Query sequence : I3U217: (2017-12-21 ) MTTQELDELAHSEAGAFITKSCTINERKGNPEPRYFDVPLGSINSMGLPNLGFSYYLEYALAYEKVQENQNQPLFFSIAGMSVQENLEMLEKIEKSGFNGITELNLSCPNVPGKPQLAYDFEATYETLKEVFSIFSKPLGIKLPPYFDFAHFDQMADILNQFPLTYVNAINSVGNGLYIDTEQEAVVIKPKEGFGGIGGEYIKPTALANVRAFYTRLKPEIQIIGTGGIRTGQDAFEHLLCGASMLQIGTELHKEGPEIFSRIIKELTQIMSEKGYTSIDEFKGKLRTIS

Atome Classification :

	(108 SA)										Binding Score for complex ligand / Scwrl (Unconserved SChains Recalculated) model (Only selected ligand are displayed)
			(Atome)	(Ident)	(Tito)	(Num)		(pKd)	(Uniprot)		W7P_B_20(3W7P) PYRD_TRYCC [Raw transfer] W87_B_(3W87) PYRD_TRYCC [Raw transfer] W86_B_(3W86) PYRD_TRYCC [Raw transfer] DOR_A_5(2E68) PYRD_TRYCC [Raw transfer] DOR_B_7(2E68) PYRD_TRYCC [Raw transfer] W7O_B_15(3W7O) PYRD_TRYCC [Raw transfer] W88_B_(3W88) PYRD_TRYCC [Raw transfer] W7Q_B_17(3W7Q) PYRD_TRYCC [Raw transfer] W7F_B_17(3W7E) PYRD_TRYCC [Raw transfer] 34D_B_8(2BX7) PYRDA_LACLM [Raw transfer] DHB_B_8(2BSL) PYRDA_LACLM [Raw transfer] W7A_B_20(3W71) PYRD_TRYCC [Raw transfer] 5LL_B_25(5E93) PYRD_TRYCC [Raw transfer] GOL_B_18(3W7Q) PYRD_TRYCC [Raw transfer] GOL_B_21(3W71) PYRD_TRYCC [Raw transfer] 5LL_A_3(5E93) PYRD_TRYCC [Raw transfer] FMN_A_3(4EF8) ? [Raw transfer] FMN_A_15(3W7N) PYRD_TRYCC [Raw transfer] FMN_A_17(3W7M) PYRD_TRYCC [Raw transfer] FMN_A_9(3W84) PYRD_TRYCC [Raw transfer] FMN_B_5(1JRB) PYRDA_LACLM [Raw transfer] FMN_A_12(3W85) PYRD_TRYCC [Raw transfer] FMN_B_5(2DOR) PYRDA_LACLM [Raw transfer] FMN_B_24(3W7M) PYRD_TRYCC [Raw transfer] FMN_A_9(3C3N) PYRD_TRYCC [Raw transfer] FMN_A_13(3W7J) PYRD_TRYCC [Raw transfer] FMN_A_3(1JRB) PYRDA_LACLM [Raw transfer] FMN_B_(3W7I) PYRD_TRYCC [Raw transfer] FMN_D_12(3C3N) PYRD_TRYCC [Raw transfer] FMN_B_18(3W7N) PYRD_TRYCC [Raw transfer] FMN_B_18(3W84) PYRD_TRYCC [Raw transfer] FMN_B_19(3W70) PYRD_TRYCC [Raw transfer] FMN_A_3(2DOR) PYRDA_LACLM [Raw transfer] FMN_B_25(3W83) PYRD_TRYCC [Raw transfer] FMN_A_10(5E93) PYRD_TRYCC [Raw transfer] FMN_A_14(3W7C) PYRD_TRYCC [Raw transfer] FMN_A_3(2DOR) PYRDA_LACLM [Raw transfer] FMN_A_3(2DOR) PYRDA_LACLM [Raw transfer] FMN_A_5(1JQX) PYRDA_LACLM [Raw transfer] FMN_A_12(4JD4) PYRD_TRYCC [Raw transfer] FMN_B_7(2BX7) PYRDA_LACLM [Raw transfer] FMN_A_13(3W7K) PYRD_TRYCC [Raw transfer] FMN_A_18(3W7P) PYRD_TRYCC [Raw transfer] FMN_B_7(2BSL) PYRDA_LACLM [Raw transfer] FMN_B_7(1JQV) PYRDA_LACLM [Raw transfer] FMN_B_22(3C61) ? [Raw transfer] FMN_B_10(3C3N) PYRD_TRYCC [Raw transfer] FMN_A_14(4JDB) PYRD_TRYCC [Raw transfer] FMN_B_26(3W7J) PYRD_TRYCC [Raw transfer] FMN_A_12(3W73) PYRD_TRYCC [Raw transfer] FMN_B_7(1JQX) PYRDA_LACLM [Raw transfer] FMN_B_16(3W85) PYRD_TRYCC [Raw transfer] FMN_A_3(1DOR) PYRDA_LACLM [Raw transfer] FMN_B_22(3W7K) PYRD_TRYCC [Raw transfer] FMN_B_21(3W75) PYRD_TRYCC [Raw transfer] FMN_C_11(3C3N) PYRD_TRYCC [Raw transfer] FMN_A_19(3W88) PYRD_TRYCC [Raw transfer] FMN_A_12(3W75) PYRD_TRYCC [Raw transfer] FMN_A_15(3W7Q) PYRD_TRYCC [Raw transfer] FMN_A_3(2BSL) PYRDA_LACLM [Raw transfer] FMN_D_26(3C61) ? [Raw transfer] FMN_B_24(3W7C) PYRD_TRYCC [Raw transfer] FMN_B_4(1DOR) PYRDA_LACLM [Raw transfer] FMN_A_19(3W87) PYRD_TRYCC [Raw transfer] FMN_C_24(3C61) ? [Raw transfer] FMN_A_12(3W7G) PYRD_TRYCC [Raw transfer] FMN_A_13(3W70) PYRD_TRYCC [Raw transfer] FMN_B_7(2BSL) PYRDA_LACLM [Raw transfer] FMN_B_(3W74) PYRD_TRYCC [Raw transfer] FMN_A_13(3W7D) PYRD_TRYCC [Raw transfer] FMN_B_24(4JD4) PYRD_TRYCC [Raw transfer] FMN_B_21(3W76) PYRD_TRYCC [Raw transfer] FMN_A_13(3W7I) PYRD_TRYCC [Raw transfer] FMN_A_5(1JQV) PYRDA_LACLM [Raw transfer] FMN_A_14(3W86) PYRD_TRYCC [Raw transfer] FMN_A_19(3W88) PYRD_TRYCC [Raw transfer] FMN_A_19(3C61) ? [Raw transfer] FMN_A_13(3W76) PYRD_TRYCC [Raw transfer] FMN_B_11(3TQ0) ? [Raw transfer] FMN_A_13(3W83) PYRD_TRYCC [Raw transfer] FMN_B_21(4JDB) PYRD_TRYCC [Raw transfer] FMN_B_9(2E6D) PYRD_TRYCC [Raw transfer] FMN_A_4(2E6A) PYRD_TRYCC [Raw transfer] FMN_B_23(3W7D) PYRD_TRYCC [Raw transfer] FMN_A_13(3W74) PYRD_TRYCC [Raw transfer] FMN_A_13(3W7O) PYRD_TRYCC [Raw transfer] FMN_A_11(5EA9) PYRD_TRYCC [Raw transfer] FMN_A_4(2E6D) PYRD_TRYCC [Raw transfer] FMN_A_4(2E6F) PYRD_TRYCC [Raw transfer] FMN_A_4(2E6F) PYRD_TRYCC [Raw transfer] FMN_B_6(2E68) PYRD_TRYCC [Raw transfer] FMN_B_6(2E6F) PYRD_TRYCC [Raw transfer] FMN_A_18(3W71) PYRD_TRYCC [Raw transfer] FMN_B_26(3W7L) PYRD_TRYCC [Raw transfer] FMN_A_15(3W7E) PYRD_TRYCC [Raw transfer] FMN_A_4(2E68) PYRD_TRYCC [Raw transfer] FMN_B_22(3W73) PYRD_TRYCC [Raw transfer] FMN_B_6(2E6A) PYRD_TRYCC [Raw transfer] FMN_B_24(5EA9) PYRD_TRYCC [Raw transfer] FMN_A_5(1JUB) PYRDA_LACLM [Raw transfer] FMN_A_13(3W7H) PYRD_TRYCC [Raw transfer] FMN_A_3(2BX7) PYRDA_LACLM [Raw transfer] FMN_B_6(1OVD) PYRDA_LACLM [Raw transfer] FMN_B_(3W7H) PYRD_TRYCC [Raw transfer] FMN_B_6(1JUB) PYRDA_LACLM [Raw transfer] FMN_A_5(1JUE) PYRDA_LACLM [Raw transfer] FMN_A_5(1OVD) PYRDA_LACLM [Raw transfer] FMN_B_6(1JUB) PYRDA_LACLM [Raw transfer] FMN_B_6(1JUE) PYRDA_LACLM [Raw transfer] FMN_B_5(1JRC) PYRDA_LACLM [Raw transfer] FMN_A_3(1JRC) PYRDA_LACLM [Raw transfer] FMN_B_25(3W72) PYRD_TRYCC [Raw transfer] FMN_A_13(3W7L) PYRD_TRYCC [Raw transfer] FMN_A_16(3W72) PYRD_TRYCC [Raw transfer] FMN_B_21(3W7G) PYRD_TRYCC [Raw transfer] ACY_B_8(1JUE) PYRDA_LACLM [Raw transfer] ACY_A_7(1JUE) PYRDA_LACLM [Raw transfer]
25	PsiBlast_CBE		96.42	74%	-90	- C2 -	1DOR	7.9	PYRDA_LACLM
21	PsiBlast_CBE		96.35	74%	-92	- C2 -	2DOR	7.9	PYRDA_LACLM
23	PsiBlast_CBE		96.11	74%	-92	- C2 -	2BSL	8.1	PYRDA_LACLM
2	PsiBlast_PDB		96.08	74%	-92	- C2 -	2DOR	8.1	PYRDA_LACLM
1	PsiBlast_PDB		95.97	74%	-91	- C2 -	1DOR	8.0	PYRDA_LACLM
22	PsiBlast_CBE		95.67	74%	-94	- C2 -	2BX7	7.9	PYRDA_LACLM
24	PsiBlast_CBE		95.49	74%	-90	- C2 -	1JUE	7.9	PYRDA_LACLM
8	PsiBlast_PDB		95.32	73%	-93	- C2 -	1OVD	8.0	PYRDA_LACLM
3	PsiBlast_PDB		95.26	74%	-90	- C2 -	1JUE	8.0	PYRDA_LACLM
5	PsiBlast_PDB		95.10	74%	-91	- C2 -	2BX7	8.1	PYRDA_LACLM
10	PsiBlast_PDB		95.03	73%	-91	- C2 -	1JRC	8.0	PYRDA_LACLM
31	PsiBlast_CBE		94.98	73%	-93	- C2 -	1JQX	8.0	PYRDA_LACLM
26	PsiBlast_CBE		94.97	73%	-93	- C2 -	1OVD	8.2	PYRDA_LACLM
4	PsiBlast_PDB		94.93	74%	-89	- C2 -	2BSL	7.8	PYRDA_LACLM
29	PsiBlast_CBE		94.90	73%	-92	- C2 -	1JRB	7.9	PYRDA_LACLM
27	PsiBlast_CBE		94.89	73%	-92	- C2 -	1JUB	8.0	PYRDA_LACLM
7	PsiBlast_PDB		94.76	73%	-93	- C2 -	1JUB	8.0	PYRDA_LACLM
11	PsiBlast_PDB		94.65	73%	-92	- C2 -	1JQX	7.9	PYRDA_LACLM
30	PsiBlast_CBE		94.58	73%	-90	- C2 -	1JRC	8.2	PYRDA_LACLM
28	PsiBlast_CBE		94.58	73%	-94	- C2 -	1JQV	8.1	PYRDA_LACLM
6	PsiBlast_PDB		94.52	73%	-94	- C2 -	1JQV	7.8	PYRDA_LACLM
9	PsiBlast_PDB		94.28	73%	-91	- C2 -	1JRB	7.6	PYRDA_LACLM
78	PsiBlast_CBE		81.43	54%	-34	- C2 -	3W7H	8.2	PYRD_TRYCC
42	PsiBlast_CBE		81.31	54%	-33	- C2 -	3W87	7.2	PYRD_TRYCC
72	PsiBlast_CBE		81.26	54%	-34	- C2 -	3W7K	8.2	PYRD_TRYCC
74	PsiBlast_CBE		81.03	54%	-35	- C2 -	3W7J	8.0	PYRD_TRYCC
41	PsiBlast_CBE		81.00	54%	-34	- C2 -	3W88	6.7	PYRD_TRYCC
119	HHSearch		80.86	73%	-8	- C2 -	2BSL	8.1	PYRDA_LACLM
64	PsiBlast_CBE		80.79	54%	-35	- C2 -	3W7O	8.3	PYRD_TRYCC
82	PsiBlast_CBE		80.75	54%	-34	- C2 -	3W7E	8.1	PYRD_TRYCC
89	PsiBlast_CBE		80.74	54%	-34	- C2 -	3W75	8.2	PYRD_TRYCC
54	PsiBlast_CBE		80.69	54%	-36	- C2 -	3W85	8.4	PYRD_TRYCC
61	PsiBlast_CBE		80.67	54%	-35	- C2 -	3W7P	5.4	PYRD_TRYCC
67	PsiBlast_CBE		80.60	54%	-33	- C2 -	3W7M	8.0	PYRD_TRYCC
93	PsiBlast_CBE		80.36	54%	-34	- C2 -	3W73	8.2	PYRD_TRYCC
56	PsiBlast_CBE		80.30	54%	-33	- C2 -	3W84	7.6	PYRD_TRYCC
118	HHSearch		80.28	73%	-12	- C2 -	1JUB	8.0	PYRDA_LACLM
95	PsiBlast_CBE		80.25	54%	-35	- C2 -	3W72	8.0	PYRD_TRYCC
90	PsiBlast_CBE		80.25	54%	-33	- C2 -	3W75	8.2	PYRD_TRYCC
86	PsiBlast_CBE		80.21	54%	-33	- C2 -	3W7C	8.3	PYRD_TRYCC
68	PsiBlast_CBE		80.21	54%	-32	- C2 -	3W7M	8.1	PYRD_TRYCC
80	PsiBlast_CBE		80.20	54%	-33	- C2 -	3W7G	7.7	PYRD_TRYCC
76	PsiBlast_CBE		80.20	54%	-32	- C2 -	3W7I	8.2	PYRD_TRYCC
57	PsiBlast_CBE		80.16	54%	-30	- C2 -	3W83	7.8	PYRD_TRYCC
55	PsiBlast_CBE		80.15	54%	-33	- C2 -	3W84	8.0	PYRD_TRYCC
51	PsiBlast_CBE		80.14	54%	-32	- C2 -	3W86	6.1	PYRD_TRYCC
92	PsiBlast_CBE		80.12	54%	-33	- C2 -	3W74	8.4	PYRD_TRYCC
60	PsiBlast_CBE		79.99	54%	-34	- C2 -	3W7Q	8.5	PYRD_TRYCC
39	PsiBlast_CBE		79.96	54%	-30	- C2 -	5EA9	8.2	PYRD_TRYCC
66	PsiBlast_CBE		79.90	54%	-32	- C2 -	3W7N	7.9	PYRD_TRYCC
97	PsiBlast_CBE		79.88	54%	-31	- C2 -	3W71	5.9	PYRD_TRYCC
33	PsiBlast_CBE		79.88	55%	-29	- C2 -	3C3N	6.6	PYRD_TRYCC
19	PsiBlast_PDB		79.85	54%	-32	- C2 -	3W87	8.2	PYRD_TRYCC
70	PsiBlast_CBE		79.84	54%	-30	- C2 -	3W7L	8.4	PYRD_TRYCC
59	PsiBlast_CBE		79.83	54%	-33	- C2 -	3W7Q	7.0	PYRD_TRYCC
18	PsiBlast_PDB		79.81	54%	-32	- C2 -	3W88	8.2	PYRD_TRYCC
81	PsiBlast_CBE		79.75	54%	-31	- C2 -	3W7E	6.7	PYRD_TRYCC
34	PsiBlast_CBE		79.75	55%	-29	- C2 -	3C3N	7.7	PYRD_TRYCC
75	PsiBlast_CBE		79.72	54%	-29	- C2 -	3W7I	8.2	PYRD_TRYCC
50	PsiBlast_CBE		79.69	54%	-32	- C2 -	4JD4	8.2	PYRD_TRYCC
71	PsiBlast_CBE		79.68	54%	-31	- C2 -	3W7K	8.3	PYRD_TRYCC
88	PsiBlast_CBE		79.65	54%	-33	- C2 -	3W76	8.3	PYRD_TRYCC
87	PsiBlast_CBE		79.64	54%	-34	- C2 -	3W76	8.5	PYRD_TRYCC
84	PsiBlast_CBE		79.57	54%	-34	- C2 -	3W7D	8.2	PYRD_TRYCC
40	PsiBlast_CBE		79.53	54%	-26	- C2 -	5E93	3.8	PYRD_TRYCC
77	PsiBlast_CBE		79.51	54%	-32	- C2 -	3W7H	8.2	PYRD_TRYCC
69	PsiBlast_CBE		79.48	54%	-32	- C2 -	3W7L	8.2	PYRD_TRYCC
49	PsiBlast_CBE		79.43	54%	-33	- C2 -	4JD4	8.0	PYRD_TRYCC
99	PsiBlast_CBE		79.42	54%	-30	- C2 -	3W70	7.6	PYRD_TRYCC
98	PsiBlast_CBE		79.35	54%	-33	- C2 -	3W71	8.2	PYRD_TRYCC
91	PsiBlast_CBE		79.34	54%	-32	- C2 -	3W74	8.0	PYRD_TRYCC
79	PsiBlast_CBE		79.34	54%	-30	- C2 -	3W7G	8.4	PYRD_TRYCC
96	PsiBlast_CBE		79.31	54%	-32	- C2 -	3W72	8.6	PYRD_TRYCC
48	PsiBlast_CBE		79.28	54%	-29	- C2 -	4JDB	8.4	PYRD_TRYCC
62	PsiBlast_CBE		79.24	54%	-32	- C2 -	3W7P	8.3	PYRD_TRYCC
35	PsiBlast_CBE		79.24	54%	-24	- C2 -	3C61	7.5	?
32	PsiBlast_CBE		79.21	55%	-28	- C2 -	3C3N	7.3	PYRD_TRYCC
20	PsiBlast_PDB		79.18	54%	-28	- C2 -	5E93	8.3	PYRD_TRYCC
44	PsiBlast_CBE		79.09	54%	-28	- C2 -	2E6D	8.5	PYRD_TRYCC
52	PsiBlast_CBE		79.06	54%	-30	- C2 -	3W86	8.2	PYRD_TRYCC
16	PsiBlast_PDB		79.06	54%	-27	- C2 -	2E6D	8.4	PYRD_TRYCC
46	PsiBlast_CBE		79.03	54%	-26	- C2 -	2E68	8.3	PYRD_TRYCC
58	PsiBlast_CBE		79.00	54%	-27	- C2 -	3W83	7.1	PYRD_TRYCC
47	PsiBlast_CBE		78.98	54%	-32	- C2 -	4JDB	8.2	PYRD_TRYCC
12	PsiBlast_PDB		78.89	55%	-29	- C2 -	3C3N	7.5	PYRD_TRYCC
94	PsiBlast_CBE		78.84	54%	-31	- C2 -	3W73	8.2	PYRD_TRYCC
83	PsiBlast_CBE		78.80	54%	-32	- C2 -	3W7D	8.3	PYRD_TRYCC
14	PsiBlast_PDB		78.80	54%	-26	- C2 -	2E68	8.4	PYRD_TRYCC
85	PsiBlast_CBE		78.72	54%	-31	- C2 -	3W7C	8.3	PYRD_TRYCC
63	PsiBlast_CBE		78.72	54%	-31	- C2 -	3W7O	5.5	PYRD_TRYCC
45	PsiBlast_CBE		78.68	54%	-28	- C2 -	2E6A	8.4	PYRD_TRYCC
53	PsiBlast_CBE		78.65	54%	-30	- C2 -	3W85	8.2	PYRD_TRYCC
73	PsiBlast_CBE		78.55	54%	-32	- C2 -	3W7J	7.9	PYRD_TRYCC
100	PsiBlast_CBE		78.53	54%	-33	- C2 -	3W70	7.7	PYRD_TRYCC
43	PsiBlast_CBE		78.52	54%	-26	- C2 -	2E6F	8.5	PYRD_TRYCC
38	PsiBlast_CBE		78.52	54%	-26	- C2 -	5EA9	8.3	PYRD_TRYCC
37	PsiBlast_CBE		78.27	54%	-25	- C2 -	3C61	6.9	?
15	PsiBlast_PDB		78.10	54%	-25	- C2 -	2E6A	8.4	PYRD_TRYCC
17	PsiBlast_PDB		77.83	54%	-26	- C2 -	2E6F	8.5	PYRD_TRYCC
65	PsiBlast_CBE		77.60	54%	-31	- C2 -	3W7N	8.2	PYRD_TRYCC
13	PsiBlast_PDB		77.46	54%	-25	- C2 -	3C61	7.4	?
36	PsiBlast_CBE		77.20	54%	-23	- C2 -	3C61	6.6	?
101	Fugue		77.07	74%	31	- C2 -	2DOR	8.1	PYRDA_LACLM
113	HHSearch		76.59	53%	-23	- C2 -	3W88	8.2	PYRD_TRYCC
120	HHSearch		76.23	53%	-23	* C2 *	4EF8	7.8	?
115	HHSearch		75.86	53%	-19	- C2 -	3TQ0	7.5	?
114	HHSearch		74.98	53%	-17	- C2 -	2E6F	8.5	PYRD_TRYCC
102	Fugue		73.32	68%	7	- C2 -	2DOR	8.1	PYRDA_LACLM