Project name: 10bd12bcf5d88ef

Chain sequence(s)	E: SVLTQPPSASGTPGQRVTISCSGSSSNIETNYVSWYQQFPGTAPKLLIYRNNQRPSGVPDRFSGSKSGTSASLAISGLRSEDEAEYYCGTWDDNSWVFGGGTKLTV; D: QLQLQESGPGLVKPSETLSLTCTVSGASIDRSTYYWGWIRQPPGKGLEWIANIYYNGRAVYSPSLKSRVTISVDTSKNQFSLKVRSLTAADTAVYYCATRWNYFFDFDYWGRGTLVTV
Selected Chain(s)	D,E
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                                          (00:01:43)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:44)

• Minimal score value: -2.8318
• Maximal score value: 2.0233
• Average score: -0.6381
• Total score value: -142.9306

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	D	-1.6285
2	L	D	0.0000
3	Q	D	-1.9667
4	L	D	0.0000
5	Q	D	-2.1721
6	E	D	-1.4140
7	S	D	-0.7563
8	G	D	-0.2733
9	P	D	0.1102
11	G	D	0.5002
12	L	D	1.1871
13	V	D	0.0000
14	K	D	-1.7044
15	P	D	-1.6663
16	S	D	-1.6447
17	E	D	-2.2900
18	T	D	-2.0530
19	L	D	0.0000
20	S	D	-0.9737
21	L	D	0.0000
22	T	D	-0.5694
23	C	D	0.0000
24	T	D	-1.2705
25	V	D	0.0000
26	S	D	-1.2114
27	G	D	-1.2399
28	A	D	-1.0280
29	S	D	-1.3361
30	I	D	0.0000
31	D	D	-2.8155
34	R	D	-2.8318
35	S	D	-1.4932
36	T	D	0.0000
37	Y	D	0.1554
38	Y	D	0.0000
39	W	D	0.0000
40	G	D	0.0000
41	W	D	0.0000
42	I	D	0.0000
43	R	D	0.0000
44	Q	D	0.0000
45	P	D	-0.8325
46	P	D	-0.9765
47	G	D	-1.5382
48	K	D	-2.2790
49	G	D	-1.5042
50	L	D	0.0000
51	E	D	-1.0771
52	W	D	0.0000
53	I	D	0.0000
54	A	D	0.0000
55	N	D	0.0000
56	I	D	0.0000
57	Y	D	-1.0217
58	Y	D	-1.6308
59	N	D	-2.3619
63	G	D	-1.8340
64	R	D	-2.2228
65	A	D	-0.8874
66	V	D	-0.5716
67	Y	D	-0.5388
68	S	D	0.0000
69	P	D	-0.9156
70	S	D	-0.8935
71	L	D	0.0000
72	K	D	-2.0102
74	S	D	-1.6478
75	R	D	-2.0193
76	V	D	0.0000
77	T	D	-1.0171
78	I	D	0.0000
79	S	D	-0.5995
80	V	D	-0.8166
81	D	D	-1.3482
82	T	D	-1.6225
83	S	D	-1.3883
84	K	D	-2.2126
85	N	D	-1.7225
86	Q	D	-1.3694
87	F	D	0.0000
88	S	D	-0.4535
89	L	D	0.0000
90	K	D	-1.4014
91	V	D	0.0000
92	R	D	-2.6902
93	S	D	-1.7700
94	L	D	0.0000
95	T	D	-0.4708
96	A	D	-0.0119
97	A	D	0.1522
98	D	D	0.0000
99	T	D	0.5372
100	A	D	0.0000
101	V	D	0.2887
102	Y	D	0.0000
103	Y	D	0.0000
104	C	D	0.0000
105	A	D	0.0000
106	T	D	0.0000
107	R	D	0.4452
108	W	D	0.6750
109	N	D	0.8344
110	Y	D	2.0233
112	F	D	2.0074
113	F	D	1.0649
114	D	D	0.0000
115	F	D	0.0000
116	D	D	-0.0925
117	Y	D	-0.3595
118	W	D	-0.8557
119	G	D	0.0000
120	R	D	-2.1644
121	G	D	0.0000
122	T	D	-0.2630
123	L	D	0.9353
124	V	D	0.0000
125	T	D	0.5846
126	V	D	0.2099
2	S	E	0.5400
3	V	E	1.5567
4	L	E	0.0000
5	T	E	0.1643
6	Q	E	0.0000
7	P	E	-0.5290
8	P	E	-0.8872
9	S	E	-0.7774
11	A	E	-0.3274
12	S	E	-0.1307
13	G	E	-0.6572
14	T	E	-0.7828
15	P	E	-1.3010
16	G	E	-1.8740
17	Q	E	-2.3768
18	R	E	-2.6558
19	V	E	0.0000
20	T	E	-0.6171
21	I	E	0.0000
22	S	E	-0.3985
23	C	E	0.0000
24	S	E	-0.3224
25	G	E	-0.4145
26	S	E	-0.3660
27	S	E	-0.9710
28	S	E	-1.0689
29	N	E	0.0000
30	I	E	0.0000
35	E	E	-1.5318
36	T	E	-0.8008
37	N	E	-0.8380
38	Y	E	-0.3170
39	V	E	0.0000
40	S	E	0.0000
41	W	E	0.0000
42	Y	E	0.0000
43	Q	E	0.0000
44	Q	E	0.0000
45	F	E	0.1168
46	P	E	-0.2785
47	G	E	-0.3910
48	T	E	-0.5405
49	A	E	-0.6846
50	P	E	0.0000
51	K	E	-1.5061
52	L	E	0.0000
53	L	E	0.0000
54	I	E	0.0000
55	Y	E	-0.5070
56	R	E	-1.4212
57	N	E	-1.9449
65	N	E	-2.5404
66	Q	E	-2.3124
67	R	E	-2.1586
68	P	E	-0.8220
69	S	E	-0.6831
70	G	E	-0.8312
71	V	E	-0.7736
72	P	E	-1.3111
74	D	E	-2.2201
75	R	E	-1.5785
76	F	E	0.0000
77	S	E	-1.3181
78	G	E	-1.2884
79	S	E	-1.3288
80	K	E	-1.2497
83	S	E	-0.9435
84	G	E	-1.0956
85	T	E	-1.0429
86	S	E	-0.8455
87	A	E	0.0000
88	S	E	-0.5037
89	L	E	0.0000
90	A	E	-0.6604
91	I	E	0.0000
92	S	E	-1.9179
93	G	E	-1.6889
94	L	E	0.0000
95	R	E	-2.1143
96	S	E	-1.7006
97	E	E	-2.2665
98	D	E	0.0000
99	E	E	-1.4341
100	A	E	0.0000
101	E	E	-0.6841
102	Y	E	0.0000
103	Y	E	0.0000
104	C	E	0.0000
105	G	E	0.0000
106	T	E	0.0000
107	W	E	-0.7985
108	D	E	-1.7379
109	D	E	-2.6140
114	N	E	-2.1136
115	S	E	-1.2330
116	W	E	0.0000
117	V	E	0.1963
118	F	E	0.0000
119	G	E	0.0000
120	G	E	-0.6178
121	G	E	-1.0569
122	T	E	0.0000
123	K	E	-1.1253
124	L	E	0.0000
125	T	E	-0.0190
126	V	E	0.3647