Project name: P2A10

Chain sequence(s)	H: QVQLQQSGPELVKPGASVKISCEASGYTFADYYMNWVKQSHGQSLEWIGDINPSNGNTAYNQKFKDKATLTVDKSSSTAYMELRSLTSEDSAVYFCARGGLLLDSWGQGTTLTVSS; L: DIVITQSPASLAVSLGKRATISCRASESVSIIGTNLIHWYQQKPGQPPKLLIYHASNLETGVPARFSGSGSGTDFTLTIDPVEEDDVAIYYCLQGGKFSTFGAGTKLEIK
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                                          (00:01:21)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:22)

• Minimal score value: -3.5228
• Maximal score value: 2.4611
• Average score: -0.6183
• Total score value: -139.7428

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	-1.4604
2	V	H	-0.9705
3	Q	H	-1.7817
4	L	H	0.0000
5	Q	H	-1.9860
6	Q	H	0.0000
7	S	H	-1.0752
8	G	H	-1.1005
9	P	H	-0.5339
11	E	H	-0.4197
12	L	H	0.7312
13	V	H	-0.3449
14	K	H	-1.6985
15	P	H	-1.5227
16	G	H	-1.2774
17	A	H	-1.0440
18	S	H	-1.1643
19	V	H	0.0000
20	K	H	-1.3887
21	I	H	0.0000
22	S	H	-0.5767
23	C	H	0.0000
24	E	H	-1.1666
25	A	H	0.0000
26	S	H	-1.0661
27	G	H	-0.9897
28	Y	H	-0.6180
29	T	H	-0.5362
30	F	H	0.0000
35	A	H	-1.2171
36	D	H	-1.5470
37	Y	H	-0.2960
38	Y	H	0.2280
39	M	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.8319
45	S	H	-1.3734
46	H	H	-1.5919
47	G	H	-1.5239
48	Q	H	-1.8474
49	S	H	-1.0046
50	L	H	0.0000
51	E	H	-0.9671
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	D	H	-0.1855
56	I	H	0.0000
57	N	H	-1.0145
58	P	H	0.0000
59	S	H	-1.6021
62	N	H	-2.0605
63	G	H	-1.8525
64	N	H	-1.8512
65	T	H	-0.8635
66	A	H	-0.5098
67	Y	H	-1.1606
68	N	H	-1.7578
69	Q	H	-2.8397
70	K	H	-3.1873
71	F	H	0.0000
72	K	H	-3.5228
74	D	H	-3.3179
75	K	H	-2.3054
76	A	H	0.0000
77	T	H	-0.9714
78	L	H	0.0000
79	T	H	-0.3204
80	V	H	-0.6550
81	D	H	-1.4062
82	K	H	-2.2404
83	S	H	-1.2500
84	S	H	-1.0392
85	S	H	-1.0967
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.0952
89	M	H	0.0000
90	E	H	-0.9259
91	L	H	0.0000
92	R	H	-1.4660
93	S	H	-1.2474
94	L	H	0.0000
95	T	H	-1.3846
96	S	H	-1.4592
97	E	H	-1.9772
98	D	H	0.0000
99	S	H	-0.6881
100	A	H	0.0000
101	V	H	-0.1270
102	Y	H	0.0000
103	F	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	G	H	0.0000
108	G	H	-0.0046
109	L	H	0.7253
114	L	H	0.3334
115	L	H	0.0000
116	D	H	-0.5447
117	S	H	-0.6335
118	W	H	-0.9003
119	G	H	0.0000
120	Q	H	-1.9060
121	G	H	-1.0438
122	T	H	0.0000
123	T	H	-0.2120
124	L	H	0.0000
125	T	H	-0.1982
126	V	H	0.0000
127	S	H	-0.6081
128	S	H	-0.7779
1	D	L	-1.4675
2	I	L	0.0000
3	V	L	0.8416
4	I	L	0.0000
5	T	L	-0.4723
6	Q	L	0.0000
7	S	L	-0.6135
8	P	L	-0.3309
9	A	L	-0.2606
10	S	L	-0.4807
11	L	L	-0.2288
12	A	L	-0.3716
13	V	L	-0.9498
14	S	L	-1.3764
15	L	L	-1.3149
16	G	L	-2.0029
17	K	L	-2.9688
18	R	L	-3.1404
19	A	L	0.0000
20	T	L	-0.6227
21	I	L	0.0000
22	S	L	-0.8419
23	C	L	0.0000
24	R	L	-2.2230
25	A	L	0.0000
26	S	L	-0.7926
27	E	L	-1.2506
28	S	L	-0.8694
29	V	L	0.0000
30	S	L	0.6370
31	I	L	2.1869
34	I	L	2.4611
35	G	L	0.8469
36	T	L	0.5961
37	N	L	0.1126
38	L	L	0.1594
39	I	L	0.0000
40	H	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	-1.0478
46	P	L	-0.8476
47	G	L	-1.2518
48	Q	L	-1.7863
49	P	L	-1.2718
50	P	L	0.0000
51	K	L	-1.3496
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.1262
56	H	L	-0.2561
57	A	L	0.0000
65	S	L	-0.5450
66	N	L	-0.4128
67	L	L	0.1354
68	E	L	-0.4259
69	T	L	-0.4155
70	G	L	-0.5060
71	V	L	0.0000
72	P	L	-0.3353
74	A	L	-0.2469
75	R	L	-0.9819
76	F	L	0.0000
77	S	L	-0.3908
78	G	L	-0.3637
79	S	L	-0.7437
80	G	L	-1.0546
83	S	L	-1.0709
84	G	L	-0.8529
85	T	L	-1.5225
86	D	L	-1.9816
87	F	L	0.0000
88	T	L	-0.7488
89	L	L	0.0000
90	T	L	-0.8001
91	I	L	0.0000
92	D	L	-2.3154
93	P	L	-2.1660
94	V	L	0.0000
95	E	L	-2.7593
96	E	L	-2.8099
97	D	L	-2.7890
98	D	L	0.0000
99	V	L	-0.6193
100	A	L	0.0000
101	I	L	-0.2511
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	L	L	0.0000
106	Q	L	0.0000
107	G	L	0.0669
108	G	L	-0.0066
114	K	L	-0.9525
115	F	L	0.1637
116	S	L	0.0352
117	T	L	0.0357
118	F	L	0.0000
119	G	L	0.0000
120	A	L	-0.1497
121	G	L	-0.4391
122	T	L	0.0000
123	K	L	-0.7259
124	L	L	0.0000
125	E	L	-0.6726
126	I	L	-0.3487
127	K	L	-1.2390