Project name: 1C8Z

Chain sequence(s)	H: EVQLVESGGGLVQPGGSLRLSCAASGYDFTHYGMNWVRQAPGKGLEWVGWINTYTGEPTYAADFKRRFTFSLDTSKSTAYLQMNSLRAEDTAVYYCAKYPYYYGTSHWYFDVWGQGTLVTVSS; L: DIQLTQSPSSLSASVGDRVTITCSASQDISNYLNWYQQKPGKAPKVLIYFTSSLHSGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQYSTVPWTFGQGTKLEIK
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                                          (00:00:52)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:54)

• Minimal score value: -2.8181
• Maximal score value: 2.4072
• Average score: -0.4411
• Total score value: -101.4436

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	-1.9221
2	V	H	-1.0065
3	Q	H	-0.8596
4	L	H	0.0000
5	V	H	1.0737
6	E	H	0.0000
7	S	H	-0.2879
8	G	H	-0.6367
9	G	H	0.0768
11	G	H	0.7820
12	L	H	1.3446
13	V	H	-0.0324
14	Q	H	-1.2960
15	P	H	-1.5121
16	G	H	-1.3783
17	G	H	-1.1090
18	S	H	-1.1345
19	L	H	-0.9436
20	R	H	-1.9583
21	L	H	0.0000
22	S	H	-0.3102
23	C	H	0.0000
24	A	H	0.0821
25	A	H	0.0000
26	S	H	-0.9388
27	G	H	-1.3681
28	Y	H	-1.2472
29	D	H	-1.8329
30	F	H	0.0000
35	T	H	-0.4141
36	H	H	-0.8850
37	Y	H	-0.0993
38	G	H	-0.0726
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	-0.7544
45	A	H	-1.0946
46	P	H	-0.9731
47	G	H	-1.4166
48	K	H	-2.3987
49	G	H	-1.6658
50	L	H	0.0000
51	E	H	-1.4067
52	W	H	0.0000
53	V	H	0.0000
54	G	H	0.0000
55	W	H	-0.0112
56	I	H	0.0000
57	N	H	-0.2187
58	T	H	0.0000
59	Y	H	0.8709
62	T	H	0.1458
63	G	H	-0.3316
64	E	H	-0.8067
65	P	H	-0.6714
66	T	H	-0.1563
67	Y	H	-0.5293
68	A	H	0.0000
69	A	H	-1.2686
70	D	H	-2.1442
71	F	H	0.0000
72	K	H	-2.3744
74	R	H	-2.8181
75	R	H	-1.8723
76	F	H	0.0000
77	T	H	-0.9444
78	F	H	0.0000
79	S	H	-0.3836
80	L	H	-0.0153
81	D	H	-0.8379
82	T	H	-0.8423
83	S	H	-1.1365
84	K	H	-1.9141
85	S	H	-1.2619
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.3996
89	L	H	0.0000
90	Q	H	-1.1429
91	M	H	0.0000
92	N	H	-1.4072
93	S	H	-1.3193
94	L	H	0.0000
95	R	H	-1.9543
96	A	H	-1.5533
97	E	H	-2.1447
98	D	H	0.0000
99	T	H	-0.3417
100	A	H	0.0000
101	V	H	0.6877
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	K	H	0.0000
107	Y	H	0.0000
108	P	H	1.0519
109	Y	H	2.1017
110	Y	H	2.4072
111	Y	H	1.9971
111A	G	H	0.6208
112B	T	H	0.6706
112A	S	H	0.8287
112	H	H	0.9588
113	W	H	0.8222
114	Y	H	0.0000
115	F	H	0.0000
116	D	H	-0.1106
117	V	H	-0.1190
118	W	H	-0.2866
119	G	H	0.0000
120	Q	H	-1.2811
121	G	H	-0.3079
122	T	H	0.0000
123	L	H	1.6357
124	V	H	0.0000
125	T	H	0.3176
126	V	H	0.0000
127	S	H	-0.6685
128	S	H	-0.5619
1	D	L	-1.8475
2	I	L	0.0000
3	Q	L	-1.7816
4	L	L	0.0000
5	T	L	-0.8229
6	Q	L	0.0000
7	S	L	-0.4740
8	P	L	-0.5191
9	S	L	-0.8286
10	S	L	-0.8790
11	L	L	-0.6319
12	S	L	-0.8476
13	A	L	0.0000
14	S	L	-0.6236
15	V	L	0.2555
16	G	L	-0.6485
17	D	L	-1.4996
18	R	L	-2.1859
19	V	L	0.0000
20	T	L	-0.6262
21	I	L	0.0000
22	T	L	-0.5220
23	C	L	0.0000
24	S	L	-1.3020
25	A	L	0.0000
26	S	L	-1.7650
27	Q	L	-2.3958
28	D	L	-2.5428
29	I	L	0.0000
36	S	L	-0.9258
37	N	L	-0.3893
38	Y	L	0.5012
39	L	L	0.0000
40	N	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-1.0697
45	K	L	-1.4575
46	P	L	-1.0616
47	G	L	-1.6927
48	K	L	-2.5533
49	A	L	-1.5088
50	P	L	0.0000
51	K	L	-1.1735
52	V	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.7242
56	F	L	0.9098
57	T	L	0.0000
65	S	L	0.0295
66	S	L	0.3487
67	L	L	0.4595
68	H	L	-0.0645
69	S	L	-0.3532
70	G	L	-0.4841
71	V	L	-0.2766
72	P	L	-0.3296
74	S	L	-0.3969
75	R	L	-0.7407
76	F	L	0.0000
77	S	L	-0.3096
78	G	L	-0.1231
79	S	L	-0.6282
80	G	L	-0.9078
83	S	L	-1.0749
84	G	L	-1.5793
85	T	L	-1.8882
86	D	L	-2.1132
87	F	L	0.0000
88	T	L	-0.5825
89	L	L	0.0000
90	T	L	0.0000
91	I	L	0.0000
92	S	L	-1.4052
93	S	L	-1.1093
94	L	L	0.0000
95	Q	L	-0.5709
96	P	L	-0.8519
97	E	L	-1.4722
98	D	L	0.0000
99	F	L	0.2010
100	A	L	0.0000
101	T	L	-0.7079
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	Y	L	0.0000
108	S	L	-0.2055
109	T	L	0.3330
114	V	L	1.0063
115	P	L	0.2426
116	W	L	0.0000
117	T	L	-0.6306
118	F	L	-0.5112
119	G	L	0.0000
120	Q	L	-1.6968
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.4217
124	L	L	0.0000
125	E	L	-0.8626
126	I	L	-0.4724
127	K	L	-1.4919