Project name: f96763bffaeaf5e

Chain sequence(s)	H: EVQLVVSGGGLVKPGGSMILSCAASGFTFSNYSMNWVRQAPGKGLEWVSSISSSSEYIYYADFVKGRFTISRDNAKNSLYLQMDSLRAEDTAVYYCAWPGYRKAWGRGTLVTVSS; L: QSVLTQPASVSGSPGQSITISCAGTSSDVGGYNYVSWYQQHPGKAPKLMIYEDSKRPSGVSNRFSGSKSGNTASLTISGLRAEDEADYYCSYCASKGHWLFGGGTKLAVL
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                                          (00:01:04)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:05)

• Minimal score value: -2.5867
• Maximal score value: 1.6604
• Average score: -0.5192
• Total score value: -116.8124

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	-1.7251
2	V	H	-0.5953
3	Q	H	-0.6595
4	L	H	0.0000
5	V	H	0.4126
6	V	H	0.0912
7	S	H	0.0456
8	G	H	0.1412
9	G	H	0.7654
11	G	H	1.1125
12	L	H	1.3956
13	V	H	-0.1998
14	K	H	-1.7993
15	P	H	-1.9695
16	G	H	-1.4803
17	G	H	-1.3162
18	S	H	-0.7210
19	M	H	0.4975
20	I	H	1.4270
21	L	H	0.0000
22	S	H	0.4412
23	C	H	0.0000
24	A	H	-0.1549
25	A	H	-0.3131
26	S	H	-0.4673
27	G	H	-0.7636
28	F	H	-0.3648
29	T	H	-0.5260
30	F	H	0.0000
35	S	H	-1.2165
36	N	H	-1.2798
37	Y	H	-0.4612
38	S	H	-0.0262
39	M	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.6433
45	A	H	-1.0050
46	P	H	-0.7978
47	G	H	-1.4747
48	K	H	-2.2708
49	G	H	-1.5197
50	L	H	0.0000
51	E	H	-0.8318
52	W	H	0.0000
53	V	H	0.0000
54	S	H	0.0000
55	S	H	0.0000
56	I	H	0.0000
57	S	H	0.0000
58	S	H	-0.7948
59	S	H	-0.8646
62	S	H	-0.6540
63	E	H	-1.0880
64	Y	H	0.8825
65	I	H	1.1330
66	Y	H	0.5312
67	Y	H	-0.6116
68	A	H	0.0000
69	D	H	-2.2739
70	F	H	-1.2388
71	V	H	0.0000
72	K	H	-2.3372
74	G	H	-1.6749
75	R	H	-1.3027
76	F	H	0.0000
77	T	H	-0.2895
78	I	H	0.0000
79	S	H	-0.1511
80	R	H	-0.8974
81	D	H	-1.4731
82	N	H	-1.7275
83	A	H	-1.3630
84	K	H	-2.2527
85	N	H	-1.6680
86	S	H	-0.9499
87	L	H	0.0000
88	Y	H	0.4736
89	L	H	0.0000
90	Q	H	0.1194
91	M	H	0.0000
92	D	H	-1.1348
93	S	H	-1.3456
94	L	H	0.0000
95	R	H	-2.3842
96	A	H	-1.7682
97	E	H	-2.1459
98	D	H	0.0000
99	T	H	-0.3078
100	A	H	0.0000
101	V	H	0.7309
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	W	H	0.0000
107	P	H	-0.1725
108	G	H	0.0050
114	Y	H	-0.0321
115	R	H	-0.8785
116	K	H	0.0000
117	A	H	-0.5789
118	W	H	-0.6266
119	G	H	0.0000
120	R	H	-1.8917
121	G	H	-0.5745
122	T	H	0.3517
123	L	H	1.6604
124	V	H	0.0000
125	T	H	0.2463
126	V	H	0.0000
127	S	H	-0.6675
128	S	H	-0.6025
1	Q	L	-0.9536
2	S	L	0.1440
3	V	L	1.2125
4	L	L	0.0000
5	T	L	0.1223
6	Q	L	-0.2284
7	P	L	-0.3511
8	A	L	-0.4189
9	S	L	-0.5013
11	V	L	-0.0312
12	S	L	0.0390
13	G	L	0.0000
14	S	L	-0.1597
15	P	L	-1.0023
16	G	L	-1.5680
17	Q	L	-1.6435
18	S	L	-1.1238
19	I	L	-0.2438
20	T	L	-0.0455
21	I	L	0.0000
22	S	L	-0.2348
23	C	L	0.0000
24	A	L	-0.3435
25	G	L	-0.3433
26	T	L	-0.6366
27	S	L	-0.8518
28	S	L	-0.7646
29	D	L	0.0000
30	V	L	0.0000
31	G	L	-1.2533
35	G	L	-0.7521
36	Y	L	-0.5047
37	N	L	-1.2918
38	Y	L	-0.0776
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	H	L	-1.8046
46	P	L	-1.3547
47	G	L	-1.4703
48	K	L	-2.5867
49	A	L	-1.7436
50	P	L	0.0000
51	K	L	-1.5796
52	L	L	0.0000
53	M	L	0.0000
54	I	L	0.0000
55	Y	L	-1.2879
56	E	L	-1.9476
57	D	L	0.0000
65	S	L	-1.7437
66	K	L	-2.4480
67	R	L	-2.3007
68	P	L	0.0000
69	S	L	-1.0933
70	G	L	-0.7848
71	V	L	-1.0251
72	S	L	-1.0066
74	N	L	-1.6774
75	R	L	-0.9919
76	F	L	0.0000
77	S	L	-1.0131
78	G	L	0.0000
79	S	L	-1.0577
80	K	L	-1.1683
83	S	L	-0.9784
84	G	L	-1.3039
85	N	L	-1.5445
86	T	L	-0.9807
87	A	L	0.0000
88	S	L	-0.3507
89	L	L	0.0000
90	T	L	-0.1841
91	I	L	0.0000
92	S	L	-1.0972
93	G	L	-1.2632
94	L	L	0.0000
95	R	L	-2.3790
96	A	L	-1.5261
97	E	L	-2.5212
98	D	L	0.0000
99	E	L	-1.6566
100	A	L	0.0000
101	D	L	-1.1598
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	S	L	0.0000
106	Y	L	0.0000
107	C	L	-0.0874
108	A	L	0.0000
109	S	L	-1.0410
113	K	L	-1.6624
114	G	L	-0.4028
115	H	L	-0.4175
116	W	L	-0.0524
117	L	L	0.0000
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-0.5400
121	G	L	-0.9341
122	T	L	0.0000
123	K	L	-1.1399
124	L	L	0.0000
125	A	L	0.0322
126	V	L	-0.0633
127	L	L	1.1773