Atome 2 Filter

Binding Site Prediction
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Binding Site Number :C1_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 C1_S1
Complex: 34U_A_2(4QMQ) / Model_20(4QMQ/A) = [8.0]	Download	1314.12	33.39	MTGRFTRPQWSLATGRHYASSGHSAASSCSTHTLKVNQTESYRPGPDDSGTYSANLRDSPSRTMSNTSVSVSPMDSSSPQEWGRSFRLFNSCRFLTSASGSRQRDGSIGQLYRSTFLHGRQGRGSSVGPEAERPLLGSSMIHQPQSSFFGAFSGQGGRYSFWPPDVNASGVLTAASPYAASNPSAPLSTASPLLGSSRFLGTGISPRGLADGHAVHRVVASCAMGSVVCTVSPGQNELPLAMNALRTHLALRGKTIIQGDAAHPLEIRKGPLIGAGGFAKVFAGVDTVRGELVAIKEIDISGVDDVKALNAIEAEFALLKSLHHPNIVSYSLFEHSKSQKVCRIAMELLAGDSTLHLLQKFGPLTEAVLRIVARSVLRAIRFIHKEGIFHRDIKPANILVSHRGEVKLCDFGCSKRVSELNKAASCIIGTPVYMAPEFIKGEANHKADIWSMACALFELSTGLLPWYHSGVKDNLPLMFYITTTSESPMVLPSPEAKSEFSAEFLSFMELCFTRNVANRPEADDLLKHPWITGSRLAPVPNLPSAVLSLHQESSAVFRAFGSPGKSSTFSSPRDSAADRDDMSFNGSDGLQKSVSTTPTLNPAEEEMACQQELETVAAATALELCSLLVCSLEIPPRTAQETVTGEVGSGTGDTSPSLTRTFSIHSPALSHRGGGVSASVAEFLSPVYTPEHSMVHENFYYSQVPLGASAGNFVLPPGLDLDGAPPQQQYLRINEEGNLDMVYLPGDEMEDSVHGRSTFGDSVYGSFHAGRIVSPARNSSFSRGTLSPRVAAGPNTVGVADGPFSPLLGISGVFSRRESPSRGGPSVPSSPQGIPAPPLLYRPGPSTTFVSQPSSHTGSMHTSHVSPTSTSKAGSNVDAATPHTPRSNSPTSTQRSESFRGLPEKLKTHADGKLHMSFSVNTAPGCAVNVELNVDVADVQCKVVDNQPNFVVAFTDDVRSQIANKIKEVAEHSSSGKPAQTAGTHASSLSPLCGMEARRSVSAGGGHFYNSPLFAAASKATPRPLSRVSTGSAQRLVAVPREALAGYSSYSGEEGSDVDSHTSSPVTAGWNERVGK
Complex: STU_A_2(3CKX) / Model_9(3CKX/A) = [7.9]	Download	1015.26	27.50	MTGRFTRPQWSLATGRHYASSGHSAASSCSTHTLKVNQTESYRPGPDDSGTYSANLRDSPSRTMSNTSVSVSPMDSSSPQEWGRSFRLFNSCRFLTSASGSRQRDGSIGQLYRSTFLHGRQGRGSSVGPEAERPLLGSSMIHQPQSSFFGAFSGQGGRYSFWPPDVNASGVLTAASPYAASNPSAPLSTASPLLGSSRFLGTGISPRGLADGHAVHRVVASCAMGSVVCTVSPGQNELPLAMNALRTHLALRGKTIIQGDAAHPLEIRKGPLIGAGGFAKVFAGVDTVRGELVAIKEIDISGVDDVKALNAIEAEFALLKSLHHPNIVSYSLFEHSKSQKVCRIAMELLAGDSTLHLLQKFGPLTEAVLRIVARSVLRAIRFIHKEGIFHRDIKPANILVSHRGEVKLCDFGCSKRVSELNKAASCIIGTPVYMAPEFIKGEANHKADIWSMACALFELSTGLLPWYHSGVKDNLPLMFYITTTSESPMVLPSPEAKSEFSAEFLSFMELCFTRNVANRPEADDLLKHPWITGSRLAPVPNLPSAVLSLHQESSAVFRAFGSPGKSSTFSSPRDSAADRDDMSFNGSDGLQKSVSTTPTLNPAEEEMACQQELETVAAATALELCSLLVCSLEIPPRTAQETVTGEVGSGTGDTSPSLTRTFSIHSPALSHRGGGVSASVAEFLSPVYTPEHSMVHENFYYSQVPLGASAGNFVLPPGLDLDGAPPQQQYLRINEEGNLDMVYLPGDEMEDSVHGRSTFGDSVYGSFHAGRIVSPARNSSFSRGTLSPRVAAGPNTVGVADGPFSPLLGISGVFSRRESPSRGGPSVPSSPQGIPAPPLLYRPGPSTTFVSQPSSHTGSMHTSHVSPTSTSKAGSNVDAATPHTPRSNSPTSTQRSESFRGLPEKLKTHADGKLHMSFSVNTAPGCAVNVELNVDVADVQCKVVDNQPNFVVAFTDDVRSQIANKIKEVAEHSSSGKPAQTAGTHASSLSPLCGMEARRSVSAGGGHFYNSPLFAAASKATPRPLSRVSTGSAQRLVAVPREALAGYSSYSGEEGSDVDSHTSSPVTAGWNERVGK
Complex: 3JB_A_2(4W8E) / Model_6(4W8E/A) = [7.5]	Download	1203.73	25.56	MTGRFTRPQWSLATGRHYASSGHSAASSCSTHTLKVNQTESYRPGPDDSGTYSANLRDSPSRTMSNTSVSVSPMDSSSPQEWGRSFRLFNSCRFLTSASGSRQRDGSIGQLYRSTFLHGRQGRGSSVGPEAERPLLGSSMIHQPQSSFFGAFSGQGGRYSFWPPDVNASGVLTAASPYAASNPSAPLSTASPLLGSSRFLGTGISPRGLADGHAVHRVVASCAMGSVVCTVSPGQNELPLAMNALRTHLALRGKTIIQGDAAHPLEIRKGPLIGAGGFAKVFAGVDTVRGELVAIKEIDISGVDDVKALNAIEAEFALLKSLHHPNIVSYSLFEHSKSQKVCRIAMELLAGDSTLHLLQKFGPLTEAVLRIVARSVLRAIRFIHKEGIFHRDIKPANILVSHRGEVKLCDFGCSKRVSELNKAASCIIGTPVYMAPEFIKGEANHKADIWSMACALFELSTGLLPWYHSGVKDNLPLMFYITTTSESPMVLPSPEAKSEFSAEFLSFMELCFTRNVANRPEADDLLKHPWITGSRLAPVPNLPSAVLSLHQESSAVFRAFGSPGKSSTFSSPRDSAADRDDMSFNGSDGLQKSVSTTPTLNPAEEEMACQQELETVAAATALELCSLLVCSLEIPPRTAQETVTGEVGSGTGDTSPSLTRTFSIHSPALSHRGGGVSASVAEFLSPVYTPEHSMVHENFYYSQVPLGASAGNFVLPPGLDLDGAPPQQQYLRINEEGNLDMVYLPGDEMEDSVHGRSTFGDSVYGSFHAGRIVSPARNSSFSRGTLSPRVAAGPNTVGVADGPFSPLLGISGVFSRRESPSRGGPSVPSSPQGIPAPPLLYRPGPSTTFVSQPSSHTGSMHTSHVSPTSTSKAGSNVDAATPHTPRSNSPTSTQRSESFRGLPEKLKTHADGKLHMSFSVNTAPGCAVNVELNVDVADVQCKVVDNQPNFVVAFTDDVRSQIANKIKEVAEHSSSGKPAQTAGTHASSLSPLCGMEARRSVSAGGGHFYNSPLFAAASKATPRPLSRVSTGSAQRLVAVPREALAGYSSYSGEEGSDVDSHTSSPVTAGWNERVGK
Complex: ADP_A_2(3A7J) / Model_14(3A7J/A) = [6.8]	Download	944.54	21.38	MTGRFTRPQWSLATGRHYASSGHSAASSCSTHTLKVNQTESYRPGPDDSGTYSANLRDSPSRTMSNTSVSVSPMDSSSPQEWGRSFRLFNSCRFLTSASGSRQRDGSIGQLYRSTFLHGRQGRGSSVGPEAERPLLGSSMIHQPQSSFFGAFSGQGGRYSFWPPDVNASGVLTAASPYAASNPSAPLSTASPLLGSSRFLGTGISPRGLADGHAVHRVVASCAMGSVVCTVSPGQNELPLAMNALRTHLALRGKTIIQGDAAHPLEIRKGPLIGAGGFAKVFAGVDTVRGELVAIKEIDISGVDDVKALNAIEAEFALLKSLHHPNIVSYSLFEHSKSQKVCRIAMELLAGDSTLHLLQKFGPLTEAVLRIVARSVLRAIRFIHKEGIFHRDIKPANILVSHRGEVKLCDFGCSKRVSELNKAASCIIGTPVYMAPEFIKGEANHKADIWSMACALFELSTGLLPWYHSGVKDNLPLMFYITTTSESPMVLPSPEAKSEFSAEFLSFMELCFTRNVANRPEADDLLKHPWITGSRLAPVPNLPSAVLSLHQESSAVFRAFGSPGKSSTFSSPRDSAADRDDMSFNGSDGLQKSVSTTPTLNPAEEEMACQQELETVAAATALELCSLLVCSLEIPPRTAQETVTGEVGSGTGDTSPSLTRTFSIHSPALSHRGGGVSASVAEFLSPVYTPEHSMVHENFYYSQVPLGASAGNFVLPPGLDLDGAPPQQQYLRINEEGNLDMVYLPGDEMEDSVHGRSTFGDSVYGSFHAGRIVSPARNSSFSRGTLSPRVAAGPNTVGVADGPFSPLLGISGVFSRRESPSRGGPSVPSSPQGIPAPPLLYRPGPSTTFVSQPSSHTGSMHTSHVSPTSTSKAGSNVDAATPHTPRSNSPTSTQRSESFRGLPEKLKTHADGKLHMSFSVNTAPGCAVNVELNVDVADVQCKVVDNQPNFVVAFTDDVRSQIANKIKEVAEHSSSGKPAQTAGTHASSLSPLCGMEARRSVSAGGGHFYNSPLFAAASKATPRPLSRVSTGSAQRLVAVPREALAGYSSYSGEEGSDVDSHTSSPVTAGWNERVGK
Complex: 3FE_A_3(4U8Z) / Model_4(4U8Z/A) = [6.6]	Download	781.19	25.96	MTGRFTRPQWSLATGRHYASSGHSAASSCSTHTLKVNQTESYRPGPDDSGTYSANLRDSPSRTMSNTSVSVSPMDSSSPQEWGRSFRLFNSCRFLTSASGSRQRDGSIGQLYRSTFLHGRQGRGSSVGPEAERPLLGSSMIHQPQSSFFGAFSGQGGRYSFWPPDVNASGVLTAASPYAASNPSAPLSTASPLLGSSRFLGTGISPRGLADGHAVHRVVASCAMGSVVCTVSPGQNELPLAMNALRTHLALRGKTIIQGDAAHPLEIRKGPLIGAGGFAKVFAGVDTVRGELVAIKEIDISGVDDVKALNAIEAEFALLKSLHHPNIVSYSLFEHSKSQKVCRIAMELLAGDSTLHLLQKFGPLTEAVLRIVARSVLRAIRFIHKEGIFHRDIKPANILVSHRGEVKLCDFGCSKRVSELNKAASCIIGTPVYMAPEFIKGEANHKADIWSMACALFELSTGLLPWYHSGVKDNLPLMFYITTTSESPMVLPSPEAKSEFSAEFLSFMELCFTRNVANRPEADDLLKHPWITGSRLAPVPNLPSAVLSLHQESSAVFRAFGSPGKSSTFSSPRDSAADRDDMSFNGSDGLQKSVSTTPTLNPAEEEMACQQELETVAAATALELCSLLVCSLEIPPRTAQETVTGEVGSGTGDTSPSLTRTFSIHSPALSHRGGGVSASVAEFLSPVYTPEHSMVHENFYYSQVPLGASAGNFVLPPGLDLDGAPPQQQYLRINEEGNLDMVYLPGDEMEDSVHGRSTFGDSVYGSFHAGRIVSPARNSSFSRGTLSPRVAAGPNTVGVADGPFSPLLGISGVFSRRESPSRGGPSVPSSPQGIPAPPLLYRPGPSTTFVSQPSSHTGSMHTSHVSPTSTSKAGSNVDAATPHTPRSNSPTSTQRSESFRGLPEKLKTHADGKLHMSFSVNTAPGCAVNVELNVDVADVQCKVVDNQPNFVVAFTDDVRSQIANKIKEVAEHSSSGKPAQTAGTHASSLSPLCGMEARRSVSAGGGHFYNSPLFAAASKATPRPLSRVSTGSAQRLVAVPREALAGYSSYSGEEGSDVDSHTSSPVTAGWNERVGK
Consensus [pKd Mean = 7.36]	-	1051 (s=188)	26 (s=3)	MTGRFTRPQWSLATGRHYASSGHSAASSCSTHTLKVNQTESYRPGPDDSGTYSANLRDSPSRTMSNTSVSVSPMDSSSPQEWGRSFRLFNSCRFLTSASGSRQRDGSIGQLYRSTFLHGRQGRGSSVGPEAERPLLGSSMIHQPQSSFFGAFSGQGGRYSFWPPDVNASGVLTAASPYAASNPSAPLSTASPLLGSSRFLGTGISPRGLADGHAVHRVVASCAMGSVVCTVSPGQNELPLAMNALRTHLALRGKTIIQGDAAHPLEIRKGPLIGAGGFAKVFAGVDTVRGELVAIKEIDISGVDDVKALNAIEAEFALLKSLHHPNIVSYSLFEHSKSQKVCRIAMELLAGDSTLHLLQKFGPLTEAVLRIVARSVLRAIRFIHKEGIFHRDIKPANILVSHRGEVKLCDFGCSKRVSELNKAASCIIGTPVYMAPEFIKGEANHKADIWSMACALFELSTGLLPWYHSGVKDNLPLMFYITTTSESPMVLPSPEAKSEFSAEFLSFMELCFTRNVANRPEADDLLKHPWITGSRLAPVPNLPSAVLSLHQESSAVFRAFGSPGKSSTFSSPRDSAADRDDMSFNGSDGLQKSVSTTPTLNPAEEEMACQQELETVAAATALELCSLLVCSLEIPPRTAQETVTGEVGSGTGDTSPSLTRTFSIHSPALSHRGGGVSASVAEFLSPVYTPEHSMVHENFYYSQVPLGASAGNFVLPPGLDLDGAPPQQQYLRINEEGNLDMVYLPGDEMEDSVHGRSTFGDSVYGSFHAGRIVSPARNSSFSRGTLSPRVAAGPNTVGVADGPFSPLLGISGVFSRRESPSRGGPSVPSSPQGIPAPPLLYRPGPSTTFVSQPSSHTGSMHTSHVSPTSTSKAGSNVDAATPHTPRSNSPTSTQRSESFRGLPEKLKTHADGKLHMSFSVNTAPGCAVNVELNVDVADVQCKVVDNQPNFVVAFTDDVRSQIANKIKEVAEHSSSGKPAQTAGTHASSLSPLCGMEARRSVSAGGGHFYNSPLFAAASKATPRPLSRVSTGSAQRLVAVPREALAGYSSYSGEEGSDVDSHTSSPVTAGWNERVGK

Res_Name	Res_Num	Res_At	Nb_Contacts	Nb_Complexes	Nb[At_Ligand]
PRO	271	O	2	13	2[C],
PRO	271	C	2	13	2[C],
PRO	271	CA	1	13	1[C],
PRO	271	CB	3	13	1[O], 2[C],
PRO	271	CG	3	13	1[O], 2[C],
LEU	272	C	49	13	1[S], 1[F], 9[O], 5[N], 33[C],
LEU	272	CB	3	13	1[O], 2[C],
LEU	272	CD2	2	13	1[F], 1[C],
LEU	272	CD1	13	13	1[F], 4[O], 8[C],
LEU	272	N	3	13	1[O], 2[C],
LEU	272	O	38	13	1[S], 1[F], 8[O], 3[N], 25[C],
LEU	272	CA	4	13	1[F], 1[O], 2[C],
LEU	272	CG	7	13	1[F], 3[O], 3[C],
ILE	273	CA	213	13	1[F], 3[S], 20[O], 44[N], 145[C],
ILE	273	N	162	13	1[F], 3[S], 17[O], 30[N], 111[C],
ILE	273	CG1	279	13	2[F], 4[S], 25[O], 58[N], 190[C],
ILE	273	C	251	13	2[F], 4[S], 25[O], 48[N], 172[C],
ILE	273	CG2	191	13	1[F], 3[S], 18[O], 43[N], 126[C],
ILE	273	O	260	13	2[F], 4[S], 27[O], 51[N], 176[C],
ILE	273	CD1	276	13	2[F], 4[S], 23[O], 187[C], 60[N],
ILE	273	CB	251	13	1[F], 4[S], 22[O], 55[N], 169[C],
GLY	274	N	241	13	2[F], 4[S], 28[O], 39[N], 167[C], 1[P],
GLY	274	CA	245	13	2[F], 3[S], 30[O], 38[N], 170[C], 2[P],
GLY	274	O	157	13	1[F], 2[S], 24[O], 105[C], 23[N], 2[P],
GLY	274	C	209	13	2[F], 2[S], 31[O], 34[N], 136[C], 4[P],
ALA	275	N	198	13	2[F], 2[S], 32[O], 30[N], 127[C], 5[P],
ALA	275	O	171	13	2[F], 1[S], 36[O], 22[N], 103[C], 7[P],
ALA	275	CB	89	13	1[F], 1[S], 19[O], 9[N], 57[C], 2[P],
ALA	275	C	169	13	2[F], 2[S], 36[O], 22[N], 100[C], 7[P],
ALA	275	CA	156	13	1[F], 1[S], 31[O], 23[N], 94[C], 6[P],
GLY	276	CA	155	13	2[F], 2[S], 38[O], 19[N], 87[C], 7[P],
GLY	276	C	113	13	1[F], 1[S], 31[O], 10[N], 63[C], 7[P],
GLY	276	N	168	13	2[F], 2[S], 38[O], 22[N], 97[C], 7[P],
GLY	276	O	80	13	1[F], 1[S], 24[O], 9[N], 38[C], 7[P],
GLY	277	C	41	13	17[O], 5[N], 13[C], 6[P],
GLY	277	O	29	13	12[O], 9[C], 4[N], 4[P],
GLY	277	CA	58	13	22[O], 6[N], 23[C], 7[P],
GLY	277	N	97	13	1[F], 27[O], 9[N], 53[C], 7[P],
PHE	278	O	29	13	1[F], 11[O], 11[C], 2[N], 4[P],
PHE	278	CE2	44	13	16[O], 18[C], 3[N], 6[P],
PHE	278	CE1	32	13	15[O], 1[N], 11[C], 4[P],
PHE	278	CD1	35	13	15[O], 2[N], 13[C], 4[P],
PHE	278	CD2	41	13	16[O], 2[N], 17[C], 5[P],
PHE	278	CZ	34	13	14[O], 1[N], 13[C], 5[P],
PHE	278	CG	36	13	15[O], 2[N], 14[C], 4[P],
PHE	278	C	24	13	14[O], 5[C], 1[N], 4[P],
PHE	278	CA	23	13	13[O], 1[N], 3[C], 5[P],
PHE	278	N	46	13	20[O], 4[N], 15[C], 7[P],
PHE	278	CB	29	13	13[O], 1[N], 11[C], 3[P],
ALA	279	CB	20	13	10[O], 5[C], 2[N], 3[P],
ALA	279	CA	16	13	8[O], 3[C], 2[N], 3[P],
ALA	279	C	38	13	1[F], 13[O], 15[C], 5[N], 4[P],
ALA	279	N	28	13	13[O], 7[C], 3[N], 5[P],
ALA	279	O	71	13	1[F], 1[S], 16[O], 7[N], 42[C], 4[P],
LYS	280	N	23	13	1[F], 9[O], 8[C], 2[N], 3[P],
LYS	280	CB	5	13	1[F], 2[O], 2[C],
LYS	280	O	65	13	1[F], 1[S], 12[O], 8[N], 41[C], 2[P],
LYS	280	CA	41	13	1[F], 11[O], 3[N], 24[C], 2[P],
LYS	280	C	88	13	1[F], 1[S], 17[O], 11[N], 56[C], 2[P],
VAL	281	CA	213	13	1[F], 2[S], 20[O], 37[N], 151[C], 2[P],
VAL	281	CB	289	13	2[F], 3[S], 33[O], 61[N], 185[C], 4[P],
VAL	281	N	160	13	1[F], 2[S], 22[O], 24[N], 109[C], 2[P],
VAL	281	CG2	279	13	2[F], 2[S], 37[O], 56[N], 175[C], 6[P],
VAL	281	CG1	288	13	2[F], 3[S], 30[O], 59[N], 190[C], 3[P],
VAL	281	O	163	13	1[F], 3[S], 14[O], 29[N], 116[C],
VAL	281	C	183	13	1[F], 2[S], 15[O], 30[N], 135[C],
PHE	282	CA	42	13	1[F], 1[O], 10[N], 30[C],
PHE	282	C	119	13	1[F], 1[S], 5[O], 33[N], 79[C],
PHE	282	O	146	13	1[F], 2[S], 6[O], 46[N], 91[C],
PHE	282	N	142	13	1[F], 2[S], 9[O], 29[N], 101[C],
ALA	283	N	93	13	1[F], 1[S], 4[O], 26[N], 61[C],
ALA	283	CB	73	13	1[S], 5[O], 21[N], 46[C],
ALA	283	CA	80	13	1[S], 4[O], 25[N], 50[C],
LEU	292	C	1	13	1[O],
LEU	292	O	4	13	2[O], 2[N],
VAL	293	CB	2	13	2[N],
VAL	293	C	86	13	4[O], 29[N], 53[C],
VAL	293	CA	41	13	3[O], 21[N], 17[C],
VAL	293	N	12	13	3[O], 1[C], 8[N],
VAL	293	O	83	13	3[O], 33[N], 47[C],
ALA	294	C	145	13	1[S], 1[F], 5[O], 40[N], 98[C],
ALA	294	CB	221	13	1[F], 3[S], 9[O], 56[N], 151[C],
ALA	294	O	119	13	1[S], 5[O], 31[N], 82[C],
ALA	294	N	125	13	1[S], 5[O], 79[C], 40[N],
ALA	294	CA	166	13	1[F], 2[S], 5[O], 110[C], 48[N],
ILE	295	C	70	13	1[S], 1[F], 2[O], 17[N], 49[C],
ILE	295	N	131	13	1[S], 1[F], 5[O], 35[N], 89[C],
ILE	295	CA	48	13	1[S], 2[O], 14[N], 31[C],
ILE	295	O	63	13	1[S], 1[F], 5[O], 12[N], 44[C],
LYS	296	CB	120	13	1[F], 2[S], 17[O], 19[N], 77[C], 4[P],
LYS	296	CG	108	13	1[F], 2[S], 21[O], 16[N], 63[C], 5[P],
LYS	296	C	11	13	2[O], 6[C], 3[N],
LYS	296	O	1	13	1[N],
LYS	296	CD	137	13	1[F], 2[S], 23[O], 19[N], 86[C], 6[P],
LYS	296	CE	121	13	1[F], 2[S], 24[O], 18[N], 70[C], 6[P],
LYS	296	N	81	13	1[S], 1[F], 4[O], 18[N], 57[C],
LYS	296	CA	82	13	1[S], 1[F], 15[O], 13[N], 50[C], 2[P],
LYS	296	NZ	123	13	1[F], 2[S], 25[O], 18[N], 71[C], 6[P],
GLU	297	O	3	13	3[O],
GLU	297	C	1	13	1[O],
GLU	297	N	3	13	2[O], 1[N],
ILE	298	CB	1	13	1[O],
ILE	298	CD1	12	13	7[O], 3[N], 2[P],
ILE	298	CG1	8	13	5[O], 2[N], 1[P],
ILE	298	CG2	1	13	1[O],
ALA	311	CB	2	13	2[O],
ALA	311	O	1	13	1[O],
ALA	311	C	1	13	1[O],
ILE	312	CG1	2	13	2[O],
GLU	315	CD	52	13	15[O], 26[C], 6[N], 5[P],
GLU	315	CG	24	13	6[O], 13[C], 3[N], 2[P],
GLU	315	CB	10	13	3[O], 5[C], 2[N],
GLU	315	OE2	83	13	1[S], 19[O], 13[N], 45[C], 5[P],
GLU	315	OE1	52	13	18[O], 22[C], 6[N], 6[P],
PHE	316	CD1	3	13	2[C], 1[N],
PHE	316	CE1	3	13	2[C], 1[N],
PHE	316	CZ	1	13	1[C],
LEU	319	CD1	33	13	1[S], 1[O], 6[N], 25[C],
LEU	319	CB	1	13	1[C],
LEU	319	CG	14	13	11[C], 3[N],
LEU	319	CD2	26	13	3[N], 23[C],
ILE	327	C	2	13	2[C],
VAL	328	CG1	154	13	1[S], 1[F], 6[O], 40[N], 105[C],
VAL	328	O	23	13	9[N], 13[C],
VAL	328	CB	130	13	1[S], 1[F], 5[O], 34[N], 88[C],
VAL	328	N	29	13	11[N], 17[C],
VAL	328	CG2	173	13	1[F], 2[S], 6[O], 45[N], 118[C],
VAL	328	C	31	13	11[N], 19[C],
VAL	328	CA	67	13	1[S], 3[O], 18[N], 44[C],
SER	329	CA	5	13	3[N], 2[C],
SER	329	OG	2	13	1[N], 1[C],
SER	329	C	14	13	6[N], 8[C],
SER	329	O	32	13	11[N], 21[C],
SER	329	N	25	13	11[N], 14[C],
ILE	344	O	24	13	9[N], 15[C],
ILE	344	CD1	7	13	2[O], 2[N], 3[C],
ILE	344	C	3	13	1[N], 2[C],
ILE	344	CG2	14	13	11[C], 3[N],
ILE	344	CB	7	13	2[N], 5[C],
ILE	344	CA	1	13	1[N],
ILE	344	CG1	1	13	1[N],
ALA	345	O	7	13	3[N], 4[C],
ALA	345	CA	1	13	1[C],
ALA	345	C	17	13	8[N], 9[C],
MET	346	CB	135	13	1[S], 4[O], 40[N], 89[C],
MET	346	N	63	13	1[S], 3[O], 19[N], 40[C],
MET	346	CA	89	13	1[S], 4[O], 27[N], 57[C],
MET	346	CE	188	13	2[F], 2[S], 14[O], 45[N], 122[C], 2[P],
MET	346	O	93	13	1[S], 5[O], 27[N], 60[C],
MET	346	CG	132	13	1[S], 4[O], 33[N], 93[C],
MET	346	C	98	13	1[S], 5[O], 27[N], 65[C],
MET	346	SD	172	13	2[F], 2[S], 11[O], 42[N], 111[C], 3[P],
GLU	347	CB	74	13	3[O], 22[N], 49[C],
GLU	347	C	131	13	1[S], 5[O], 86[C], 39[N],
GLU	347	N	95	13	1[S], 5[O], 27[N], 62[C],
GLU	347	CA	89	13	1[S], 4[O], 27[N], 57[C],
GLU	347	CD	42	13	2[O], 20[N], 20[C],
GLU	347	CG	61	13	4[O], 22[N], 35[C],
GLU	347	OE2	25	13	12[N], 13[C],
GLU	347	O	172	13	2[S], 5[O], 115[C], 49[N],
GLU	347	OE1	15	13	2[C], 13[N],
LEU	348	CD2	96	13	1[S], 4[O], 35[N], 56[C],
LEU	348	N	119	13	1[S], 4[O], 75[C], 39[N],
LEU	348	CG	143	13	1[S], 5[O], 39[N], 98[C],
LEU	348	CD1	184	13	2[S], 7[O], 50[N], 125[C],
LEU	348	C	147	13	2[S], 5[O], 44[N], 96[C],
LEU	348	CB	126	13	1[S], 4[O], 35[N], 86[C],
LEU	348	O	113	13	1[S], 3[O], 34[N], 75[C],
LEU	348	CA	152	13	2[S], 5[O], 47[N], 98[C],
LEU	349	CA	166	13	1[S], 5[O], 48[N], 112[C],
LEU	349	CD2	96	13	4[O], 59[C], 33[N],
LEU	349	CG	157	13	2[S], 5[O], 47[N], 102[C],
LEU	349	CD1	160	13	1[F], 2[S], 5[O], 105[C], 46[N],
LEU	349	CB	181	13	2[S], 7[O], 50[N], 122[C],
LEU	349	C	175	13	1[S], 7[O], 50[N], 117[C],
LEU	349	O	218	13	2[S], 14[O], 54[N], 148[C],
LEU	349	N	183	13	2[S], 6[O], 50[N], 125[C],
ALA	350	N	138	13	1[S], 6[O], 40[N], 91[C],
ALA	350	CA	126	13	2[S], 7[O], 29[N], 88[C],
ALA	350	O	95	13	2[S], 7[O], 27[N], 59[C],
ALA	350	C	104	13	2[S], 7[O], 28[N], 67[C],
ALA	350	CB	73	13	1[S], 6[O], 22[N], 44[C],
GLY	351	N	101	13	2[S], 7[O], 28[N], 64[C],
GLY	351	O	70	13	2[S], 4[O], 13[N], 51[C],
GLY	351	CA	76	13	2[S], 5[O], 15[N], 54[C],
GLY	351	C	95	13	2[S], 8[O], 22[N], 63[C],
ASP	352	CB	127	13	2[S], 13[O], 27[N], 85[C],
ASP	352	O	145	13	1[F], 2[S], 12[O], 95[C], 35[N],
ASP	352	OD1	102	13	2[S], 9[O], 21[N], 70[C],
ASP	352	CA	173	13	2[S], 18[O], 41[N], 112[C],
ASP	352	CG	99	13	2[S], 8[O], 18[N], 71[C],
ASP	352	OD2	70	13	2[S], 6[O], 13[N], 49[C],
ASP	352	N	151	13	2[S], 12[O], 37[N], 100[C],
ASP	352	C	174	13	1[F], 2[S], 17[O], 39[N], 115[C],
SER	353	CA	145	13	1[F], 2[S], 15[O], 100[C], 27[N],
SER	353	OG	141	13	1[F], 2[S], 16[O], 100[C], 22[N],
SER	353	O	46	13	2[S], 5[O], 31[C], 8[N],
SER	353	C	59	13	1[F], 2[S], 7[O], 6[N], 43[C],
SER	353	CB	179	13	1[F], 3[S], 19[O], 32[N], 124[C],
SER	353	N	190	13	1[F], 2[S], 20[O], 39[N], 128[C],
THR	354	CA	1	13	1[C],
THR	354	C	1	13	1[C],
THR	354	N	10	13	3[O], 2[N], 5[C],
LEU	355	CD1	1	13	1[C],
LEU	355	N	3	13	1[C], 2[N],
LEU	355	CB	7	13	2[O], 2[N], 3[C],
LEU	355	O	3	13	1[N], 2[C],
LEU	355	C	4	13	2[N], 2[C],
LEU	355	CA	3	13	1[C], 2[N],
LEU	355	CD2	5	13	2[N], 3[C],
LEU	355	CG	3	13	1[C], 2[N],
HIS	356	CA	36	13	1[S], 4[O], 9[N], 22[C],
HIS	356	CB	77	13	2[S], 12[O], 11[N], 52[C],
HIS	356	O	15	13	1[S], 1[O], 3[N], 10[C],
HIS	356	C	18	13	1[S], 2[O], 11[C], 4[N],
HIS	356	NE2	134	13	2[F], 2[S], 19[O], 24[N], 87[C],
HIS	356	ND1	120	13	2[S], 16[O], 21[N], 81[C],
HIS	356	CD2	107	13	2[S], 16[O], 16[N], 73[C],
HIS	356	N	30	13	1[S], 5[O], 17[C], 7[N],
HIS	356	CG	97	13	2[S], 14[O], 14[N], 67[C],
HIS	356	CE1	139	13	2[F], 2[S], 20[O], 22[N], 93[C],
LEU	357	CD2	14	13	1[S], 1[O], 2[N], 10[C],
LEU	357	CB	3	13	1[N], 2[C],
LEU	357	CA	4	13	2[N], 2[C],
LEU	357	CD1	2	13	1[N], 1[C],
LEU	357	CG	6	13	1[O], 2[N], 3[C],
LEU	357	N	12	13	1[S], 1[O], 7[C], 3[N],
GLN	359	CD	6	13	1[S], 1[O], 1[N], 3[C],
GLN	359	NE2	9	13	1[S], 2[O], 2[N], 4[C],
GLN	359	CG	1	13	1[N],
GLN	359	OE1	10	13	1[S], 3[O], 2[N], 4[C],
LYS	360	CE	8	13	2[N], 6[C],
LYS	360	NZ	10	13	3[N], 7[C],
LYS	360	CD	6	13	4[C], 2[N],
HIS	390	NE2	3	13	1[F], 2[C],
HIS	390	CE1	1	13	1[C],
ASP	392	CB	1	13	1[O],
ASP	392	OD2	23	13	11[O], 1[N], 6[C], 5[P],
ASP	392	CG	3	13	3[O],
ASP	392	OD1	1	13	1[O],
LYS	394	O	7	13	1[F], 1[N], 5[C],
LYS	394	CG	7	13	1[O], 2[N], 4[C],
LYS	394	CE	26	13	8[O], 3[N], 13[C], 2[P],
LYS	394	CD	7	13	1[O], 2[N], 4[C],
LYS	394	NZ	22	13	10[O], 3[N], 7[C], 2[P],
PRO	395	CA	2	13	1[N], 1[C],
PRO	395	O	15	13	1[F], 4[O], 2[N], 8[C],
PRO	395	C	11	13	1[F], 3[O], 2[N], 5[C],
ALA	396	N	18	13	1[F], 4[O], 2[N], 11[C],
ALA	396	O	201	13	2[F], 2[S], 31[O], 31[N], 131[C], 3[P],
ALA	396	CA	56	13	1[F], 1[S], 10[O], 6[N], 37[C], 1[P],
ALA	396	CB	63	13	1[F], 1[S], 13[O], 7[N], 38[C], 3[P],
ALA	396	C	104	13	1[F], 1[S], 16[O], 13[N], 69[C], 3[P],
ASN	397	O	75	13	1[F], 2[S], 7[O], 10[N], 53[C], 1[P],
ASN	397	C	67	13	1[F], 1[S], 9[O], 9[N], 45[C], 1[P],
ASN	397	N	65	13	1[F], 1[S], 10[O], 9[N], 42[C], 2[P],
ASN	397	ND2	64	13	1[F], 1[S], 16[O], 8[N], 33[C], 5[P],
ASN	397	CA	100	13	1[F], 2[S], 12[O], 12[N], 70[C], 2[P],
ASN	397	OD1	151	13	2[F], 2[S], 31[O], 17[N], 91[C], 7[P],
ASN	397	CG	99	13	1[F], 1[S], 18[O], 13[N], 61[C], 5[P],
ASN	397	CB	76	13	1[F], 1[S], 11[O], 11[N], 48[C], 3[P],
ILE	398	CB	2	13	1[F], 1[C],
ILE	398	C	23	13	1[F], 4[O], 4[N], 14[C],
ILE	398	CA	16	13	1[F], 2[O], 1[N], 12[C],
ILE	398	O	25	13	1[F], 4[O], 3[N], 17[C],
ILE	398	N	31	13	1[F], 5[O], 5[N], 20[C],
LEU	399	N	87	13	1[F], 6[O], 15[N], 64[C],
LEU	399	CD2	297	13	2[F], 3[S], 29[O], 62[N], 199[C], 1[P],
LEU	399	CG	285	13	2[F], 3[S], 27[O], 60[N], 191[C], 1[P],
LEU	399	O	3	13	1[O], 2[N],
LEU	399	CB	240	13	1[F], 3[S], 14[O], 57[N], 164[C],
LEU	399	CA	183	13	1[S], 1[F], 9[O], 51[N], 120[C],
LEU	399	CD1	296	13	2[F], 3[S], 30[O], 61[N], 197[C], 2[P],
LEU	399	C	84	13	1[F], 2[O], 28[N], 53[C],
VAL	400	CG2	1	13	1[C],
VAL	400	CA	8	13	3[N], 5[C],
VAL	400	C	40	13	1[S], 2[O], 15[N], 22[C],
VAL	400	O	100	13	1[S], 5[O], 27[N], 67[C],
VAL	400	N	78	13	1[S], 3[O], 49[C], 25[N],
SER	401	N	4	13	1[O], 3[N],
SER	401	CA	11	13	1[O], 8[N], 2[C],
LYS	407	C	2	13	1[F], 1[C],
LYS	407	CB	5	13	2[N], 3[C],
LYS	407	CG	1	13	1[N],
LYS	407	O	8	13	1[F], 6[C],
LYS	407	CD	1	13	1[C],
LEU	408	CB	1	13	1[C],
LEU	408	N	1	13	1[C],
LEU	408	O	68	13	1[S], 1[F], 3[O], 15[N], 47[C],
LEU	408	C	62	13	1[S], 1[F], 3[O], 7[N], 49[C],
LEU	408	CA	3	13	1[F], 1[C],
CYS	409	CA	153	13	1[F], 2[S], 11[O], 29[N], 108[C], 1[P],
CYS	409	O	101	13	1[F], 2[S], 11[O], 12[N], 73[C], 1[P],
CYS	409	C	132	13	1[F], 2[S], 15[O], 22[N], 89[C], 2[P],
CYS	409	CB	238	13	2[F], 2[S], 21[O], 54[N], 156[C], 2[P],
CYS	409	SG	264	13	2[F], 2[S], 31[O], 57[N], 166[C], 5[P],
CYS	409	N	101	13	1[F], 2[S], 5[O], 17[N], 74[C], 1[P],
ASP	410	CG	139	13	2[F], 2[S], 29[O], 15[N], 83[C], 7[P],
ASP	410	CB	153	13	2[F], 2[S], 28[O], 18[N], 95[C], 7[P],
ASP	410	CA	132	13	2[F], 2[S], 23[O], 16[N], 82[C], 6[P],
ASP	410	N	163	13	2[F], 2[S], 20[O], 28[N], 104[C], 6[P],
ASP	410	O	62	13	1[F], 9[O], 7[N], 41[C], 3[P],
ASP	410	C	86	13	1[F], 2[S], 14[O], 10[N], 54[C], 4[P],
ASP	410	OD1	125	13	1[F], 2[S], 27[O], 12[N], 75[C], 7[P],
ASP	410	OD2	142	13	2[F], 2[S], 31[O], 14[N], 85[C], 7[P],
PHE	411	CE1	12	13	11[C],
PHE	411	CD1	18	13	1[N], 16[C],
PHE	411	C	16	13	2[O], 3[N], 11[C],
PHE	411	N	70	13	1[S], 1[F], 10[O], 8[N], 47[C], 2[P],
PHE	411	CZ	10	13	9[C],
PHE	411	O	5	13	2[N], 3[C],
PHE	411	CD2	21	13	1[O], 3[N], 16[C],
PHE	411	CB	19	13	1[O], 3[N], 14[C],
PHE	411	CE2	14	13	1[O], 1[N], 11[C],
PHE	411	CA	28	13	2[O], 5[N], 20[C],
PHE	411	CG	14	13	1[O], 2[N], 10[C],
GLY	412	CA	17	13	3[O], 10[C], 3[N], 1[P],
GLY	412	C	3	13	1[O], 2[N],
GLY	412	N	31	13	7[O], 5[N], 17[C], 2[P],
CYS	413	N	1	13	1[O],
THR	430	CB	1	13	1[O],
THR	430	CG2	1	13	1[O],
THR	430	OG1	2	13	1[O], 1[P],
Total = 323


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