Project name: aa10154623c039a

Chain sequence(s)	H: VQLVESGGGVVQPGRSLRLDCKASGITFSNSGMHWVRQAPGKGLEWVAVIWYDGSKRYYADSVKGRFTISRDNSKNTLFLQMNSLRAEDTAVYYCATNDDYWGQGTLVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDK; L: EIVLTQSPATLSLSPGERATLSCRASQSVSSYLAWYQQKPGQAPRLLIYDASNRATGIPARFSGSGSGTDFTLTISSLEPEDFAVYYCQQSSNWPRTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR
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]                                                (00:00:01)
[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]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:04:18)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:21)

• Minimal score value: -3.9862
• Maximal score value: 1.3734
• Average score: -0.7616
• Total score value: -319.092

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	L	-1.6990
2	I	L	0.0000
3	V	L	0.5485
4	L	L	0.0000
5	T	L	-0.7272
6	Q	L	0.0000
7	S	L	-0.7250
8	P	L	-0.2973
9	A	L	-0.4068
10	T	L	-0.3299
11	L	L	-0.2299
12	S	L	-0.6322
13	L	L	-1.0597
14	S	L	-1.4745
15	P	L	-1.7438
16	G	L	-1.7188
17	E	L	-2.4511
18	R	L	-2.5759
19	A	L	0.0000
20	T	L	-0.6581
21	L	L	0.0000
22	S	L	-0.8882
23	C	L	0.0000
24	R	L	-2.4174
25	A	L	0.0000
26	S	L	-1.0935
27	Q	L	-1.7555
28	S	L	-1.2369
29	V	L	0.0000
30	S	L	-0.6018
31	S	L	-0.5113
32	Y	L	0.1458
33	L	L	0.0000
34	A	L	-0.3198
35	W	L	0.0000
36	Y	L	0.0000
37	Q	L	-0.7626
38	Q	L	0.0000
39	K	L	-1.3364
40	P	L	-1.2235
41	G	L	-1.3300
42	Q	L	-1.9933
43	A	L	-1.2919
44	P	L	0.0000
45	R	L	-1.1967
46	L	L	0.0000
47	L	L	0.0000
48	I	L	0.0000
49	Y	L	-1.0170
50	D	L	-1.7531
51	A	L	0.0000
52	S	L	-1.4096
53	N	L	-2.0616
54	R	L	-1.7242
55	A	L	-1.2522
56	T	L	-0.5866
57	G	L	-0.5529
58	I	L	-0.4855
59	P	L	-0.3625
60	A	L	-0.3535
61	R	L	-0.7768
62	F	L	0.0000
63	S	L	-0.6668
64	G	L	-0.8678
65	S	L	-1.0192
66	G	L	-1.2694
67	S	L	-1.1081
68	G	L	-1.0996
69	T	L	-1.8668
70	D	L	-2.4041
71	F	L	0.0000
72	T	L	-0.7928
73	L	L	0.0000
74	T	L	-0.6083
75	I	L	0.0000
76	S	L	-1.3820
77	S	L	-1.6747
78	L	L	0.0000
79	E	L	-2.0270
80	P	L	-2.2600
81	E	L	-2.5149
82	D	L	0.0000
83	F	L	0.0000
84	A	L	0.0000
85	V	L	-0.4344
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	S	L	-0.5563
92	S	L	-0.5561
93	N	L	-1.3675
94	W	L	-0.6273
95	P	L	-0.9903
96	R	L	-0.7022
97	T	L	-0.5059
98	F	L	-0.1612
99	G	L	0.0000
100	Q	L	-1.4830
101	G	L	0.0000
102	T	L	0.0000
103	K	L	-0.9597
104	V	L	0.0000
105	E	L	-0.8381
106	I	L	0.0000
107	K	L	-1.2065
108	R	L	-0.9438
109	T	L	-0.0175
110	V	L	0.4329
111	A	L	0.0072
112	A	L	-0.0872
113	P	L	0.0000
114	S	L	-0.0934
115	V	L	0.0559
116	F	L	0.2009
117	I	L	0.0724
118	F	L	0.0000
119	P	L	-0.6517
120	P	L	-0.6252
121	S	L	-1.4130
122	D	L	-2.5828
123	E	L	-2.4534
124	Q	L	0.0000
125	L	L	-1.8311
126	K	L	-2.6121
127	S	L	-1.5339
128	G	L	-1.3977
129	T	L	-1.0538
130	A	L	0.0000
131	S	L	0.0000
132	V	L	0.0000
133	V	L	0.0000
134	C	L	0.0000
135	L	L	0.0000
136	L	L	0.0000
137	N	L	0.0000
138	N	L	-0.8428
139	F	L	0.0000
140	Y	L	0.0000
141	P	L	-1.4791
142	R	L	-2.5030
143	E	L	-2.9476
144	A	L	-2.1238
145	K	L	-2.1491
146	V	L	-1.2245
147	Q	L	-0.5315
148	W	L	0.0000
149	K	L	-0.8496
150	V	L	0.0000
151	D	L	-2.5038
152	N	L	-1.8083
153	A	L	-0.5843
154	L	L	0.5813
155	Q	L	-0.0840
156	S	L	-0.3932
157	G	L	-0.8333
158	N	L	-0.6820
159	S	L	-1.0165
160	Q	L	-1.2754
161	E	L	-1.8345
162	S	L	-0.6472
163	V	L	-0.3897
164	T	L	-0.9132
165	E	L	-2.0062
166	Q	L	0.0000
167	D	L	-2.0432
168	S	L	-2.3297
169	K	L	-2.8293
170	D	L	-2.3094
171	S	L	0.0000
172	T	L	0.0000
173	Y	L	0.0000
174	S	L	0.0000
175	L	L	0.0000
176	S	L	0.0000
177	S	L	0.0000
178	T	L	-0.6208
179	L	L	0.0000
180	T	L	-0.2678
181	L	L	-0.5494
182	S	L	-1.2911
183	K	L	-2.2236
184	A	L	-2.0666
185	D	L	-2.9625
186	Y	L	0.0000
187	E	L	-3.9862
188	K	L	-3.7446
189	H	L	-3.4218
190	K	L	-3.2255
191	V	L	-2.0557
192	Y	L	0.0000
193	A	L	0.0000
194	C	L	0.0000
195	E	L	-0.8851
196	V	L	0.0000
197	T	L	-1.1264
198	H	L	-1.4375
199	Q	L	-1.6268
200	G	L	-0.3753
201	L	L	-0.1789
202	S	L	-0.4334
203	S	L	-0.4315
204	P	L	-0.4439
205	V	L	-0.1146
206	T	L	-0.5047
207	K	L	-0.6949
208	S	L	-0.6892
209	F	L	0.0000
210	N	L	-2.2165
211	R	L	-3.2118
2	V	H	1.1550
3	Q	H	-0.6063
4	L	H	0.0000
5	V	H	-0.8142
6	E	H	0.0000
7	S	H	-0.9552
8	G	H	-0.9001
9	G	H	-0.2493
10	G	H	-0.0753
11	V	H	0.0518
12	V	H	0.0000
13	Q	H	-1.5458
14	P	H	-2.1702
15	G	H	-2.2641
16	R	H	-2.7506
17	S	H	-1.9051
18	L	H	-1.4403
19	R	H	-2.1483
20	L	H	0.0000
21	D	H	-1.4927
22	C	H	0.0000
23	K	H	-2.4506
24	A	H	0.0000
25	S	H	-0.6233
26	G	H	-0.0160
27	I	H	0.1261
28	T	H	-0.2926
29	F	H	0.0000
30	S	H	-1.3505
31	N	H	-1.3457
32	S	H	-1.0824
33	G	H	-1.0943
34	M	H	0.0000
35	H	H	0.0000
36	W	H	0.0000
37	V	H	0.0000
38	R	H	0.0000
39	Q	H	-0.8774
40	A	H	-1.1628
41	P	H	-0.8901
42	G	H	-1.4434
43	K	H	-2.4172
44	G	H	-1.7126
45	L	H	0.0000
46	E	H	-1.5275
47	W	H	0.0000
48	V	H	0.0000
49	A	H	0.0000
50	V	H	0.0000
51	I	H	0.0000
52	W	H	-0.7780
53	Y	H	-0.7902
54	D	H	-1.9444
55	G	H	-1.4079
56	S	H	-1.2627
57	K	H	-1.5230
58	R	H	-1.1898
59	Y	H	-0.5106
60	Y	H	-0.8998
61	A	H	-1.3161
62	D	H	-2.4586
63	S	H	-1.6527
64	V	H	0.0000
65	K	H	-2.5663
66	G	H	-1.7681
67	R	H	-1.5867
68	F	H	0.0000
69	T	H	-0.8929
70	I	H	0.0000
71	S	H	-0.7990
72	R	H	-1.2060
73	D	H	-1.8025
74	N	H	-2.0891
75	S	H	-1.5576
76	K	H	-2.6412
77	N	H	-2.2560
78	T	H	0.0000
79	L	H	0.0000
80	F	H	-0.8217
81	L	H	0.0000
82	Q	H	-1.2409
83	M	H	0.0000
84	N	H	-1.9753
85	S	H	-1.8739
86	L	H	0.0000
87	R	H	-3.0868
88	A	H	-1.9009
89	E	H	-2.4375
90	D	H	0.0000
91	T	H	-0.7424
92	A	H	0.0000
93	V	H	0.2998
94	Y	H	0.0000
95	Y	H	0.0000
96	C	H	0.0000
97	A	H	0.0000
98	T	H	0.0000
99	N	H	-1.9095
100	D	H	-2.2321
101	D	H	-1.2323
102	Y	H	-0.0025
103	W	H	-0.3434
104	G	H	0.0000
105	Q	H	-1.4288
106	G	H	-0.5581
107	T	H	0.0059
108	L	H	0.6611
109	V	H	0.0000
110	T	H	-0.3182
111	V	H	0.0000
112	S	H	-0.5921
113	S	H	-0.6677
114	A	H	-0.3602
115	S	H	-0.5591
116	T	H	-0.9860
117	K	H	-1.4103
118	G	H	-1.5486
119	P	H	-0.7927
120	S	H	-0.5651
121	V	H	0.0000
122	F	H	0.0000
123	P	H	-0.8245
124	L	H	0.0000
125	A	H	-0.2419
126	P	H	-0.5324
127	S	H	-0.8703
128	S	H	-1.2309
129	K	H	-2.0517
130	S	H	-1.3172
131	T	H	-1.0531
132	S	H	-0.7562
133	G	H	-0.8145
134	G	H	-0.8702
135	T	H	-0.5797
136	A	H	0.0000
137	A	H	0.0000
138	L	H	0.3455
139	G	H	0.0000
140	C	H	0.0000
141	L	H	0.0000
142	V	H	0.0000
143	K	H	-0.4316
144	D	H	-0.5210
145	Y	H	0.0000
146	F	H	-0.3408
147	P	H	0.0000
148	E	H	-0.7120
149	P	H	-0.8721
150	V	H	0.0000
151	T	H	-0.7176
152	V	H	-0.4629
153	S	H	-0.4540
154	W	H	0.0000
155	N	H	-0.4385
156	S	H	-0.6381
157	G	H	-0.5888
158	A	H	-0.2400
159	L	H	0.0351
160	T	H	-0.1785
161	S	H	-0.1800
162	G	H	-0.2000
163	V	H	0.1963
164	H	H	-0.2631
165	T	H	-0.1165
166	F	H	0.0000
167	P	H	-0.2540
168	A	H	0.1889
169	V	H	0.6117
170	L	H	1.3734
171	Q	H	0.3032
172	S	H	-0.0861
173	S	H	-0.2357
174	G	H	0.0350
175	L	H	0.1098
176	Y	H	0.3411
177	S	H	0.2045
178	L	H	0.0000
179	S	H	0.0000
180	S	H	0.0000
181	V	H	0.0000
182	V	H	0.0000
183	T	H	-0.0693
184	V	H	0.0000
185	P	H	-0.5780
186	S	H	-0.8724
187	S	H	-0.8180
188	S	H	-0.5832
189	L	H	-0.7852
190	G	H	-0.9558
191	T	H	-0.6931
192	Q	H	-0.9436
193	T	H	-0.3484
194	Y	H	-0.1529
195	I	H	-0.2904
196	C	H	0.0000
197	N	H	-1.4994
198	V	H	0.0000
199	N	H	-2.0223
200	H	H	0.0000
201	K	H	-2.7351
202	P	H	-1.5799
203	S	H	-1.8352
204	N	H	-2.5861
205	T	H	-2.1628
206	K	H	-2.7094
207	V	H	-1.6488
208	D	H	-2.4298
209	K	H	-1.5285