Project name: 2VXV

Chain sequence(s)	H: EVQLVQSGTEVKKPGESLKISCCKGSGYTVTSYWIIGWVRQMPGKGLEWMGFIYPGDSETRYSPTFQGQVVTISADKSFNTAFLQWSSLKASDTAMYYCCARVGSGWYPYTFDIWGQGTMVTVSSSASSTKGPSVFPLAPSSKSTSGGTAALGCCLVKDYFPEEPVTVSWNSGALTSSGVHTFPAVVLQSSGLYSSLSSSVVTVPSSSLGTQTTYICCNVNHKPSNNTKKVDKKKVEPK; L: EIVMTQSSPATLSVSPGERATLSCCRASESSISSSNLAWYQQKPGQAPRLFIYTTASTRAATTDDIPARFSGSSGSGTEFTLTISSSSLQSSEDFAVYYCQQYNNWPSITFGQGTRLEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACCEEVTHQGLSSSPVTKSFNRGE
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]                                                (00:00:00)
[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 all 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                                          (00:03:54)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:57)

• Minimal score value: -3.4666
• Maximal score value: 1.0301
• Average score: -0.7015
• Total score value: -305.8344

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	E	H	-2.0139
2	V	H	-1.0372
3	Q	H	-1.0909
4	L	H	0.0000
5	V	H	0.5983
6	Q	H	0.0000
7	S	H	-0.4614
8	G	H	-0.5417
9	T	H	-0.2170
10	E	H	-0.3778
11	V	H	0.0224
12	K	H	-1.1355
13	K	H	-1.8639
14	P	H	-1.9597
15	G	H	-1.8239
16	E	H	-1.8780
17	S	H	-1.6627
18	L	H	0.0000
19	K	H	-1.9543
20	I	H	0.0000
21	S	H	-0.4523
22	C	H	0.0000
23	K	H	-0.5714
24	G	H	0.0000
25	S	H	-0.7353
26	G	H	-1.1617
27	Y	H	-0.5063
28	T	H	-0.1570
29	V	H	0.0000
30	T	H	-0.7883
31	S	H	-0.1434
32	Y	H	0.2928
33	W	H	0.2481
34	I	H	0.0000
35	G	H	0.0000
36	W	H	0.0000
37	V	H	0.0000
38	R	H	-0.6854
39	Q	H	-0.9015
40	M	H	-0.8667
41	P	H	-0.9566
42	G	H	-1.4184
43	K	H	-2.3501
44	G	H	-1.5546
45	L	H	0.0000
46	E	H	-1.0277
47	W	H	-0.2702
48	M	H	0.0000
49	G	H	0.0000
50	F	H	0.0000
51	I	H	0.0000
52	Y	H	-0.7216
52A	P	H	0.0000
53	G	H	-1.6429
54	D	H	-2.4371
55	S	H	-1.7784
56	E	H	-1.4716
57	T	H	-0.9375
58	R	H	-1.0767
59	Y	H	-0.9074
60	S	H	0.0000
61	P	H	-1.1519
62	T	H	-0.8061
63	F	H	0.0000
64	Q	H	-1.9450
65	G	H	-1.6439
66	Q	H	-1.9194
67	V	H	0.0000
68	T	H	-0.9131
69	I	H	0.0000
70	S	H	-0.8318
71	A	H	-1.0326
72	D	H	-1.3745
73	K	H	-2.0768
74	S	H	-0.4847
75	F	H	0.5979
76	N	H	-0.8627
77	T	H	0.0000
78	A	H	0.0000
79	F	H	-0.5553
80	L	H	0.0000
81	Q	H	-1.3536
82	W	H	0.0000
82A	S	H	-1.3225
82B	S	H	-1.5944
82C	L	H	0.0000
83	K	H	-2.3978
84	A	H	-1.2836
85	S	H	-0.7717
86	D	H	-0.8403
87	T	H	-0.3989
88	A	H	0.0000
89	M	H	-0.0409
90	Y	H	0.0000
91	Y	H	0.0000
92	C	H	0.0000
93	A	H	0.0000
94	R	H	0.0000
95	V	H	0.0000
96	G	H	0.0000
97	S	H	0.2632
98	G	H	0.1820
99	W	H	1.0301
100	Y	H	0.5788
100A	P	H	0.5303
100B	Y	H	0.6851
100C	T	H	0.0000
100D	F	H	0.0000
101	D	H	-0.1385
102	I	H	-0.3842
103	W	H	0.0000
104	G	H	0.0000
105	Q	H	-1.2545
106	G	H	-0.6815
107	T	H	0.0000
108	M	H	0.0561
109	V	H	0.0000
110	T	H	-0.4041
111	V	H	0.0000
112	S	H	-0.8743
113	S	H	-0.9501
114	A	H	-0.5211
115	S	H	-0.6060
116	T	H	-0.6961
117	K	H	-1.1780
118	G	H	-1.4727
119	P	H	0.0000
120	S	H	-0.3950
121	V	H	0.0000
122	F	H	0.0000
123	P	H	-1.0653
124	L	H	0.0000
125	A	H	-1.1694
126	P	H	0.0000
127	S	H	-1.2530
128	S	H	-1.4860
129	K	H	-1.9235
130	S	H	-1.1737
131	T	H	-0.9393
132	S	H	-0.8808
133	G	H	-0.7938
134	G	H	-0.6130
135	T	H	-0.4610
136	A	H	0.0000
137	A	H	0.0000
138	L	H	0.0000
139	G	H	0.0000
140	C	H	0.0000
141	L	H	0.0000
142	V	H	0.0000
143	K	H	0.0000
144	D	H	-0.4496
145	Y	H	0.0000
146	F	H	0.0000
147	P	H	0.0000
148	E	H	-1.4404
149	P	H	-1.3322
150	V	H	-0.9389
151	T	H	-0.6595
152	V	H	-0.2004
153	S	H	-0.3661
154	W	H	0.0000
155	N	H	-0.6984
156	S	H	-0.6393
157	G	H	-0.5670
158	A	H	-0.2396
159	L	H	0.0229
160	T	H	-0.1673
161	S	H	-0.1832
162	G	H	-0.2299
163	V	H	0.1439
164	H	H	-0.3183
165	T	H	0.0103
166	F	H	0.0000
167	P	H	-0.3290
168	A	H	0.0184
169	V	H	0.4844
170	L	H	0.8843
171	Q	H	0.1981
172	S	H	-0.0927
173	S	H	-0.2268
174	G	H	-0.0336
175	L	H	-0.1029
176	Y	H	0.0000
177	S	H	0.0000
178	L	H	0.0000
179	S	H	0.0000
180	S	H	0.0000
181	V	H	0.0000
182	V	H	0.0000
183	T	H	-0.1270
184	V	H	0.0000
185	P	H	-0.6009
186	S	H	-0.7549
187	S	H	-0.7126
188	S	H	-0.6470
189	L	H	-0.8225
190	G	H	-0.9714
191	T	H	-0.7221
192	Q	H	-1.2259
193	T	H	-1.1003
194	Y	H	0.0000
195	I	H	-1.1322
196	C	H	0.0000
197	N	H	-1.3716
198	V	H	0.0000
199	N	H	-1.9264
200	H	H	0.0000
201	K	H	-2.8926
202	P	H	-1.8492
203	S	H	-1.8684
204	N	H	-2.6406
205	T	H	-2.0455
206	K	H	-2.6336
207	V	H	-1.3274
208	D	H	-2.3929
209	K	H	-1.8390
210	K	H	-2.4283
211	V	H	0.0000
212	E	H	-2.8026
213	P	H	-1.9409
214	K	H	-2.2671
1	E	L	-1.5230
2	I	L	-0.3431
3	V	L	0.7535
4	M	L	0.0000
5	T	L	-0.5320
6	Q	L	0.0000
7	S	L	-0.5851
8	P	L	-0.1998
9	A	L	-0.2556
10	T	L	-0.0587
11	L	L	0.0002
12	S	L	-0.4841
13	V	L	0.0000
14	S	L	-1.7618
15	P	L	-1.7367
16	G	L	-2.0128
17	E	L	-2.9493
18	R	L	-2.9297
19	A	L	0.0000
20	T	L	-0.5207
21	L	L	0.0000
22	S	L	-0.7965
23	C	L	0.0000
24	R	L	-2.0487
25	A	L	0.0000
26	S	L	-1.1660
27	E	L	-2.2587
28	S	L	-1.6756
29	I	L	0.0000
30	S	L	-1.0113
31	S	L	-0.7688
32	N	L	-0.6652
33	L	L	0.0000
34	A	L	0.0000
35	W	L	0.0000
36	Y	L	0.0000
37	Q	L	0.0000
38	Q	L	0.0000
39	K	L	-1.5456
40	P	L	-1.3365
41	G	L	-1.4532
42	Q	L	-2.1783
43	A	L	-1.5565
44	P	L	0.0000
45	R	L	-1.9255
46	L	L	0.0000
47	F	L	0.0000
48	I	L	0.0000
49	Y	L	-0.1484
50	T	L	-0.2892
51	A	L	0.0000
52	S	L	-0.6848
53	T	L	-0.6521
54	R	L	-1.4022
55	A	L	-1.0967
56	T	L	-1.1983
57	D	L	-2.0060
58	I	L	0.0000
59	P	L	-0.8207
60	A	L	-0.6190
61	R	L	-0.7963
62	F	L	0.0000
63	S	L	-0.6394
64	G	L	-0.5442
65	S	L	-0.7584
66	G	L	-1.1920
67	S	L	-1.1792
68	G	L	-1.4158
69	T	L	-1.9684
70	E	L	-2.5635
71	F	L	0.0000
72	T	L	-0.7986
73	L	L	0.0000
74	T	L	-0.6574
75	I	L	0.0000
76	S	L	-1.6950
77	S	L	-1.8894
78	L	L	0.0000
79	Q	L	-1.6580
80	S	L	-1.4160
81	E	L	-2.1183
82	D	L	0.0000
83	F	L	-0.5346
84	A	L	0.0000
85	V	L	-0.0320
86	Y	L	0.0000
87	Y	L	0.0000
88	C	L	0.0000
89	Q	L	0.0000
90	Q	L	0.0000
91	Y	L	0.0000
92	N	L	-1.3391
93	N	L	-1.4442
94	W	L	-0.5508
95	P	L	-0.4493
95A	S	L	-1.0452
96	I	L	0.0000
97	T	L	-0.1296
98	F	L	0.1097
99	G	L	0.0000
100	Q	L	-1.3725
101	G	L	0.0000
102	T	L	0.0000
103	R	L	-0.2908
104	L	L	0.0000
105	E	L	0.0000
106	I	L	-0.8482
107	K	L	-1.3610
108	R	L	-1.1173
109	T	L	-0.1409
110	V	L	0.3954
111	A	L	0.0110
112	A	L	-0.1299
113	P	L	0.0000
114	S	L	-0.1818
115	V	L	0.0000
116	F	L	0.1560
117	I	L	0.1486
118	F	L	0.0000
119	P	L	-0.3950
120	P	L	0.0000
121	S	L	-1.7735
122	D	L	-2.9025
123	E	L	-2.9802
124	Q	L	0.0000
125	L	L	-2.3054
126	K	L	-2.7891
127	S	L	-1.7379
128	G	L	-1.3926
129	T	L	-0.8858
130	A	L	0.0000
131	S	L	0.0000
132	V	L	0.0000
133	V	L	0.0000
134	C	L	0.0000
135	L	L	0.0000
136	L	L	0.0000
137	N	L	0.0000
138	N	L	-0.9882
139	F	L	0.0000
140	Y	L	0.0000
141	P	L	-1.3833
142	R	L	-2.2480
143	E	L	-2.7832
144	A	L	-1.9618
145	K	L	-1.9409
146	V	L	-0.7679
147	Q	L	-0.5286
148	W	L	0.0000
149	K	L	-0.7868
150	V	L	0.0000
151	D	L	-1.7632
152	N	L	-1.5771
153	A	L	-0.5428
154	L	L	0.1393
155	Q	L	-0.6330
156	S	L	-0.8182
157	G	L	-1.3472
158	N	L	-1.7344
159	S	L	-1.4792
160	Q	L	-1.4250
161	E	L	-1.5866
162	S	L	-0.7976
163	V	L	-0.5074
164	T	L	0.0000
165	E	L	-2.1582
166	Q	L	-1.8181
167	D	L	-2.0694
168	S	L	-2.0050
169	K	L	-2.3509
170	D	L	-1.9478
171	S	L	-1.8126
172	T	L	0.0000
173	Y	L	0.0000
174	S	L	0.0000
175	L	L	0.0000
176	S	L	0.0000
177	S	L	0.0000
178	T	L	-0.7231
179	L	L	0.0000
180	T	L	-0.5532
181	L	L	-0.8512
182	S	L	-1.0957
183	K	L	-2.1544
184	A	L	-1.9477
185	D	L	-2.6372
186	Y	L	0.0000
187	E	L	-3.3608
188	K	L	-3.4666
189	H	L	-2.5256
190	K	L	-2.2653
191	V	L	-0.7218
192	Y	L	0.0000
193	A	L	0.0000
194	C	L	0.0000
195	E	L	-0.6904
196	V	L	0.0000
197	T	L	-1.0384
198	H	L	0.0000
199	Q	L	-1.6528
200	G	L	-0.4648
201	L	L	-0.2499
202	S	L	-0.4675
203	S	L	-0.4150
204	P	L	-0.4404
205	V	L	0.0330
206	T	L	-0.3836
207	K	L	-0.5529
208	S	L	-0.2881
209	F	L	-0.6530
210	N	L	-1.4764
211	R	L	-2.0011
212	G	L	-1.8882
213	E	L	-2.3733