IID

P58181_Q8NGR1.1 contacts (residues)

Receptor	R: Secondary Structure	R: Residue	R; Chain	R: Residue number	Ligand	L: Secondary Structure	L: Residue	L: Chain	L: Residue Number
R	H	TYR	A	120	L	H	VAL	V	47
R	H	TYR	A	138	L	H	VAL	V	83
R	H	MET	A	153	L	-	THR	V	87
R	H	VAL	A	157	L	H	LEU	V	32
R	H	PHE	A	158	L	H	PHE	V	28
R	H	PHE	A	158	L	H	LEU	V	32
R	H	PHE	A	158	L	H	LEU	V	82
R	H	GLY	A	161	L	H	LEU	V	32
R	H	GLY	A	161	L	H	VAL	V	36
R	H	THR	A	164	L	H	VAL	V	36
R	H	ALA	A	165	L	H	TYR	V	35
R	H	ALA	A	165	L	H	LEU	V	39
R	H	LEU	A	168	L	H	LEU	V	39
R	H	LEU	A	168	L	H	MET	V	40
R	H	LEU	A	168	L	H	ALA	V	43
R	H	LEU	A	169	L	H	LEU	V	39
R	H	LEU	A	169	L	H	VAL	V	71
R	H	LEU	A	169	L	H	SER	V	72
R	H	LEU	A	169	L	H	ALA	V	75
R	H	ALA	A	171	L	H	VAL	V	47
R	H	VAL	A	172	L	H	ASN	V	42
R	H	VAL	A	172	L	H	ALA	V	43
R	H	VAL	A	172	L	H	THR	V	46
R	H	VAL	A	172	L	H	VAL	V	47
R	H	VAL	A	172	L	H	VAL	V	68
R	H	VAL	A	172	L	H	VAL	V	71
R	H	ASN	A	173	L	H	THR	V	46
R	H	ASN	A	173	L	H	VAL	V	68
R	H	ALA	A	175	L	H	THR	V	46
R	H	ALA	A	175	L	H	VAL	V	47
R	H	ALA	A	175	L	H	SER	V	50
R	H	ALA	A	175	L	H	LEU	V	64
R	H	ILE	A	176	L	H	THR	V	46
R	H	ILE	A	176	L	H	SER	V	50
R	H	ILE	A	176	L	H	LEU	V	64
R	H	ILE	A	176	L	H	VAL	V	68
R	H	GLY	A	179	L	H	SER	V	50
R	H	GLY	A	179	L	-	HIS	V	56
R	H	LEU	A	180	L	H	MET	V	142
R	H	LEU	A	182	L	H	SER	V	50
R	H	LEU	A	182	L	-	HIS	V	56
R	H	ARG	A	183	L	H	ARG	V	138
R	H	ARG	A	183	L	H	PHE	V	141
R	H	ARG	A	183	L	-	HIS	V	56
R	H	ARG	A	183	L	H	LEU	V	61
R	-	LEU	A	184	L	H	ARG	V	138
R	-	ASP	A	185	L	H	ARG	V	138
R	-	SER	A	208	L	H	ARG	V	138
R	-	SER	A	209	L	H	MET	V	142
R	H	TYR	A	211	L	H	ILE	V	146
R	H	TYR	A	211	L	H	ILE	V	150
R	H	VAL	A	212	L	H	MET	V	142
R	H	VAL	A	212	L	H	VAL	V	145
R	H	VAL	A	212	L	H	ILE	V	146
R	H	MET	A	216	L	H	TRP	V	149
R	H	MET	A	216	L	H	VAL	V	68
R	H	LEU	A	219	L	H	TRP	V	149
R	H	LEU	A	219	L	H	ILE	V	153
R	H	ALA	A	222	L	H	PHE	V	103
R	H	PHE	A	223	L	H	PHE	V	103
R	H	PHE	A	223	L	H	PHE	V	107
R	H	PHE	A	223	L	H	SER	V	72
R	H	PHE	A	223	L	H	VAL	V	76
R	H	VAL	A	227	L	H	PHE	V	103
R	H	LEU	A	230	L	H	VAL	V	95
R	H	LEU	A	230	L	H	ALA	V	99
R	H	PHE	A	238	L	S	MET	V	91

- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
- In the Secondary Structure columns: 'H' means that residues in that row are part of Alpha Helix; 'S' - Beta Sheet

P58181_Q8NGR1.1 contacts (residues & atoms)

Receptor	R: Secondary Structure	R: Atom	R: Residue	R; Chain	R: Residue number	Ligand	L: Secondary Structure	L; Atom	L: Residue	L: Chain	L: Residue Number
R	H	CE2	TYR	A	120	L	H	HG22	VAL	V	47
R	H	OH	TYR	A	120	L	H	CG2	VAL	V	47
R	H	OH	TYR	A	120	L	H	HG22	VAL	V	47
R	H	OH	TYR	A	120	L	H	HG23	VAL	V	47
R	H	CZ	TYR	A	120	L	H	HG22	VAL	V	47
R	H	CE1	TYR	A	138	L	H	HG23	VAL	V	83
R	H	CE2	TYR	A	138	L	H	HG22	VAL	V	83
R	H	CE2	TYR	A	138	L	H	HG23	VAL	V	83
R	H	OH	TYR	A	138	L	H	CG2	VAL	V	83
R	H	OH	TYR	A	138	L	H	HG12	VAL	V	83
R	H	OH	TYR	A	138	L	H	HG22	VAL	V	83
R	H	OH	TYR	A	138	L	H	HG23	VAL	V	83
R	H	CZ	TYR	A	138	L	H	CG2	VAL	V	83
R	H	CZ	TYR	A	138	L	H	HG22	VAL	V	83
R	H	CZ	TYR	A	138	L	H	HG23	VAL	V	83
R	H	CG	MET	A	153	L	-	HG22	THR	V	87
R	H	SD	MET	A	153	L	-	HG22	THR	V	87
R	H	CE	MET	A	153	L	-	CG2	THR	V	87
R	H	CE	MET	A	153	L	-	HG21	THR	V	87
R	H	CE	MET	A	153	L	-	HG22	THR	V	87
R	H	CE	MET	A	153	L	-	HG23	THR	V	87
R	H	C	VAL	A	157	L	H	HD23	LEU	V	32
R	H	O	VAL	A	157	L	H	HD23	LEU	V	32
R	H	CG1	VAL	A	157	L	H	CD2	LEU	V	32
R	H	CG1	VAL	A	157	L	H	HD21	LEU	V	32
R	H	CG1	VAL	A	157	L	H	HD23	LEU	V	32
R	H	N	PHE	A	158	L	H	HD23	LEU	V	32
R	H	CA	PHE	A	158	L	H	HD23	LEU	V	32
R	H	CB	PHE	A	158	L	H	HZ	PHE	V	28
R	H	CG	PHE	A	158	L	H	HZ	PHE	V	28
R	H	CD2	PHE	A	158	L	H	CZ	PHE	V	28
R	H	CD2	PHE	A	158	L	H	HE2	PHE	V	28
R	H	CD2	PHE	A	158	L	H	HZ	PHE	V	28
R	H	CD2	PHE	A	158	L	H	HD13	LEU	V	32
R	H	CD2	PHE	A	158	L	H	HD12	LEU	V	82
R	H	CE2	PHE	A	158	L	H	CZ	PHE	V	28
R	H	CE2	PHE	A	158	L	H	HE2	PHE	V	28
R	H	CE2	PHE	A	158	L	H	HZ	PHE	V	28
R	H	CE2	PHE	A	158	L	H	HB3	LEU	V	82
R	H	CE2	PHE	A	158	L	H	HD12	LEU	V	82
R	H	CA	GLY	A	161	L	H	HD12	LEU	V	32
R	H	CA	GLY	A	161	L	H	HG22	VAL	V	36
R	H	CA	GLY	A	161	L	H	HG23	VAL	V	36
R	H	O	GLY	A	161	L	H	HG22	VAL	V	36
R	H	CG2	THR	A	164	L	H	HG12	VAL	V	36
R	H	N	ALA	A	165	L	H	HD12	LEU	V	39
R	H	CA	ALA	A	165	L	H	HH	TYR	V	35
R	H	CA	ALA	A	165	L	H	CD1	LEU	V	39
R	H	CA	ALA	A	165	L	H	HD11	LEU	V	39
R	H	CA	ALA	A	165	L	H	HD12	LEU	V	39
R	H	CA	ALA	A	165	L	H	HD13	LEU	V	39
R	H	C	ALA	A	165	L	H	CD1	LEU	V	39
R	H	C	ALA	A	165	L	H	HD13	LEU	V	39
R	H	CB	ALA	A	165	L	H	CE1	TYR	V	35
R	H	CB	ALA	A	165	L	H	OH	TYR	V	35
R	H	CB	ALA	A	165	L	H	CZ	TYR	V	35
R	H	CB	ALA	A	165	L	H	HE1	TYR	V	35
R	H	CB	ALA	A	165	L	H	HH	TYR	V	35
R	H	CB	ALA	A	165	L	H	CD1	LEU	V	39
R	H	CB	ALA	A	165	L	H	HD11	LEU	V	39
R	H	CB	ALA	A	165	L	H	HD12	LEU	V	39
R	H	CB	ALA	A	165	L	H	HD13	LEU	V	39
R	H	O	ALA	A	165	L	H	CD1	LEU	V	39
R	H	O	ALA	A	165	L	H	HD11	LEU	V	39
R	H	O	ALA	A	165	L	H	HD13	LEU	V	39
R	H	CA	LEU	A	168	L	H	HB1	ALA	V	43
R	H	CA	LEU	A	168	L	H	HB3	ALA	V	43
R	H	C	LEU	A	168	L	H	HB1	ALA	V	43
R	H	C	LEU	A	168	L	H	HB3	ALA	V	43
R	H	CB	LEU	A	168	L	H	HB3	LEU	V	39
R	H	CB	LEU	A	168	L	H	HA	MET	V	40
R	H	CB	LEU	A	168	L	H	HB2	ALA	V	43
R	H	CB	LEU	A	168	L	H	HB3	ALA	V	43
R	H	O	LEU	A	168	L	H	CB	ALA	V	43
R	H	O	LEU	A	168	L	H	HB1	ALA	V	43
R	H	O	LEU	A	168	L	H	HB3	ALA	V	43
R	H	CG	LEU	A	168	L	H	HA	MET	V	40
R	H	CD1	LEU	A	168	L	H	C	LEU	V	39
R	H	CD1	LEU	A	168	L	H	HB2	LEU	V	39
R	H	CD1	LEU	A	168	L	H	HB3	LEU	V	39
R	H	CD1	LEU	A	168	L	H	N	MET	V	40
R	H	CD1	LEU	A	168	L	H	CA	MET	V	40
R	H	CD1	LEU	A	168	L	H	CB	MET	V	40
R	H	CD1	LEU	A	168	L	H	H	MET	V	40
R	H	CD1	LEU	A	168	L	H	HA	MET	V	40
R	H	CD1	LEU	A	168	L	H	HB2	MET	V	40
R	H	CD1	LEU	A	168	L	H	HG2	MET	V	40
R	H	CD2	LEU	A	168	L	H	HA	MET	V	40
R	H	CD2	LEU	A	168	L	H	HG2	MET	V	40
R	H	CD2	LEU	A	168	L	H	HB1	ALA	V	43
R	H	CD2	LEU	A	168	L	H	HB2	ALA	V	43
R	H	N	LEU	A	169	L	H	HD23	LEU	V	39
R	H	CA	LEU	A	169	L	H	HD23	LEU	V	39
R	H	CA	LEU	A	169	L	H	CG1	VAL	V	71
R	H	CA	LEU	A	169	L	H	HG12	VAL	V	71
R	H	CA	LEU	A	169	L	H	HG13	VAL	V	71
R	H	C	LEU	A	169	L	H	HG13	VAL	V	71
R	H	CB	LEU	A	169	L	H	HD23	LEU	V	39
R	H	CB	LEU	A	169	L	H	CG1	VAL	V	71
R	H	CB	LEU	A	169	L	H	HG11	VAL	V	71
R	H	CB	LEU	A	169	L	H	HG12	VAL	V	71
R	H	CB	LEU	A	169	L	H	HG13	VAL	V	71
R	H	O	LEU	A	169	L	H	HG13	VAL	V	71
R	H	CG	LEU	A	169	L	H	CG1	VAL	V	71
R	H	CG	LEU	A	169	L	H	HG11	VAL	V	71
R	H	CG	LEU	A	169	L	H	HG12	VAL	V	71
R	H	CG	LEU	A	169	L	H	HG13	VAL	V	71
R	H	CG	LEU	A	169	L	H	HB2	ALA	V	75
R	H	CD1	LEU	A	169	L	H	HD23	LEU	V	39
R	H	CD1	LEU	A	169	L	H	C	VAL	V	71
R	H	CD1	LEU	A	169	L	H	CB	VAL	V	71
R	H	CD1	LEU	A	169	L	H	O	VAL	V	71
R	H	CD1	LEU	A	169	L	H	CG1	VAL	V	71
R	H	CD1	LEU	A	169	L	H	HG11	VAL	V	71
R	H	CD1	LEU	A	169	L	H	HG12	VAL	V	71
R	H	CD1	LEU	A	169	L	H	HG13	VAL	V	71
R	H	CD1	LEU	A	169	L	H	HA	SER	V	72
R	H	CD1	LEU	A	169	L	H	HB2	ALA	V	75
R	H	CD2	LEU	A	169	L	H	HG11	VAL	V	71
R	H	CD2	LEU	A	169	L	H	CB	ALA	V	75
R	H	CD2	LEU	A	169	L	H	HB1	ALA	V	75
R	H	CD2	LEU	A	169	L	H	HB2	ALA	V	75
R	H	CD2	LEU	A	169	L	H	HB3	ALA	V	75
R	H	O	ALA	A	171	L	H	HG21	VAL	V	47
R	H	O	ALA	A	171	L	H	HG22	VAL	V	47
R	H	N	VAL	A	172	L	H	HA	ALA	V	43
R	H	N	VAL	A	172	L	H	HB1	ALA	V	43
R	H	CA	VAL	A	172	L	H	HA	ALA	V	43
R	H	CA	VAL	A	172	L	H	HB1	ALA	V	43
R	H	CA	VAL	A	172	L	H	CB	THR	V	46
R	H	CA	VAL	A	172	L	H	CG2	THR	V	46
R	H	CA	VAL	A	172	L	H	HB	THR	V	46
R	H	CA	VAL	A	172	L	H	HG21	THR	V	46
R	H	CA	VAL	A	172	L	H	HG22	THR	V	46
R	H	CA	VAL	A	172	L	H	HG21	VAL	V	47
R	H	C	VAL	A	172	L	H	CG2	THR	V	46
R	H	C	VAL	A	172	L	H	HB	THR	V	46
R	H	C	VAL	A	172	L	H	HG21	THR	V	46
R	H	C	VAL	A	172	L	H	HG22	THR	V	46
R	H	C	VAL	A	172	L	H	HG22	VAL	V	68
R	H	CB	VAL	A	172	L	H	CA	ALA	V	43
R	H	CB	VAL	A	172	L	H	CB	ALA	V	43
R	H	CB	VAL	A	172	L	H	HA	ALA	V	43
R	H	CB	VAL	A	172	L	H	HB1	ALA	V	43
R	H	CB	VAL	A	172	L	H	HB3	ALA	V	43
R	H	CB	VAL	A	172	L	H	CB	THR	V	46
R	H	CB	VAL	A	172	L	H	HB	THR	V	46
R	H	CB	VAL	A	172	L	H	HG1	THR	V	46
R	H	CB	VAL	A	172	L	H	HG21	THR	V	46
R	H	CB	VAL	A	172	L	H	HG13	VAL	V	71
R	H	CB	VAL	A	172	L	H	HG23	VAL	V	71
R	H	O	VAL	A	172	L	H	CB	THR	V	46
R	H	O	VAL	A	172	L	H	CG2	THR	V	46
R	H	O	VAL	A	172	L	H	HB	THR	V	46
R	H	O	VAL	A	172	L	H	HG21	THR	V	46
R	H	O	VAL	A	172	L	H	HG22	THR	V	46
R	H	O	VAL	A	172	L	H	HG23	THR	V	46
R	H	O	VAL	A	172	L	H	HG22	VAL	V	68
R	H	CG1	VAL	A	172	L	H	O	ASN	V	42
R	H	CG1	VAL	A	172	L	H	CA	ALA	V	43
R	H	CG1	VAL	A	172	L	H	HA	ALA	V	43
R	H	CG1	VAL	A	172	L	H	CB	THR	V	46
R	H	CG1	VAL	A	172	L	H	CG2	THR	V	46
R	H	CG1	VAL	A	172	L	H	OG1	THR	V	46
R	H	CG1	VAL	A	172	L	H	HB	THR	V	46
R	H	CG1	VAL	A	172	L	H	HG1	THR	V	46
R	H	CG1	VAL	A	172	L	H	HG21	THR	V	46
R	H	CG1	VAL	A	172	L	H	HA	VAL	V	68
R	H	CG1	VAL	A	172	L	H	HG22	VAL	V	68
R	H	CG1	VAL	A	172	L	H	HG13	VAL	V	71
R	H	CG1	VAL	A	172	L	H	HG23	VAL	V	71
R	H	CG2	VAL	A	172	L	H	C	ASN	V	42
R	H	CG2	VAL	A	172	L	H	O	ASN	V	42
R	H	CG2	VAL	A	172	L	H	N	ALA	V	43
R	H	CG2	VAL	A	172	L	H	CA	ALA	V	43
R	H	CG2	VAL	A	172	L	H	C	ALA	V	43
R	H	CG2	VAL	A	172	L	H	CB	ALA	V	43
R	H	CG2	VAL	A	172	L	H	O	ALA	V	43
R	H	CG2	VAL	A	172	L	H	H	ALA	V	43
R	H	CG2	VAL	A	172	L	H	HA	ALA	V	43
R	H	CG2	VAL	A	172	L	H	HB1	ALA	V	43
R	H	CG2	VAL	A	172	L	H	HB2	ALA	V	43
R	H	CG2	VAL	A	172	L	H	HB3	ALA	V	43
R	H	CG2	VAL	A	172	L	H	HB	THR	V	46
R	H	CG2	VAL	A	172	L	H	HG1	THR	V	46
R	H	CG2	VAL	A	172	L	H	HG23	VAL	V	71
R	H	N	ASN	A	173	L	H	HG21	THR	V	46
R	H	CA	ASN	A	173	L	H	HG22	VAL	V	68
R	H	OD1	ASN	A	173	L	H	HG12	VAL	V	68
R	H	N	ALA	A	175	L	H	HG22	THR	V	46
R	H	CA	ALA	A	175	L	H	HG22	THR	V	46
R	H	CA	ALA	A	175	L	H	OG	SER	V	50
R	H	CA	ALA	A	175	L	H	HB2	SER	V	50
R	H	CA	ALA	A	175	L	H	HB3	SER	V	50
R	H	CA	ALA	A	175	L	H	HG	SER	V	50
R	H	C	ALA	A	175	L	H	CG2	THR	V	46
R	H	C	ALA	A	175	L	H	HG22	THR	V	46
R	H	C	ALA	A	175	L	H	HG23	THR	V	46
R	H	C	ALA	A	175	L	H	CB	SER	V	50
R	H	C	ALA	A	175	L	H	OG	SER	V	50
R	H	C	ALA	A	175	L	H	HB2	SER	V	50
R	H	C	ALA	A	175	L	H	HB3	SER	V	50
R	H	C	ALA	A	175	L	H	HG	SER	V	50
R	H	C	ALA	A	175	L	H	HD13	LEU	V	64
R	H	CB	ALA	A	175	L	H	C	THR	V	46
R	H	CB	ALA	A	175	L	H	O	THR	V	46
R	H	CB	ALA	A	175	L	H	CG2	THR	V	46
R	H	CB	ALA	A	175	L	H	HG21	THR	V	46
R	H	CB	ALA	A	175	L	H	HG22	THR	V	46
R	H	CB	ALA	A	175	L	H	N	VAL	V	47
R	H	CB	ALA	A	175	L	H	CA	VAL	V	47
R	H	CB	ALA	A	175	L	H	CG2	VAL	V	47
R	H	CB	ALA	A	175	L	H	HA	VAL	V	47
R	H	CB	ALA	A	175	L	H	HG21	VAL	V	47
R	H	CB	ALA	A	175	L	H	HG22	VAL	V	47
R	H	CB	ALA	A	175	L	H	CB	SER	V	50
R	H	CB	ALA	A	175	L	H	OG	SER	V	50
R	H	CB	ALA	A	175	L	H	HB2	SER	V	50
R	H	CB	ALA	A	175	L	H	HG	SER	V	50
R	H	O	ALA	A	175	L	H	HG22	THR	V	46
R	H	O	ALA	A	175	L	H	CB	SER	V	50
R	H	O	ALA	A	175	L	H	OG	SER	V	50
R	H	O	ALA	A	175	L	H	HB2	SER	V	50
R	H	O	ALA	A	175	L	H	HB3	SER	V	50
R	H	O	ALA	A	175	L	H	HG	SER	V	50
R	H	O	ALA	A	175	L	H	HD13	LEU	V	64
R	H	N	ILE	A	176	L	H	CG2	THR	V	46
R	H	N	ILE	A	176	L	H	HG21	THR	V	46
R	H	N	ILE	A	176	L	H	HG22	THR	V	46
R	H	N	ILE	A	176	L	H	HG23	THR	V	46
R	H	N	ILE	A	176	L	H	OG	SER	V	50
R	H	N	ILE	A	176	L	H	HG	SER	V	50
R	H	N	ILE	A	176	L	H	HD13	LEU	V	64
R	H	CA	ILE	A	176	L	H	CG2	THR	V	46
R	H	CA	ILE	A	176	L	H	HG21	THR	V	46
R	H	CA	ILE	A	176	L	H	HG22	THR	V	46
R	H	CA	ILE	A	176	L	H	HG23	THR	V	46
R	H	CA	ILE	A	176	L	H	OG	SER	V	50
R	H	CA	ILE	A	176	L	H	HD13	LEU	V	64
R	H	CA	ILE	A	176	L	H	HD22	LEU	V	64
R	H	CA	ILE	A	176	L	H	HG23	VAL	V	68
R	H	C	ILE	A	176	L	H	HD22	LEU	V	64
R	H	CB	ILE	A	176	L	H	CG2	THR	V	46
R	H	CB	ILE	A	176	L	H	HG21	THR	V	46
R	H	CB	ILE	A	176	L	H	HG23	THR	V	46
R	H	CB	ILE	A	176	L	H	CD2	LEU	V	64
R	H	CB	ILE	A	176	L	H	HG	LEU	V	64
R	H	CB	ILE	A	176	L	H	HD13	LEU	V	64
R	H	CB	ILE	A	176	L	H	HD22	LEU	V	64
R	H	CB	ILE	A	176	L	H	CG2	VAL	V	68
R	H	CB	ILE	A	176	L	H	HG21	VAL	V	68
R	H	CB	ILE	A	176	L	H	HG22	VAL	V	68
R	H	CB	ILE	A	176	L	H	HG23	VAL	V	68
R	H	O	ILE	A	176	L	H	HD22	LEU	V	64
R	H	CG1	ILE	A	176	L	H	CB	THR	V	46
R	H	CG1	ILE	A	176	L	H	CG2	THR	V	46
R	H	CG1	ILE	A	176	L	H	OG1	THR	V	46
R	H	CG1	ILE	A	176	L	H	HG21	THR	V	46
R	H	CG1	ILE	A	176	L	H	HG22	THR	V	46
R	H	CG1	ILE	A	176	L	H	HG23	THR	V	46
R	H	CG1	ILE	A	176	L	H	O	LEU	V	64
R	H	CG1	ILE	A	176	L	H	CG	LEU	V	64
R	H	CG1	ILE	A	176	L	H	CD2	LEU	V	64
R	H	CG1	ILE	A	176	L	H	HG	LEU	V	64
R	H	CG1	ILE	A	176	L	H	HD13	LEU	V	64
R	H	CG1	ILE	A	176	L	H	HD21	LEU	V	64
R	H	CG1	ILE	A	176	L	H	HD22	LEU	V	64
R	H	CG1	ILE	A	176	L	H	CB	VAL	V	68
R	H	CG1	ILE	A	176	L	H	CG2	VAL	V	68
R	H	CG1	ILE	A	176	L	H	HG21	VAL	V	68
R	H	CG1	ILE	A	176	L	H	HG22	VAL	V	68
R	H	CG1	ILE	A	176	L	H	HG23	VAL	V	68
R	H	CG2	ILE	A	176	L	H	CD2	LEU	V	64
R	H	CG2	ILE	A	176	L	H	HD21	LEU	V	64
R	H	CG2	ILE	A	176	L	H	HD22	LEU	V	64
R	H	CG2	ILE	A	176	L	H	CG2	VAL	V	68
R	H	CG2	ILE	A	176	L	H	HG13	VAL	V	68
R	H	CG2	ILE	A	176	L	H	HG23	VAL	V	68
R	H	CD1	ILE	A	176	L	H	CG2	THR	V	46
R	H	CD1	ILE	A	176	L	H	OG1	THR	V	46
R	H	CD1	ILE	A	176	L	H	HG21	THR	V	46
R	H	CD1	ILE	A	176	L	H	HG23	THR	V	46
R	H	CD1	ILE	A	176	L	H	O	LEU	V	64
R	H	CD1	ILE	A	176	L	H	HG	LEU	V	64
R	H	CD1	ILE	A	176	L	H	N	VAL	V	68
R	H	CD1	ILE	A	176	L	H	CA	VAL	V	68
R	H	CD1	ILE	A	176	L	H	CB	VAL	V	68
R	H	CD1	ILE	A	176	L	H	CG1	VAL	V	68
R	H	CD1	ILE	A	176	L	H	CG2	VAL	V	68
R	H	CD1	ILE	A	176	L	H	H	VAL	V	68
R	H	CD1	ILE	A	176	L	H	HA	VAL	V	68
R	H	CD1	ILE	A	176	L	H	HB	VAL	V	68
R	H	CD1	ILE	A	176	L	H	HG12	VAL	V	68
R	H	CD1	ILE	A	176	L	H	HG13	VAL	V	68
R	H	CD1	ILE	A	176	L	H	HG21	VAL	V	68
R	H	CD1	ILE	A	176	L	H	HG22	VAL	V	68
R	H	CD1	ILE	A	176	L	H	HG23	VAL	V	68
R	H	N	GLY	A	179	L	H	CB	SER	V	50
R	H	N	GLY	A	179	L	H	HB3	SER	V	50
R	H	CA	GLY	A	179	L	H	CB	SER	V	50
R	H	CA	GLY	A	179	L	H	OG	SER	V	50
R	H	CA	GLY	A	179	L	H	HA	SER	V	50
R	H	CA	GLY	A	179	L	H	HB3	SER	V	50
R	H	O	GLY	A	179	L	-	CE1	HIS	V	56
R	H	O	GLY	A	179	L	-	HE1	HIS	V	56
R	H	CD2	LEU	A	180	L	H	HE1	MET	V	142
R	H	CB	LEU	A	182	L	-	HE1	HIS	V	56
R	H	CD1	LEU	A	182	L	H	O	SER	V	50
R	H	CD1	LEU	A	182	L	-	HE1	HIS	V	56
R	H	CA	ARG	A	183	L	H	NH2	ARG	V	138
R	H	CA	ARG	A	183	L	H	HH22	ARG	V	138
R	H	C	ARG	A	183	L	H	NH2	ARG	V	138
R	H	C	ARG	A	183	L	H	CZ	ARG	V	138
R	H	C	ARG	A	183	L	H	HH12	ARG	V	138
R	H	C	ARG	A	183	L	H	HH21	ARG	V	138
R	H	C	ARG	A	183	L	H	HH22	ARG	V	138
R	H	CB	ARG	A	183	L	H	NH2	ARG	V	138
R	H	CB	ARG	A	183	L	H	HH21	ARG	V	138
R	H	CB	ARG	A	183	L	H	HH22	ARG	V	138
R	H	O	ARG	A	183	L	H	NH1	ARG	V	138
R	H	O	ARG	A	183	L	H	NH2	ARG	V	138
R	H	O	ARG	A	183	L	H	CZ	ARG	V	138
R	H	O	ARG	A	183	L	H	HH11	ARG	V	138
R	H	O	ARG	A	183	L	H	HH12	ARG	V	138
R	H	O	ARG	A	183	L	H	HH21	ARG	V	138
R	H	O	ARG	A	183	L	H	HH22	ARG	V	138
R	H	CG	ARG	A	183	L	-	ND1	HIS	V	56
R	H	CD	ARG	A	183	L	H	CD1	LEU	V	61
R	H	CD	ARG	A	183	L	H	CD2	LEU	V	61
R	H	CD	ARG	A	183	L	H	HD12	LEU	V	61
R	H	CD	ARG	A	183	L	H	HD13	LEU	V	61
R	H	CD	ARG	A	183	L	H	HD22	LEU	V	61
R	H	CD	ARG	A	183	L	H	HD23	LEU	V	61
R	H	NE	ARG	A	183	L	-	CG	HIS	V	56
R	H	NE	ARG	A	183	L	-	ND1	HIS	V	56
R	H	NE	ARG	A	183	L	-	HB3	HIS	V	56
R	H	NE	ARG	A	183	L	H	CG	LEU	V	61
R	H	NE	ARG	A	183	L	H	CD1	LEU	V	61
R	H	NE	ARG	A	183	L	H	CD2	LEU	V	61
R	H	NE	ARG	A	183	L	H	HD12	LEU	V	61
R	H	NE	ARG	A	183	L	H	HD13	LEU	V	61
R	H	NE	ARG	A	183	L	H	HD21	LEU	V	61
R	H	NE	ARG	A	183	L	H	HD22	LEU	V	61
R	H	NE	ARG	A	183	L	H	HD23	LEU	V	61
R	H	NH1	ARG	A	183	L	H	CB	LEU	V	61
R	H	NH1	ARG	A	183	L	H	CG	LEU	V	61
R	H	NH1	ARG	A	183	L	H	CD1	LEU	V	61
R	H	NH1	ARG	A	183	L	H	CD2	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HB2	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HB3	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HG	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HD11	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HD12	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HD13	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HD21	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HD22	LEU	V	61
R	H	NH1	ARG	A	183	L	H	HD23	LEU	V	61
R	H	NH1	ARG	A	183	L	H	CE1	PHE	V	141
R	H	NH1	ARG	A	183	L	H	CZ	PHE	V	141
R	H	NH1	ARG	A	183	L	H	HE1	PHE	V	141
R	H	NH1	ARG	A	183	L	H	HZ	PHE	V	141
R	H	NH2	ARG	A	183	L	-	HA	HIS	V	56
R	H	NH2	ARG	A	183	L	H	CA	LEU	V	61
R	H	NH2	ARG	A	183	L	H	CB	LEU	V	61
R	H	NH2	ARG	A	183	L	H	CG	LEU	V	61
R	H	NH2	ARG	A	183	L	H	CD1	LEU	V	61
R	H	NH2	ARG	A	183	L	H	CD2	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HA	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HB2	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HB3	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HG	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HD11	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HD12	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HD13	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HD21	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HD22	LEU	V	61
R	H	NH2	ARG	A	183	L	H	HD23	LEU	V	61
R	H	CZ	ARG	A	183	L	-	HA	HIS	V	56
R	H	CZ	ARG	A	183	L	-	HB3	HIS	V	56
R	H	CZ	ARG	A	183	L	H	CB	LEU	V	61
R	H	CZ	ARG	A	183	L	H	CG	LEU	V	61
R	H	CZ	ARG	A	183	L	H	CD1	LEU	V	61
R	H	CZ	ARG	A	183	L	H	CD2	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HB2	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HB3	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HG	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HD11	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HD12	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HD13	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HD21	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HD22	LEU	V	61
R	H	CZ	ARG	A	183	L	H	HD23	LEU	V	61
R	-	N	LEU	A	184	L	H	NH2	ARG	V	138
R	-	N	LEU	A	184	L	H	HH22	ARG	V	138
R	-	CA	LEU	A	184	L	H	HH22	ARG	V	138
R	-	C	LEU	A	184	L	H	HH22	ARG	V	138
R	-	CD2	LEU	A	184	L	H	NH2	ARG	V	138
R	-	CD2	LEU	A	184	L	H	HH21	ARG	V	138
R	-	CD2	LEU	A	184	L	H	HH22	ARG	V	138
R	-	N	ASP	A	185	L	H	HH12	ARG	V	138
R	-	CG	ASP	A	185	L	H	HH12	ARG	V	138
R	-	OD2	ASP	A	185	L	H	NH1	ARG	V	138
R	-	OD2	ASP	A	185	L	H	HH11	ARG	V	138
R	-	OD2	ASP	A	185	L	H	HH12	ARG	V	138
R	-	CB	SER	A	208	L	H	NH1	ARG	V	138
R	-	CB	SER	A	208	L	H	HH12	ARG	V	138
R	-	CB	SER	A	208	L	H	HH22	ARG	V	138
R	-	OG	SER	A	208	L	H	NH1	ARG	V	138
R	-	OG	SER	A	208	L	H	HH12	ARG	V	138
R	-	OG	SER	A	208	L	H	HH22	ARG	V	138
R	-	O	SER	A	209	L	H	HE3	MET	V	142
R	H	CB	TYR	A	211	L	H	HD11	ILE	V	146
R	H	CG	TYR	A	211	L	H	CD1	ILE	V	146
R	H	CG	TYR	A	211	L	H	HD11	ILE	V	146
R	H	CG	TYR	A	211	L	H	HD13	ILE	V	146
R	H	CD1	TYR	A	211	L	H	CG1	ILE	V	146
R	H	CD1	TYR	A	211	L	H	CD1	ILE	V	146
R	H	CD1	TYR	A	211	L	H	HG12	ILE	V	146
R	H	CD1	TYR	A	211	L	H	HG23	ILE	V	146
R	H	CD1	TYR	A	211	L	H	HD11	ILE	V	146
R	H	CD1	TYR	A	211	L	H	HD12	ILE	V	146
R	H	CD1	TYR	A	211	L	H	HD13	ILE	V	146
R	H	CE1	TYR	A	211	L	H	CB	ILE	V	146
R	H	CE1	TYR	A	211	L	H	CG1	ILE	V	146
R	H	CE1	TYR	A	211	L	H	CG2	ILE	V	146
R	H	CE1	TYR	A	211	L	H	CD1	ILE	V	146
R	H	CE1	TYR	A	211	L	H	HG12	ILE	V	146
R	H	CE1	TYR	A	211	L	H	HG22	ILE	V	146
R	H	CE1	TYR	A	211	L	H	HG23	ILE	V	146
R	H	CE1	TYR	A	211	L	H	HD11	ILE	V	146
R	H	CE1	TYR	A	211	L	H	HD12	ILE	V	146
R	H	CE1	TYR	A	211	L	H	HD13	ILE	V	146
R	H	OH	TYR	A	211	L	H	CG2	ILE	V	146
R	H	OH	TYR	A	211	L	H	HG22	ILE	V	146
R	H	OH	TYR	A	211	L	H	HG23	ILE	V	146
R	H	OH	TYR	A	211	L	H	HD13	ILE	V	146
R	H	OH	TYR	A	211	L	H	CD1	ILE	V	150
R	H	OH	TYR	A	211	L	H	HD12	ILE	V	150
R	H	CZ	TYR	A	211	L	H	CG2	ILE	V	146
R	H	CZ	TYR	A	211	L	H	HG22	ILE	V	146
R	H	CZ	TYR	A	211	L	H	HG23	ILE	V	146
R	H	CZ	TYR	A	211	L	H	HD13	ILE	V	146
R	H	CZ	TYR	A	211	L	H	HD12	ILE	V	150
R	H	N	VAL	A	212	L	H	HD11	ILE	V	146
R	H	CA	VAL	A	212	L	H	HD11	ILE	V	146
R	H	CB	VAL	A	212	L	H	SD	MET	V	142
R	H	CB	VAL	A	212	L	H	CE	MET	V	142
R	H	CB	VAL	A	212	L	H	HE1	MET	V	142
R	H	CB	VAL	A	212	L	H	HE3	MET	V	142
R	H	CB	VAL	A	212	L	H	HD11	ILE	V	146
R	H	CG1	VAL	A	212	L	H	SD	MET	V	142
R	H	CG1	VAL	A	212	L	H	HE1	MET	V	142
R	H	CG1	VAL	A	212	L	H	HG12	VAL	V	145
R	H	CG2	VAL	A	212	L	H	CB	MET	V	142
R	H	CG2	VAL	A	212	L	H	CG	MET	V	142
R	H	CG2	VAL	A	212	L	H	SD	MET	V	142
R	H	CG2	VAL	A	212	L	H	CE	MET	V	142
R	H	CG2	VAL	A	212	L	H	HA	MET	V	142
R	H	CG2	VAL	A	212	L	H	HB2	MET	V	142
R	H	CG2	VAL	A	212	L	H	HG3	MET	V	142
R	H	CG2	VAL	A	212	L	H	HE1	MET	V	142
R	H	CG2	VAL	A	212	L	H	HE3	MET	V	142
R	H	CG2	VAL	A	212	L	H	CG1	ILE	V	146
R	H	CG2	VAL	A	212	L	H	CD1	ILE	V	146
R	H	CG2	VAL	A	212	L	H	HG12	ILE	V	146
R	H	CG2	VAL	A	212	L	H	HG13	ILE	V	146
R	H	CG2	VAL	A	212	L	H	HD11	ILE	V	146
R	H	CG2	VAL	A	212	L	H	HD12	ILE	V	146
R	H	SD	MET	A	216	L	H	CE2	TRP	V	149
R	H	SD	MET	A	216	L	H	NE1	TRP	V	149
R	H	SD	MET	A	216	L	H	CZ2	TRP	V	149
R	H	SD	MET	A	216	L	H	HZ2	TRP	V	149
R	H	SD	MET	A	216	L	H	HE1	TRP	V	149
R	H	CE	MET	A	216	L	H	HG13	VAL	V	68
R	H	CE	MET	A	216	L	H	CZ2	TRP	V	149
R	H	CE	MET	A	216	L	H	HZ2	TRP	V	149
R	H	CG	LEU	A	219	L	H	HD11	ILE	V	153
R	H	CD1	LEU	A	219	L	H	CD2	TRP	V	149
R	H	CD1	LEU	A	219	L	H	CE3	TRP	V	149
R	H	CD1	LEU	A	219	L	H	CZ3	TRP	V	149
R	H	CD1	LEU	A	219	L	H	HB2	TRP	V	149
R	H	CD1	LEU	A	219	L	H	HE3	TRP	V	149
R	H	CD1	LEU	A	219	L	H	HD11	ILE	V	153
R	H	CD2	LEU	A	219	L	H	CD1	ILE	V	153
R	H	CD2	LEU	A	219	L	H	HG12	ILE	V	153
R	H	CD2	LEU	A	219	L	H	HD11	ILE	V	153
R	H	CD2	LEU	A	219	L	H	HD12	ILE	V	153
R	H	O	ALA	A	222	L	H	HZ	PHE	V	103
R	H	CA	PHE	A	223	L	H	HE1	PHE	V	103
R	H	CA	PHE	A	223	L	H	HZ	PHE	V	103
R	H	CB	PHE	A	223	L	H	HE1	PHE	V	103
R	H	CG	PHE	A	223	L	H	CE1	PHE	V	103
R	H	CG	PHE	A	223	L	H	HE1	PHE	V	103
R	H	CG	PHE	A	223	L	H	HZ	PHE	V	107
R	H	CD1	PHE	A	223	L	H	HZ	PHE	V	107
R	H	CD2	PHE	A	223	L	H	CG	PHE	V	103
R	H	CD2	PHE	A	223	L	H	CD1	PHE	V	103
R	H	CD2	PHE	A	223	L	H	CE1	PHE	V	103
R	H	CD2	PHE	A	223	L	H	CZ	PHE	V	103
R	H	CD2	PHE	A	223	L	H	HD1	PHE	V	103
R	H	CD2	PHE	A	223	L	H	HE1	PHE	V	103
R	H	CD2	PHE	A	223	L	H	HZ	PHE	V	103
R	H	CD2	PHE	A	223	L	H	CE2	PHE	V	107
R	H	CD2	PHE	A	223	L	H	CZ	PHE	V	107
R	H	CD2	PHE	A	223	L	H	HE2	PHE	V	107
R	H	CD2	PHE	A	223	L	H	HZ	PHE	V	107
R	H	CE1	PHE	A	223	L	H	HB3	SER	V	72
R	H	CE2	PHE	A	223	L	H	HB3	SER	V	72
R	H	CE2	PHE	A	223	L	H	CG2	VAL	V	76
R	H	CE2	PHE	A	223	L	H	HG21	VAL	V	76
R	H	CE2	PHE	A	223	L	H	HG22	VAL	V	76
R	H	CE2	PHE	A	223	L	H	HG23	VAL	V	76
R	H	CE2	PHE	A	223	L	H	CG	PHE	V	103
R	H	CE2	PHE	A	223	L	H	CD1	PHE	V	103
R	H	CE2	PHE	A	223	L	H	CE1	PHE	V	103
R	H	CE2	PHE	A	223	L	H	HB3	PHE	V	103
R	H	CE2	PHE	A	223	L	H	HD1	PHE	V	103
R	H	CE2	PHE	A	223	L	H	CE2	PHE	V	107
R	H	CE2	PHE	A	223	L	H	CZ	PHE	V	107
R	H	CE2	PHE	A	223	L	H	HE2	PHE	V	107
R	H	CE2	PHE	A	223	L	H	HZ	PHE	V	107
R	H	CZ	PHE	A	223	L	H	HB3	SER	V	72
R	H	CZ	PHE	A	223	L	H	CG2	VAL	V	76
R	H	CZ	PHE	A	223	L	H	HG21	VAL	V	76
R	H	CZ	PHE	A	223	L	H	HG23	VAL	V	76
R	H	CZ	PHE	A	223	L	H	HE2	PHE	V	107
R	H	CZ	PHE	A	223	L	H	HZ	PHE	V	107
R	H	CG2	VAL	A	227	L	H	CD2	PHE	V	103
R	H	CG2	VAL	A	227	L	H	CE2	PHE	V	103
R	H	CG2	VAL	A	227	L	H	CZ	PHE	V	103
R	H	CG2	VAL	A	227	L	H	HE2	PHE	V	103
R	H	CG2	VAL	A	227	L	H	HZ	PHE	V	103
R	H	CG	LEU	A	230	L	H	HG11	VAL	V	95
R	H	CG	LEU	A	230	L	H	HG13	VAL	V	95
R	H	CD1	LEU	A	230	L	H	CG1	VAL	V	95
R	H	CD1	LEU	A	230	L	H	HG11	VAL	V	95
R	H	CD1	LEU	A	230	L	H	HG13	VAL	V	95
R	H	CD1	LEU	A	230	L	H	CB	ALA	V	99
R	H	CD1	LEU	A	230	L	H	HB1	ALA	V	99
R	H	CD1	LEU	A	230	L	H	HB2	ALA	V	99
R	H	CD2	LEU	A	230	L	H	CG1	VAL	V	95
R	H	CD2	LEU	A	230	L	H	HG11	VAL	V	95
R	H	CD2	LEU	A	230	L	H	HG12	VAL	V	95
R	H	CD2	LEU	A	230	L	H	HG13	VAL	V	95
R	H	CE1	PHE	A	238	L	S	HB2	MET	V	91
R	H	CZ	PHE	A	238	L	S	HB2	MET	V	91

- Title of columns started by 'R:' means Receptor, 'L:' means Ligand
- In the Secondary Structure columns: 'H' means that residues/atoms in that row are part of Alpha Helix; 'S' - Beta Sheet

Krembil, Jurisica Lab. July 16, 2025 Database: 1.0.4.1