
27	A	A	0.0000
28	F	A	0.0000
29	S	A	0.0000
30	T	A	0.0000
31	I	A	0.0000
32	A	A	-0.1194
33	T	A	0.0000
34	V	A	0.0000
35	E	A	0.0000
36	G	A	0.0000
37	I	A	0.0000
38	N	A	0.0000
39	K	A	-0.3113
40	I	A	0.3560
41	V	A	1.1652
42	T	A	0.1590
43	G	A	-0.6206
44	N	A	-1.1413
45	L	A	-0.1718
46	L	A	-0.5032
47	E	A	-1.0547
48	L	A	0.0000
49	S	A	0.0000
50	E	A	0.0000
51	Q	A	0.0000
52	E	A	0.0000
53	L	A	0.0000
54	V	A	0.0000
55	D	A	0.0000
56	C	A	0.0000
57	D	A	0.0000
58	K	A	-1.9482
59	H	A	-1.4811
60	S	A	0.0000
61	Y	A	-0.1740
62	G	A	0.0000
63	C	A	-1.1268
64	K	A	-1.6309
65	G	A	-0.7175
66	G	A	-0.2375
67	Y	A	0.5502
68	Q	A	0.0000
69	T	A	-0.3327
70	T	A	-0.4843
71	S	A	0.0000
72	L	A	0.0000
73	Q	A	-0.8595
74	Y	A	-1.1888
75	V	A	0.0000
76	A	A	0.0000
77	N	A	-1.8294
78	N	A	-1.7595
79	G	A	0.0000
80	V	A	0.0000
81	H	A	0.0000
82	T	A	-1.2719
83	S	A	-0.9802
84	K	A	-1.7654
85	V	A	-0.8351
86	Y	A	0.0000
87	P	A	-0.6953
88	Y	A	-0.9055
89	Q	A	-1.2976
90	A	A	-1.4440
91	K	A	-2.2577
92	Q	A	-1.6242
93	Y	A	-1.1209
94	K	A	-1.5771
95	C	A	-1.1963
96	R	A	-1.3644
97	A	A	-1.3390
98	T	A	-1.2382
99	D	A	-2.2164
100	K	A	-1.8592
101	P	A	-1.3711
102	G	A	-1.3551
103	P	A	-1.4668
104	K	A	-2.2961
105	V	A	0.0000
106	K	A	-1.1565
107	I	A	0.0000
108	T	A	-0.0096
109	G	A	-0.3775
110	Y	A	-0.4696
111	K	A	-1.6908
112	R	A	-2.0010
113	V	A	0.0000
114	P	A	-0.9608
115	S	A	-1.0967
116	N	A	-1.4734
117	C	A	-1.1446
118	E	A	-0.9888
119	T	A	-0.3704
120	S	A	-0.4409
121	F	A	0.0000
122	L	A	0.0000
123	G	A	-0.1274
124	A	A	-0.4664
125	L	A	0.0000
126	A	A	-0.5271
127	N	A	-0.9872
128	Q	A	0.0000
129	P	A	0.0000
130	L	A	0.0000
131	S	A	0.0000
132	V	A	0.0000
133	L	A	-0.2317
134	V	A	0.0000
135	E	A	0.0000
136	A	A	0.0000
137	G	A	-1.6550
138	G	A	-1.3891
139	K	A	-1.7525
140	P	A	-1.1638
141	F	A	0.0000
142	Q	A	-0.8662
143	L	A	0.1554
144	Y	A	0.0000
145	K	A	-2.0479
146	S	A	-1.3158
147	G	A	-1.0457
148	V	A	-1.1442
149	F	A	0.0000
150	D	A	-2.0311
151	G	A	-1.3509
152	P	A	-1.0072
153	C	A	-1.0272
154	G	A	-0.8452
155	T	A	-1.2363
156	K	A	-2.0535
157	L	A	-1.3628
158	D	A	-2.0600
159	H	A	0.0000
160	A	A	0.0000
161	V	A	0.0000
162	T	A	0.0000
163	A	A	0.0000
164	V	A	0.0000
165	G	A	0.0000
166	Y	A	0.0000
167	G	A	0.0000
168	T	A	-1.3109
169	S	A	-1.4983
170	D	A	-2.3604
171	G	A	-1.8396
172	K	A	-1.8770
173	N	A	-1.6041
174	Y	A	-0.8939
175	I	A	0.0000
176	I	A	0.0000
177	I	A	0.0000
178	K	A	0.0000
179	N	A	0.0000
180	S	A	0.0000
181	W	A	-0.9416
182	G	A	0.0000
183	P	A	-1.7758
184	N	A	-2.2519
185	W	A	0.0000
186	G	A	-1.8067
187	E	A	-2.1081
188	K	A	-2.5836
189	G	A	0.0000
190	Y	A	0.0000
191	M	A	0.0000
192	R	A	-0.7540
193	L	A	0.0000
194	K	A	-1.3802
195	R	A	0.0000
196	Q	A	-1.5136
197	S	A	-1.1497
198	G	A	-1.2559
199	N	A	-1.8264
200	S	A	-1.5121
201	Q	A	-1.6172
202	G	A	0.0000
203	T	A	0.0000
204	C	A	0.0000
205	G	A	0.0000
206	V	A	0.0000
207	Y	A	0.0000
208	K	A	-0.7478
209	S	A	-0.5311
210	S	A	0.0000
211	Y	A	-0.6658
212	Y	A	-0.3686
213	P	A	0.0000
214	F	A	0.8586
215	K	A	0.7530
216	G	A	0.6151
217	F	A	1.6920
218	A	A	0.8677