Atome 2 Filter

Binding Site Prediction
[Download fasta file] - [Download text file]
Binding Site Number :C4_S1
Best Complexes choosen after comparative docking [pKd > 3] : 5 (5 maxi)

Complexes [Theoretical pKd]	File	Volume (A3) (FPocket)	Hydrophobicity Score(FPocket)	Contacts Ligand/Receptor [<4A] in Site C4_S1
Complex: 5M2_A_3(5ECV) / Model_24(5ECV/A) = [5.6]	Download	474.72	23.81	MTARIQKGKLAIAKELYDFIENEALPGSGLDSETYWKNFEQVVVDLSPKNKALLAKRDELQAKIDEWHRNNKFELGAYKAFLTEIGYLLPEVEDFQITTENVDEEIALLAGPQLVVPVRNARYCLNAANARWGSLYDALYGFDVISEEGGAEKGKGYNPVRGAKVIEFAKNFLNEIFPLAQGSHADATKYAIEQNKIVVTLKDGTKTGLAHEAQFVGFNGEEANPSEVVLLSNGLHVIIEIDANSPIGQTDLAGVKDLTLEAAVTTIQDLEDSVAAVDAEEKVEGYRNWLGLMKGTLQESIEKNGKTIVRALNKDREIKNLIGGTTKLHGRSLMLLRNVGHLMTNPAILVDGEEIFEGIMDALVTPLLSIADIRSENENKNSRKGSMYIVKPKMHGPEEVAFAVELFERAEQALGLPAKSLKIGIMDEERRTSVNLKNCIAAAKDRTIFINTGFMDRTGDEIHTSMEAAPVVRKEAVKTQKWIAAYENRNVAIGLKCGLQGKAQIGKGMWPKPDSMKDMLATKAAHPNAGASCAWVPSPTGAVLHAMHYHQVNVKARQDQLKAEEMLSLDDLLTPPFATDTNWSAEEINNELENNCQGILGYVVRWVDLGVGCSKVPDINNVGLMEDRATLRISSQHVANWLRHGIVTREQVEEVLKRMAKIVDEQNANDPLYKPMAANFETNIAFQAASDLIFKGCEQPSGYTEPLLHAARLKLKGYTGD
Complex: I93_A_3(3SB0) / Model_9(3SB0/A) = [5.4]	Download	477.87	23.61	MTARIQKGKLAIAKELYDFIENEALPGSGLDSETYWKNFEQVVVDLSPKNKALLAKRDELQAKIDEWHRNNKFELGAYKAFLTEIGYLLPEVEDFQITTENVDEEIALLAGPQLVVPVRNARYCLNAANARWGSLYDALYGFDVISEEGGAEKGKGYNPVRGAKVIEFAKNFLNEIFPLAQGSHADATKYAIEQNKIVVTLKDGTKTGLAHEAQFVGFNGEEANPSEVVLLSNGLHVIIEIDANSPIGQTDLAGVKDLTLEAAVTTIQDLEDSVAAVDAEEKVEGYRNWLGLMKGTLQESIEKNGKTIVRALNKDREIKNLIGGTTKLHGRSLMLLRNVGHLMTNPAILVDGEEIFEGIMDALVTPLLSIADIRSENENKNSRKGSMYIVKPKMHGPEEVAFAVELFERAEQALGLPAKSLKIGIMDEERRTSVNLKNCIAAAKDRTIFINTGFMDRTGDEIHTSMEAAPVVRKEAVKTQKWIAAYENRNVAIGLKCGLQGKAQIGKGMWPKPDSMKDMLATKAAHPNAGASCAWVPSPTGAVLHAMHYHQVNVKARQDQLKAEEMLSLDDLLTPPFATDTNWSAEEINNELENNCQGILGYVVRWVDLGVGCSKVPDINNVGLMEDRATLRISSQHVANWLRHGIVTREQVEEVLKRMAKIVDEQNANDPLYKPMAANFETNIAFQAASDLIFKGCEQPSGYTEPLLHAARLKLKGYTGD
Complex: 5ER_A_6(5DRC) / Model_6(5DRC/A) = [5.4]	Download	425.38	22.50	MTARIQKGKLAIAKELYDFIENEALPGSGLDSETYWKNFEQVVVDLSPKNKALLAKRDELQAKIDEWHRNNKFELGAYKAFLTEIGYLLPEVEDFQITTENVDEEIALLAGPQLVVPVRNARYCLNAANARWGSLYDALYGFDVISEEGGAEKGKGYNPVRGAKVIEFAKNFLNEIFPLAQGSHADATKYAIEQNKIVVTLKDGTKTGLAHEAQFVGFNGEEANPSEVVLLSNGLHVIIEIDANSPIGQTDLAGVKDLTLEAAVTTIQDLEDSVAAVDAEEKVEGYRNWLGLMKGTLQESIEKNGKTIVRALNKDREIKNLIGGTTKLHGRSLMLLRNVGHLMTNPAILVDGEEIFEGIMDALVTPLLSIADIRSENENKNSRKGSMYIVKPKMHGPEEVAFAVELFERAEQALGLPAKSLKIGIMDEERRTSVNLKNCIAAAKDRTIFINTGFMDRTGDEIHTSMEAAPVVRKEAVKTQKWIAAYENRNVAIGLKCGLQGKAQIGKGMWPKPDSMKDMLATKAAHPNAGASCAWVPSPTGAVLHAMHYHQVNVKARQDQLKAEEMLSLDDLLTPPFATDTNWSAEEINNELENNCQGILGYVVRWVDLGVGCSKVPDINNVGLMEDRATLRISSQHVANWLRHGIVTREQVEEVLKRMAKIVDEQNANDPLYKPMAANFETNIAFQAASDLIFKGCEQPSGYTEPLLHAARLKLKGYTGD
Complex: 043_A_2(3SAZ) / Model_8(3SAZ/A) = [5.3]	Download	499.04	23.61	MTARIQKGKLAIAKELYDFIENEALPGSGLDSETYWKNFEQVVVDLSPKNKALLAKRDELQAKIDEWHRNNKFELGAYKAFLTEIGYLLPEVEDFQITTENVDEEIALLAGPQLVVPVRNARYCLNAANARWGSLYDALYGFDVISEEGGAEKGKGYNPVRGAKVIEFAKNFLNEIFPLAQGSHADATKYAIEQNKIVVTLKDGTKTGLAHEAQFVGFNGEEANPSEVVLLSNGLHVIIEIDANSPIGQTDLAGVKDLTLEAAVTTIQDLEDSVAAVDAEEKVEGYRNWLGLMKGTLQESIEKNGKTIVRALNKDREIKNLIGGTTKLHGRSLMLLRNVGHLMTNPAILVDGEEIFEGIMDALVTPLLSIADIRSENENKNSRKGSMYIVKPKMHGPEEVAFAVELFERAEQALGLPAKSLKIGIMDEERRTSVNLKNCIAAAKDRTIFINTGFMDRTGDEIHTSMEAAPVVRKEAVKTQKWIAAYENRNVAIGLKCGLQGKAQIGKGMWPKPDSMKDMLATKAAHPNAGASCAWVPSPTGAVLHAMHYHQVNVKARQDQLKAEEMLSLDDLLTPPFATDTNWSAEEINNELENNCQGILGYVVRWVDLGVGCSKVPDINNVGLMEDRATLRISSQHVANWLRHGIVTREQVEEVLKRMAKIVDEQNANDPLYKPMAANFETNIAFQAASDLIFKGCEQPSGYTEPLLHAARLKLKGYTGD
Complex: XI7_A_2(3S9I) / Model_7(3S9I/A) = [5.1]	Download	432.18	27.04	MTARIQKGKLAIAKELYDFIENEALPGSGLDSETYWKNFEQVVVDLSPKNKALLAKRDELQAKIDEWHRNNKFELGAYKAFLTEIGYLLPEVEDFQITTENVDEEIALLAGPQLVVPVRNARYCLNAANARWGSLYDALYGFDVISEEGGAEKGKGYNPVRGAKVIEFAKNFLNEIFPLAQGSHADATKYAIEQNKIVVTLKDGTKTGLAHEAQFVGFNGEEANPSEVVLLSNGLHVIIEIDANSPIGQTDLAGVKDLTLEAAVTTIQDLEDSVAAVDAEEKVEGYRNWLGLMKGTLQESIEKNGKTIVRALNKDREIKNLIGGTTKLHGRSLMLLRNVGHLMTNPAILVDGEEIFEGIMDALVTPLLSIADIRSENENKNSRKGSMYIVKPKMHGPEEVAFAVELFERAEQALGLPAKSLKIGIMDEERRTSVNLKNCIAAAKDRTIFINTGFMDRTGDEIHTSMEAAPVVRKEAVKTQKWIAAYENRNVAIGLKCGLQGKAQIGKGMWPKPDSMKDMLATKAAHPNAGASCAWVPSPTGAVLHAMHYHQVNVKARQDQLKAEEMLSLDDLLTPPFATDTNWSAEEINNELENNCQGILGYVVRWVDLGVGCSKVPDINNVGLMEDRATLRISSQHVANWLRHGIVTREQVEEVLKRMAKIVDEQNANDPLYKPMAANFETNIAFQAASDLIFKGCEQPSGYTEPLLHAARLKLKGYTGD
Consensus [pKd Mean = 5.36]	-	461 (s=28)	24 (s=1)	MTARIQKGKLAIAKELYDFIENEALPGSGLDSETYWKNFEQVVVDLSPKNKALLAKRDELQAKIDEWHRNNKFELGAYKAFLTEIGYLLPEVEDFQITTENVDEEIALLAGPQLVVPVRNARYCLNAANARWGSLYDALYGFDVISEEGGAEKGKGYNPVRGAKVIEFAKNFLNEIFPLAQGSHADATKYAIEQNKIVVTLKDGTKTGLAHEAQFVGFNGEEANPSEVVLLSNGLHVIIEIDANSPIGQTDLAGVKDLTLEAAVTTIQDLEDSVAAVDAEEKVEGYRNWLGLMKGTLQESIEKNGKTIVRALNKDREIKNLIGGTTKLHGRSLMLLRNVGHLMTNPAILVDGEEIFEGIMDALVTPLLSIADIRSENENKNSRKGSMYIVKPKMHGPEEVAFAVELFERAEQALGLPAKSLKIGIMDEERRTSVNLKNCIAAAKDRTIFINTGFMDRTGDEIHTSMEAAPVVRKEAVKTQKWIAAYENRNVAIGLKCGLQGKAQIGKGMWPKPDSMKDMLATKAAHPNAGASCAWVPSPTGAVLHAMHYHQVNVKARQDQLKAEEMLSLDDLLTPPFATDTNWSAEEINNELENNCQGILGYVVRWVDLGVGCSKVPDINNVGLMEDRATLRISSQHVANWLRHGIVTREQVEEVLKRMAKIVDEQNANDPLYKPMAANFETNIAFQAASDLIFKGCEQPSGYTEPLLHAARLKLKGYTGD

Res_Name	Res_Num	Res_At	Nb_Contacts	Nb_Complexes	Nb[At_Ligand]
GLN	113	O	1	12	1[C],
LEU	114	CD2	1	12	1[F],
LEU	114	C	32	12	25[C], 1[S], 1[N], 1[F],
LEU	114	CB	3	12	1[F], 2[C],
LEU	114	CG	3	12	1[F], 2[C],
LEU	114	CA	5	12	1[F], 4[C],
LEU	114	O	16	12	1[F], 1[S], 12[C],
LEU	114	CD1	12	12	1[F], 9[C],
VAL	115	CG2	135	12	1[F], 9[N], 3[S], 17[O], 100[C],
VAL	115	O	98	12	1[F], 6[N], 2[S], 6[O], 79[C],
VAL	115	CA	88	12	4[N], 1[S], 72[C], 6[O], 1[F],
VAL	115	N	64	12	1[F], 56[C], 1[S], 1[O], 1[N],
VAL	115	CB	134	12	1[F], 98[C], 3[S], 17[O], 10[N],
VAL	115	CG1	138	12	1[F], 17[O], 3[S], 103[C], 10[N],
VAL	115	C	87	12	1[F], 6[N], 1[S], 69[C], 6[O],
VAL	116	N	61	12	1[N], 1[S], 54[C], 1[F],
VAL	116	CA	57	12	1[F], 1[N], 1[S], 50[C],
VAL	116	O	34	12	1[F], 1[B], 27[C], 1[S], 1[N],
VAL	116	CG1	17	12	1[N], 1[S], 12[C], 1[F],
VAL	116	CB	32	12	25[C], 1[S], 1[N], 1[F],
VAL	116	CG2	16	12	1[F], 1[N], 12[C],
VAL	116	C	48	12	1[F], 1[N], 1[S], 41[C],
PRO	117	CG	36	12	1[N], 1[S], 29[C], 1[B], 1[F],
PRO	117	C	6	12	1[F], 4[C],
PRO	117	CD	56	12	2[N], 1[S], 48[C], 1[F],
PRO	117	N	47	12	1[N], 1[S], 40[C], 1[F],
PRO	117	CA	29	12	22[C], 1[S], 1[N], 1[F], 1[B],
PRO	117	CB	27	12	1[N], 1[S], 21[C], 1[B], 1[F],
PRO	117	O	4	12	1[F], 3[C],
VAL	118	N	3	12	1[F], 2[C],
TYR	123	O	1	12	1[F],
TYR	123	CG	2	12	1[C], 1[F],
TYR	123	CZ	1	12	1[F],
TYR	123	CE1	1	12	1[F],
TYR	123	CE2	2	12	1[F], 1[C],
TYR	123	CB	2	12	1[F], 1[C],
TYR	123	CD1	1	12	1[F],
TYR	123	C	1	12	1[F],
TYR	123	CD2	3	12	2[C], 1[F],
TYR	123	CA	1	12	1[F],
ALA	127	CB	1	12	1[F],
ILE	267	CG2	9	12	7[C], 1[S],
ILE	267	CD1	5	12	4[C], 1[O],
ILE	267	C	1	12	1[C],
ILE	267	O	23	12	1[F], 17[C], 1[S], 1[N],
ILE	267	CB	7	12	5[C], 1[S],
ILE	267	CG1	1	12	1[C],
ASP	269	CA	15	12	1[S], 12[C],
ASP	269	CB	58	12	1[F], 46[C], 1[S], 5[O], 1[N],
ASP	269	C	2	12	2[C],
ASP	269	CG	83	12	3[N], 1[S], 59[C], 16[O],
ASP	269	OD2	126	12	1[F], 17[O], 2[S], 96[C], 6[N],
ASP	269	OD1	54	12	2[N], 1[S], 34[C], 15[O],
ASP	269	N	11	12	1[S], 8[C],
GLU	271	CD	46	12	18[C], 26[O], 2[N],
GLU	271	CA	5	12	5[O],
GLU	271	CG	15	12	15[O],
GLU	271	OE2	37	12	12[C], 25[O],
GLU	271	OE1	87	12	27[O], 1[S], 55[C], 3[N],
GLU	271	C	15	12	7[C], 1[S], 6[O],
GLU	271	O	7	12	2[C], 5[O],
GLU	271	CB	15	12	15[O],
ASP	272	CG	105	12	1[F], 4[N], 68[C], 31[O],
ASP	272	O	114	12	10[N], 3[S], 12[O], 84[C], 1[F],
ASP	272	C	129	12	1[F], 10[N], 2[S], 17[O], 95[C],
ASP	272	N	77	12	2[N], 1[S], 57[C], 16[O],
ASP	272	CB	153	12	1[F], 9[N], 3[S], 104[C], 34[O],
ASP	272	OD1	68	12	1[F], 1[N], 35[C], 30[O],
ASP	272	CA	111	12	81[C], 1[S], 21[O], 4[N], 1[F],
ASP	272	OD2	97	12	2[S], 33[O], 58[C], 4[N],
SER	273	O	52	12	1[F], 1[N], 1[S], 45[C],
SER	273	OG	98	12	1[F], 79[C], 1[S], 7[O], 6[N],
SER	273	N	124	12	10[N], 2[S], 17[O], 89[C], 2[F],
SER	273	CA	104	12	8[N], 82[C], 2[S], 7[O], 1[F],
SER	273	C	58	12	46[C], 1[S], 5[O], 1[N], 1[F],
SER	273	CB	113	12	2[F], 10[N], 3[S], 87[C], 7[O],
VAL	274	CG1	2	12	2[C],
VAL	274	N	23	12	1[B], 1[N], 1[S], 17[C],
ARG	337	CB	7	12	6[O],
ARG	337	CZ	156	12	7[N], 3[S], 37[O], 104[C], 1[F],
ARG	337	CG	16	12	15[O],
ARG	337	NE	108	12	4[N], 27[O], 2[S], 74[C],
ARG	337	CD	67	12	20[O], 1[S], 42[C], 3[N],
VAL	390	CG1	10	12	10[O],
PRO	392	N	3	12	3[O],
PRO	392	CB	37	12	12[C], 25[O],
PRO	392	CG	10	12	10[O],
PRO	392	C	8	12	8[O],
PRO	392	CA	13	12	11[O], 2[C],
LYS	393	CE	30	12	9[C], 21[O],
LYS	393	CG	24	12	4[C], 20[O],
LYS	393	CD	16	12	16[O],
LYS	393	N	20	12	19[O], 1[C],
LYS	393	NZ	67	12	2[N], 34[O], 31[C],
MET	426	C	4	12	3[O], 1[C],
MET	426	CB	43	12	19[C], 24[O],
MET	426	CA	21	12	16[O], 5[C],
MET	426	N	1	12	1[O],
MET	426	CE	88	12	4[N], 36[O], 48[C],
MET	426	CG	56	12	1[N], 31[O], 24[C],
MET	426	SD	72	12	34[O], 34[C], 4[N],
ASP	427	N	2	12	1[O], 1[C],
ASP	427	O	36	12	24[O], 12[C],
ASP	427	C	26	12	17[O], 9[C],
GLU	428	N	35	12	24[O], 11[C],
GLU	428	C	29	12	10[C], 19[O],
GLU	428	CD	75	12	3[N], 35[O], 37[C],
GLU	428	CA	47	12	29[O], 18[C],
GLU	428	O	37	12	26[O], 11[C],
GLU	428	CB	61	12	1[N], 29[C], 31[O],
GLU	428	CG	58	12	1[N], 27[C], 30[O],
GLU	428	OE1	70	12	35[O], 33[C], 2[N],
GLU	428	OE2	89	12	2[S], 45[C], 37[O], 4[N], 1[F],
GLU	429	CD	3	12	3[O],
GLU	429	OE1	9	12	9[O],
GLU	429	N	7	12	7[O],
ASN	451	CG	44	12	1[N], 20[O], 23[C],
ASN	451	CB	12	12	4[C], 8[O],
ASN	451	OD1	59	12	28[C], 28[O], 3[N],
ASN	451	O	43	12	26[O], 17[C],
ASN	451	C	16	12	7[C], 9[O],
ASN	451	CA	1	12	1[C],
ASN	451	ND2	24	12	1[N], 10[O], 1[S], 12[C],
THR	452	CB	12	12	8[O], 4[C],
THR	452	N	17	12	8[C], 9[O],
THR	452	CA	41	12	19[C], 22[O],
THR	452	O	69	12	32[O], 1[S], 32[C], 4[N],
THR	452	OG1	7	12	7[O],
THR	452	C	65	12	3[N], 32[C], 30[O],
GLY	453	CA	90	12	1[F], 4[N], 2[S], 46[C], 37[O],
GLY	453	N	70	12	3[N], 31[O], 36[C],
GLY	453	O	75	12	1[F], 2[N], 1[S], 35[C], 36[O],
GLY	453	C	82	12	2[S], 38[C], 37[O], 4[N], 1[F],
PHE	454	CD2	61	12	1[F], 1[N], 1[S], 23[O], 34[C],
PHE	454	CD1	65	12	1[S], 34[C], 26[O], 2[N], 1[F],
PHE	454	N	80	12	2[S], 41[C], 32[O], 4[N], 1[F],
PHE	454	CG	55	12	1[F], 21[O], 1[S], 29[C], 2[N],
PHE	454	CA	67	12	3[N], 32[C], 2[S], 30[O],
PHE	454	CE1	64	12	1[F], 25[O], 1[S], 33[C], 3[N],
PHE	454	C	68	12	1[F], 32[C], 2[S], 30[O], 3[N],
PHE	454	CB	55	12	21[O], 1[S], 31[C], 2[N],
PHE	454	CE2	61	12	1[S], 33[C], 24[O], 1[N], 1[F],
PHE	454	CZ	65	12	1[F], 39[C], 1[S], 20[O], 3[N],
PHE	454	O	50	12	21[O], 29[C],
MET	455	CA	101	12	4[N], 38[O], 2[S], 55[C], 1[F],
MET	455	O	61	12	1[F], 30[O], 30[C],
MET	455	SD	138	12	1[F], 36[O], 2[S], 89[C], 8[N],
MET	455	C	84	12	1[F], 3[N], 2[S], 36[O], 41[C],
MET	455	CG	133	12	1[F], 38[O], 2[S], 82[C], 9[N],
MET	455	CB	123	12	38[O], 2[S], 74[C], 7[N], 1[F],
MET	455	N	102	12	1[F], 55[C], 2[S], 38[O], 5[N],
MET	455	CE	138	12	92[C], 2[S], 34[O], 8[N], 1[F],
ASP	456	N	95	12	4[N], 38[O], 2[S], 50[C], 1[F],
ASP	456	O	31	12	20[O], 11[C],
ASP	456	CB	79	12	4[N], 1[S], 37[C], 36[O], 1[F],
ASP	456	OD1	79	12	1[F], 1[N], 36[O], 41[C],
ASP	456	CA	78	12	37[C], 36[O], 4[N], 1[F],
ASP	456	CG	80	12	1[F], 36[O], 1[S], 38[C], 4[N],
ASP	456	OD2	88	12	1[F], 4[N], 2[S], 37[O], 44[C],
ASP	456	C	55	12	24[C], 31[O],
ARG	457	N	54	12	23[C], 31[O],
ARG	457	CG	6	12	6[O],
ARG	457	C	25	12	7[C], 18[O],
ARG	457	CA	30	12	10[C], 20[O],
ARG	457	CB	31	12	20[O], 11[C],
THR	458	OG1	13	12	1[C], 12[O],
THR	458	N	28	12	9[C], 19[O],
THR	458	CA	2	12	2[O],
THR	458	CB	9	12	9[O],
GLY	459	N	9	12	9[O],
TYR	486	CE2	6	12	6[O],
TYR	486	CZ	13	12	1[C], 12[O],
LYS	507	C	12	12	3[C], 9[O],
LYS	507	O	13	12	7[O], 6[C],
GLY	508	O	35	12	2[S], 19[C], 10[O], 3[N],
GLY	508	CA	98	12	5[N], 57[C], 2[S], 32[O], 1[F],
GLY	508	N	39	12	3[N], 1[S], 11[O], 24[C],
GLY	508	C	98	12	8[N], 2[S], 18[O], 68[C], 1[F],
MET	509	C	117	12	1[F], 91[C], 3[S], 12[O], 9[N],
MET	509	CG	157	12	24[O], 3[S], 113[C], 10[N], 2[F],
MET	509	CA	154	12	1[F], 25[O], 3[S], 111[C], 10[N],
MET	509	O	107	12	81[C], 2[S], 13[O], 9[N], 1[F],
MET	509	N	152	12	38[O], 3[S], 99[C], 9[N], 1[F],
MET	509	CB	171	12	10[N], 3[S], 114[C], 38[O], 1[F],
MET	509	SD	130	12	2[F], 10[N], 3[S], 8[O], 102[C],
MET	509	CE	153	12	2[F], 108[C], 3[S], 25[O], 10[N],
TRP	510	C	67	12	1[F], 6[N], 2[O], 55[C], 2[S],
TRP	510	O	77	12	62[C], 2[O], 2[S], 7[N], 1[F],
TRP	510	CA	38	12	5[N], 3[O], 27[C], 2[S],
TRP	510	N	78	12	64[C], 3[O], 2[S], 7[N], 1[F],
PRO	511	C	35	12	1[S], 1[O], 27[C], 5[N],
PRO	511	CG	42	12	6[N], 2[O], 30[C], 2[S], 1[F],
PRO	511	CA	74	12	1[F], 59[C], 2[O], 2[S], 7[N],
PRO	511	N	61	12	48[C], 3[O], 2[S], 6[N], 1[F],
PRO	511	CB	75	12	1[F], 7[N], 3[O], 61[C], 2[S],
PRO	511	O	37	12	30[C], 1[O], 5[N],
PRO	511	CD	40	12	6[N], 2[O], 28[C], 2[S], 1[F],
LYS	512	N	5	12	3[N], 1[C],
PRO	513	CG	4	12	1[N], 3[C],
PRO	513	CD	2	12	1[C], 1[N],
TRP	535	CD2	161	12	1[F], 107[C], 3[S], 37[O], 9[N],
TRP	535	CD1	46	12	5[O], 2[S], 34[C], 4[N],
TRP	535	CZ3	166	12	1[F], 38[O], 3[S], 110[C], 9[N],
TRP	535	CA	30	12	23[C], 1[O], 2[S], 3[N],
TRP	535	CE3	169	12	1[F], 38[O], 3[S], 112[C], 10[N],
TRP	535	CG	133	12	25[O], 3[S], 94[C], 9[N],
TRP	535	CZ2	114	12	71[C], 3[S], 35[O], 4[N],
TRP	535	CB	146	12	1[F], 9[N], 3[S], 23[O], 106[C],
TRP	535	NE1	53	12	4[N], 1[S], 34[C], 13[O],
TRP	535	CE2	108	12	73[C], 3[S], 27[O], 4[N],
TRP	535	O	18	12	3[N], 1[O], 12[C], 1[S],
TRP	535	C	28	12	25[C], 1[O], 2[S],
VAL	536	O	80	12	1[F], 68[C], 1[S], 1[O], 5[N],
VAL	536	CA	26	12	2[N], 1[S], 21[C],
VAL	536	C	73	12	1[F], 5[N], 1[S], 61[C], 1[O],
VAL	536	CB	1	12	1[C],
VAL	536	N	34	12	1[S], 1[O], 30[C],
PRO	537	O	58	12	48[C], 1[S], 5[N], 1[F],
PRO	537	CG	60	12	1[F], 48[C], 1[S], 1[O], 6[N],
PRO	537	CD	49	12	41[C], 5[N], 1[F],
PRO	537	CB	90	12	6[N], 2[O], 74[C], 2[S], 1[F],
PRO	537	N	76	12	1[F], 63[C], 1[S], 6[N],
PRO	537	C	55	12	1[F], 45[C], 1[S], 5[N],
PRO	537	CA	91	12	6[N], 1[S], 2[O], 76[C], 1[F],
SER	538	C	2	12	1[C], 1[F],
SER	538	CA	4	12	1[F], 3[C],
SER	538	N	22	12	1[F], 2[N], 16[C],
SER	538	CB	4	12	1[F], 3[C],
PRO	539	CD	1	12	1[F],
TYR	602	CE1	4	12	2[N], 2[C],
GLY	612	O	72	12	1[O], 1[S], 61[C], 5[N], 1[F],
GLY	612	C	34	12	1[F], 2[N], 28[C],
GLY	612	CA	1	12	1[C],
CYS	613	N	39	12	2[N], 1[S], 32[C], 1[F],
CYS	613	CA	67	12	1[F], 5[N], 1[S], 1[O], 56[C],
CYS	613	C	45	12	1[F], 38[C], 3[N],
CYS	613	O	27	12	1[B], 1[F], 2[N], 21[C],
CYS	613	CB	90	12	1[F], 76[C], 1[S], 2[O], 6[N],
CYS	613	SG	96	12	2[F], 3[O], 3[S], 78[C], 6[N],
SER	614	N	46	12	4[N], 38[C], 1[F],
SER	614	O	29	12	23[C], 4[N],
SER	614	C	16	12	1[N], 12[C], 1[F],
SER	614	CA	17	12	1[F], 12[C], 2[N],
LEU	624	C	25	12	19[C], 5[N],
LEU	624	CA	3	12	1[C], 2[N],
LEU	624	O	16	12	12[C], 4[N],
LEU	624	CB	4	12	1[C], 3[N],
MET	625	C	102	12	3[S], 2[O], 82[C], 9[N], 2[F],
MET	625	CB	88	12	6[N], 1[O], 72[C], 3[S], 2[F],
MET	625	CG	89	12	72[C], 2[O], 2[S], 6[N], 2[F],
MET	625	N	57	12	6[N], 1[O], 45[C], 1[S], 1[F],
MET	625	CA	87	12	6[N], 1[O], 71[C], 3[S], 2[F],
MET	625	CE	62	12	2[S], 51[C], 5[N], 1[F],
MET	625	SD	78	12	1[F], 66[C], 1[S], 6[N],
MET	625	O	116	12	4[O], 3[S], 92[C], 10[N], 2[F],
GLU	626	C	120	12	10[N], 3[S], 6[O], 94[C], 2[F],
GLU	626	OE1	15	12	2[S], 1[O], 6[C], 4[N], 1[F],
GLU	626	CD	25	12	5[N], 1[O], 16[C], 2[S],
GLU	626	OE2	17	12	4[N], 1[S], 9[C], 2[O],
GLU	626	CB	89	12	1[F], 3[S], 4[O], 69[C], 10[N],
GLU	626	O	111	12	87[C], 3[S], 4[O], 10[N], 2[F],
GLU	626	CA	112	12	89[C], 3[S], 5[O], 10[N], 1[F],
GLU	626	CG	61	12	8[N], 4[O], 2[S], 45[C],
GLU	626	N	102	12	2[F], 9[N], 3[O], 3[S], 81[C],
ASP	627	CB	161	12	2[F], 10[N], 3[S], 112[C], 29[O],
ASP	627	OD2	171	12	1[F], 38[O], 3[S], 114[C], 10[N],
ASP	627	CA	142	12	10[N], 3[S], 20[O], 103[C], 1[F],
ASP	627	CG	171	12	1[F], 38[O], 3[S], 114[C], 10[N],
ASP	627	O	126	12	10[N], 3[S], 17[O], 93[C], 1[F],
ASP	627	OD1	169	12	112[C], 3[S], 38[O], 10[N], 1[F],
ASP	627	N	142	12	10[N], 3[S], 103[C], 20[O], 1[F],
ASP	627	C	139	12	1[F], 101[C], 3[S], 19[O], 10[N],
ARG	628	N	136	12	18[O], 3[S], 100[C], 10[N], 1[F],
ARG	628	C	83	12	1[F], 24[O], 2[S], 52[C], 4[N],
ARG	628	CB	14	12	7[C], 6[O], 1[F],
ARG	628	O	12	12	1[F], 1[C], 10[O],
ARG	628	CA	54	12	4[N], 1[S], 39[C], 9[O], 1[F],
ALA	629	CA	117	12	38[O], 2[S], 69[C], 6[N], 1[F],
ALA	629	CB	138	12	1[F], 87[C], 2[S], 38[O], 8[N],
ALA	629	N	136	12	38[O], 2[S], 86[C], 8[N], 1[F],
ALA	629	C	102	12	6[N], 2[S], 56[C], 36[O], 1[F],
ALA	629	O	52	12	1[F], 1[S], 21[O], 29[C],
THR	630	CB	41	12	1[F], 5[N], 2[O], 30[C], 2[S],
THR	630	CA	53	12	1[F], 19[O], 1[S], 29[C], 2[N],
THR	630	O	1	12	1[F],
THR	630	N	108	12	1[F], 65[C], 2[S], 31[O], 8[N],
THR	630	OG1	39	12	2[N], 2[O], 33[C], 1[F],
THR	630	C	5	12	3[C], 1[O], 1[F],
THR	630	CG2	63	12	42[C], 1[S], 16[O], 2[N], 1[F],
LEU	631	N	1	12	1[F],
ARG	632	CD	6	12	6[O],
ARG	632	CZ	8	12	8[O],
ARG	632	NE	3	12	3[O],
ARG	632	CB	3	12	3[O],
ILE	633	CD1	26	12	17[O], 8[C], 1[F],
ILE	633	CG1	13	12	13[O],
Total = 296


Binding Site Information :		Doc...
Information extracted from the bests complexes created by comparative docking.