Project name: SVAB38

Chain sequence(s)	A: DIQMTQSPSSLSASVGDRVTITCQASQDISNYLNWYQQKPGKAPKLLIYDASNLETGVPSRFSGSGSGTDFTFTISSLQPEDIATYFCQHFDHLPLAFGCGTKVEIKGGGGSGGGGSGGGGSQVQLQESGPGLVKPSETLSLTCTVSGGSVSSGDYAWTWIRQSPGKCLEWIGHIYYSGNTNYNPSLKSRLTISIDTSKTQFSLKLSSVTAADTAIYYCVRDRVTGAFDIWGQGTMVTVS
Selected Chain(s)	A
Distance of aggregation	5 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 A 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                                          (00:01:15)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:16)

• Minimal score value: -2.0018
• Maximal score value: 1.7172
• Average score: -0.2536
• Total score value: -60.8633

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	A	-1.7894
2	I	A	0.0000
3	Q	A	-1.1983
4	M	A	0.0000
5	T	A	-0.0516
6	Q	A	0.0000
7	S	A	-0.1504
8	P	A	-0.2090
9	S	A	-0.2772
10	S	A	-0.3736
11	L	A	0.1663
12	S	A	-0.3498
13	A	A	-0.0450
14	S	A	0.0868
15	V	A	0.7408
16	G	A	-0.3629
17	D	A	-1.2156
18	R	A	-2.0018
19	V	A	0.0000
20	T	A	-0.0545
21	I	A	0.0000
22	T	A	-0.0329
23	C	A	0.0000
24	Q	A	-1.1868
25	A	A	0.0000
26	S	A	-0.4152
27	Q	A	-1.4773
28	D	A	-2.0008
29	I	A	0.0000
30	S	A	-0.3147
31	N	A	-0.8726
32	Y	A	0.8991
33	L	A	0.0000
34	N	A	0.0000
35	W	A	0.0000
36	Y	A	0.0000
37	Q	A	0.0000
38	Q	A	0.0000
39	K	A	-0.2165
40	P	A	-0.3699
41	G	A	-0.6421
42	K	A	-0.7920
43	A	A	-0.1207
44	P	A	0.0000
45	K	A	-1.1264
46	L	A	0.0000
47	L	A	0.0000
48	I	A	0.0000
49	Y	A	0.1586
50	D	A	-0.7550
51	A	A	0.0000
52	S	A	-0.3137
53	N	A	-0.4569
54	L	A	0.3806
55	E	A	-0.2053
56	T	A	-0.2072
57	G	A	-0.4467
58	V	A	0.0638
59	P	A	-0.1512
60	S	A	-0.3009
61	R	A	-0.3898
62	F	A	0.0000
63	S	A	-0.2006
64	G	A	-0.1573
65	S	A	-0.2623
66	G	A	-0.2929
67	S	A	-0.2622
68	G	A	-0.3420
69	T	A	-0.4720
70	D	A	-1.4784
71	F	A	0.0000
72	T	A	-0.0209
73	F	A	0.0000
74	T	A	-0.0212
75	I	A	0.0000
76	S	A	-0.1983
77	S	A	-0.3433
78	L	A	0.0000
79	Q	A	-0.4301
80	P	A	-0.5232
81	E	A	-1.8366
82	D	A	0.0000
83	I	A	0.2544
84	A	A	0.0000
85	T	A	-0.2153
86	Y	A	0.0000
87	F	A	0.0000
88	C	A	0.0000
89	Q	A	0.0000
90	H	A	0.0000
91	F	A	0.4362
92	D	A	-0.8320
93	H	A	-1.0334
94	L	A	0.3234
95	P	A	0.1085
96	L	A	0.0000
97	A	A	0.0128
98	F	A	0.0000
99	G	A	0.0000
100	C	A	0.5667
101	G	A	0.0000
102	T	A	0.0000
103	K	A	-1.3725
104	V	A	0.0000
105	E	A	-1.6635
106	I	A	0.0000
107	K	A	-1.7845
108	G	A	-0.8056
109	G	A	-0.3371
110	G	A	-0.4607
111	G	A	-0.4306
112	S	A	-0.2914
113	G	A	-0.2284
114	G	A	-0.5715
115	G	A	-0.6383
116	G	A	-0.5917
117	S	A	-0.3146
118	G	A	-0.2988
119	G	A	-0.5665
120	G	A	-0.6359
121	G	A	-0.6078
122	S	A	-0.4401
123	Q	A	-0.7764
124	V	A	-0.0740
125	Q	A	-0.5711
126	L	A	0.0000
127	Q	A	-0.6183
128	E	A	0.0000
129	S	A	-0.2334
130	G	A	-0.4816
131	P	A	-0.3021
132	G	A	-0.0009
133	L	A	1.5023
134	V	A	0.0000
135	K	A	-1.7258
136	P	A	-0.4850
137	S	A	-0.5928
138	E	A	-1.8074
139	T	A	-0.3617
140	L	A	0.0000
141	S	A	-0.2222
142	L	A	0.0000
143	T	A	-0.0225
144	C	A	0.0000
145	T	A	-0.0659
146	V	A	0.0000
147	S	A	-0.1264
148	G	A	-0.2661
149	G	A	-0.5256
150	S	A	-0.2987
151	V	A	0.0000
152	S	A	-0.0693
153	S	A	-0.2268
154	G	A	-0.4108
155	D	A	-1.7172
156	Y	A	0.0838
157	A	A	0.1237
158	W	A	0.0000
159	T	A	0.0000
160	W	A	0.0000
161	I	A	0.0000
162	R	A	0.0000
163	Q	A	-0.1481
164	S	A	-0.1033
165	P	A	-0.3449
166	G	A	-0.8268
167	K	A	-1.7445
168	C	A	-0.0921
169	L	A	0.0000
170	E	A	-0.6255
171	W	A	0.0000
172	I	A	0.0000
173	G	A	0.0000
174	H	A	-0.1382
175	I	A	0.0000
176	Y	A	0.4351
177	Y	A	0.4193
178	S	A	-0.1865
179	G	A	-0.5262
180	N	A	-1.3246
181	T	A	-0.3984
182	N	A	-0.7038
183	Y	A	0.1072
184	N	A	-0.1101
185	P	A	-0.2563
186	S	A	-0.2484
187	L	A	0.0000
188	K	A	-1.7383
189	S	A	-0.5865
190	R	A	-0.4148
191	L	A	0.0000
192	T	A	-0.0467
193	I	A	0.0000
194	S	A	-0.0859
195	I	A	0.2434
196	D	A	-0.4801
197	T	A	-0.1987
198	S	A	-0.5340
199	K	A	-1.7429
200	T	A	-0.3838
201	Q	A	-0.2825
202	F	A	0.0000
203	S	A	-0.0460
204	L	A	0.0000
205	K	A	-1.3241
206	L	A	0.0000
207	S	A	-0.1689
208	S	A	-0.2637
209	V	A	0.0000
210	T	A	-0.0500
211	A	A	0.0581
212	A	A	0.0691
213	D	A	0.0000
214	T	A	-0.0129
215	A	A	0.0000
216	I	A	0.7357
217	Y	A	0.0000
218	Y	A	0.0000
219	C	A	0.0000
220	V	A	0.0000
221	R	A	-0.2283
222	D	A	0.0000
223	R	A	0.1241
224	V	A	1.7172
225	T	A	0.2552
226	G	A	0.0000
227	A	A	0.0000
228	F	A	0.0000
229	D	A	-0.2328
230	I	A	0.2469
231	W	A	0.1693
232	G	A	0.0000
233	Q	A	-1.2197
234	G	A	-0.3382
235	T	A	0.0610
236	M	A	0.6025
237	V	A	0.0000
238	T	A	0.0090
239	V	A	0.1306
240	S	A	-0.1811