Project name: 4dau_modified_chains-ABC.pdb_stat_DIBS

Chain sequence(s)	A: MGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCCEERNLLSSVAYKNVVVGGQRAAWRVLSSSSIEQGPEVREYREKVETEELLQGVCDTTVLGLLDSHLIKEEAGDAEESSRVFYLKMKGDYYRYLAEVATKKRIIDSARRSSAYQEAMDISSKKEEMPPTNPIRLGLALNFSSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLLIMQLLRDNLTLWT; C: MGSMERASLIQKAKLAEQAERYEDMAAFMKGAVEKGEELSCCEERNLLSSVAYKNVVVGGQRAAWRVLSSSSIEQGPEVREYREKVETEELLQGVCDTTVLGLLDSHLIKEEAGDAEESSRVFYLKMKGDYYRYLAEVATKKRIIDSARRSSAYQEAMDISSKKEEMPPTNPIRLGLALNFSSVFHYEIANSPEEAISLAKTTFDEAMADLHTLSEDSYKDSTLLIMQLLRDNLTLWT; B: AMFQS
Distance of aggregation	10 Å
Dynamic mode	No

• Minimal score value: -4.0221
• Maximal score value: 1.186
• Average score: -1.1099
• Total score value: -496.1149

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
-2	M	A	-0.3012
-1	G	A	-0.9040
0	S	A	-0.5903
1	M	A	-0.8666
2	E	A	-1.9740
3	R	A	-1.7414
4	A	A	-0.7507
5	S	A	-1.0884
6	L	A	0.0000
7	I	A	-1.0156
8	Q	A	-1.2148
9	K	A	0.0000
10	A	A	0.0000
11	K	A	-2.3732
12	L	A	0.0000
13	A	A	0.0000
14	E	A	-2.8721
15	Q	A	-2.3804
16	A	A	0.0000
17	E	A	-3.0272
18	R	A	-2.3301
19	Y	A	-2.1370
20	E	A	-2.2865
21	D	A	-1.4975
22	M	A	0.0000
23	A	A	0.0000
24	A	A	-0.5944
25	F	A	0.0000
26	M	A	0.0000
27	K	A	-1.0538
28	G	A	0.0000
29	A	A	0.0000
30	V	A	0.0000
31	E	A	-2.9793
32	K	A	-2.7080
33	G	A	-2.8299
34	E	A	-3.6623
35	E	A	-3.5446
36	L	A	0.0000
37	S	A	-1.4022
38	C	A	-1.0757
39	E	A	-1.9453
40	E	A	-1.5700
41	R	A	-1.3288
42	N	A	-1.2580
43	L	A	0.0000
44	L	A	0.0000
45	S	A	0.0000
46	V	A	-0.5309
47	A	A	0.0000
48	Y	A	0.0000
49	K	A	-0.9738
50	N	A	-1.5359
51	V	A	0.0000
52	V	A	0.0000
53	G	A	-0.8219
54	G	A	-1.2475
55	Q	A	-1.4900
56	R	A	-1.1931
57	A	A	-0.9858
58	A	A	0.0000
59	W	A	-1.3981
60	R	A	-1.5888
61	V	A	-0.9006
62	L	A	0.0000
63	S	A	-1.2831
64	S	A	-0.7537
65	I	A	-0.4640
66	E	A	-1.4028
67	Q	A	-1.5039
78	G	A	-0.9995
79	P	A	-1.4312
80	E	A	-1.6792
81	V	A	-1.8163
82	R	A	-3.2277
83	E	A	-2.9751
84	Y	A	0.0000
85	R	A	-2.5932
86	E	A	-3.2653
87	K	A	-3.0616
88	V	A	0.0000
89	E	A	-2.6076
90	T	A	-2.2459
91	E	A	-2.8774
92	L	A	0.0000
93	Q	A	-1.9945
94	G	A	-1.6132
95	V	A	-1.0112
96	C	A	0.0000
97	D	A	-1.5639
98	T	A	-0.9758
99	V	A	0.0000
100	L	A	-0.9252
101	G	A	-1.1672
102	L	A	0.0000
103	L	A	0.0000
104	D	A	-2.3471
105	S	A	-2.0836
106	H	A	-2.9262
107	L	A	0.0000
108	I	A	0.0000
109	K	A	-3.2110
110	E	A	-4.0221
111	A	A	0.0000
112	G	A	-2.6153
113	D	A	-2.9173
114	A	A	-2.3120
115	E	A	-2.0726
116	S	A	0.0000
117	R	A	-1.9638
118	V	A	0.0000
119	F	A	0.0000
120	Y	A	0.0000
121	L	A	0.0000
122	K	A	0.0000
123	M	A	0.0000
124	K	A	-0.6957
125	G	A	0.0000
126	D	A	0.0000
127	Y	A	0.0000
128	Y	A	-0.6760
129	R	A	0.0000
130	Y	A	0.0000
131	L	A	0.0000
132	A	A	0.0000
133	E	A	-0.7782
134	V	A	0.0000
135	A	A	-1.0480
136	T	A	-0.7473
140	K	A	-3.0562
141	K	A	-3.6376
142	R	A	-3.6710
143	I	A	-2.2512
144	I	A	-2.3907
145	D	A	-3.4139
146	S	A	-2.1029
147	A	A	0.0000
148	R	A	-2.2983
149	S	A	-1.6531
150	A	A	0.0000
151	Y	A	0.0000
152	Q	A	-1.4042
153	E	A	-1.5863
154	A	A	0.0000
155	M	A	0.0000
156	D	A	-2.3010
157	I	A	-2.4318
158	S	A	0.0000
159	K	A	-3.1704
160	K	A	-3.4879
161	E	A	-3.5998
162	M	A	0.0000
163	P	A	-1.4500
164	P	A	-1.4524
165	T	A	0.0000
166	N	A	-0.8468
167	P	A	-0.4554
168	I	A	0.0000
169	R	A	-0.9205
170	L	A	0.0000
171	G	A	0.0000
172	L	A	0.0000
173	A	A	0.0000
174	L	A	0.0000
175	N	A	0.0000
176	F	A	0.0000
177	S	A	0.0000
178	V	A	0.0000
179	F	A	0.0000
180	H	A	-1.5227
181	Y	A	-1.4363
182	E	A	-1.8066
183	I	A	-1.0670
184	A	A	-1.6792
185	N	A	-2.0644
186	S	A	-1.9808
187	P	A	-1.9545
188	E	A	-2.7810
189	E	A	-2.9309
190	A	A	0.0000
191	I	A	-1.5275
192	S	A	-1.6197
193	L	A	-1.2819
194	A	A	0.0000
195	K	A	-2.6593
196	T	A	-1.6475
197	T	A	0.0000
198	F	A	-1.8387
199	D	A	-2.5679
200	E	A	-2.3229
201	A	A	0.0000
202	M	A	-0.4802
203	A	A	-0.8669
204	D	A	-0.8072
205	L	A	0.0000
206	H	A	-0.9716
207	T	A	-0.5903
208	L	A	-1.0468
209	S	A	-1.8372
210	E	A	-3.2223
211	D	A	-3.4801
212	S	A	-2.2072
213	Y	A	-1.8404
214	K	A	-3.0442
215	D	A	-2.7959
216	S	A	0.0000
217	T	A	-0.9716
218	L	A	-0.5419
219	I	A	0.0000
220	M	A	0.0000
221	Q	A	-1.5168
222	L	A	0.0000
223	L	A	0.0000
224	R	A	-2.3598
225	D	A	-1.3593
226	N	A	0.0000
227	L	A	-0.6021
228	T	A	0.0124
229	L	A	1.1860
230	W	A	0.0000
231	T	A	0.2213
8	A	B	0.5017
9	M	B	0.6072
11	F	B	0.0786
12	Q	B	-0.4141
13	S	B	-0.5243
-2	M	C	-0.2890
-1	G	C	-0.8985
0	S	C	-0.6051
1	M	C	-0.9095
2	E	C	-1.9980
3	R	C	-1.7504
4	A	C	-0.7680
5	S	C	-1.1095
6	L	C	0.0000
7	I	C	-1.0344
8	Q	C	-1.2315
9	K	C	0.0000
10	A	C	0.0000
11	K	C	-2.3405
12	L	C	0.0000
13	A	C	0.0000
14	E	C	-2.7703
15	Q	C	-2.3423
16	A	C	0.0000
17	E	C	-3.0087
18	R	C	-2.3052
19	Y	C	-2.1589
20	E	C	-2.2543
21	D	C	-1.5934
22	M	C	0.0000
23	A	C	0.0000
24	A	C	-0.6594
25	F	C	0.0000
26	M	C	0.0000
27	K	C	-1.1443
28	G	C	0.0000
29	A	C	0.0000
30	V	C	0.0000
31	E	C	-2.9934
32	K	C	-2.7017
33	G	C	-2.8159
34	E	C	-3.6580
35	E	C	-3.5301
36	L	C	0.0000
37	S	C	-1.4075
38	C	C	-1.0998
39	E	C	-2.0255
40	E	C	-1.5825
41	R	C	0.0000
42	N	C	-1.4569
43	L	C	0.0000
44	L	C	0.0000
45	S	C	-0.8857
46	V	C	-0.5433
47	A	C	0.0000
48	Y	C	0.0000
49	K	C	-1.7118
50	N	C	-1.6335
51	V	C	-1.0819
52	V	C	0.0000
53	G	C	-0.9757
54	G	C	-1.2658
55	Q	C	0.0000
56	R	C	-1.2458
57	A	C	-0.9995
58	A	C	0.0000
59	W	C	0.0000
60	R	C	-1.6567
61	V	C	-0.9373
62	L	C	0.0000
63	S	C	-1.3262
64	S	C	-0.7594
65	I	C	-0.4577
66	E	C	-1.3331
67	Q	C	-1.4607
78	G	C	-1.0337
79	P	C	-1.4989
80	E	C	-1.7858
81	V	C	-1.9092
82	R	C	-3.3848
83	E	C	-3.2855
84	Y	C	0.0000
85	R	C	-2.7142
86	E	C	-3.4371
87	K	C	-3.0012
88	V	C	0.0000
89	E	C	-2.4896
90	T	C	-1.9422
91	E	C	-2.1888
92	L	C	0.0000
93	Q	C	-1.7419
94	G	C	-1.3574
95	V	C	-0.8306
96	C	C	0.0000
97	D	C	-1.5099
98	T	C	-0.9842
99	V	C	0.0000
100	L	C	0.0000
101	G	C	-1.0888
102	L	C	0.0000
103	L	C	0.0000
104	D	C	-1.9830
105	S	C	-1.9438
106	H	C	-2.8497
107	L	C	0.0000
108	I	C	0.0000
109	K	C	-3.1453
110	E	C	-3.9941
111	A	C	0.0000
112	G	C	-2.5940
113	D	C	-2.8666
114	A	C	-2.2311
115	E	C	-1.8514
116	S	C	-1.7296
117	R	C	-1.9639
118	V	C	0.0000
119	F	C	0.0000
120	Y	C	0.0000
121	L	C	0.0000
122	K	C	-0.8285
123	M	C	0.0000
124	K	C	-0.6719
125	G	C	0.0000
126	D	C	0.0000
127	Y	C	0.0000
128	Y	C	-0.6087
129	R	C	0.0000
130	Y	C	0.0000
131	L	C	0.0000
132	A	C	0.0000
133	E	C	-0.7087
134	V	C	0.0000
135	A	C	-0.8591
136	T	C	-0.5881
140	K	C	-2.4103
141	K	C	-3.1676
142	R	C	-3.2385
143	I	C	-1.8421
144	I	C	-1.9100
145	D	C	-2.6005
146	S	C	-1.7304
147	A	C	0.0000
148	R	C	-2.2512
149	S	C	-1.5666
150	A	C	0.0000
151	Y	C	0.0000
152	Q	C	-1.8106
153	E	C	-1.7881
154	A	C	0.0000
155	M	C	0.0000
156	D	C	-2.4340
157	I	C	-2.4849
158	S	C	0.0000
159	K	C	-3.2822
160	K	C	-3.5460
161	E	C	-3.6109
162	M	C	0.0000
163	P	C	-1.4826
164	P	C	-1.4261
165	T	C	0.0000
166	N	C	-0.7115
167	P	C	-0.1820
168	I	C	-0.1087
169	R	C	-0.8097
170	L	C	0.0000
171	G	C	0.0719
172	L	C	0.0000
173	A	C	0.0000
174	L	C	0.0553
175	N	C	-0.2258
176	F	C	0.0000
177	S	C	0.0000
178	V	C	-0.4762
179	F	C	0.0000
180	H	C	-1.4647
181	Y	C	-1.4008
182	E	C	-1.8610
183	I	C	-1.0899
184	A	C	-1.5822
185	N	C	-2.0483
186	S	C	-1.9061
187	P	C	-1.8479
188	E	C	-2.6633
189	E	C	-2.6831
190	A	C	0.0000
191	I	C	-1.3410
192	S	C	-1.4528
193	L	C	-1.0742
194	A	C	0.0000
195	K	C	-2.2943
196	T	C	-1.4537
197	T	C	0.0000
198	F	C	-1.5535
199	D	C	-2.4223
200	E	C	-2.1770
201	A	C	0.0000
202	M	C	-0.4285
203	A	C	-0.8161
204	D	C	-0.7956
205	L	C	0.0000
206	H	C	-0.9904
207	T	C	-0.6175
208	L	C	-1.0768
209	S	C	-1.8682
210	E	C	-3.2535
211	D	C	-3.4763
212	S	C	-2.1238
213	Y	C	-1.8105
214	K	C	-2.7634
215	D	C	-2.3080
216	S	C	0.0000
217	T	C	-0.3690
218	L	C	0.6332
219	I	C	0.1181
220	M	C	0.0000
221	Q	C	-0.9528
222	L	C	-0.1345
223	L	C	0.0000
224	R	C	-2.1284
225	D	C	-1.4188
226	N	C	-0.5391
227	L	C	0.0000
228	T	C	-0.0121
229	L	C	0.9963
230	W	C	0.3674
231	T	C	0.2243