Project name: f021298c66a0281

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGFTFNSYWINWVRQAPGKGLEWVSGIAYDSSNTLYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCARGLGAFHWDMQPDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEP; L: SYELTQPPSVSVAPGQTARISCSGDNIGGTFVSWYQQKPGQAPVLVIYDDNDRPSGIPERFSGSNSGNTATLTISGTQAEDEADYYCGTWDMVTNNVFGGGTKLTVLGQPKAAPSVTLFPPSSEELQANKATLVCLISDFYPGAVTVAWKADSSPVKAGVETTTPSKQSNNKYAASSYLSLTPEQWKSHRSYSCQVTHEGSTVEKTVAPT
Selected Chain(s)	H,L
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[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 all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:04:50)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:54)

• Minimal score value: -3.3137
• Maximal score value: 2.1853
• Average score: -0.6736
• Total score value: -291.006

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	Q	H	-1.4938
2	V	H	-0.8162
3	Q	H	-0.9426
4	L	H	0.0000
5	V	H	0.8170
6	E	H	0.0000
7	S	H	-0.2706
8	G	H	-0.6473
9	G	H	0.0441
10	G	H	0.5150
11	L	H	1.0067
12	V	H	-0.1442
13	Q	H	-1.3742
14	P	H	-1.6318
15	G	H	-1.3783
16	G	H	-1.1149
17	S	H	-1.2641
18	L	H	-1.0747
19	R	H	-2.1296
20	L	H	0.0000
21	S	H	-0.4142
22	C	H	0.0000
23	A	H	-0.1867
24	A	H	0.0000
25	S	H	-0.9272
26	G	H	-1.0429
27	F	H	-0.5619
28	T	H	-0.5596
29	F	H	0.0000
30	N	H	-1.9340
31	S	H	-0.6448
32	Y	H	-0.0291
33	W	H	0.0000
34	I	H	0.0000
35	N	H	0.0000
36	W	H	0.0000
37	V	H	0.0000
38	R	H	0.0000
39	Q	H	-0.6468
40	A	H	-1.0371
41	P	H	-0.8521
42	G	H	-1.5058
43	K	H	-2.2634
44	G	H	-1.4526
45	L	H	0.0000
46	E	H	-0.9155
47	W	H	0.0000
48	V	H	0.0000
49	S	H	0.0000
50	G	H	0.0000
51	I	H	0.0000
52	A	H	0.0000
53	Y	H	-0.6816
54	D	H	-1.5181
55	S	H	-1.2800
56	S	H	-0.9659
57	N	H	-1.0813
58	T	H	-0.3033
59	L	H	-0.3075
60	Y	H	-0.7688
61	A	H	-1.3417
62	D	H	-2.4022
63	S	H	-1.7277
64	V	H	0.0000
65	K	H	-2.5281
66	G	H	-1.7408
67	R	H	-1.2855
68	F	H	0.0000
69	T	H	-0.8223
70	I	H	0.0000
71	S	H	-0.4244
72	R	H	-1.2093
73	D	H	-1.7343
74	N	H	-2.1731
75	S	H	-1.8068
76	K	H	-2.5188
77	N	H	-1.9712
78	T	H	-1.1346
79	L	H	0.0000
80	Y	H	-0.5207
81	L	H	0.0000
82	Q	H	-1.2937
83	M	H	0.0000
84	N	H	-1.4985
85	S	H	-1.2761
86	L	H	0.0000
87	R	H	-2.2926
88	A	H	-1.7523
89	E	H	-2.2147
90	D	H	0.0000
91	T	H	-0.4524
92	A	H	0.0000
93	V	H	0.6299
94	Y	H	0.0000
95	Y	H	0.0000
96	C	H	0.0000
97	A	H	0.0000
98	R	H	0.0000
99	G	H	0.0000
100	L	H	0.5145
101	G	H	0.4490
102	A	H	0.3717
103	F	H	0.8765
104	H	H	0.7193
105	W	H	1.5508
106	D	H	0.6929
107	M	H	0.0000
108	Q	H	0.0000
109	P	H	0.0000
110	D	H	0.6787
111	Y	H	1.0978
112	W	H	0.4508
113	G	H	0.0000
114	Q	H	-1.1433
115	G	H	0.0000
116	T	H	0.4769
117	L	H	1.3310
118	V	H	0.0000
119	T	H	0.2001
120	V	H	0.0000
121	S	H	-0.8277
122	S	H	-0.7901
123	A	H	-0.5386
124	S	H	-0.6196
125	T	H	-0.6452
126	K	H	-1.0512
127	G	H	-1.3518
128	P	H	0.0000
129	S	H	-0.2193
130	V	H	0.0000
131	F	H	0.0000
132	P	H	-1.0069
133	L	H	0.0000
134	A	H	-0.8771
135	P	H	0.0000
136	S	H	-0.9975
137	S	H	-1.2328
138	K	H	-2.0758
139	S	H	-1.3028
140	T	H	-1.0124
141	S	H	-0.8355
142	G	H	-0.8141
143	G	H	-0.8535
144	T	H	-0.7020
145	A	H	-0.7031
146	A	H	-0.3863
147	L	H	0.0000
148	G	H	0.0000
149	C	H	0.0000
150	L	H	0.0000
151	V	H	0.0000
152	K	H	0.0000
153	D	H	-0.3162
154	Y	H	0.0000
155	F	H	0.0000
156	P	H	-0.6452
157	E	H	-0.7985
158	P	H	-0.9504
159	V	H	-0.8577
160	T	H	-0.7513
161	V	H	-0.4683
162	S	H	-0.4089
163	W	H	0.0000
164	N	H	-0.7526
165	S	H	-0.6507
166	G	H	-0.4749
167	A	H	-0.1921
168	L	H	0.0674
169	T	H	-0.1529
170	S	H	-0.2215
171	G	H	-0.2524
172	V	H	0.1945
173	H	H	-0.1335
174	T	H	-0.0193
175	F	H	0.0000
176	P	H	-0.0365
177	A	H	0.2192
178	V	H	0.0000
179	L	H	1.1448
180	Q	H	0.2878
181	S	H	-0.1088
182	S	H	-0.1716
183	G	H	0.0602
184	L	H	0.0786
185	Y	H	0.3289
186	S	H	0.0000
187	L	H	0.0000
188	S	H	0.0000
189	S	H	0.0000
190	V	H	0.1501
191	V	H	0.0000
192	T	H	-0.1588
193	V	H	0.0000
194	P	H	-0.5804
195	S	H	-0.5641
196	S	H	-0.6682
197	S	H	-0.6414
198	L	H	-0.7931
199	G	H	-1.1830
200	T	H	-0.7941
201	Q	H	-1.4853
202	T	H	-1.1759
203	Y	H	0.0000
204	I	H	-1.0619
205	C	H	0.0000
206	N	H	-1.5941
207	V	H	0.0000
208	N	H	-2.3026
209	H	H	0.0000
210	K	H	-2.8540
211	P	H	-1.7324
212	S	H	-1.8412
213	N	H	-2.6249
214	T	H	-2.1810
215	K	H	-2.8096
216	V	H	-1.5740
217	D	H	-2.5501
218	K	H	-1.9098
219	K	H	-2.2709
220	V	H	0.0000
221	E	H	-2.4582
222	P	H	-1.2048
1	S	L	-0.3925
2	Y	L	-0.9805
3	E	L	-2.1093
4	L	L	0.0000
5	T	L	-0.7603
6	Q	L	-0.6769
7	P	L	-0.5048
8	P	L	-0.7217
9	S	L	-0.6329
10	V	L	-0.5660
11	S	L	-0.3677
12	V	L	0.0000
13	A	L	-0.3761
14	P	L	-0.9085
15	G	L	-1.5389
16	Q	L	-1.9790
17	T	L	-1.5425
18	A	L	0.0000
19	R	L	-2.0220
20	I	L	0.0000
21	S	L	-0.7845
22	C	L	0.0000
23	S	L	-1.5521
24	G	L	-2.3308
25	D	L	-3.3137
26	N	L	-3.0341
27	I	L	0.0000
28	G	L	-1.5663
29	G	L	-1.0707
30	T	L	0.1485
31	F	L	1.3703
32	V	L	0.0000
33	S	L	0.0000
34	W	L	0.0000
35	Y	L	0.0000
36	Q	L	-0.1586
37	Q	L	-0.7285
38	K	L	-1.4634
39	P	L	-1.4741
40	G	L	-1.4680
41	Q	L	-1.7490
42	A	L	-0.7007
43	P	L	0.0000
44	V	L	1.4854
45	L	L	0.0000
46	V	L	0.0000
47	I	L	0.0000
48	Y	L	-0.7442
49	D	L	-0.7936
50	D	L	-1.1171
51	N	L	-2.1793
52	D	L	-2.3911
53	R	L	-2.0364
54	P	L	-0.7672
55	S	L	-0.8956
56	G	L	-0.8026
57	I	L	-0.5864
58	P	L	-1.2410
59	E	L	-2.2564
60	R	L	-1.5659
61	F	L	0.0000
62	S	L	-1.5743
63	G	L	-1.4901
64	S	L	-1.1292
65	N	L	-1.0950
66	S	L	-1.3073
67	G	L	-2.1129
68	N	L	-2.7989
69	T	L	-1.5387
70	A	L	0.0000
71	T	L	-0.8892
72	L	L	0.0000
73	T	L	-1.0025
74	I	L	0.0000
75	S	L	-1.5400
76	G	L	-1.4057
77	T	L	0.0000
78	Q	L	-1.7676
79	A	L	-1.2360
80	E	L	-2.1937
81	D	L	0.0000
82	E	L	-1.4270
83	A	L	0.0000
84	D	L	-1.1641
85	Y	L	0.0000
86	Y	L	0.0000
87	C	L	0.0000
88	G	L	0.0000
89	T	L	0.0000
90	W	L	1.1335
91	D	L	1.2727
92	M	L	1.9179
93	V	L	2.1853
94	T	L	0.6427
95	N	L	0.9584
96	N	L	0.0000
97	V	L	-0.0865
98	F	L	-0.3050
99	G	L	0.0000
100	G	L	-1.2536
101	G	L	0.0000
102	T	L	0.0000
103	K	L	-1.2703
104	L	L	0.0000
105	T	L	-0.3186
106	V	L	0.0000
107	L	L	0.7972
108	G	L	-0.4808
109	Q	L	-1.1651
110	P	L	-1.1985
111	K	L	-2.0654
112	A	L	-1.2771
113	A	L	-0.8062
114	P	L	0.0000
115	S	L	-0.3926
116	V	L	0.0000
117	T	L	-0.5921
118	L	L	0.0000
119	F	L	0.0000
120	P	L	-0.1388
121	P	L	0.0000
122	S	L	-0.9778
123	S	L	-1.5370
124	E	L	-2.4430
125	E	L	0.0000
126	L	L	-1.9277
127	Q	L	-2.3107
128	A	L	-1.8668
129	N	L	-2.6009
130	K	L	-2.5150
131	A	L	0.0000
132	T	L	0.0000
133	L	L	0.0000
134	V	L	0.0000
135	C	L	0.0000
136	L	L	0.0000
137	I	L	0.0000
138	S	L	-0.6221
139	D	L	-1.3385
140	F	L	0.0000
141	Y	L	-1.5151
142	P	L	-1.2135
143	G	L	-1.0201
144	A	L	-0.2844
145	V	L	-0.1477
146	T	L	-0.1055
147	V	L	0.1479
148	A	L	-0.3816
149	W	L	0.0000
150	K	L	-1.2721
151	A	L	0.0000
152	D	L	-2.1378
153	S	L	-1.1198
154	S	L	-0.9146
155	P	L	-0.9719
156	V	L	-0.8839
157	K	L	-1.6184
158	A	L	-0.7773
159	G	L	-0.6053
160	V	L	-0.3485
161	E	L	-0.3510
162	T	L	0.0374
163	T	L	0.0189
164	T	L	-0.2185
165	P	L	-0.6034
166	S	L	-1.2188
167	K	L	-2.5291
168	Q	L	-2.1102
169	S	L	-1.7925
170	N	L	-2.4217
171	N	L	-2.7738
172	K	L	-2.3435
173	Y	L	-1.4365
174	A	L	0.0000
175	A	L	0.0000
176	S	L	0.0000
177	S	L	0.0000
178	Y	L	0.0000
179	L	L	0.0000
180	S	L	-0.5024
181	L	L	0.0000
182	T	L	-1.7974
183	P	L	-2.2913
184	E	L	-3.0274
185	Q	L	-2.5813
186	W	L	0.0000
187	K	L	-2.6940
188	S	L	-2.2677
189	H	L	-2.6029
190	R	L	-2.7463
191	S	L	-1.7295
192	Y	L	0.0000
193	S	L	0.0000
194	C	L	0.0000
195	Q	L	-0.7968
196	V	L	0.0000
197	T	L	-0.6189
198	H	L	0.0000
199	E	L	-2.2733
200	G	L	-1.4521
201	S	L	-0.8150
202	T	L	-0.5896
203	V	L	-0.4018
204	E	L	-1.4986
205	K	L	-1.3388
206	T	L	-0.8158
207	V	L	-0.2572
208	A	L	-0.8384
209	P	L	-0.8902
210	T	L	-0.4719