Project name: test [mutate: AN23H, AN24H]

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCAASGFTFSSYAMSWVRQAPGKGLEWVSAISGSGGSTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAILGATSLSAFDIWGQGTMVTVSS; L: EIVLTQSPGTLSLSPGERATLSCRASQSVSSSYLAWYQQKPGQAPRLLIYGASSRATGIPDRFSGSGSGTDFTLTISRLEPEDFAVYYCQQYGSSPLTFGQGTKVEIK
Selected Chain(s)	H,L
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No
Mutated residues	AN24H,AN23H
Energy difference between WT (input) and mutated protein (by FoldX)	2.27209 kcal/mol CAUTION: Your mutation/s can destabilize the protein structure

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]       FoldX:    Building mutant model                                                       (00:01:44)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:01:53)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:46)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:47)

• Minimal score value: -3.1983
• Maximal score value: 1.2504
• Average score: -0.6285
• Total score value: -143.3084

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	-2.0803
2	V	H	-1.2206
3	Q	H	-1.5213
4	L	H	0.0000
5	L	H	0.0615
6	E	H	0.0000
7	S	H	-0.5731
8	G	H	-0.6806
9	G	H	-0.0796
10	G	H	0.4524
11	L	H	1.2504
12	V	H	-0.0343
13	Q	H	-1.3374
14	P	H	-1.6042
15	G	H	-1.4129
16	G	H	-0.9826
17	S	H	-1.0253
18	L	H	-0.5493
19	R	H	-1.2453
20	L	H	0.0000
21	S	H	-0.5434
22	C	H	0.0000
23	N	H	-1.5034	mutated: AN23H
24	N	H	0.0000	mutated: AN24H
25	S	H	-1.1336
26	G	H	-1.1958
27	F	H	-0.4871
28	T	H	-0.2105
29	F	H	0.0000
30	S	H	-0.5805
31	S	H	-0.2387
32	Y	H	0.1317
33	A	H	0.0107
34	M	H	0.0000
35	S	H	0.0000
36	W	H	0.0000
37	V	H	0.0000
38	R	H	0.0000
39	Q	H	-0.7443
40	A	H	-1.1278
41	P	H	-0.9242
42	G	H	-1.4549
43	K	H	-2.3839
44	G	H	-1.5878
45	L	H	0.0000
46	E	H	-0.9613
47	W	H	0.0000
48	V	H	0.0000
49	S	H	0.0000
50	A	H	0.0000
51	I	H	0.0000
52	S	H	-0.2053
52A	G	H	-0.4436
53	S	H	-0.6811
54	G	H	-0.7470
55	G	H	-0.6970
56	S	H	-0.2020
57	T	H	0.3362
58	Y	H	0.6639
59	Y	H	-0.4099
60	A	H	-1.1928
61	D	H	-2.3817
62	S	H	-1.7343
63	V	H	0.0000
64	K	H	-2.4384
65	G	H	-1.7235
66	R	H	-1.4268
67	F	H	0.0000
68	T	H	-0.5804
69	I	H	0.0000
70	S	H	-0.3981
71	R	H	-0.9844
72	D	H	-1.4893
73	N	H	-1.7090
74	S	H	-1.5602
75	K	H	-2.5308
76	N	H	-2.0206
77	T	H	0.0000
78	L	H	0.0000
79	Y	H	-0.4572
80	L	H	0.0000
81	Q	H	-0.7715
82	M	H	0.0000
82A	N	H	-1.1614
82B	S	H	-1.2124
82C	L	H	0.0000
83	R	H	-2.1660
84	A	H	-1.6469
85	E	H	-2.1968
86	D	H	0.0000
87	T	H	-0.5065
88	A	H	0.0000
89	V	H	0.3584
90	Y	H	0.0000
91	Y	H	0.0000
92	C	H	0.0000
93	A	H	0.0000
94	I	H	0.0000
95	L	H	0.1169
96	G	H	-0.0525
97	A	H	-0.0158
98	T	H	-0.0456
99	S	H	-0.0410
100	L	H	0.1573
100A	S	H	0.0437
100B	A	H	0.0000
100C	F	H	0.0000
101	D	H	-0.4850
102	I	H	-0.2032
103	W	H	0.0000
104	G	H	0.0000
105	Q	H	-1.3643
106	G	H	-0.4792
107	T	H	0.0228
108	M	H	0.6407
109	V	H	0.0000
110	T	H	0.1300
111	V	H	0.0000
112	S	H	-0.7224
113	S	H	-0.5635
1	E	L	-1.6135
2	I	L	0.0000
3	V	L	0.6382
4	L	L	0.0000
5	T	L	-0.7866
6	Q	L	0.0000
7	S	L	-0.9952
8	P	L	-0.6451
9	G	L	-1.0991
10	T	L	-0.9796
11	L	L	-0.7342
12	S	L	-0.7436
13	L	L	-1.0920
14	S	L	-1.5659
15	P	L	-1.5988
16	G	L	-1.8605
17	E	L	-2.4945
18	R	L	-3.0147
19	A	L	0.0000
20	T	L	-0.7992
21	L	L	0.0000
22	S	L	-0.9068
23	C	L	0.0000
24	R	L	-2.3545
25	A	L	0.0000
26	S	L	-1.0349
27	Q	L	-1.7491
28	S	L	-1.4251
29	V	L	0.0000
30	S	L	-0.5211
30A	S	L	-0.5193
31	S	L	-0.0980
32	Y	L	0.2688
33	L	L	0.0000
34	A	L	0.0000
35	W	L	0.0000
36	Y	L	0.0000
37	Q	L	-0.6043
38	Q	L	0.0000
39	K	L	-1.3107
40	P	L	-0.8772
41	G	L	-1.4496
42	Q	L	-2.0770
43	A	L	-1.3200
44	P	L	0.0000
45	R	L	-1.2972
46	L	L	0.0000
47	L	L	0.0000
48	I	L	0.0000
49	Y	L	-0.1348
50	G	L	-0.1983
51	A	L	0.0000
52	S	L	-0.7168
53	S	L	-0.8523
54	R	L	-1.7328
55	A	L	0.0000
56	T	L	-0.6223
57	G	L	-0.8467
58	I	L	-0.9892
59	P	L	-1.2876
60	D	L	-2.4097
61	R	L	-1.9221
62	F	L	0.0000
63	S	L	-0.9615
64	G	L	0.0000
65	S	L	-0.6582
66	G	L	-1.1031
67	S	L	-1.0626
68	G	L	-1.2274
69	T	L	-1.8044
70	D	L	-2.2021
71	F	L	0.0000
72	T	L	-0.7637
73	L	L	0.0000
74	T	L	-0.8121
75	I	L	0.0000
76	S	L	-2.3184
77	R	L	-3.1983
78	L	L	0.0000
79	E	L	-1.6325
80	P	L	-1.4010
81	E	L	-1.6114
82	D	L	0.0000
83	F	L	0.0376
84	A	L	0.0000
85	V	L	-0.5866
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	G	L	-0.3421
93	S	L	-0.6469
94	S	L	-0.5028
95	P	L	-0.7415
96	L	L	-0.0489
97	T	L	-0.1184
98	F	L	0.0782
99	G	L	0.0000
100	Q	L	-1.4136
101	G	L	0.0000
102	T	L	0.0000
103	K	L	-1.5144
104	V	L	0.0000
105	E	L	-1.0075
106	I	L	-1.0137
107	K	L	-1.6634