Project name: 1f0e98ab85d486a

Chain sequence(s)	H: QVQLVESGGGVVQPGRSLRLSCAASGFTFSNYGMHWVRQAPGKGLEWVAVISYDGSNKYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCARGVLDVWGQGTTVTVSS; L: IQMTQSPSSLSASVGDRVTITCRASQGPTSYLAWYQQKPGKAPKLLIYATKTLQSGVPSRFSGSGSGTDFTLTISRLQPEDFATYYCQQLNSYPLTFGGGTKVEIK
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                                          (00:01:57)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:58)

• Minimal score value: -2.8652
• Maximal score value: 1.5085
• Average score: -0.6615
• Total score value: -145.5222

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	-1.2527
2	V	H	-0.4860
3	Q	H	-1.0816
4	L	H	0.0000
5	V	H	-0.0711
6	E	H	0.0000
7	S	H	-0.6441
8	G	H	-0.7024
9	G	H	-0.3286
11	G	H	0.5135
12	V	H	1.5085
13	V	H	-0.0320
14	Q	H	-1.1383
15	P	H	-1.8292
16	G	H	-2.1155
17	R	H	-2.6661
18	S	H	-1.9165
19	L	H	-1.0906
20	R	H	-1.6869
21	L	H	0.0000
22	S	H	-0.4908
23	C	H	0.0000
24	A	H	-0.3957
25	A	H	0.0000
26	S	H	-0.6465
27	G	H	-0.7572
28	F	H	-0.3786
29	T	H	-0.4049
30	F	H	0.0000
35	S	H	-1.0440
36	N	H	-1.0279
37	Y	H	0.1015
38	G	H	-0.0839
39	M	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.8935
45	A	H	-1.2634
46	P	H	-1.0298
47	G	H	-1.4732
48	K	H	-2.2870
49	G	H	-1.4803
50	L	H	0.0000
51	E	H	-1.1035
52	W	H	0.0000
53	V	H	0.0000
54	A	H	0.0000
55	V	H	0.1531
56	I	H	0.0000
57	S	H	-0.6554
58	Y	H	-0.1344
59	D	H	-1.6560
62	G	H	-1.2329
63	S	H	-1.3179
64	N	H	-1.6634
65	K	H	-1.0164
66	Y	H	-0.0978
67	Y	H	-0.4885
68	A	H	0.0000
69	D	H	-2.2407
70	S	H	-1.7869
71	V	H	0.0000
72	K	H	-2.5014
74	G	H	-1.7301
75	R	H	-1.2659
76	F	H	0.0000
77	T	H	-0.7853
78	I	H	0.0000
79	S	H	-0.4854
80	R	H	-1.0726
81	D	H	-1.8137
82	N	H	-1.8337
83	S	H	-1.5579
84	K	H	-2.3573
85	N	H	-1.6552
86	T	H	0.0000
87	L	H	0.0000
88	Y	H	-0.5167
89	L	H	0.0000
90	Q	H	-1.0472
91	M	H	0.0000
92	N	H	-1.8487
93	S	H	-1.7951
94	L	H	0.0000
95	R	H	-2.6343
96	A	H	-1.7213
97	E	H	-2.3053
98	D	H	0.0000
99	T	H	-0.6967
100	A	H	0.0000
101	V	H	-0.0715
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0012
107	G	H	0.1684
108	V	H	0.5386
115	L	H	0.0000
116	D	H	-0.6201
117	V	H	-0.2061
118	W	H	-0.6589
119	G	H	0.0000
120	Q	H	-1.6128
121	G	H	-0.8516
122	T	H	-0.4126
123	T	H	-0.0635
124	V	H	0.0000
125	T	H	0.1144
126	V	H	0.0000
127	S	H	-0.4085
128	S	H	-0.1786
2	I	L	-0.2885
3	Q	L	-1.4864
4	M	L	0.0000
5	T	L	-1.2524
6	Q	L	-0.9206
7	S	L	-0.7003
8	P	L	-0.5393
9	S	L	-0.6923
10	S	L	-0.8294
11	L	L	-0.4571
12	S	L	-0.8590
13	A	L	-0.9690
14	S	L	-1.0094
15	V	L	-0.3396
16	G	L	-1.3719
17	D	L	-2.2228
18	R	L	-2.8652
19	V	L	0.0000
20	T	L	-0.5912
21	I	L	0.0000
22	T	L	0.0000
23	C	L	0.0000
24	R	L	-2.7207
25	A	L	-1.9839
26	S	L	-1.6362
27	Q	L	-1.9365
28	G	L	-1.5070
29	P	L	-0.4466
36	T	L	-0.2857
37	S	L	-0.2636
38	Y	L	0.7059
39	L	L	0.0000
40	A	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	-1.4748
46	P	L	-1.0964
47	G	L	-1.6532
48	K	L	-2.5492
49	A	L	-1.6327
50	P	L	0.0000
51	K	L	-1.7499
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.2522
56	A	L	0.0343
57	T	L	0.0000
65	K	L	-1.5715
66	T	L	-0.5908
67	L	L	-0.0809
68	Q	L	-0.5073
69	S	L	-0.4344
70	G	L	-0.5115
71	V	L	-0.3595
72	P	L	-0.3552
74	S	L	-0.4214
75	R	L	-1.2348
76	F	L	0.0000
77	S	L	-0.6716
78	G	L	-0.8260
79	S	L	-1.1709
80	G	L	-1.4004
83	S	L	-0.9890
84	G	L	-1.1890
85	T	L	-2.0026
86	D	L	-2.7490
87	F	L	0.0000
88	T	L	-0.9956
89	L	L	0.0000
90	T	L	-0.8218
91	I	L	0.0000
92	S	L	-2.1706
93	R	L	-2.7979
94	L	L	0.0000
95	Q	L	-1.1496
96	P	L	-1.0906
97	E	L	-1.6875
98	D	L	0.0000
99	F	L	-0.4919
100	A	L	0.0000
101	T	L	-0.6410
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	Q	L	0.0000
107	L	L	0.6616
108	N	L	0.2035
109	S	L	0.6165
114	Y	L	1.1359
115	P	L	0.3029
116	L	L	0.0000
117	T	L	-0.1875
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-1.1867
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.2451
124	V	L	0.0000
125	E	L	-1.4283
126	I	L	-0.8517
127	K	L	-1.5917