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: WCX_A_2(2XNP) / Model_19(2XNP/A) = [9.0]	Download	1553.04	17.73	MDKYQRVKVLGKGSFGSAILIKRKTDGLLFVVKEVGMTRMSKKERDEARHECTVLQQLQHPNIVRYVEQFENNNNLYIVMEYCDGGDLAEKVKHSRGPMKESSMLYYFSQICLAIEYLHARHILHRDIKTMNVFLMKNGAVKLGDFGISTVLRTTMGMANTVCGTPYYFSPELCRNRPYNNKSDIWALGVLLYECATGGRHPFDGTSMNQLMQRIVQGHYAPLSSQYSSDFRKMVDWCLQKDPAKRPSIKQTLALPLMRRSLEQLEENLMLATQCRVRLKDIIDFEGGMDQEERKGSSPQPSPKLSPRAVAKDGVSPGQAAALAMARQNLSPVFQPPTTPSHSPMASPERGGGAPAAVGPKPSAAVPQSPTASPKQGNEAHRFYSPCQKRPIANPLLPGGGARPAPAESPSGAVPPPLAQRPLEEPHHTPPLRIKVTLGGAGDRRGLAAAALPAAAAAPAPGPSPNAADAFHADMRRVDAIIARYGRNSDEKAKETIHAYMRRKHEAYLKRQKEEIEARERRNRMRKEELRRVLENQRMAVSPLRNNDPRNSPHLNNINMNGYPDDRSPRRGSPQPRAKPENVHLPSRSPPSSPLQDKEPVSARTPTNAEPAVFGRDPRRGAPPGEPASRPTTPQQQRVLQQPPSPAAAAPNGNPLPQTPPRRVLYAANSPQQAHPPSQNRTEAPEARRAVTPDPLHSPPSRLGAPRGAAFDIDRRSLPNSKPEAASGGQKAPLTAGLGGGIDGHRMVLQTSQQHLPQPRRPMDAEQLPARRDRRESRVLEDAAVGRRPSALSPISGDPHDHCSPSQAAAAAPERASLSAGDPRLQRPGRALQRYLKPLGGRGEDGVSPLPSPTSAQSPRRGAAGVDRGHRGSSGVPPPVKSKALVSAGNANPPSSAPGELADIPRTAAHSTRAQASPCTPVKEALRALRRSKVQAGAPAPPPSSAMAAGMKDLPAIITSPEHERGARRNHPRYRLEEAALYRGMRREQPSREDERVLVDEHRKPHHAEVSAVPNTLEALRSLRAQQDKAMRAEGGAREEVNPGGQLALLKQRQRMQQRPRQGSTSSSASVPLAPRLMTRATEAAASPRSEVPSGYDRKTPVPRDNAAARPSAAHVTALSLGDVNRGAAPSRAAPPSAHAGAPPSPKPSTGGGAGVQSSMEGYAEMLQHLKDLLQRRRVSSAGGASAPTSPTTAASALSAIENPRDPGARSPISMRNRALPPPLNPSPLGGVDMSCASDSGDSGVLVSPPHLKATRPLHPQPNAVPVVNVRPGCDAEEEDDDDFEDAVPLSPVRCTELNDAYARQQDQQEQKWRHAQEDVYTSDVDLTSAAMEEELEGEEGYTDYHKRPSSKELPKGIKS
Complex: WGZ_A_2(2XNM) / Model_16(2XNM/A) = [7.4]	Download	1394.68	22.96	MDKYQRVKVLGKGSFGSAILIKRKTDGLLFVVKEVGMTRMSKKERDEARHECTVLQQLQHPNIVRYVEQFENNNNLYIVMEYCDGGDLAEKVKHSRGPMKESSMLYYFSQICLAIEYLHARHILHRDIKTMNVFLMKNGAVKLGDFGISTVLRTTMGMANTVCGTPYYFSPELCRNRPYNNKSDIWALGVLLYECATGGRHPFDGTSMNQLMQRIVQGHYAPLSSQYSSDFRKMVDWCLQKDPAKRPSIKQTLALPLMRRSLEQLEENLMLATQCRVRLKDIIDFEGGMDQEERKGSSPQPSPKLSPRAVAKDGVSPGQAAALAMARQNLSPVFQPPTTPSHSPMASPERGGGAPAAVGPKPSAAVPQSPTASPKQGNEAHRFYSPCQKRPIANPLLPGGGARPAPAESPSGAVPPPLAQRPLEEPHHTPPLRIKVTLGGAGDRRGLAAAALPAAAAAPAPGPSPNAADAFHADMRRVDAIIARYGRNSDEKAKETIHAYMRRKHEAYLKRQKEEIEARERRNRMRKEELRRVLENQRMAVSPLRNNDPRNSPHLNNINMNGYPDDRSPRRGSPQPRAKPENVHLPSRSPPSSPLQDKEPVSARTPTNAEPAVFGRDPRRGAPPGEPASRPTTPQQQRVLQQPPSPAAAAPNGNPLPQTPPRRVLYAANSPQQAHPPSQNRTEAPEARRAVTPDPLHSPPSRLGAPRGAAFDIDRRSLPNSKPEAASGGQKAPLTAGLGGGIDGHRMVLQTSQQHLPQPRRPMDAEQLPARRDRRESRVLEDAAVGRRPSALSPISGDPHDHCSPSQAAAAAPERASLSAGDPRLQRPGRALQRYLKPLGGRGEDGVSPLPSPTSAQSPRRGAAGVDRGHRGSSGVPPPVKSKALVSAGNANPPSSAPGELADIPRTAAHSTRAQASPCTPVKEALRALRRSKVQAGAPAPPPSSAMAAGMKDLPAIITSPEHERGARRNHPRYRLEEAALYRGMRREQPSREDERVLVDEHRKPHHAEVSAVPNTLEALRSLRAQQDKAMRAEGGAREEVNPGGQLALLKQRQRMQQRPRQGSTSSSASVPLAPRLMTRATEAAASPRSEVPSGYDRKTPVPRDNAAARPSAAHVTALSLGDVNRGAAPSRAAPPSAHAGAPPSPKPSTGGGAGVQSSMEGYAEMLQHLKDLLQRRRVSSAGGASAPTSPTTAASALSAIENPRDPGARSPISMRNRALPPPLNPSPLGGVDMSCASDSGDSGVLVSPPHLKATRPLHPQPNAVPVVNVRPGCDAEEEDDDDFEDAVPLSPVRCTELNDAYARQQDQQEQKWRHAQEDVYTSDVDLTSAAMEEELEGEEGYTDYHKRPSSKELPKGIKS
Complex: VGK_A_2(2WQO) / Model_6(2WQO/A) = [7.3]	Download	986.82	30.68	MDKYQRVKVLGKGSFGSAILIKRKTDGLLFVVKEVGMTRMSKKERDEARHECTVLQQLQHPNIVRYVEQFENNNNLYIVMEYCDGGDLAEKVKHSRGPMKESSMLYYFSQICLAIEYLHARHILHRDIKTMNVFLMKNGAVKLGDFGISTVLRTTMGMANTVCGTPYYFSPELCRNRPYNNKSDIWALGVLLYECATGGRHPFDGTSMNQLMQRIVQGHYAPLSSQYSSDFRKMVDWCLQKDPAKRPSIKQTLALPLMRRSLEQLEENLMLATQCRVRLKDIIDFEGGMDQEERKGSSPQPSPKLSPRAVAKDGVSPGQAAALAMARQNLSPVFQPPTTPSHSPMASPERGGGAPAAVGPKPSAAVPQSPTASPKQGNEAHRFYSPCQKRPIANPLLPGGGARPAPAESPSGAVPPPLAQRPLEEPHHTPPLRIKVTLGGAGDRRGLAAAALPAAAAAPAPGPSPNAADAFHADMRRVDAIIARYGRNSDEKAKETIHAYMRRKHEAYLKRQKEEIEARERRNRMRKEELRRVLENQRMAVSPLRNNDPRNSPHLNNINMNGYPDDRSPRRGSPQPRAKPENVHLPSRSPPSSPLQDKEPVSARTPTNAEPAVFGRDPRRGAPPGEPASRPTTPQQQRVLQQPPSPAAAAPNGNPLPQTPPRRVLYAANSPQQAHPPSQNRTEAPEARRAVTPDPLHSPPSRLGAPRGAAFDIDRRSLPNSKPEAASGGQKAPLTAGLGGGIDGHRMVLQTSQQHLPQPRRPMDAEQLPARRDRRESRVLEDAAVGRRPSALSPISGDPHDHCSPSQAAAAAPERASLSAGDPRLQRPGRALQRYLKPLGGRGEDGVSPLPSPTSAQSPRRGAAGVDRGHRGSSGVPPPVKSKALVSAGNANPPSSAPGELADIPRTAAHSTRAQASPCTPVKEALRALRRSKVQAGAPAPPPSSAMAAGMKDLPAIITSPEHERGARRNHPRYRLEEAALYRGMRREQPSREDERVLVDEHRKPHHAEVSAVPNTLEALRSLRAQQDKAMRAEGGAREEVNPGGQLALLKQRQRMQQRPRQGSTSSSASVPLAPRLMTRATEAAASPRSEVPSGYDRKTPVPRDNAAARPSAAHVTALSLGDVNRGAAPSRAAPPSAHAGAPPSPKPSTGGGAGVQSSMEGYAEMLQHLKDLLQRRRVSSAGGASAPTSPTTAASALSAIENPRDPGARSPISMRNRALPPPLNPSPLGGVDMSCASDSGDSGVLVSPPHLKATRPLHPQPNAVPVVNVRPGCDAEEEDDDDFEDAVPLSPVRCTELNDAYARQQDQQEQKWRHAQEDVYTSDVDLTSAAMEEELEGEEGYTDYHKRPSSKELPKGIKS
Complex: OL2_A_2(2XK4) / Model_8(2XK4/A) = [7.1]	Download	1509.44	24.22	MDKYQRVKVLGKGSFGSAILIKRKTDGLLFVVKEVGMTRMSKKERDEARHECTVLQQLQHPNIVRYVEQFENNNNLYIVMEYCDGGDLAEKVKHSRGPMKESSMLYYFSQICLAIEYLHARHILHRDIKTMNVFLMKNGAVKLGDFGISTVLRTTMGMANTVCGTPYYFSPELCRNRPYNNKSDIWALGVLLYECATGGRHPFDGTSMNQLMQRIVQGHYAPLSSQYSSDFRKMVDWCLQKDPAKRPSIKQTLALPLMRRSLEQLEENLMLATQCRVRLKDIIDFEGGMDQEERKGSSPQPSPKLSPRAVAKDGVSPGQAAALAMARQNLSPVFQPPTTPSHSPMASPERGGGAPAAVGPKPSAAVPQSPTASPKQGNEAHRFYSPCQKRPIANPLLPGGGARPAPAESPSGAVPPPLAQRPLEEPHHTPPLRIKVTLGGAGDRRGLAAAALPAAAAAPAPGPSPNAADAFHADMRRVDAIIARYGRNSDEKAKETIHAYMRRKHEAYLKRQKEEIEARERRNRMRKEELRRVLENQRMAVSPLRNNDPRNSPHLNNINMNGYPDDRSPRRGSPQPRAKPENVHLPSRSPPSSPLQDKEPVSARTPTNAEPAVFGRDPRRGAPPGEPASRPTTPQQQRVLQQPPSPAAAAPNGNPLPQTPPRRVLYAANSPQQAHPPSQNRTEAPEARRAVTPDPLHSPPSRLGAPRGAAFDIDRRSLPNSKPEAASGGQKAPLTAGLGGGIDGHRMVLQTSQQHLPQPRRPMDAEQLPARRDRRESRVLEDAAVGRRPSALSPISGDPHDHCSPSQAAAAAPERASLSAGDPRLQRPGRALQRYLKPLGGRGEDGVSPLPSPTSAQSPRRGAAGVDRGHRGSSGVPPPVKSKALVSAGNANPPSSAPGELADIPRTAAHSTRAQASPCTPVKEALRALRRSKVQAGAPAPPPSSAMAAGMKDLPAIITSPEHERGARRNHPRYRLEEAALYRGMRREQPSREDERVLVDEHRKPHHAEVSAVPNTLEALRSLRAQQDKAMRAEGGAREEVNPGGQLALLKQRQRMQQRPRQGSTSSSASVPLAPRLMTRATEAAASPRSEVPSGYDRKTPVPRDNAAARPSAAHVTALSLGDVNRGAAPSRAAPPSAHAGAPPSPKPSTGGGAGVQSSMEGYAEMLQHLKDLLQRRRVSSAGGASAPTSPTTAASALSAIENPRDPGARSPISMRNRALPPPLNPSPLGGVDMSCASDSGDSGVLVSPPHLKATRPLHPQPNAVPVVNVRPGCDAEEEDDDDFEDAVPLSPVRCTELNDAYARQQDQQEQKWRHAQEDVYTSDVDLTSAAMEEELEGEEGYTDYHKRPSSKELPKGIKS
Complex: 5R1_A_2(2XK8) / Model_11(2XK8/A) = [7.0]	Download	1263.86	24.80	MDKYQRVKVLGKGSFGSAILIKRKTDGLLFVVKEVGMTRMSKKERDEARHECTVLQQLQHPNIVRYVEQFENNNNLYIVMEYCDGGDLAEKVKHSRGPMKESSMLYYFSQICLAIEYLHARHILHRDIKTMNVFLMKNGAVKLGDFGISTVLRTTMGMANTVCGTPYYFSPELCRNRPYNNKSDIWALGVLLYECATGGRHPFDGTSMNQLMQRIVQGHYAPLSSQYSSDFRKMVDWCLQKDPAKRPSIKQTLALPLMRRSLEQLEENLMLATQCRVRLKDIIDFEGGMDQEERKGSSPQPSPKLSPRAVAKDGVSPGQAAALAMARQNLSPVFQPPTTPSHSPMASPERGGGAPAAVGPKPSAAVPQSPTASPKQGNEAHRFYSPCQKRPIANPLLPGGGARPAPAESPSGAVPPPLAQRPLEEPHHTPPLRIKVTLGGAGDRRGLAAAALPAAAAAPAPGPSPNAADAFHADMRRVDAIIARYGRNSDEKAKETIHAYMRRKHEAYLKRQKEEIEARERRNRMRKEELRRVLENQRMAVSPLRNNDPRNSPHLNNINMNGYPDDRSPRRGSPQPRAKPENVHLPSRSPPSSPLQDKEPVSARTPTNAEPAVFGRDPRRGAPPGEPASRPTTPQQQRVLQQPPSPAAAAPNGNPLPQTPPRRVLYAANSPQQAHPPSQNRTEAPEARRAVTPDPLHSPPSRLGAPRGAAFDIDRRSLPNSKPEAASGGQKAPLTAGLGGGIDGHRMVLQTSQQHLPQPRRPMDAEQLPARRDRRESRVLEDAAVGRRPSALSPISGDPHDHCSPSQAAAAAPERASLSAGDPRLQRPGRALQRYLKPLGGRGEDGVSPLPSPTSAQSPRRGAAGVDRGHRGSSGVPPPVKSKALVSAGNANPPSSAPGELADIPRTAAHSTRAQASPCTPVKEALRALRRSKVQAGAPAPPPSSAMAAGMKDLPAIITSPEHERGARRNHPRYRLEEAALYRGMRREQPSREDERVLVDEHRKPHHAEVSAVPNTLEALRSLRAQQDKAMRAEGGAREEVNPGGQLALLKQRQRMQQRPRQGSTSSSASVPLAPRLMTRATEAAASPRSEVPSGYDRKTPVPRDNAAARPSAAHVTALSLGDVNRGAAPSRAAPPSAHAGAPPSPKPSTGGGAGVQSSMEGYAEMLQHLKDLLQRRRVSSAGGASAPTSPTTAASALSAIENPRDPGARSPISMRNRALPPPLNPSPLGGVDMSCASDSGDSGVLVSPPHLKATRPLHPQPNAVPVVNVRPGCDAEEEDDDDFEDAVPLSPVRCTELNDAYARQQDQQEQKWRHAQEDVYTSDVDLTSAAMEEELEGEEGYTDYHKRPSSKELPKGIKS
Consensus [pKd Mean = 7.56]	-	1341 (s=203)	24 (s=4)	MDKYQRVKVLGKGSFGSAILIKRKTDGLLFVVKEVGMTRMSKKERDEARHECTVLQQLQHPNIVRYVEQFENNNNLYIVMEYCDGGDLAEKVKHSRGPMKESSMLYYFSQICLAIEYLHARHILHRDIKTMNVFLMKNGAVKLGDFGISTVLRTTMGMANTVCGTPYYFSPELCRNRPYNNKSDIWALGVLLYECATGGRHPFDGTSMNQLMQRIVQGHYAPLSSQYSSDFRKMVDWCLQKDPAKRPSIKQTLALPLMRRSLEQLEENLMLATQCRVRLKDIIDFEGGMDQEERKGSSPQPSPKLSPRAVAKDGVSPGQAAALAMARQNLSPVFQPPTTPSHSPMASPERGGGAPAAVGPKPSAAVPQSPTASPKQGNEAHRFYSPCQKRPIANPLLPGGGARPAPAESPSGAVPPPLAQRPLEEPHHTPPLRIKVTLGGAGDRRGLAAAALPAAAAAPAPGPSPNAADAFHADMRRVDAIIARYGRNSDEKAKETIHAYMRRKHEAYLKRQKEEIEARERRNRMRKEELRRVLENQRMAVSPLRNNDPRNSPHLNNINMNGYPDDRSPRRGSPQPRAKPENVHLPSRSPPSSPLQDKEPVSARTPTNAEPAVFGRDPRRGAPPGEPASRPTTPQQQRVLQQPPSPAAAAPNGNPLPQTPPRRVLYAANSPQQAHPPSQNRTEAPEARRAVTPDPLHSPPSRLGAPRGAAFDIDRRSLPNSKPEAASGGQKAPLTAGLGGGIDGHRMVLQTSQQHLPQPRRPMDAEQLPARRDRRESRVLEDAAVGRRPSALSPISGDPHDHCSPSQAAAAAPERASLSAGDPRLQRPGRALQRYLKPLGGRGEDGVSPLPSPTSAQSPRRGAAGVDRGHRGSSGVPPPVKSKALVSAGNANPPSSAPGELADIPRTAAHSTRAQASPCTPVKEALRALRRSKVQAGAPAPPPSSAMAAGMKDLPAIITSPEHERGARRNHPRYRLEEAALYRGMRREQPSREDERVLVDEHRKPHHAEVSAVPNTLEALRSLRAQQDKAMRAEGGAREEVNPGGQLALLKQRQRMQQRPRQGSTSSSASVPLAPRLMTRATEAAASPRSEVPSGYDRKTPVPRDNAAARPSAAHVTALSLGDVNRGAAPSRAAPPSAHAGAPPSPKPSTGGGAGVQSSMEGYAEMLQHLKDLLQRRRVSSAGGASAPTSPTTAASALSAIENPRDPGARSPISMRNRALPPPLNPSPLGGVDMSCASDSGDSGVLVSPPHLKATRPLHPQPNAVPVVNVRPGCDAEEEDDDDFEDAVPLSPVRCTELNDAYARQQDQQEQKWRHAQEDVYTSDVDLTSAAMEEELEGEEGYTDYHKRPSSKELPKGIKS

Res_Name	Res_Num	Res_At	Nb_Contacts	Nb_Complexes	Nb[At_Ligand]
LYS	8	CG	3	16	3[C],
LYS	8	CD	5	16	1[O], 4[C],
LYS	8	CE	31	16	7[O], 1[N], 23[C],
LYS	8	NZ	28	16	6[O], 1[N], 21[C],
VAL	9	CG1	17	16	12[F], 1[N], 4[C],
VAL	9	C	35	16	1[S], 11[F], 3[O], 2[N], 18[C],
VAL	9	O	32	16	7[F], 6[O], 1[N], 18[C],
VAL	9	CA	1	16	1[F],
LEU	10	CG	330	16	12[F], 3[S], 29[O], 53[N], 233[C],
LEU	10	O	222	16	12[F], 3[S], 28[O], 11[N], 168[C],
LEU	10	C	241	16	12[F], 3[S], 29[O], 18[N], 179[C],
LEU	10	N	159	16	12[F], 2[S], 25[O], 5[N], 115[C],
LEU	10	CD2	289	16	11[F], 3[S], 29[O], 40[N], 206[C],
LEU	10	CA	254	16	12[F], 3[S], 29[O], 20[N], 190[C],
LEU	10	CD1	366	16	12[F], 5[S], 30[O], 54[N], 265[C],
LEU	10	CB	347	16	12[F], 3[S], 29[O], 47[N], 256[C],
GLY	11	O	67	16	1[S], 12[F], 4[O], 2[N], 48[C],
GLY	11	N	223	16	12[F], 3[S], 25[O], 17[N], 166[C],
GLY	11	CA	179	16	12[F], 3[S], 21[O], 11[N], 132[C],
GLY	11	C	78	16	1[S], 12[F], 12[O], 2[N], 51[C],
LYS	12	O	34	16	10[F], 24[C],
LYS	12	C	30	16	11[F], 19[C],
LYS	12	CG	7	16	4[F], 3[C],
LYS	12	N	51	16	12[F], 1[O], 38[C],
LYS	12	CA	30	16	12[F], 18[C],
LYS	12	CB	11	16	7[F], 4[C],
GLY	13	CA	12	16	3[F], 9[C],
GLY	13	C	6	16	1[F], 5[C],
GLY	13	N	20	16	6[F], 2[O], 12[C],
GLY	13	O	3	16	3[C],
SER	14	CB	2	16	2[C],
SER	14	CA	2	16	2[C],
SER	14	C	2	16	2[C],
SER	14	N	5	16	1[F], 4[C],
PHE	15	CD1	9	16	2[O], 1[N], 6[C],
PHE	15	CB	10	16	3[O], 7[C],
PHE	15	CD2	5	16	2[O], 3[C],
PHE	15	CZ	5	16	2[O], 3[C],
PHE	15	C	4	16	1[F], 1[O], 2[C],
PHE	15	CE2	3	16	2[O], 1[C],
PHE	15	CA	4	16	1[O], 3[C],
PHE	15	N	9	16	1[F], 2[O], 6[C],
PHE	15	CE1	7	16	2[O], 1[N], 4[C],
PHE	15	CG	7	16	2[O], 5[C],
PHE	15	O	6	16	1[F], 1[O], 4[C],
GLY	16	N	6	16	1[O], 5[C],
GLY	16	CA	3	16	3[C],
GLY	16	O	18	16	5[F], 1[O], 12[C],
GLY	16	C	11	16	4[F], 7[C],
SER	17	N	14	16	4[F], 1[O], 1[N], 8[C],
SER	17	CB	9	16	1[S], 4[F], 2[C], 2[N],
SER	17	OG	6	16	1[S], 1[F], 2[C], 2[N],
SER	17	C	57	16	1[S], 12[F], 3[O], 2[N], 39[C],
SER	17	O	50	16	9[F], 4[O], 2[N], 35[C],
SER	17	CA	30	16	11[F], 1[O], 2[N], 16[C],
ALA	18	CB	354	16	12[F], 6[S], 27[O], 51[N], 258[C],
ALA	18	C	145	16	1[S], 12[F], 7[O], 19[N], 106[C],
ALA	18	O	116	16	1[S], 12[F], 3[O], 13[N], 87[C],
ALA	18	N	87	16	1[S], 12[F], 9[O], 3[N], 62[C],
ALA	18	CA	178	16	1[S], 12[F], 12[O], 21[N], 132[C],
ILE	19	N	103	16	1[S], 12[F], 1[O], 16[N], 73[C],
ILE	19	C	71	16	1[S], 4[F], 19[N], 47[C],
ILE	19	CA	18	16	1[S], 8[F], 2[N], 7[C],
ILE	19	O	112	16	1[S], 4[F], 37[N], 70[C],
LEU	20	CA	47	16	1[S], 16[N], 30[C],
LEU	20	CD1	132	16	5[O], 31[N], 96[C],
LEU	20	N	48	16	1[S], 3[F], 13[N], 31[C],
LEU	20	CG	59	16	2[O], 17[N], 40[C],
LEU	20	CB	80	16	3[O], 18[N], 59[C],
LEU	20	CD2	46	16	5[O], 4[N], 37[C],
LEU	29	O	1	16	1[N],
PHE	30	C	74	16	35[N], 39[C],
PHE	30	CA	44	16	17[C], 27[N],
PHE	30	O	71	16	34[N], 37[C],
PHE	30	CB	5	16	5[N],
VAL	31	CG1	275	16	4[F], 6[S], 9[O], 50[N], 206[C],
VAL	31	C	131	16	4[S], 38[N], 89[C],
VAL	31	N	125	16	1[S], 44[N], 80[C],
VAL	31	O	96	16	2[S], 57[C], 37[N],
VAL	31	CA	163	16	1[F], 4[S], 1[O], 49[N], 108[C],
VAL	31	CB	255	16	4[F], 4[S], 5[O], 50[N], 192[C],
VAL	31	CG2	303	16	5[F], 6[S], 21[O], 53[N], 218[C],
VAL	32	C	103	16	1[S], 3[F], 5[O], 16[N], 78[C],
VAL	32	CB	1	16	1[C],
VAL	32	CA	49	16	15[N], 34[C],
VAL	32	CG2	1	16	1[C],
VAL	32	O	120	16	1[S], 7[F], 8[O], 18[N], 86[C],
VAL	32	N	103	16	1[S], 1[F], 66[C], 35[N],
LYS	33	CE	219	16	9[F], 4[S], 32[O], 20[N], 154[C],
LYS	33	N	109	16	1[F], 21[O], 73[C], 14[N],
LYS	33	NZ	230	16	9[F], 4[S], 33[O], 21[N], 163[C],
LYS	33	CA	114	16	6[F], 24[O], 7[N], 77[C],
LYS	33	O	5	16	3[O], 2[C],
LYS	33	CB	148	16	2[S], 5[F], 25[O], 11[N], 105[C],
LYS	33	C	20	16	7[O], 13[C],
LYS	33	CD	208	16	10[F], 4[S], 31[O], 19[N], 144[C],
LYS	33	CG	181	16	8[F], 4[S], 31[O], 15[N], 123[C],
GLU	34	O	1	16	1[O],
GLU	34	N	6	16	2[O], 4[C],
VAL	35	CG2	1	16	1[O],
LEU	55	CB	3	16	3[O],
LEU	55	CD2	35	16	18[O], 3[N], 14[C],
LEU	55	CG	17	16	12[O], 2[N], 3[C],
LEU	55	CD1	25	16	15[O], 3[N], 7[C],
ILE	63	C	5	16	2[O], 3[C],
ILE	63	O	1	16	1[C],
ILE	63	CA	1	16	1[C],
ILE	63	CG2	3	16	2[O], 1[C],
VAL	64	CB	206	16	3[S], 24[O], 131[C], 48[N],
VAL	64	CG1	235	16	3[S], 27[O], 52[N], 153[C],
VAL	64	N	64	16	3[S], 13[O], 36[C], 12[N],
VAL	64	CG2	240	16	3[S], 28[O], 52[N], 157[C],
VAL	64	O	64	16	3[S], 14[O], 35[C], 12[N],
VAL	64	C	66	16	3[S], 12[O], 38[C], 13[N],
VAL	64	CA	118	16	3[S], 13[O], 19[N], 83[C],
ARG	65	N	41	16	3[S], 5[O], 22[C], 11[N],
ARG	65	O	39	16	3[S], 2[O], 22[C], 12[N],
ARG	65	C	16	16	2[O], 3[C], 11[N],
ARG	65	CA	10	16	1[O], 1[C], 8[N],
TYR	66	CD2	41	16	12[O], 28[C], 1[N],
TYR	66	CE2	58	16	16[O], 38[C], 4[N],
TYR	66	CA	1	16	1[C],
TYR	66	CE1	87	16	18[O], 59[C], 10[N],
TYR	66	CB	7	16	6[O], 1[C],
TYR	66	CG	37	16	13[O], 24[C],
TYR	66	CZ	82	16	18[O], 54[C], 10[N],
TYR	66	CD1	68	16	17[O], 9[N], 42[C],
TYR	66	N	1	16	1[C],
ILE	78	CD1	12	16	9[O], 3[C],
ILE	78	CB	26	16	15[O], 1[N], 10[C],
ILE	78	N	1	16	1[C],
ILE	78	CG1	11	16	9[O], 2[C],
ILE	78	CG2	33	16	16[O], 1[N], 16[C],
ILE	78	CA	2	16	1[O], 1[C],
ILE	78	O	46	16	11[O], 25[C], 10[N],
ILE	78	C	3	16	1[O], 2[C],
VAL	79	O	1	16	1[N],
VAL	79	N	1	16	1[C],
VAL	79	C	13	16	2[C], 11[N],
MET	80	SD	242	16	1[F], 4[S], 29[O], 47[N], 161[C],
MET	80	CG	240	16	1[F], 4[S], 30[O], 48[N], 157[C],
MET	80	CA	123	16	3[S], 6[O], 79[C], 35[N],
MET	80	CE	212	16	4[S], 30[O], 133[C], 45[N],
MET	80	CB	190	16	3[S], 21[O], 127[C], 39[N],
MET	80	O	107	16	3[S], 36[N], 68[C],
MET	80	C	113	16	3[S], 1[O], 74[C], 35[N],
MET	80	N	49	16	3[S], 16[N], 30[C],
GLU	81	OE1	37	16	14[C], 23[N],
GLU	81	C	167	16	3[S], 48[N], 116[C],
GLU	81	CD	48	16	22[C], 26[N],
GLU	81	O	234	16	4[S], 5[O], 49[N], 176[C],
GLU	81	N	112	16	3[S], 2[O], 72[C], 35[N],
GLU	81	OE2	33	16	2[S], 16[C], 15[N],
GLU	81	CB	82	16	3[S], 47[C], 32[N],
GLU	81	CG	96	16	2[S], 35[N], 59[C],
GLU	81	CA	110	16	3[S], 34[N], 73[C],
TYR	82	O	140	16	45[N], 95[C],
TYR	82	CG	191	16	9[O], 45[N], 137[C],
TYR	82	CE2	144	16	9[O], 23[N], 112[C],
TYR	82	N	142	16	3[S], 48[N], 91[C],
TYR	82	CA	194	16	3[S], 2[O], 48[N], 141[C],
TYR	82	CD1	251	16	3[S], 12[O], 50[N], 186[C],
TYR	82	CB	160	16	45[N], 115[C],
TYR	82	CE1	258	16	3[S], 22[O], 51[N], 182[C],
TYR	82	CD2	153	16	9[O], 35[N], 109[C],
TYR	82	C	197	16	3[S], 1[O], 48[N], 145[C],
TYR	82	CZ	215	16	11[O], 45[N], 159[C],
CYS	83	CB	283	16	5[S], 13[O], 48[N], 217[C],
CYS	83	N	257	16	6[S], 12[O], 48[N], 191[C],
CYS	83	O	300	16	6[S], 28[O], 51[N], 215[C],
CYS	83	CA	248	16	5[S], 12[O], 48[N], 183[C],
CYS	83	SG	237	16	5[S], 4[O], 48[N], 180[C],
CYS	83	C	256	16	4[S], 15[O], 49[N], 188[C],
ASP	84	CB	109	16	9[O], 19[N], 81[C],
ASP	84	CA	194	16	2[S], 11[O], 35[N], 146[C],
ASP	84	OD1	86	16	7[O], 13[N], 66[C],
ASP	84	CG	72	16	9[O], 6[N], 57[C],
ASP	84	O	186	16	2[S], 18[O], 20[N], 146[C],
ASP	84	OD2	32	16	6[O], 1[N], 25[C],
ASP	84	C	203	16	2[S], 17[O], 28[N], 156[C],
ASP	84	N	207	16	2[S], 9[O], 45[N], 151[C],
GLY	85	N	196	16	2[S], 17[O], 28[N], 149[C],
GLY	85	CA	171	16	2[S], 17[O], 17[N], 135[C],
GLY	85	C	210	16	2[S], 25[O], 33[N], 150[C],
GLY	85	O	180	16	2[S], 25[O], 7[N], 146[C],
GLY	86	N	259	16	2[S], 28[O], 39[N], 190[C],
GLY	86	CA	302	16	3[F], 3[S], 29[O], 42[N], 225[C],
GLY	86	O	298	16	4[S], 28[O], 46[N], 220[C],
GLY	86	C	314	16	4[S], 29[O], 41[N], 240[C],
ASP	87	OD2	199	16	3[F], 3[S], 20[O], 16[N], 157[C],
ASP	87	CG	245	16	8[F], 3[S], 29[O], 18[N], 187[C],
ASP	87	N	323	16	4[F], 4[S], 29[O], 41[N], 245[C],
ASP	87	O	138	16	2[S], 23[O], 4[N], 109[C],
ASP	87	C	144	16	2[S], 19[O], 6[N], 117[C],
ASP	87	CA	273	16	4[S], 29[O], 25[N], 215[C],
ASP	87	CB	323	16	8[F], 6[S], 32[O], 28[N], 249[C],
ASP	87	OD1	239	16	10[F], 2[S], 28[O], 16[N], 183[C],
LEU	88	CA	1	16	1[C],
LEU	88	C	1	16	1[C],
LEU	88	N	57	16	2[S], 10[O], 1[N], 44[C],
ALA	89	CA	14	16	1[O], 13[C],
ALA	89	C	16	16	3[O], 13[C],
ALA	89	N	31	16	6[O], 1[N], 24[C],
ALA	89	CB	35	16	9[O], 1[N], 25[C],
ALA	89	O	2	16	2[C],
GLU	90	C	19	16	6[O], 2[N], 11[C],
GLU	90	CB	124	16	2[S], 27[O], 5[N], 90[C],
GLU	90	O	12	16	2[N], 10[C],
GLU	90	OE1	124	16	1[F], 1[S], 22[O], 7[N], 93[C],
GLU	90	CG	156	16	3[F], 2[S], 28[O], 5[N], 118[C],
GLU	90	CA	67	16	15[O], 4[N], 48[C],
GLU	90	CD	138	16	2[F], 2[S], 24[O], 5[N], 105[C],
GLU	90	N	62	16	16[O], 4[N], 42[C],
GLU	90	OE2	131	16	2[F], 2[S], 21[O], 9[N], 97[C],
ARG	126	CD	1	16	1[O],
ARG	126	CG	1	16	1[O],
ARG	126	NE	7	16	6[O], 1[C],
ARG	126	CZ	19	16	10[O], 2[N], 7[C],
ASP	127	OD2	5	16	3[C], 2[N],
LYS	129	NZ	6	16	1[O], 5[C],
LYS	129	O	2	16	2[C],
LYS	129	CE	7	16	7[C],
THR	130	O	21	16	1[O], 1[N], 19[C],
THR	130	C	13	16	1[O], 12[C],
MET	131	CE	64	16	4[F], 8[O], 3[N], 49[C],
MET	131	CA	55	16	1[S], 10[O], 4[N], 40[C],
MET	131	SD	29	16	2[O], 27[C],
MET	131	N	16	16	1[O], 15[C],
MET	131	CB	50	16	1[S], 6[O], 3[N], 40[C],
MET	131	O	270	16	5[F], 6[S], 36[O], 25[N], 198[C],
MET	131	C	135	16	3[S], 24[O], 7[N], 101[C],
MET	131	CG	42	16	6[O], 2[N], 34[C],
ASN	132	C	110	16	4[S], 19[O], 7[N], 80[C],
ASN	132	N	81	16	1[S], 12[O], 6[N], 62[C],
ASN	132	CG	109	16	4[S], 29[O], 6[N], 70[C],
ASN	132	CB	100	16	2[S], 25[O], 6[N], 67[C],
ASN	132	ND2	100	16	2[S], 25[O], 5[N], 68[C],
ASN	132	O	106	16	3[S], 20[O], 6[N], 77[C],
ASN	132	CA	141	16	4[S], 28[O], 8[N], 101[C],
ASN	132	OD1	117	16	2[S], 24[O], 8[N], 83[C],
VAL	133	CA	30	16	1[S], 5[O], 24[C],
VAL	133	C	70	16	5[S], 5[O], 9[N], 51[C],
VAL	133	N	65	16	4[S], 7[O], 3[N], 51[C],
VAL	133	O	93	16	3[S], 4[O], 13[N], 73[C],
PHE	134	CG	387	16	4[F], 6[S], 38[O], 56[N], 283[C],
PHE	134	N	135	16	5[S], 6[O], 24[N], 100[C],
PHE	134	O	6	16	2[N], 4[C],
PHE	134	C	132	16	4[S], 36[N], 92[C],
PHE	134	CE1	373	16	4[F], 6[S], 44[O], 55[N], 264[C],
PHE	134	CD2	427	16	8[F], 6[S], 52[O], 56[N], 305[C],
PHE	134	CB	308	16	6[S], 14[O], 49[N], 239[C],
PHE	134	CE2	433	16	12[F], 6[S], 55[O], 57[N], 303[C],
PHE	134	CA	230	16	5[S], 5[O], 49[N], 171[C],
PHE	134	CD1	360	16	6[S], 41[O], 55[N], 258[C],
PHE	134	CZ	409	16	12[F], 6[S], 42[O], 56[N], 293[C],
LEU	135	O	183	16	2[S], 9[O], 41[N], 131[C],
LEU	135	N	151	16	2[S], 35[N], 114[C],
LEU	135	C	79	16	18[N], 61[C],
LEU	135	CA	23	16	9[N], 14[C],
MET	136	CA	25	16	15[N], 10[C],
MET	136	SD	4	16	1[C], 3[N],
MET	136	CG	27	16	7[C], 20[N],
MET	136	N	22	16	14[N], 8[C],
LYS	137	CE	1	16	1[C],
LYS	142	CD	10	16	1[C], 9[N],
LYS	142	NZ	1	16	1[C],
LYS	142	O	50	16	3[S], 6[O], 4[N], 37[C],
LYS	142	CG	4	16	2[C], 2[N],
LYS	142	CB	30	16	2[S], 1[O], 18[C], 9[N],
LYS	142	C	27	16	2[S], 5[O], 1[N], 19[C],
LEU	143	CA	22	16	6[O], 16[C],
LEU	143	N	8	16	5[O], 3[C],
LEU	143	CG	2	16	1[O], 1[C],
LEU	143	CB	3	16	1[O], 2[C],
LEU	143	C	75	16	3[S], 16[O], 5[N], 51[C],
LEU	143	O	75	16	3[S], 16[O], 4[N], 52[C],
LEU	143	CD1	1	16	1[C],
GLY	144	O	92	16	3[S], 24[O], 6[N], 59[C],
GLY	144	N	120	16	3[S], 24[O], 10[N], 83[C],
GLY	144	CA	173	16	3[S], 30[O], 116[C], 24[N],
GLY	144	C	130	16	3[S], 30[O], 10[N], 87[C],
ASP	145	N	152	16	3[S], 31[O], 12[N], 106[C],
ASP	145	C	113	16	3[S], 30[O], 4[N], 76[C],
ASP	145	CA	117	16	3[S], 30[O], 7[N], 77[C],
ASP	145	O	108	16	3[S], 28[O], 4[N], 73[C],
ASP	145	OD2	124	16	1[S], 30[O], 9[N], 84[C],
ASP	145	OD1	134	16	1[S], 28[O], 10[N], 95[C],
ASP	145	CB	113	16	2[S], 29[O], 7[N], 75[C],
ASP	145	CG	127	16	2[S], 30[O], 9[N], 86[C],
PHE	146	N	74	16	22[O], 5[N], 47[C],
PHE	146	CE2	80	16	1[F], 15[O], 7[N], 57[C],
PHE	146	CD2	77	16	17[O], 5[N], 55[C],
PHE	146	CD1	80	16	18[O], 6[N], 56[C],
PHE	146	O	45	16	18[O], 5[N], 22[C],
PHE	146	CE1	85	16	2[F], 15[O], 5[N], 63[C],
PHE	146	CB	68	16	22[O], 5[N], 41[C],
PHE	146	CZ	80	16	3[F], 1[S], 15[O], 5[N], 56[C],
PHE	146	CG	78	16	21[O], 5[N], 52[C],
PHE	146	CA	68	16	22[O], 5[N], 41[C],
PHE	146	C	50	16	19[O], 5[N], 26[C],
GLY	147	O	12	16	2[O], 2[N], 8[C],
GLY	147	C	13	16	4[O], 2[N], 7[C],
GLY	147	N	21	16	9[O], 3[N], 9[C],
GLY	147	CA	13	16	5[O], 2[N], 6[C],
ILE	148	N	8	16	2[O], 1[N], 5[C],
ILE	148	CA	11	16	2[O], 1[N], 8[C],
ILE	148	O	13	16	1[F], 4[O], 1[N], 7[C],
ILE	148	CG2	17	16	2[F], 1[S], 2[O], 1[N], 11[C],
ILE	148	CD1	14	16	1[S], 3[O], 2[N], 8[C],
ILE	148	CB	13	16	1[S], 2[O], 1[N], 9[C],
ILE	148	C	13	16	1[F], 2[O], 1[N], 9[C],
ILE	148	CG1	11	16	1[S], 2[O], 1[N], 7[C],
SER	149	N	16	16	1[F], 1[S], 2[O], 1[N], 11[C],
SER	149	CB	17	16	1[F], 2[O], 1[N], 13[C],
SER	149	C	11	16	1[F], 1[O], 1[N], 8[C],
SER	149	OG	21	16	3[F], 1[S], 2[O], 1[N], 14[C],
SER	149	O	7	16	1[F], 1[O], 1[N], 4[C],
SER	149	CA	18	16	2[F], 2[O], 1[N], 13[C],
THR	150	N	5	16	1[O], 1[N], 3[C],
THR	150	C	1	16	1[C],
THR	150	CA	1	16	1[C],
VAL	151	N	1	16	1[C],
VAL	151	C	1	16	1[C],
VAL	151	CG2	2	16	1[N], 1[C],
LEU	152	O	1	16	1[C],
LEU	152	CD1	14	16	3[F], 1[O], 1[N], 9[C],
LEU	152	CG	11	16	3[F], 1[O], 7[C],
LEU	152	C	1	16	1[C],
LEU	152	CB	7	16	1[F], 1[O], 5[C],
LEU	152	CA	3	16	1[F], 2[C],
LEU	152	CD2	16	16	3[F], 1[O], 1[N], 11[C],
LEU	152	N	2	16	2[C],
Total = 332


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