Project name: 998bca24a350c64

Chain sequence(s)	H: QVQLVQSGAEVKKPGASVKVSCKTSGFTFSSTYISWVRQAPGQSLEWMGWIYAGTGGTRYNQKFQGRVTITVDTSASTAYMELSSLRSEDTAVYYCARRDPIPYFDVWGQGTTVTVSS; L: EIVMTQSPATLSLSPGERATLSCRASENVGAYVSWYQQKPGQAPRLLIYGASNRYTGVPDRFSGSGSGTDFTLTISSLQPEDLADYHCGQSYSFPFTFGQGTKLEIK
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                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:07)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:09)

• Minimal score value: -2.7497
• Maximal score value: 1.4735
• Average score: -0.565
• Total score value: -127.1284

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	-1.2240
2	V	H	-0.4445
3	Q	H	-0.8082
4	L	H	0.0000
5	V	H	0.7154
6	Q	H	0.0000
7	S	H	-0.5355
8	G	H	-0.5422
9	A	H	-0.0436
11	E	H	-0.0944
12	V	H	0.9192
13	K	H	-0.8862
14	K	H	-2.1344
15	P	H	-2.1641
16	G	H	-1.4918
17	A	H	-1.2021
18	S	H	-1.3361
19	V	H	0.0000
20	K	H	-2.0286
21	V	H	0.0000
22	S	H	-0.5398
23	C	H	0.0000
24	K	H	-0.9493
25	T	H	0.0000
26	S	H	-0.6259
27	G	H	-0.7198
28	F	H	-0.1050
29	T	H	-0.0705
30	F	H	0.0000
35	S	H	-0.3327
36	S	H	-0.2581
37	T	H	0.0000
38	Y	H	0.1538
39	I	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.5493
45	A	H	-0.9713
46	P	H	-0.9933
47	G	H	-1.1930
48	Q	H	-1.7972
49	S	H	-1.2673
50	L	H	0.0000
51	E	H	-0.8361
52	W	H	0.0000
53	M	H	0.0000
54	G	H	0.0000
55	W	H	-0.0732
56	I	H	0.0000
57	Y	H	0.0255
58	A	H	0.0000
59	G	H	-0.4917
62	T	H	-0.3283
63	G	H	-0.3963
64	G	H	-0.4714
65	T	H	-0.4798
66	R	H	-0.9529
67	Y	H	-1.0897
68	N	H	-1.4876
69	Q	H	-2.4743
70	K	H	-2.7497
71	F	H	0.0000
72	Q	H	-2.5089
74	G	H	-1.5883
75	R	H	-1.2316
76	V	H	0.0000
77	T	H	-0.8238
78	I	H	0.0000
79	T	H	-0.1164
80	V	H	-0.3093
81	D	H	-0.8466
82	T	H	-0.5651
83	S	H	-0.4363
84	A	H	-0.5877
85	S	H	-0.6511
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.5962
89	M	H	0.0000
90	E	H	-1.3763
91	L	H	0.0000
92	S	H	-1.0735
93	S	H	-1.1482
94	L	H	0.0000
95	R	H	-2.7195
96	S	H	-2.1917
97	E	H	-2.4529
98	D	H	0.0000
99	T	H	-0.7978
100	A	H	0.0000
101	V	H	0.2331
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	-0.1591
107	R	H	0.0000
108	D	H	0.0987
109	P	H	0.3387
110	I	H	1.4735
113	P	H	0.9531
114	Y	H	0.5553
115	F	H	0.0000
116	D	H	-0.0874
117	V	H	-0.1263
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.1765
121	G	H	-0.5655
122	T	H	0.0000
123	T	H	0.0399
124	V	H	0.0000
125	T	H	-0.2662
126	V	H	0.0000
127	S	H	-1.1199
128	S	H	-0.9504
1	E	L	-1.4471
2	I	L	0.0000
3	V	L	0.5169
4	M	L	0.0000
5	T	L	-0.6973
6	Q	L	0.0000
7	S	L	-0.7635
8	P	L	-0.3474
9	A	L	-0.5191
10	T	L	-0.6326
11	L	L	-0.4855
12	S	L	-0.7082
13	L	L	-1.0892
14	S	L	-1.4660
15	P	L	-1.6177
16	G	L	-1.4249
17	E	L	-2.0894
18	R	L	-2.4506
19	A	L	0.0000
20	T	L	-0.6508
21	L	L	0.0000
22	S	L	-0.8939
23	C	L	0.0000
24	R	L	-2.5651
25	A	L	0.0000
26	S	L	-1.5572
27	E	L	-2.5600
28	N	L	-2.3356
29	V	L	0.0000
36	G	L	-0.5058
37	A	L	-0.0656
38	Y	L	1.1094
39	V	L	0.0000
40	S	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	0.0000
45	K	L	-1.4881
46	P	L	-1.0300
47	G	L	-1.4458
48	Q	L	-2.0436
49	A	L	-1.2650
50	P	L	0.0000
51	R	L	-0.9513
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.2417
56	G	L	0.0618
57	A	L	0.0000
65	S	L	-0.7741
66	N	L	-1.1620
67	R	L	-1.4432
68	Y	L	-0.4804
69	T	L	-0.4601
70	G	L	-0.8090
71	V	L	0.0000
72	P	L	-1.3131
74	D	L	-2.2261
75	R	L	-1.6323
76	F	L	0.0000
77	S	L	-1.0311
78	G	L	-0.6287
79	S	L	-0.7926
80	G	L	-1.1117
83	S	L	-1.0798
84	G	L	-1.5174
85	T	L	-2.2483
86	D	L	-2.2713
87	F	L	0.0000
88	T	L	-0.7976
89	L	L	0.0000
90	T	L	-0.6142
91	I	L	0.0000
92	S	L	-1.5023
93	S	L	-1.6497
94	L	L	0.0000
95	Q	L	-1.5238
96	P	L	-1.3758
97	E	L	-1.7219
98	D	L	0.0000
99	L	L	-0.3271
100	A	L	0.0000
101	D	L	-1.0039
102	Y	L	0.0000
103	H	L	0.0000
104	C	L	0.0000
105	G	L	0.0000
106	Q	L	0.0000
107	S	L	0.0000
108	Y	L	1.3296
109	S	L	0.6968
114	F	L	0.9913
115	P	L	-0.0446
116	F	L	0.0000
117	T	L	0.2213
118	F	L	0.0000
119	G	L	0.0000
120	Q	L	-1.2613
121	G	L	-1.0905
122	T	L	0.0000
123	K	L	-1.3587
124	L	L	0.0000
125	E	L	-1.1110
126	I	L	-0.9681
127	K	L	-1.7637