Project name: c02934af375513b

Chain sequence(s)	H: EVALQQSGAELVKPGASVKLSCAASGFTIKDAYMHWVKQKPEQGLEWIGRIDSGSSNTNYDPTFKGKATITADDSSNTAYLQMSSLTSEDTAVYYCARVYAMDYWGQGTSVTVSSAKTTPPSVYPLAPGSAAQTNSMVTLGCLVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLSSSVSVPTSTETVTCNVAHAPSSTKVDKKIVPR; L: DIVMTQSPSSLTVTTGEKVTMTCKSSQSLLNSGAQKNYLTWYQQKPGQSPKLLIYWASTRESGVPDRFTGSGSGTDFTLSISGVQAEDLAVYYCQNNYNYPLTFGAGTKLELKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSWTDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC
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                                          (00:04:36)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:38)

• Minimal score value: -3.5056
• Maximal score value: 1.5539
• Average score: -0.7351
• Total score value: -317.5583

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	D	L	-1.4204
2	I	L	0.0000
3	V	L	0.6945
4	M	L	0.0000
5	T	L	-0.4685
6	Q	L	0.0000
7	S	L	-0.7269
8	P	L	-0.6048
9	S	L	-0.6089
10	S	L	-0.6325
11	L	L	-0.3539
12	T	L	-0.6935
13	V	L	0.0000
14	T	L	-1.7305
15	T	L	-1.7000
16	G	L	-2.0089
17	E	L	-3.0886
18	K	L	-2.9570
19	V	L	0.0000
20	T	L	-0.6357
21	M	L	0.0000
22	T	L	-0.8364
23	C	L	0.0000
24	K	L	-2.2754
25	S	L	0.0000
26	S	L	-1.0540
27	Q	L	-1.3867
28	S	L	-0.8716
29	L	L	0.0000
30	L	L	0.0555
31	N	L	-0.5806
32	S	L	-0.9172
33	G	L	-1.0203
34	A	L	-0.9064
35	Q	L	-1.4887
36	K	L	-0.8916
37	N	L	-0.1135
38	Y	L	0.5802
39	L	L	0.0000
40	T	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	-0.8607
44	Q	L	0.0000
45	K	L	-1.5104
46	P	L	-1.4437
47	G	L	-1.4482
48	Q	L	-2.0978
49	S	L	-1.4421
50	P	L	0.0000
51	K	L	-1.8070
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.2136
56	W	L	0.4717
57	A	L	0.0000
58	S	L	-0.4680
59	T	L	-0.5873
60	R	L	-1.5713
61	E	L	-1.5905
62	S	L	-0.8965
63	G	L	-1.0556
64	V	L	-1.2567
65	P	L	-1.4096
66	D	L	-2.3281
67	R	L	-1.7259
68	F	L	0.0000
69	T	L	-0.8465
70	G	L	-0.3402
71	S	L	-0.5329
72	G	L	-1.1278
73	S	L	-1.0212
74	G	L	-1.0191
75	T	L	-1.7670
76	D	L	-2.6080
77	F	L	0.0000
78	T	L	-0.7787
79	L	L	0.0000
80	S	L	-0.5889
81	I	L	0.0000
82	S	L	-2.1030
83	G	L	-1.8874
84	V	L	0.0000
85	Q	L	-1.7914
86	A	L	-1.1567
87	E	L	-1.9593
88	D	L	0.0000
89	L	L	-0.7483
90	A	L	0.0000
91	V	L	-0.3894
92	Y	L	0.0000
93	Y	L	0.0000
94	C	L	0.0000
95	Q	L	0.0000
96	N	L	0.0000
97	N	L	0.6834
98	Y	L	0.8157
99	N	L	0.0013
100	Y	L	0.5230
101	P	L	-0.1896
102	L	L	0.0000
103	T	L	-0.0990
104	F	L	0.0000
105	G	L	-0.1496
106	A	L	-0.5468
107	G	L	0.0000
108	T	L	0.0000
109	K	L	-0.9577
110	L	L	0.0000
111	E	L	-1.2688
112	L	L	-1.2316
113	K	L	-2.3768
114	R	L	-2.4780
115	A	L	-1.8302
116	D	L	-2.7092
117	A	L	-1.4696
118	A	L	-0.7405
119	P	L	0.0000
120	T	L	-0.2180
121	V	L	0.0000
122	S	L	0.0019
123	I	L	0.0068
124	F	L	0.0000
125	P	L	-0.5172
126	P	L	-0.4372
127	S	L	-0.8337
128	S	L	-1.1083
129	E	L	-1.5510
130	Q	L	0.0000
131	L	L	-1.1680
132	T	L	-0.8688
133	S	L	-0.8624
134	G	L	-1.1563
135	G	L	-1.0189
136	A	L	0.0000
137	S	L	0.0000
138	V	L	0.0000
139	V	L	0.0000
140	C	L	0.0000
141	F	L	0.0000
142	L	L	0.0000
143	N	L	0.0000
144	N	L	-0.9773
145	F	L	0.0000
146	Y	L	0.0000
147	P	L	-2.4057
148	K	L	-2.4103
149	D	L	-2.8013
150	I	L	0.0000
151	N	L	-2.0026
152	V	L	-0.8271
153	K	L	-1.7799
154	W	L	0.0000
155	K	L	-2.5002
156	I	L	0.0000
157	D	L	-2.1703
158	G	L	-1.7807
159	S	L	-2.1112
160	E	L	-3.3378
161	R	L	-2.9001
162	Q	L	-2.7674
163	N	L	-2.1987
164	G	L	-0.9701
165	V	L	-0.5258
166	L	L	0.0547
167	N	L	-0.3110
168	S	L	-0.0008
169	W	L	-0.2171
170	T	L	-1.0923
171	D	L	-2.1462
172	Q	L	-1.8262
173	D	L	-1.9798
174	S	L	-1.8766
175	K	L	-2.2971
176	D	L	-2.1109
177	S	L	0.0000
178	T	L	0.0000
179	Y	L	0.0000
180	S	L	0.0000
181	M	L	0.0000
182	S	L	0.0000
183	S	L	0.0000
184	T	L	0.0000
185	L	L	0.0000
186	T	L	-0.2206
187	L	L	-0.7599
188	T	L	-1.4828
189	K	L	-2.4125
190	D	L	-3.0138
191	E	L	-2.4606
192	Y	L	0.0000
193	E	L	-3.4691
194	R	L	-3.5056
195	H	L	-2.8748
196	N	L	-2.9240
197	S	L	-1.9938
198	Y	L	0.0000
199	T	L	0.0000
200	C	L	0.0000
201	E	L	-0.7267
202	A	L	0.0000
203	T	L	-1.1181
204	H	L	0.0000
205	K	L	-2.7334
206	T	L	-1.4359
207	S	L	-0.8860
208	T	L	-0.5770
209	S	L	-0.3732
210	P	L	-0.4303
211	I	L	0.5154
212	V	L	1.0017
213	K	L	-0.3042
214	S	L	-0.6549
215	F	L	0.0000
216	N	L	-2.3492
217	R	L	-2.6715
218	N	L	-2.6958
219	E	L	-2.5594
220	C	L	-0.9752
1	E	H	-1.7418
2	V	H	-0.4445
3	A	H	-0.6549
4	L	H	0.0000
5	Q	H	-1.4744
6	Q	H	0.0000
7	S	H	-0.9917
8	G	H	-0.8629
9	A	H	-0.5844
10	E	H	-0.9165
11	L	H	-0.3778
12	V	H	0.0000
13	K	H	-2.0419
14	P	H	-1.1669
15	G	H	-1.0510
16	A	H	-0.8455
17	S	H	-0.9549
18	V	H	-0.9417
19	K	H	-1.3905
20	L	H	0.0000
21	S	H	-0.7206
22	C	H	0.0000
23	A	H	-0.7022
24	A	H	0.0000
25	S	H	-0.9078
26	G	H	-1.1476
27	F	H	-0.7952
28	T	H	-1.2385
29	I	H	0.0000
30	K	H	-3.0570
31	D	H	-2.7720
32	A	H	-1.3567
33	Y	H	-0.7638
34	M	H	0.0000
35	H	H	0.0000
36	W	H	0.0000
37	V	H	0.0000
38	K	H	0.0000
39	Q	H	0.0000
40	K	H	-2.0337
41	P	H	-1.9836
42	E	H	-2.7263
43	Q	H	-2.5884
44	G	H	-1.6185
45	L	H	0.0000
46	E	H	-1.7985
47	W	H	0.0000
48	I	H	0.0000
49	G	H	0.0000
50	R	H	-0.5629
51	I	H	-0.5318
52	D	H	-1.3949
53	S	H	-1.7747
54	G	H	-2.0046
55	S	H	-1.2993
56	S	H	-1.1163
57	N	H	-1.4964
58	T	H	-1.1455
59	N	H	-1.4991
60	Y	H	-0.7989
61	D	H	-0.8665
62	P	H	-1.0230
63	T	H	-0.6792
64	F	H	-0.9549
65	K	H	-2.1835
66	G	H	-1.5588
67	K	H	-1.3023
68	A	H	0.0000
69	T	H	-0.7810
70	I	H	0.0000
71	T	H	-0.5140
72	A	H	-0.9371
73	D	H	-1.7715
74	D	H	-2.2788
75	S	H	-1.3176
76	S	H	-0.9908
77	N	H	-1.2359
78	T	H	-0.8806
79	A	H	0.0000
80	Y	H	-0.4384
81	L	H	0.0000
82	Q	H	-1.1231
83	M	H	0.0000
84	S	H	-0.8390
85	S	H	-0.8704
86	L	H	0.0000
87	T	H	-1.1226
88	S	H	-1.3098
89	E	H	-2.0260
90	D	H	0.0000
91	T	H	-0.8100
92	A	H	0.0000
93	V	H	-0.1810
94	Y	H	0.0000
95	Y	H	0.0000
96	C	H	0.0000
97	A	H	0.0000
98	R	H	0.0000
99	V	H	0.0000
105	Y	H	1.5539
106	A	H	0.8794
107	M	H	0.3575
108	D	H	-0.3970
109	Y	H	0.1731
110	W	H	-0.4336
111	G	H	0.0000
112	Q	H	-1.7072
113	G	H	0.0000
114	T	H	0.0000
115	S	H	-0.4141
116	V	H	0.0000
117	T	H	-0.5715
118	V	H	-0.9400
119	S	H	0.0000
120	S	H	-1.3163
121	A	H	-1.3898
122	K	H	-2.0214
123	T	H	-1.1558
124	T	H	-0.7553
125	P	H	-0.7243
126	P	H	-0.2941
127	S	H	-0.2905
128	V	H	-0.3242
129	Y	H	0.0000
130	P	H	-0.4586
131	L	H	0.0000
132	A	H	0.0000
133	P	H	-0.5774
134	G	H	-0.9323
135	S	H	-0.8184
136	A	H	-0.4921
137	A	H	-0.9857
138	Q	H	-1.6802
139	T	H	-1.1756
140	N	H	-1.6085
141	S	H	-0.4976
142	M	H	0.8651
143	V	H	0.7519
144	T	H	0.3443
145	L	H	0.0000
146	G	H	0.0000
147	C	H	0.0000
148	L	H	0.0000
149	V	H	0.0000
150	K	H	-0.0847
151	G	H	-0.0905
152	Y	H	0.0000
153	F	H	0.0000
154	P	H	-0.8234
155	E	H	-0.7975
156	P	H	-0.6906
157	V	H	-0.3325
158	T	H	-0.2461
159	V	H	-0.2046
160	T	H	-0.4082
161	W	H	0.0000
162	N	H	-1.0296
163	S	H	-0.8129
164	G	H	-0.7750
165	S	H	-0.5655
166	L	H	-0.2639
167	S	H	-0.4387
168	S	H	-0.5334
169	G	H	-0.3206
170	V	H	-0.0026
171	H	H	-0.2488
172	T	H	-0.0466
173	F	H	0.0000
174	P	H	-0.1483
175	A	H	0.2630
176	V	H	0.7674
177	L	H	0.8995
178	Q	H	-0.2433
179	S	H	-0.4888
180	D	H	-0.9677
181	L	H	-0.2431
182	Y	H	0.2975
183	T	H	0.0000
184	L	H	0.0000
185	S	H	0.0000
186	S	H	0.0000
187	S	H	0.0000
188	V	H	0.0000
189	S	H	0.1894
190	V	H	0.3026
191	P	H	0.0513
192	T	H	-0.2653
193	S	H	-0.7051
194	T	H	-0.9151
195	E	H	-1.6600
196	T	H	-0.9385
197	V	H	-0.5002
198	T	H	0.0000
199	C	H	0.0000
200	N	H	-1.3416
201	V	H	0.0000
202	A	H	-0.7966
203	H	H	0.0000
204	A	H	-0.5186
205	P	H	-0.3770
206	S	H	-0.6860
207	S	H	-0.6597
208	T	H	-0.9002
209	K	H	-1.8503
210	V	H	-1.2154
211	D	H	-1.9892
212	K	H	-1.5031
213	K	H	-1.4534
214	I	H	0.0000
215	V	H	0.5333
216	P	H	-0.6066
217	R	H	-1.6270