Project name: P1C9

Chain sequence(s)	H: EVQLQQPGAELVKPGASVKLSCKASGYTFTNYWMHWVKQRPGRGLEWIGRIDPDTGDTKYNESFKSKATLTVDKPSSTAYMQLSSLTSEDSAVYYCARRAYYSKDALDYWGQGTSVTVSS; L: DIVLTQSPTSLAVSPGQRATISCRASESVDNYGISFMHWYQQKPGQPPKLLIYRASNLESGIPARFSGSGSRTDFTLTINPVETDDVATYYCQQSNKDPLTFGGGTKLELK
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                                          (00:02:03)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:04)

• Minimal score value: -3.0474
• Maximal score value: 1.4201
• Average score: -0.7008
• Total score value: -161.8917

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	-2.0908
2	V	H	-1.4020
3	Q	H	-2.1051
4	L	H	0.0000
5	Q	H	-2.1320
6	Q	H	0.0000
7	P	H	-0.9175
8	G	H	-0.8659
9	A	H	-0.1111
11	E	H	-0.0062
12	L	H	0.9403
13	V	H	-0.1756
14	K	H	-1.6199
15	P	H	-1.3204
16	G	H	-1.1003
17	A	H	-0.8841
18	S	H	-0.9682
19	V	H	0.0000
20	K	H	-1.2946
21	L	H	0.0000
22	S	H	-0.6809
23	C	H	0.0000
24	K	H	-1.8774
25	A	H	0.0000
26	S	H	-1.4319
27	G	H	-1.2527
28	Y	H	-0.6998
29	T	H	-0.5126
30	F	H	0.0000
35	T	H	-1.2808
36	N	H	-1.0790
37	Y	H	-0.0608
38	W	H	-0.1164
39	M	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.7686
45	R	H	-1.3317
46	P	H	-1.0781
47	G	H	-1.4743
48	R	H	-2.1513
49	G	H	-1.2497
50	L	H	0.0000
51	E	H	-0.5557
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	R	H	0.0000
56	I	H	0.0000
57	D	H	0.0000
58	P	H	0.0000
59	D	H	-2.0983
62	T	H	-1.0787
63	G	H	-0.9811
64	D	H	-1.1217
65	T	H	-0.8036
66	K	H	-1.4959
67	Y	H	-1.5438
68	N	H	-2.1138
69	E	H	-2.8155
70	S	H	-1.5971
71	F	H	-1.4864
72	K	H	-2.5481
74	S	H	-1.4696
75	K	H	-1.1948
76	A	H	0.0000
77	T	H	-0.6702
78	L	H	0.0000
79	T	H	-0.2789
80	V	H	-0.4986
81	D	H	-1.1483
82	K	H	-1.7386
83	P	H	-0.9122
84	S	H	-0.8877
85	S	H	-0.9623
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.2416
89	M	H	0.0000
90	Q	H	-1.0002
91	L	H	0.0000
92	S	H	-0.7952
93	S	H	-0.8333
94	L	H	0.0000
95	T	H	-1.2490
96	S	H	-1.4055
97	E	H	-1.9504
98	D	H	0.0000
99	S	H	-0.6292
100	A	H	0.0000
101	V	H	-0.0125
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0000
107	R	H	0.0000
108	A	H	0.0000
109	Y	H	1.2260
110	Y	H	1.4201
111	S	H	0.4591
112	K	H	0.0469
113	D	H	0.2416
114	A	H	0.0000
115	L	H	0.0000
116	D	H	-0.2140
117	Y	H	-0.0495
118	W	H	-0.4676
119	G	H	0.0000
120	Q	H	-1.4049
121	G	H	0.0000
122	T	H	0.0000
123	S	H	-0.1440
124	V	H	0.0000
125	T	H	-0.1169
126	V	H	0.0000
127	S	H	-0.5327
128	S	H	-0.7173
1	D	L	-2.1500
2	I	L	0.0000
3	V	L	0.6352
4	L	L	0.0000
5	T	L	-0.5456
6	Q	L	0.0000
7	S	L	-0.6115
8	P	L	-0.5142
9	T	L	-0.7461
10	S	L	-1.1948
11	L	L	-0.9384
12	A	L	-1.0933
13	V	L	0.0000
14	S	L	-1.8781
15	P	L	-1.9720
16	G	L	-2.0352
17	Q	L	-2.9420
18	R	L	-3.0474
19	A	L	0.0000
20	T	L	-0.6487
21	I	L	0.0000
22	S	L	-0.8793
23	C	L	0.0000
24	R	L	-2.5511
25	A	L	0.0000
26	S	L	-1.3615
27	E	L	-2.4188
28	S	L	-2.2545
29	V	L	0.0000
30	D	L	-1.3670
31	N	L	-0.6864
34	Y	L	0.9016
35	G	L	0.0024
36	I	L	0.3682
37	S	L	-0.5752
38	F	L	-0.3667
39	M	L	0.0000
40	H	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	-0.8372
44	Q	L	-1.1227
45	K	L	-1.3314
46	P	L	-0.9199
47	G	L	-1.2390
48	Q	L	-1.8165
49	P	L	-1.1331
50	P	L	0.0000
51	K	L	-1.3412
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.2431
56	R	L	-0.3234
57	A	L	0.0000
65	S	L	-0.4705
66	N	L	-0.5596
67	L	L	0.0573
68	E	L	-0.3923
69	S	L	-0.4266
70	G	L	-0.4580
71	I	L	-0.2448
72	P	L	-0.2678
74	A	L	-0.2337
75	R	L	-0.9143
76	F	L	0.0000
77	S	L	-0.4345
78	G	L	-0.4352
79	S	L	-0.7935
80	G	L	-1.4992
83	S	L	-1.6989
84	R	L	-2.9166
85	T	L	-2.5768
86	D	L	-2.6093
87	F	L	0.0000
88	T	L	-0.7795
89	L	L	0.0000
90	T	L	-0.7919
91	I	L	0.0000
92	N	L	-2.2592
93	P	L	-2.1307
94	V	L	0.0000
95	E	L	-2.2248
96	T	L	-1.6243
97	D	L	-1.8763
98	D	L	0.0000
99	V	L	-0.6466
100	A	L	0.0000
101	T	L	-1.0624
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	S	L	0.0000
108	N	L	-1.4287
109	K	L	-2.6627
114	D	L	-3.0228
115	P	L	-2.3166
116	L	L	0.0000
117	T	L	-0.4134
118	F	L	0.2915
119	G	L	0.0000
120	G	L	-0.7912
121	G	L	-1.0257
122	T	L	0.0000
123	K	L	-2.0964
124	L	L	0.0000
125	E	L	-2.0594
126	L	L	-1.4645
127	K	L	-1.9835