Project name: 4mbe modified

Chain sequence(s)	A: LNSELLEEQKQEIYEAFSLFDMNNDGFLDYHELKVAMKALGFELPKREILDLIDEYDSEGRHLMKYDDFYIVMGEKILKRDPLDEIKRAFQLFDDDHTGKISIKNLRRVAKELGETLTDEELRAMIEEFDLDGDGEINENEFIAICTDS; C: TMDTAQLKSQIQQYLVESGNYELISNELKARLLQEGWVDKVKDLTKSEMNINESTNFTQILSTVEPKALEMVSDSTRETVLKQIREFLEEIVDT; B: YRKDFIDTMTRELYDAFLHERLYLIYMDSRAELKRNSTLKKKFFEKWQAS; G: LPTVGFDFI
Distance of aggregation	10 Å
Dynamic mode	No

• Minimal score value: -3.8623
• Maximal score value: 1.5169
• Average score: -1.1892
• Total score value: -359.127

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
13	L	A	-0.5494
14	N	A	-1.5422
15	S	A	-1.4774
16	E	A	-2.0347
17	L	A	0.0000
18	L	A	-0.9831
19	E	A	-2.5586
20	E	A	-2.0020
21	Q	A	-1.3507
22	K	A	-1.6226
23	Q	A	-1.7381
24	E	A	0.0000
25	I	A	0.0000
26	Y	A	0.5676
27	E	A	-0.3483
28	A	A	0.0000
29	F	A	0.0000
30	S	A	-0.2141
31	L	A	-0.0203
32	F	A	0.0000
33	D	A	-1.1184
34	M	A	-0.6350
35	N	A	-2.1287
36	N	A	-2.5079
37	D	A	-2.7126
38	G	A	-1.6415
39	F	A	-1.0493
40	L	A	0.0000
41	D	A	-1.2189
42	Y	A	-0.7696
43	H	A	-0.7802
44	E	A	-0.5474
45	L	A	0.0000
46	K	A	-1.6384
47	V	A	0.0000
48	A	A	0.0000
49	M	A	0.0000
50	K	A	-1.4183
51	A	A	0.0000
52	L	A	0.0000
53	G	A	-0.9879
54	F	A	-1.1149
55	E	A	-2.3549
56	L	A	-2.0050
57	P	A	-2.6321
58	K	A	-3.5930
59	R	A	-3.6781
60	E	A	-3.6319
61	I	A	0.0000
62	L	A	-2.8574
63	D	A	-3.8329
64	L	A	-2.2902
65	I	A	0.0000
66	D	A	-3.8623
67	E	A	-2.9704
68	Y	A	-1.8185
69	D	A	-2.8499
70	S	A	-2.1833
71	E	A	-3.0611
72	G	A	-2.8064
73	R	A	-3.3395
74	H	A	-2.3310
75	L	A	-1.4993
76	M	A	0.0000
77	K	A	-1.2556
78	Y	A	-0.6634
79	D	A	-1.5654
80	D	A	-0.7613
81	F	A	0.0000
82	Y	A	0.0123
83	I	A	0.3616
84	V	A	0.0000
85	M	A	0.0000
86	G	A	0.0000
87	E	A	-1.5550
88	K	A	-1.3303
89	I	A	0.0000
90	L	A	-1.2492
91	K	A	-2.4503
92	R	A	-2.3629
93	D	A	-2.8426
94	P	A	-1.8303
95	L	A	-1.4046
96	D	A	-2.7966
97	E	A	-1.9875
98	I	A	0.0000
99	K	A	-2.2790
100	R	A	-1.8573
101	A	A	0.0000
102	F	A	0.0000
103	Q	A	-2.7123
104	L	A	-1.6541
105	F	A	0.0000
106	D	A	0.0000
107	D	A	-3.4400
108	D	A	-3.6234
109	H	A	-2.9678
110	T	A	-1.9476
111	G	A	-2.0718
112	K	A	-2.4384
113	I	A	0.0000
114	S	A	-1.6535
115	I	A	-1.4169
116	K	A	-2.3947
117	N	A	0.0000
118	L	A	0.0000
119	R	A	-2.9937
120	R	A	-2.6551
121	V	A	0.0000
122	A	A	0.0000
123	K	A	-3.1015
124	E	A	-2.9135
125	L	A	-1.9806
126	G	A	-1.8646
127	E	A	-1.9893
128	T	A	-0.8569
129	L	A	-1.2986
130	T	A	-1.7460
131	D	A	-2.5829
132	E	A	-3.0764
133	E	A	-2.8411
134	L	A	0.0000
135	R	A	-2.8130
136	A	A	-2.6243
137	M	A	0.0000
138	I	A	0.0000
139	E	A	-3.3560
140	E	A	-2.5039
141	F	A	-1.2921
142	D	A	-1.8960
143	L	A	-0.6931
144	D	A	-2.2786
145	G	A	-2.2834
146	D	A	-3.0111
147	G	A	-2.1679
148	E	A	-2.2944
149	I	A	0.0000
150	N	A	-1.8581
151	E	A	-2.0903
152	N	A	-1.6822
153	E	A	0.0000
154	F	A	0.0000
155	I	A	-0.7565
156	A	A	-0.7192
157	I	A	0.0000
158	C	A	-0.5274
159	T	A	-0.8655
160	D	A	-1.9289
161	S	A	-1.1532
756	Y	B	0.1817
757	R	B	-1.2495
758	K	B	-2.3726
759	D	B	-2.1538
760	F	B	-0.8173
761	I	B	0.0000
762	D	B	-2.3134
763	T	B	-1.8327
764	M	B	0.0000
765	T	B	0.0000
766	R	B	-2.9185
767	E	B	-2.3919
768	L	B	0.0000
769	Y	B	0.0000
770	D	B	-2.6007
771	A	B	0.0000
772	F	B	0.0000
773	L	B	0.0000
774	H	B	-0.8507
775	E	B	0.0000
776	R	B	-0.3275
777	L	B	0.0000
778	Y	B	0.2690
779	L	B	0.4340
780	I	B	-0.0754
781	Y	B	0.0843
782	M	B	0.0000
783	D	B	-0.4127
784	S	B	0.0000
785	R	B	0.0000
786	A	B	0.0000
787	E	B	-0.7665
788	L	B	-0.5553
789	K	B	-0.5436
790	R	B	0.0000
791	N	B	-0.7408
792	S	B	-0.8067
793	T	B	0.0000
794	L	B	0.0000
795	K	B	-1.4898
796	K	B	-2.1023
797	K	B	-1.7662
798	F	B	0.0000
799	F	B	0.0000
800	E	B	-2.8214
801	K	B	-2.0795
802	W	B	0.0000
803	Q	B	-1.7565
804	A	B	-1.0755
805	S	B	-1.2952
2	T	C	-0.3326
3	M	C	-0.4870
4	D	C	-1.6755
5	T	C	-0.7428
6	A	C	-0.4026
7	Q	C	-0.9216
8	L	C	-0.5273
9	K	C	-0.2792
10	S	C	-0.2805
11	Q	C	-0.6770
12	I	C	0.0000
13	Q	C	-0.6102
14	Q	C	-1.2841
15	Y	C	-0.6010
16	L	C	0.0000
17	V	C	-0.7801
18	E	C	-1.8842
19	S	C	-1.1944
20	G	C	-1.0624
21	N	C	-0.7337
22	Y	C	0.0000
23	E	C	-1.1079
24	L	C	-0.2910
25	I	C	0.0000
26	S	C	0.0000
27	N	C	-1.4660
28	E	C	-1.4479
29	L	C	0.0000
30	K	C	-1.1135
31	A	C	-0.8765
32	R	C	-1.1667
33	L	C	0.0000
34	L	C	0.1713
35	Q	C	-0.9723
36	E	C	-1.1230
37	G	C	-1.1533
38	W	C	0.0000
39	V	C	-1.4864
40	D	C	-2.8561
41	K	C	-3.1269
42	V	C	0.0000
43	K	C	-2.7177
44	D	C	-3.3653
45	L	C	-2.3334
46	T	C	0.0000
47	K	C	-2.1782
48	S	C	-1.9511
49	E	C	-2.0294
50	M	C	0.0000
51	N	C	-1.4864
52	I	C	-0.0922
53	N	C	-1.9360
54	E	C	-2.8449
55	S	C	-1.7504
56	T	C	-1.3650
57	N	C	-1.5218
58	F	C	-0.7469
59	T	C	-0.5920
60	Q	C	-1.2008
61	I	C	-0.5987
62	L	C	0.0000
63	S	C	-0.8009
64	T	C	-0.8834
65	V	C	0.0000
66	E	C	-1.2331
67	P	C	-1.4921
68	K	C	-2.3488
69	A	C	0.0000
70	L	C	-1.5085
71	E	C	-2.5536
72	M	C	-1.6004
73	V	C	0.0000
74	S	C	-1.7868
75	D	C	-2.8521
76	S	C	-1.8894
77	T	C	0.0000
78	R	C	-2.4674
79	E	C	-3.0904
80	T	C	-2.1459
81	V	C	0.0000
82	L	C	-2.4921
83	K	C	-3.2617
84	Q	C	-2.4680
85	I	C	0.0000
86	R	C	-3.7241
87	E	C	-3.6109
88	F	C	0.0000
89	L	C	0.0000
90	E	C	-2.8934
91	E	C	-2.6726
92	I	C	-1.0067
93	V	C	-1.0818
94	D	C	-1.9767
95	T	C	-0.8699
331	L	G	1.4115
332	P	G	0.6642
333	T	G	0.9469
334	V	G	1.5169
335	G	G	0.0000
336	F	G	0.0000
337	D	G	-1.1882
338	F	G	0.0000
339	I	G	1.1553