Project name: HV1

Chain sequence(s)	H: IVEGQDAEVGLSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTVDDLLVRIGKHSRTRYERKVEKISMLDKIYIHPRYNWKENLDRDIALLKLKRPIELSDYIHPVCLPDKQTAAKLLHAGFKGRVTGWGNRRETWTTSVAEVQPSVLQVVNLPLVERPVCKASTRIRITDNMFCAGYKPGEGKRGDACEGDSGGPFVMKSPYNNRWYQMGIVSWGEGCDRDGKYGFYTHVFRLKKWIQKVIDRLGS
Selected Chain(s)	H
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with H chain(s) selected             (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:09:23)
[INFO]       Main:     Simulation completed successfully.                                          (00:09:26)

• Minimal score value: -3.3362
• Maximal score value: 0.7926
• Average score: -0.8805
• Total score value: -228.0407

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	I	H	0.0000
2	V	H	0.0000
3	E	H	-2.8506
4	G	H	-2.1997
5	Q	H	-2.8123
6	D	H	-2.6866
7	A	H	0.0000
8	E	H	-1.4697
9	V	H	0.4897
10	G	H	-0.2244
11	L	H	-0.2269
12	S	H	0.0000
13	P	H	-0.3270
14	W	H	0.0000
15	Q	H	0.0000
16	V	H	0.0000
17	M	H	0.0000
18	L	H	0.0000
19	F	H	-0.7748
20	R	H	-1.7317
21	K	H	-2.0761
22A	S	H	-1.7746
23	P	H	-1.8205
24	Q	H	-2.5047
25	E	H	-2.5806
26	L	H	-0.9634
27	L	H	-0.5481
28	C	H	0.0000
29	G	H	0.0000
30	A	H	0.0000
31	S	H	0.0000
32	L	H	0.0000
33	I	H	-0.0774
34	S	H	-0.4977
35	D	H	-1.3432
36	R	H	-2.0257
37	W	H	0.0000
38	V	H	0.0000
39	L	H	0.0000
40	T	H	0.0000
41	A	H	0.0000
42	A	H	0.0000
43	H	H	0.0441
44	C	H	0.0000
45	L	H	0.0000
46	L	H	-0.3837
47A	Y	H	-0.4793
48B	P	H	-0.9062
49C	P	H	-0.5796
50D	W	H	-0.0516
51E	D	H	-1.7206
52F	K	H	-1.4289
53G	N	H	-1.5790
54H	F	H	-0.9106
55I	T	H	-0.8359
56	V	H	-0.9335
57	D	H	-1.8185
58	D	H	-1.4738
59	L	H	0.0000
60	L	H	-0.0385
61	V	H	0.0000
62	R	H	0.0155
63	I	H	0.0000
64	G	H	0.0000
65	K	H	0.0000
66	H	H	-0.3816
67	S	H	0.0000
68	R	H	-0.9925
69	T	H	-1.2592
70	R	H	-1.8254
71	Y	H	-0.9444
72	E	H	0.0000
73A	R	H	-2.7048
74	K	H	-2.5244
75	V	H	-1.4544
76	E	H	0.0000
77	K	H	-1.1636
78	I	H	0.1994
79	S	H	0.0000
80	M	H	-0.3613
81	L	H	0.0000
82	D	H	-1.7787
83	K	H	-1.0485
84	I	H	0.2024
85	Y	H	0.5649
86	I	H	0.2214
87	H	H	-0.7098
88	P	H	-1.1365
89	R	H	-2.0800
90	Y	H	0.0000
91	N	H	-1.7693
92	W	H	-1.3980
93	K	H	-2.4918
94A	E	H	-2.7951
95	N	H	0.0000
96	L	H	-1.0672
97	D	H	0.0000
98	R	H	-1.3818
99	D	H	0.0000
100	I	H	0.0000
101	A	H	0.0000
102	L	H	0.0000
103	L	H	0.0000
104	K	H	-1.4375
105	L	H	0.0000
106	K	H	-2.4314
107	R	H	-2.1807
108	P	H	-1.8179
109	I	H	0.0000
110	E	H	-1.9896
111	L	H	-0.8844
112	S	H	-1.2373
113	D	H	-1.4999
114	Y	H	-0.4262
115	I	H	0.0000
116	H	H	-1.3350
117	P	H	-0.3526
118	V	H	0.0000
119	C	H	-0.3104
120	L	H	-0.0537
121	P	H	0.0000
122	D	H	-2.4753
123	K	H	-3.0098
124	Q	H	-2.7268
125	T	H	0.0000
126	A	H	0.0000
127A	A	H	-1.7804
128B	K	H	-2.2348
129C	L	H	0.0000
130	L	H	-0.5264
131	H	H	-1.3108
132	A	H	-0.9872
133	G	H	-0.6853
134	F	H	-0.2932
135	K	H	-1.4891
136	G	H	0.0000
137	R	H	-0.9059
138	V	H	0.0000
139	T	H	0.0000
140	G	H	0.0000
141	W	H	0.0000
142	G	H	0.0000
143	N	H	0.0000
144	R	H	-3.2511
145	R	H	-3.1896
146	E	H	-1.6040
147	T	H	-0.5020
148	W	H	0.7926
149	T	H	0.4271
150A	T	H	0.3833
151B	S	H	-0.1081
152C	V	H	0.6224
153D	A	H	-0.8433
154E	E	H	-2.0540
155	V	H	0.0000
156	Q	H	-2.3017
157	P	H	-1.5047
158	S	H	-0.9326
159	V	H	-0.9121
160	L	H	0.0000
161	Q	H	0.0000
162	V	H	0.0000
163	V	H	0.0000
164	N	H	-1.3019
165	L	H	0.0000
166	P	H	0.0000
167	L	H	0.0000
168	V	H	-1.0959
169	E	H	-2.2618
170	R	H	-1.9400
171	P	H	-1.2961
172	V	H	-0.9917
173	C	H	0.0000
174	K	H	-2.2902
175	A	H	-0.9717
176	S	H	-1.1100
177	T	H	-1.6223
178	R	H	-2.4130
179	I	H	-1.9614
180	R	H	-2.5631
181	I	H	-1.6978
182	T	H	-1.2508
183	D	H	-1.8513
184	N	H	0.0000
185	M	H	0.0000
186	F	H	-0.4228
187	C	H	0.0000
188	A	H	0.0000
189	G	H	0.0000
190A	Y	H	-2.2276
191	K	H	-2.4560
192	P	H	-2.6465
193A	G	H	-2.5347
194B	E	H	-3.2745
195C	G	H	-2.7149
196D	K	H	-3.3362
197	R	H	-3.2346
198	G	H	0.0000
199	D	H	0.0000
200	A	H	-0.9975
201	C	H	-1.7830
202	E	H	-2.4224
203	G	H	-0.9119
204	D	H	0.0000
205	S	H	-0.4633
206	G	H	0.0000
207	G	H	0.0000
208	P	H	0.0000
209	F	H	0.0000
210	V	H	0.0000
211	M	H	0.0000
212	K	H	-2.0859
213	S	H	0.0000
214	P	H	-0.6958
215A	Y	H	-0.0479
216B	N	H	-1.1211
217	N	H	-2.3235
218	R	H	-2.5422
219	W	H	-1.3725
220	Y	H	0.0000
221	Q	H	0.0000
222	M	H	0.0000
223	G	H	0.0000
224	I	H	0.0000
225	V	H	0.0000
226	S	H	0.0000
227	W	H	-0.4142
228	G	H	-1.1306
229	E	H	-1.2663
230	G	H	-1.5822
231	C	H	-1.7404
232	D	H	-2.1260
233A	R	H	-2.5475
234	D	H	-2.8729
235	G	H	-1.8243
236	K	H	-1.7452
237	Y	H	0.0000
238	G	H	0.0000
239	F	H	0.0000
240	Y	H	0.0000
241	T	H	0.0000
242	H	H	-0.9012
243	V	H	0.0000
244	F	H	-1.3639
245	R	H	-2.4561
246	L	H	0.0000
247	K	H	-2.1777
248	K	H	-2.8485
249	W	H	0.0000
250	I	H	0.0000
251	Q	H	-2.5160
252	K	H	-2.7120
253	V	H	0.0000
254	I	H	-0.7274
255	D	H	-1.6356
256	R	H	-1.9309
257	L	H	0.1457
258	G	H	-0.8836
259	S	H	-1.0044