IID

A4D2G3_A6NKK0.5 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	LEU	A	222	L	H	HIS	V	64
R	H	LEU	A	222	L	H	VAL	V	67
R	H	PHE	A	223	L	H	PHE	V	60
R	H	ILE	A	225	L	H	LEU	V	45
R	H	ILE	A	225	L	H	VAL	V	67
R	H	LEU	A	226	L	H	LEU	V	45
R	H	LEU	A	226	L	H	GLY	V	46
R	H	LEU	A	226	L	H	SER	V	49
R	H	LEU	A	226	L	H	SER	V	63
R	H	LEU	A	226	L	H	VAL	V	67
R	-	LYS	A	227	L	H	LEU	V	45
R	-	LYS	A	227	L	H	GLY	V	46
R	-	LYS	A	227	L	H	SER	V	49
R	-	LYS	A	228	L	H	GLY	V	42
R	-	LYS	A	228	L	H	LEU	V	45
R	-	LYS	A	228	L	H	GLY	V	46
R	-	LYS	A	229	L	H	MET	V	303
R	-	LYS	A	229	L	H	GLY	V	46
R	-	LYS	A	229	L	H	LEU	V	50
R	H	TRP	A	23	L	-	GLN	V	5
R	H	ASP	A	231	L	H	ILE	V	35
R	H	ASP	A	231	L	H	LEU	V	38
R	H	ASP	A	231	L	H	LEU	V	39
R	H	ASP	A	231	L	H	GLY	V	42
R	H	VAL	A	234	L	H	ILE	V	70
R	H	ARG	A	235	L	H	TYR	V	34
R	H	ARG	A	235	L	H	LEU	V	38
R	H	ARG	A	235	L	H	CYS	V	74
R	H	PHE	A	238	L	H	VAL	V	67
R	H	PHE	A	238	L	H	ILE	V	70
R	H	PHE	A	238	L	H	ALA	V	71
R	H	PHE	A	238	L	H	CYS	V	74
R	H	GLY	A	242	L	H	LEU	V	102
R	H	PHE	A	246	L	H	PHE	V	101
R	H	PHE	A	246	L	H	LEU	V	102
R	H	PHE	A	246	L	H	LEU	V	159
R	H	PHE	A	246	L	H	THR	V	98
R	H	SER	A	249	L	H	PHE	V	101
R	H	SER	A	249	L	H	VAL	V	152
R	H	SER	A	249	L	H	LEU	V	156
R	H	LEU	A	250	L	H	LEU	V	159
R	H	LEU	A	250	L	-	LEU	V	163
R	H	GLY	A	253	L	H	LEU	V	156
R	H	PRO	A	254	L	H	LEU	V	156
R	H	LEU	A	256	L	H	LEU	V	153
R	H	PHE	A	257	L	H	LEU	V	153
R	H	PHE	A	257	L	H	LEU	V	156
R	H	PHE	A	257	L	H	VAL	V	157
R	H	PHE	A	257	L	H	VAL	V	160
R	H	PRO	A	26	L	-	GLN	V	5
R	H	LEU	A	27	L	-	GLN	V	5
R	H	VAL	A	273	L	H	VAL	V	160
R	H	PHE	A	277	L	H	VAL	V	160
R	H	PHE	A	277	L	-	LEU	V	163
R	H	ILE	A	281	L	-	LEU	V	163
R	H	LEU	A	285	L	H	PHE	V	93
R	H	LEU	A	285	L	H	ALA	V	94
R	H	ILE	A	288	L	-	SER	V	92
R	H	ILE	A	288	L	H	ALA	V	94
R	H	ILE	A	288	L	H	GLY	V	95
R	-	ARG	A	293	L	H	THR	V	98
R	H	ALA	A	30	L	-	GLN	V	5
R	H	ALA	A	30	L	-	SER	V	7
R	H	VAL	A	33	L	-	SER	V	7
R	H	ILE	A	34	L	-	SER	V	7
R	H	ILE	A	37	L	-	THR	V	9

- 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

A4D2G3_A6NKK0.5 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	CE3	TRP	A	23	L	-	NE2	GLN	V	5
R	H	CE3	TRP	A	23	L	-	HE21	GLN	V	5
R	H	CE3	TRP	A	23	L	-	HE22	GLN	V	5
R	H	CH2	TRP	A	23	L	-	HE21	GLN	V	5
R	H	CZ3	TRP	A	23	L	-	CD	GLN	V	5
R	H	CZ3	TRP	A	23	L	-	NE2	GLN	V	5
R	H	CZ3	TRP	A	23	L	-	HG3	GLN	V	5
R	H	CZ3	TRP	A	23	L	-	HE21	GLN	V	5
R	H	CZ3	TRP	A	23	L	-	HE22	GLN	V	5
R	H	CA	PRO	A	26	L	-	OE1	GLN	V	5
R	H	CA	PRO	A	26	L	-	HB2	GLN	V	5
R	H	C	PRO	A	26	L	-	OE1	GLN	V	5
R	H	C	PRO	A	26	L	-	HB2	GLN	V	5
R	H	CB	PRO	A	26	L	-	CD	GLN	V	5
R	H	CB	PRO	A	26	L	-	OE1	GLN	V	5
R	H	CB	PRO	A	26	L	-	HB2	GLN	V	5
R	H	CB	PRO	A	26	L	-	HG3	GLN	V	5
R	H	O	PRO	A	26	L	-	OE1	GLN	V	5
R	H	O	PRO	A	26	L	-	HB2	GLN	V	5
R	H	N	LEU	A	27	L	-	OE1	GLN	V	5
R	H	CA	LEU	A	27	L	-	OE1	GLN	V	5
R	H	CD2	LEU	A	27	L	-	HE22	GLN	V	5
R	H	CB	ALA	A	30	L	-	OE1	GLN	V	5
R	H	CB	ALA	A	30	L	-	HB3	GLN	V	5
R	H	O	ALA	A	30	L	-	HB2	SER	V	7
R	H	CB	VAL	A	33	L	-	HB3	SER	V	7
R	H	CG1	VAL	A	33	L	-	CB	SER	V	7
R	H	CG1	VAL	A	33	L	-	HB2	SER	V	7
R	H	CG1	VAL	A	33	L	-	HB3	SER	V	7
R	H	CG1	ILE	A	34	L	-	OG	SER	V	7
R	H	CG1	ILE	A	34	L	-	HB2	SER	V	7
R	H	CG1	ILE	A	34	L	-	HG	SER	V	7
R	H	CD1	ILE	A	34	L	-	HG	SER	V	7
R	H	CD1	ILE	A	37	L	-	HG21	THR	V	9
R	H	CD1	ILE	A	37	L	-	HG22	THR	V	9
R	H	CG	LEU	A	222	L	H	HG13	VAL	V	67
R	H	CG	LEU	A	222	L	H	HG23	VAL	V	67
R	H	CD1	LEU	A	222	L	H	CB	VAL	V	67
R	H	CD1	LEU	A	222	L	H	CG1	VAL	V	67
R	H	CD1	LEU	A	222	L	H	CG2	VAL	V	67
R	H	CD1	LEU	A	222	L	H	HG12	VAL	V	67
R	H	CD1	LEU	A	222	L	H	HG13	VAL	V	67
R	H	CD1	LEU	A	222	L	H	HG22	VAL	V	67
R	H	CD1	LEU	A	222	L	H	HG23	VAL	V	67
R	H	CD2	LEU	A	222	L	H	ND1	HIS	V	64
R	H	CD2	LEU	A	222	L	H	CE1	HIS	V	64
R	H	CD2	LEU	A	222	L	H	HE1	HIS	V	64
R	H	CD2	LEU	A	222	L	H	HD1	HIS	V	64
R	H	CE1	PHE	A	223	L	H	HE2	PHE	V	60
R	H	CZ	PHE	A	223	L	H	HE2	PHE	V	60
R	H	C	ILE	A	225	L	H	HB3	LEU	V	45
R	H	C	ILE	A	225	L	H	HD12	LEU	V	45
R	H	O	ILE	A	225	L	H	CD1	LEU	V	45
R	H	O	ILE	A	225	L	H	HB3	LEU	V	45
R	H	O	ILE	A	225	L	H	HD11	LEU	V	45
R	H	O	ILE	A	225	L	H	HD12	LEU	V	45
R	H	CG2	ILE	A	225	L	H	HD12	LEU	V	45
R	H	CG2	ILE	A	225	L	H	HG22	VAL	V	67
R	H	N	LEU	A	226	L	H	HB3	LEU	V	45
R	H	N	LEU	A	226	L	H	HD12	LEU	V	45
R	H	N	LEU	A	226	L	H	HD22	LEU	V	45
R	H	CA	LEU	A	226	L	H	CB	LEU	V	45
R	H	CA	LEU	A	226	L	H	CG	LEU	V	45
R	H	CA	LEU	A	226	L	H	CD1	LEU	V	45
R	H	CA	LEU	A	226	L	H	CD2	LEU	V	45
R	H	CA	LEU	A	226	L	H	HB2	LEU	V	45
R	H	CA	LEU	A	226	L	H	HB3	LEU	V	45
R	H	CA	LEU	A	226	L	H	HD12	LEU	V	45
R	H	CA	LEU	A	226	L	H	HD21	LEU	V	45
R	H	CA	LEU	A	226	L	H	HD22	LEU	V	45
R	H	C	LEU	A	226	L	H	CA	LEU	V	45
R	H	C	LEU	A	226	L	H	C	LEU	V	45
R	H	C	LEU	A	226	L	H	CB	LEU	V	45
R	H	C	LEU	A	226	L	H	O	LEU	V	45
R	H	C	LEU	A	226	L	H	HA	LEU	V	45
R	H	C	LEU	A	226	L	H	HB2	LEU	V	45
R	H	C	LEU	A	226	L	H	HB3	LEU	V	45
R	H	C	LEU	A	226	L	H	HD12	LEU	V	45
R	H	C	LEU	A	226	L	H	HD22	LEU	V	45
R	H	C	LEU	A	226	L	H	OG	SER	V	49
R	H	C	LEU	A	226	L	H	HG	SER	V	49
R	H	CB	LEU	A	226	L	H	CD2	LEU	V	45
R	H	CB	LEU	A	226	L	H	HB3	LEU	V	45
R	H	CB	LEU	A	226	L	H	HD12	LEU	V	45
R	H	CB	LEU	A	226	L	H	HD21	LEU	V	45
R	H	CB	LEU	A	226	L	H	HD22	LEU	V	45
R	H	CB	LEU	A	226	L	H	HD23	LEU	V	45
R	H	CB	LEU	A	226	L	H	HB2	SER	V	63
R	H	O	LEU	A	226	L	H	CA	LEU	V	45
R	H	O	LEU	A	226	L	H	C	LEU	V	45
R	H	O	LEU	A	226	L	H	CB	LEU	V	45
R	H	O	LEU	A	226	L	H	O	LEU	V	45
R	H	O	LEU	A	226	L	H	CG	LEU	V	45
R	H	O	LEU	A	226	L	H	CD2	LEU	V	45
R	H	O	LEU	A	226	L	H	HA	LEU	V	45
R	H	O	LEU	A	226	L	H	HB2	LEU	V	45
R	H	O	LEU	A	226	L	H	HB3	LEU	V	45
R	H	O	LEU	A	226	L	H	HD12	LEU	V	45
R	H	O	LEU	A	226	L	H	HD21	LEU	V	45
R	H	O	LEU	A	226	L	H	HD22	LEU	V	45
R	H	O	LEU	A	226	L	H	N	GLY	V	46
R	H	O	LEU	A	226	L	H	CA	GLY	V	46
R	H	O	LEU	A	226	L	H	H	GLY	V	46
R	H	O	LEU	A	226	L	H	HA2	GLY	V	46
R	H	O	LEU	A	226	L	H	OG	SER	V	49
R	H	O	LEU	A	226	L	H	HB2	SER	V	49
R	H	O	LEU	A	226	L	H	HG	SER	V	49
R	H	CG	LEU	A	226	L	H	CD2	LEU	V	45
R	H	CG	LEU	A	226	L	H	HD12	LEU	V	45
R	H	CG	LEU	A	226	L	H	HD21	LEU	V	45
R	H	CG	LEU	A	226	L	H	HD22	LEU	V	45
R	H	CG	LEU	A	226	L	H	HD23	LEU	V	45
R	H	CG	LEU	A	226	L	H	HB2	SER	V	63
R	H	CG	LEU	A	226	L	H	CG2	VAL	V	67
R	H	CG	LEU	A	226	L	H	HG21	VAL	V	67
R	H	CG	LEU	A	226	L	H	HG22	VAL	V	67
R	H	CG	LEU	A	226	L	H	HG23	VAL	V	67
R	H	CD1	LEU	A	226	L	H	CD2	LEU	V	45
R	H	CD1	LEU	A	226	L	H	HD22	LEU	V	45
R	H	CD1	LEU	A	226	L	H	HD23	LEU	V	45
R	H	CD1	LEU	A	226	L	H	CB	SER	V	63
R	H	CD1	LEU	A	226	L	H	OG	SER	V	63
R	H	CD1	LEU	A	226	L	H	HB2	SER	V	63
R	H	CD1	LEU	A	226	L	H	HG21	VAL	V	67
R	H	CD1	LEU	A	226	L	H	HG23	VAL	V	67
R	H	CD2	LEU	A	226	L	H	CG	LEU	V	45
R	H	CD2	LEU	A	226	L	H	CD1	LEU	V	45
R	H	CD2	LEU	A	226	L	H	CD2	LEU	V	45
R	H	CD2	LEU	A	226	L	H	HB3	LEU	V	45
R	H	CD2	LEU	A	226	L	H	HG	LEU	V	45
R	H	CD2	LEU	A	226	L	H	HD12	LEU	V	45
R	H	CD2	LEU	A	226	L	H	HD13	LEU	V	45
R	H	CD2	LEU	A	226	L	H	HD21	LEU	V	45
R	H	CD2	LEU	A	226	L	H	HD22	LEU	V	45
R	H	CD2	LEU	A	226	L	H	HD23	LEU	V	45
R	H	CD2	LEU	A	226	L	H	C	SER	V	63
R	H	CD2	LEU	A	226	L	H	CB	SER	V	63
R	H	CD2	LEU	A	226	L	H	O	SER	V	63
R	H	CD2	LEU	A	226	L	H	HA	SER	V	63
R	H	CD2	LEU	A	226	L	H	HB2	SER	V	63
R	H	CD2	LEU	A	226	L	H	CG2	VAL	V	67
R	H	CD2	LEU	A	226	L	H	H	VAL	V	67
R	H	CD2	LEU	A	226	L	H	HG21	VAL	V	67
R	H	CD2	LEU	A	226	L	H	HG22	VAL	V	67
R	H	CD2	LEU	A	226	L	H	HG23	VAL	V	67
R	-	N	LYS	A	227	L	H	HB3	LEU	V	45
R	-	N	LYS	A	227	L	H	OG	SER	V	49
R	-	N	LYS	A	227	L	H	HG	SER	V	49
R	-	CA	LYS	A	227	L	H	HA2	GLY	V	46
R	-	CA	LYS	A	227	L	H	CB	SER	V	49
R	-	CA	LYS	A	227	L	H	OG	SER	V	49
R	-	CA	LYS	A	227	L	H	HB2	SER	V	49
R	-	CA	LYS	A	227	L	H	HB3	SER	V	49
R	-	CA	LYS	A	227	L	H	HG	SER	V	49
R	-	C	LYS	A	227	L	H	HA2	GLY	V	46
R	-	C	LYS	A	227	L	H	OG	SER	V	49
R	-	C	LYS	A	227	L	H	HB2	SER	V	49
R	-	C	LYS	A	227	L	H	HG	SER	V	49
R	-	CB	LYS	A	227	L	H	CB	SER	V	49
R	-	CB	LYS	A	227	L	H	OG	SER	V	49
R	-	CB	LYS	A	227	L	H	HB2	SER	V	49
R	-	CB	LYS	A	227	L	H	HB3	SER	V	49
R	-	CB	LYS	A	227	L	H	HG	SER	V	49
R	-	O	LYS	A	227	L	H	CA	GLY	V	46
R	-	O	LYS	A	227	L	H	HA2	GLY	V	46
R	-	O	LYS	A	227	L	H	HB2	SER	V	49
R	-	CG	LYS	A	227	L	H	CA	SER	V	49
R	-	CG	LYS	A	227	L	H	CB	SER	V	49
R	-	CG	LYS	A	227	L	H	OG	SER	V	49
R	-	CG	LYS	A	227	L	H	HA	SER	V	49
R	-	CG	LYS	A	227	L	H	HB2	SER	V	49
R	-	CG	LYS	A	227	L	H	HB3	SER	V	49
R	-	CG	LYS	A	227	L	H	HG	SER	V	49
R	-	CD	LYS	A	227	L	H	CB	SER	V	49
R	-	CD	LYS	A	227	L	H	OG	SER	V	49
R	-	CD	LYS	A	227	L	H	HB3	SER	V	49
R	-	CE	LYS	A	227	L	H	HB3	SER	V	49
R	-	O	LYS	A	228	L	H	O	GLY	V	42
R	-	O	LYS	A	228	L	H	HA3	GLY	V	42
R	-	O	LYS	A	228	L	H	HB2	LEU	V	45
R	-	O	LYS	A	228	L	H	H	GLY	V	46
R	-	CA	LYS	A	229	L	H	HA3	GLY	V	46
R	-	CB	LYS	A	229	L	H	HA3	GLY	V	46
R	-	CG	LYS	A	229	L	H	CA	GLY	V	46
R	-	CG	LYS	A	229	L	H	HA2	GLY	V	46
R	-	CG	LYS	A	229	L	H	HA3	GLY	V	46
R	-	CG	LYS	A	229	L	H	HD11	LEU	V	50
R	-	CD	LYS	A	229	L	H	HA3	GLY	V	46
R	-	CD	LYS	A	229	L	H	CD1	LEU	V	50
R	-	CD	LYS	A	229	L	H	HD11	LEU	V	50
R	-	CD	LYS	A	229	L	H	HD13	LEU	V	50
R	-	CD	LYS	A	229	L	H	HE3	MET	V	303
R	-	CE	LYS	A	229	L	H	HA3	GLY	V	46
R	-	CE	LYS	A	229	L	H	CD1	LEU	V	50
R	-	CE	LYS	A	229	L	H	HD11	LEU	V	50
R	-	CE	LYS	A	229	L	H	HD12	LEU	V	50
R	-	CE	LYS	A	229	L	H	HD13	LEU	V	50
R	-	CE	LYS	A	229	L	H	CE	MET	V	303
R	-	CE	LYS	A	229	L	H	HE2	MET	V	303
R	-	CE	LYS	A	229	L	H	HE3	MET	V	303
R	-	NZ	LYS	A	229	L	H	CD1	LEU	V	50
R	-	NZ	LYS	A	229	L	H	HD11	LEU	V	50
R	-	NZ	LYS	A	229	L	H	HD12	LEU	V	50
R	-	NZ	LYS	A	229	L	H	HD13	LEU	V	50
R	-	NZ	LYS	A	229	L	H	SD	MET	V	303
R	-	NZ	LYS	A	229	L	H	CE	MET	V	303
R	-	NZ	LYS	A	229	L	H	HE1	MET	V	303
R	-	NZ	LYS	A	229	L	H	HE2	MET	V	303
R	-	NZ	LYS	A	229	L	H	HE3	MET	V	303
R	H	N	ASP	A	231	L	H	HD21	LEU	V	39
R	H	CA	ASP	A	231	L	H	HB3	LEU	V	38
R	H	CA	ASP	A	231	L	H	HD12	LEU	V	38
R	H	C	ASP	A	231	L	H	HB3	LEU	V	38
R	H	C	ASP	A	231	L	H	HD12	LEU	V	38
R	H	CB	ASP	A	231	L	H	CB	LEU	V	38
R	H	CB	ASP	A	231	L	H	HB2	LEU	V	38
R	H	CB	ASP	A	231	L	H	HB3	LEU	V	38
R	H	CB	ASP	A	231	L	H	HD12	LEU	V	38
R	H	CB	ASP	A	231	L	H	HG	LEU	V	39
R	H	CB	ASP	A	231	L	H	HD21	LEU	V	39
R	H	CB	ASP	A	231	L	H	HD23	LEU	V	39
R	H	O	ASP	A	231	L	H	HB3	LEU	V	38
R	H	O	ASP	A	231	L	H	HD12	LEU	V	38
R	H	CG	ASP	A	231	L	H	CA	LEU	V	38
R	H	CG	ASP	A	231	L	H	C	LEU	V	38
R	H	CG	ASP	A	231	L	H	CB	LEU	V	38
R	H	CG	ASP	A	231	L	H	O	LEU	V	38
R	H	CG	ASP	A	231	L	H	HB2	LEU	V	38
R	H	CG	ASP	A	231	L	H	HB3	LEU	V	38
R	H	CG	ASP	A	231	L	H	N	LEU	V	39
R	H	CG	ASP	A	231	L	H	CA	LEU	V	39
R	H	CG	ASP	A	231	L	H	CB	LEU	V	39
R	H	CG	ASP	A	231	L	H	CG	LEU	V	39
R	H	CG	ASP	A	231	L	H	CD2	LEU	V	39
R	H	CG	ASP	A	231	L	H	H	LEU	V	39
R	H	CG	ASP	A	231	L	H	HA	LEU	V	39
R	H	CG	ASP	A	231	L	H	HG	LEU	V	39
R	H	CG	ASP	A	231	L	H	HD21	LEU	V	39
R	H	CG	ASP	A	231	L	H	HD22	LEU	V	39
R	H	CG	ASP	A	231	L	H	HD23	LEU	V	39
R	H	OD1	ASP	A	231	L	H	CA	LEU	V	38
R	H	OD1	ASP	A	231	L	H	C	LEU	V	38
R	H	OD1	ASP	A	231	L	H	CB	LEU	V	38
R	H	OD1	ASP	A	231	L	H	O	LEU	V	38
R	H	OD1	ASP	A	231	L	H	HB2	LEU	V	38
R	H	OD1	ASP	A	231	L	H	HB3	LEU	V	38
R	H	OD1	ASP	A	231	L	H	N	LEU	V	39
R	H	OD1	ASP	A	231	L	H	CA	LEU	V	39
R	H	OD1	ASP	A	231	L	H	C	LEU	V	39
R	H	OD1	ASP	A	231	L	H	CB	LEU	V	39
R	H	OD1	ASP	A	231	L	H	CG	LEU	V	39
R	H	OD1	ASP	A	231	L	H	CD2	LEU	V	39
R	H	OD1	ASP	A	231	L	H	H	LEU	V	39
R	H	OD1	ASP	A	231	L	H	HA	LEU	V	39
R	H	OD1	ASP	A	231	L	H	HG	LEU	V	39
R	H	OD1	ASP	A	231	L	H	HD21	LEU	V	39
R	H	OD1	ASP	A	231	L	H	H	GLY	V	42
R	H	OD1	ASP	A	231	L	H	HA2	GLY	V	42
R	H	OD2	ASP	A	231	L	H	O	ILE	V	35
R	H	OD2	ASP	A	231	L	H	C	LEU	V	38
R	H	OD2	ASP	A	231	L	H	CB	LEU	V	38
R	H	OD2	ASP	A	231	L	H	O	LEU	V	38
R	H	OD2	ASP	A	231	L	H	HB2	LEU	V	38
R	H	OD2	ASP	A	231	L	H	HB3	LEU	V	38
R	H	OD2	ASP	A	231	L	H	N	LEU	V	39
R	H	OD2	ASP	A	231	L	H	CA	LEU	V	39
R	H	OD2	ASP	A	231	L	H	CB	LEU	V	39
R	H	OD2	ASP	A	231	L	H	CG	LEU	V	39
R	H	OD2	ASP	A	231	L	H	CD1	LEU	V	39
R	H	OD2	ASP	A	231	L	H	CD2	LEU	V	39
R	H	OD2	ASP	A	231	L	H	H	LEU	V	39
R	H	OD2	ASP	A	231	L	H	HA	LEU	V	39
R	H	OD2	ASP	A	231	L	H	HB2	LEU	V	39
R	H	OD2	ASP	A	231	L	H	HB3	LEU	V	39
R	H	OD2	ASP	A	231	L	H	HG	LEU	V	39
R	H	OD2	ASP	A	231	L	H	HD13	LEU	V	39
R	H	OD2	ASP	A	231	L	H	HD21	LEU	V	39
R	H	OD2	ASP	A	231	L	H	HD22	LEU	V	39
R	H	OD2	ASP	A	231	L	H	HD23	LEU	V	39
R	H	CB	VAL	A	234	L	H	HG22	ILE	V	70
R	H	CB	VAL	A	234	L	H	HD13	ILE	V	70
R	H	CG1	VAL	A	234	L	H	CG2	ILE	V	70
R	H	CG1	VAL	A	234	L	H	CD1	ILE	V	70
R	H	CG1	VAL	A	234	L	H	HG21	ILE	V	70
R	H	CG1	VAL	A	234	L	H	HG22	ILE	V	70
R	H	CG1	VAL	A	234	L	H	HG23	ILE	V	70
R	H	CG1	VAL	A	234	L	H	HD13	ILE	V	70
R	H	CA	ARG	A	235	L	H	SG	CYS	V	74
R	H	CB	ARG	A	235	L	H	OH	TYR	V	34
R	H	CB	ARG	A	235	L	H	HD11	LEU	V	38
R	H	CB	ARG	A	235	L	H	HD12	LEU	V	38
R	H	CB	ARG	A	235	L	H	SG	CYS	V	74
R	H	CG	ARG	A	235	L	H	OH	TYR	V	34
R	H	CG	ARG	A	235	L	H	HH	TYR	V	34
R	H	CG	ARG	A	235	L	H	HD11	LEU	V	38
R	H	CG	ARG	A	235	L	H	SG	CYS	V	74
R	H	CD	ARG	A	235	L	H	CE1	TYR	V	34
R	H	CD	ARG	A	235	L	H	OH	TYR	V	34
R	H	CD	ARG	A	235	L	H	CZ	TYR	V	34
R	H	CD	ARG	A	235	L	H	HE1	TYR	V	34
R	H	CD	ARG	A	235	L	H	HH	TYR	V	34
R	H	CD	ARG	A	235	L	H	CD1	LEU	V	38
R	H	CD	ARG	A	235	L	H	HD11	LEU	V	38
R	H	CD	ARG	A	235	L	H	HD12	LEU	V	38
R	H	NE	ARG	A	235	L	H	OH	TYR	V	34
R	H	NE	ARG	A	235	L	H	HE1	TYR	V	34
R	H	NE	ARG	A	235	L	H	HD11	LEU	V	38
R	H	NH1	ARG	A	235	L	H	CD1	TYR	V	34
R	H	NH1	ARG	A	235	L	H	CE1	TYR	V	34
R	H	NH1	ARG	A	235	L	H	OH	TYR	V	34
R	H	NH1	ARG	A	235	L	H	CZ	TYR	V	34
R	H	NH1	ARG	A	235	L	H	HD1	TYR	V	34
R	H	NH1	ARG	A	235	L	H	HE1	TYR	V	34
R	H	NH1	ARG	A	235	L	H	CD1	LEU	V	38
R	H	NH1	ARG	A	235	L	H	HD11	LEU	V	38
R	H	NH1	ARG	A	235	L	H	HD12	LEU	V	38
R	H	NH1	ARG	A	235	L	H	HD13	LEU	V	38
R	H	CZ	ARG	A	235	L	H	CE1	TYR	V	34
R	H	CZ	ARG	A	235	L	H	HE1	TYR	V	34
R	H	CB	PHE	A	238	L	H	HG21	ILE	V	70
R	H	CB	PHE	A	238	L	H	HA	ALA	V	71
R	H	CB	PHE	A	238	L	H	HB2	CYS	V	74
R	H	CB	PHE	A	238	L	H	HB3	CYS	V	74
R	H	CG	PHE	A	238	L	H	HG21	ILE	V	70
R	H	CG	PHE	A	238	L	H	CA	ALA	V	71
R	H	CG	PHE	A	238	L	H	HA	ALA	V	71
R	H	CG	PHE	A	238	L	H	HB1	ALA	V	71
R	H	CG	PHE	A	238	L	H	HB3	ALA	V	71
R	H	CD1	PHE	A	238	L	H	HG21	ILE	V	70
R	H	CD1	PHE	A	238	L	H	CA	ALA	V	71
R	H	CD1	PHE	A	238	L	H	CB	ALA	V	71
R	H	CD1	PHE	A	238	L	H	HA	ALA	V	71
R	H	CD1	PHE	A	238	L	H	HB1	ALA	V	71
R	H	CD1	PHE	A	238	L	H	HB3	ALA	V	71
R	H	CD2	PHE	A	238	L	H	CG2	ILE	V	70
R	H	CD2	PHE	A	238	L	H	HB	ILE	V	70
R	H	CD2	PHE	A	238	L	H	HG21	ILE	V	70
R	H	CD2	PHE	A	238	L	H	HG22	ILE	V	70
R	H	CD2	PHE	A	238	L	H	HG23	ILE	V	70
R	H	CD2	PHE	A	238	L	H	HA	ALA	V	71
R	H	CE1	PHE	A	238	L	H	O	VAL	V	67
R	H	CE1	PHE	A	238	L	H	CG1	VAL	V	67
R	H	CE1	PHE	A	238	L	H	HG11	VAL	V	67
R	H	CE1	PHE	A	238	L	H	HG12	VAL	V	67
R	H	CE1	PHE	A	238	L	H	HG21	ILE	V	70
R	H	CE1	PHE	A	238	L	H	N	ALA	V	71
R	H	CE1	PHE	A	238	L	H	CA	ALA	V	71
R	H	CE1	PHE	A	238	L	H	CB	ALA	V	71
R	H	CE1	PHE	A	238	L	H	H	ALA	V	71
R	H	CE1	PHE	A	238	L	H	HA	ALA	V	71
R	H	CE1	PHE	A	238	L	H	HB1	ALA	V	71
R	H	CE1	PHE	A	238	L	H	HB2	ALA	V	71
R	H	CE1	PHE	A	238	L	H	HB3	ALA	V	71
R	H	CE2	PHE	A	238	L	H	HA	VAL	V	67
R	H	CE2	PHE	A	238	L	H	HG12	VAL	V	67
R	H	CE2	PHE	A	238	L	H	CB	ILE	V	70
R	H	CE2	PHE	A	238	L	H	CG2	ILE	V	70
R	H	CE2	PHE	A	238	L	H	HB	ILE	V	70
R	H	CE2	PHE	A	238	L	H	HG21	ILE	V	70
R	H	CE2	PHE	A	238	L	H	HG22	ILE	V	70
R	H	CE2	PHE	A	238	L	H	HG23	ILE	V	70
R	H	CE2	PHE	A	238	L	H	HD13	ILE	V	70
R	H	CE2	PHE	A	238	L	H	H	ALA	V	71
R	H	CE2	PHE	A	238	L	H	HB1	ALA	V	71
R	H	CZ	PHE	A	238	L	H	CA	VAL	V	67
R	H	CZ	PHE	A	238	L	H	C	VAL	V	67
R	H	CZ	PHE	A	238	L	H	O	VAL	V	67
R	H	CZ	PHE	A	238	L	H	CG1	VAL	V	67
R	H	CZ	PHE	A	238	L	H	HA	VAL	V	67
R	H	CZ	PHE	A	238	L	H	HG11	VAL	V	67
R	H	CZ	PHE	A	238	L	H	HG12	VAL	V	67
R	H	CZ	PHE	A	238	L	H	HG22	VAL	V	67
R	H	CZ	PHE	A	238	L	H	CB	ILE	V	70
R	H	CZ	PHE	A	238	L	H	CG2	ILE	V	70
R	H	CZ	PHE	A	238	L	H	HB	ILE	V	70
R	H	CZ	PHE	A	238	L	H	HG21	ILE	V	70
R	H	CZ	PHE	A	238	L	H	HG22	ILE	V	70
R	H	CZ	PHE	A	238	L	H	N	ALA	V	71
R	H	CZ	PHE	A	238	L	H	CB	ALA	V	71
R	H	CZ	PHE	A	238	L	H	H	ALA	V	71
R	H	CZ	PHE	A	238	L	H	HA	ALA	V	71
R	H	CZ	PHE	A	238	L	H	HB1	ALA	V	71
R	H	C	GLY	A	242	L	H	HD13	LEU	V	102
R	H	C	GLY	A	242	L	H	HD22	LEU	V	102
R	H	O	GLY	A	242	L	H	HD13	LEU	V	102
R	H	O	GLY	A	242	L	H	HD22	LEU	V	102
R	H	CA	PHE	A	246	L	H	HE1	PHE	V	101
R	H	CB	PHE	A	246	L	H	HG22	THR	V	98
R	H	CB	PHE	A	246	L	H	HD1	PHE	V	101
R	H	CB	PHE	A	246	L	H	HE1	PHE	V	101
R	H	CB	PHE	A	246	L	H	HD22	LEU	V	102
R	H	CG	PHE	A	246	L	H	CG2	THR	V	98
R	H	CG	PHE	A	246	L	H	OG1	THR	V	98
R	H	CG	PHE	A	246	L	H	HA	THR	V	98
R	H	CG	PHE	A	246	L	H	HG21	THR	V	98
R	H	CG	PHE	A	246	L	H	HG22	THR	V	98
R	H	CG	PHE	A	246	L	H	HD1	PHE	V	101
R	H	CD1	PHE	A	246	L	H	CB	THR	V	98
R	H	CD1	PHE	A	246	L	H	CG2	THR	V	98
R	H	CD1	PHE	A	246	L	H	OG1	THR	V	98
R	H	CD1	PHE	A	246	L	H	HA	THR	V	98
R	H	CD1	PHE	A	246	L	H	HG1	THR	V	98
R	H	CD1	PHE	A	246	L	H	HG21	THR	V	98
R	H	CD1	PHE	A	246	L	H	HG22	THR	V	98
R	H	CD2	PHE	A	246	L	H	HA	THR	V	98
R	H	CD2	PHE	A	246	L	H	HG22	THR	V	98
R	H	CD2	PHE	A	246	L	H	CG	PHE	V	101
R	H	CD2	PHE	A	246	L	H	CD1	PHE	V	101
R	H	CD2	PHE	A	246	L	H	CE1	PHE	V	101
R	H	CD2	PHE	A	246	L	H	HB2	PHE	V	101
R	H	CD2	PHE	A	246	L	H	HD1	PHE	V	101
R	H	CD2	PHE	A	246	L	H	HE1	PHE	V	101
R	H	CD2	PHE	A	246	L	H	HG	LEU	V	102
R	H	CE1	PHE	A	246	L	H	CA	THR	V	98
R	H	CE1	PHE	A	246	L	H	CB	THR	V	98
R	H	CE1	PHE	A	246	L	H	CG2	THR	V	98
R	H	CE1	PHE	A	246	L	H	OG1	THR	V	98
R	H	CE1	PHE	A	246	L	H	HA	THR	V	98
R	H	CE1	PHE	A	246	L	H	HG1	THR	V	98
R	H	CE1	PHE	A	246	L	H	HG21	THR	V	98
R	H	CE1	PHE	A	246	L	H	HG22	THR	V	98
R	H	CE2	PHE	A	246	L	H	CA	THR	V	98
R	H	CE2	PHE	A	246	L	H	HA	THR	V	98
R	H	CE2	PHE	A	246	L	H	HG22	THR	V	98
R	H	CE2	PHE	A	246	L	H	CB	PHE	V	101
R	H	CE2	PHE	A	246	L	H	CG	PHE	V	101
R	H	CE2	PHE	A	246	L	H	CD1	PHE	V	101
R	H	CE2	PHE	A	246	L	H	CE1	PHE	V	101
R	H	CE2	PHE	A	246	L	H	HB2	PHE	V	101
R	H	CE2	PHE	A	246	L	H	HB3	PHE	V	101
R	H	CE2	PHE	A	246	L	H	HD1	PHE	V	101
R	H	CE2	PHE	A	246	L	H	CD2	LEU	V	159
R	H	CE2	PHE	A	246	L	H	HD22	LEU	V	159
R	H	CE2	PHE	A	246	L	H	HD23	LEU	V	159
R	H	CZ	PHE	A	246	L	H	N	THR	V	98
R	H	CZ	PHE	A	246	L	H	CA	THR	V	98
R	H	CZ	PHE	A	246	L	H	CB	THR	V	98
R	H	CZ	PHE	A	246	L	H	OG1	THR	V	98
R	H	CZ	PHE	A	246	L	H	HA	THR	V	98
R	H	CZ	PHE	A	246	L	H	HG1	THR	V	98
R	H	CZ	PHE	A	246	L	H	HG22	THR	V	98
R	H	CZ	PHE	A	246	L	H	HB2	PHE	V	101
R	H	CZ	PHE	A	246	L	H	HD1	PHE	V	101
R	H	CZ	PHE	A	246	L	H	HD22	LEU	V	159
R	H	CZ	PHE	A	246	L	H	HD23	LEU	V	159
R	H	C	SER	A	249	L	H	HD13	LEU	V	156
R	H	CB	SER	A	249	L	H	CZ	PHE	V	101
R	H	CB	SER	A	249	L	H	HE1	PHE	V	101
R	H	CB	SER	A	249	L	H	HZ	PHE	V	101
R	H	O	SER	A	249	L	H	HD12	LEU	V	156
R	H	O	SER	A	249	L	H	HD13	LEU	V	156
R	H	O	SER	A	249	L	H	HD22	LEU	V	156
R	H	O	SER	A	249	L	H	HD23	LEU	V	156
R	H	OG	SER	A	249	L	H	CZ	PHE	V	101
R	H	OG	SER	A	249	L	H	HE1	PHE	V	101
R	H	OG	SER	A	249	L	H	HZ	PHE	V	101
R	H	OG	SER	A	249	L	H	HG12	VAL	V	152
R	H	OG	SER	A	249	L	H	HG13	VAL	V	152
R	H	CG	LEU	A	250	L	H	HD23	LEU	V	159
R	H	CD2	LEU	A	250	L	H	CD2	LEU	V	159
R	H	CD2	LEU	A	250	L	H	HD21	LEU	V	159
R	H	CD2	LEU	A	250	L	H	HD23	LEU	V	159
R	H	CD2	LEU	A	250	L	-	HD13	LEU	V	163
R	H	N	GLY	A	253	L	H	HD23	LEU	V	156
R	H	CA	GLY	A	253	L	H	CD2	LEU	V	156
R	H	CA	GLY	A	253	L	H	HD12	LEU	V	156
R	H	CA	GLY	A	253	L	H	HD21	LEU	V	156
R	H	CA	GLY	A	253	L	H	HD22	LEU	V	156
R	H	CA	GLY	A	253	L	H	HD23	LEU	V	156
R	H	C	GLY	A	253	L	H	CD2	LEU	V	156
R	H	C	GLY	A	253	L	H	HD21	LEU	V	156
R	H	C	GLY	A	253	L	H	HD22	LEU	V	156
R	H	C	GLY	A	253	L	H	HD23	LEU	V	156
R	H	O	GLY	A	253	L	H	CD2	LEU	V	156
R	H	O	GLY	A	253	L	H	HD21	LEU	V	156
R	H	O	GLY	A	253	L	H	HD23	LEU	V	156
R	H	N	PRO	A	254	L	H	HD23	LEU	V	156
R	H	CD	PRO	A	254	L	H	HD23	LEU	V	156
R	H	CB	LEU	A	256	L	H	HD22	LEU	V	153
R	H	CB	LEU	A	256	L	H	HD23	LEU	V	153
R	H	CG	LEU	A	256	L	H	HD22	LEU	V	153
R	H	CD1	LEU	A	256	L	H	CD2	LEU	V	153
R	H	CD1	LEU	A	256	L	H	HD21	LEU	V	153
R	H	CD1	LEU	A	256	L	H	HD22	LEU	V	153
R	H	CG	PHE	A	257	L	H	HG23	VAL	V	160
R	H	CD1	PHE	A	257	L	H	CG2	VAL	V	157
R	H	CD1	PHE	A	257	L	H	HA	VAL	V	157
R	H	CD1	PHE	A	257	L	H	HG21	VAL	V	157
R	H	CD1	PHE	A	257	L	H	HG23	VAL	V	157
R	H	CD2	PHE	A	257	L	H	CG	LEU	V	156
R	H	CD2	PHE	A	257	L	H	CD2	LEU	V	156
R	H	CD2	PHE	A	257	L	H	HG	LEU	V	156
R	H	CD2	PHE	A	257	L	H	HD21	LEU	V	156
R	H	CD2	PHE	A	257	L	H	HD23	LEU	V	156
R	H	CD2	PHE	A	257	L	H	HG23	VAL	V	160
R	H	CE1	PHE	A	257	L	H	N	VAL	V	157
R	H	CE1	PHE	A	257	L	H	CA	VAL	V	157
R	H	CE1	PHE	A	257	L	H	CB	VAL	V	157
R	H	CE1	PHE	A	257	L	H	CG2	VAL	V	157
R	H	CE1	PHE	A	257	L	H	H	VAL	V	157
R	H	CE1	PHE	A	257	L	H	HA	VAL	V	157
R	H	CE1	PHE	A	257	L	H	HG12	VAL	V	157
R	H	CE1	PHE	A	257	L	H	HG21	VAL	V	157
R	H	CE1	PHE	A	257	L	H	HG22	VAL	V	157
R	H	CE1	PHE	A	257	L	H	HG23	VAL	V	157
R	H	CE2	PHE	A	257	L	H	C	LEU	V	156
R	H	CE2	PHE	A	257	L	H	CB	LEU	V	156
R	H	CE2	PHE	A	257	L	H	O	LEU	V	156
R	H	CE2	PHE	A	257	L	H	CG	LEU	V	156
R	H	CE2	PHE	A	257	L	H	CD1	LEU	V	156
R	H	CE2	PHE	A	257	L	H	CD2	LEU	V	156
R	H	CE2	PHE	A	257	L	H	HB2	LEU	V	156
R	H	CE2	PHE	A	257	L	H	HG	LEU	V	156
R	H	CE2	PHE	A	257	L	H	HD21	LEU	V	156
R	H	CE2	PHE	A	257	L	H	HD22	LEU	V	156
R	H	CE2	PHE	A	257	L	H	HD23	LEU	V	156
R	H	CE2	PHE	A	257	L	H	N	VAL	V	157
R	H	CE2	PHE	A	257	L	H	H	VAL	V	157
R	H	CE2	PHE	A	257	L	H	HA	VAL	V	157
R	H	CE2	PHE	A	257	L	H	HG21	VAL	V	157
R	H	CE2	PHE	A	257	L	H	CG2	VAL	V	160
R	H	CE2	PHE	A	257	L	H	HG21	VAL	V	160
R	H	CE2	PHE	A	257	L	H	HG23	VAL	V	160
R	H	CZ	PHE	A	257	L	H	O	LEU	V	153
R	H	CZ	PHE	A	257	L	H	CA	LEU	V	156
R	H	CZ	PHE	A	257	L	H	C	LEU	V	156
R	H	CZ	PHE	A	257	L	H	CB	LEU	V	156
R	H	CZ	PHE	A	257	L	H	O	LEU	V	156
R	H	CZ	PHE	A	257	L	H	CG	LEU	V	156
R	H	CZ	PHE	A	257	L	H	CD2	LEU	V	156
R	H	CZ	PHE	A	257	L	H	HB2	LEU	V	156
R	H	CZ	PHE	A	257	L	H	HG	LEU	V	156
R	H	CZ	PHE	A	257	L	H	HD21	LEU	V	156
R	H	CZ	PHE	A	257	L	H	N	VAL	V	157
R	H	CZ	PHE	A	257	L	H	CA	VAL	V	157
R	H	CZ	PHE	A	257	L	H	CB	VAL	V	157
R	H	CZ	PHE	A	257	L	H	CG2	VAL	V	157
R	H	CZ	PHE	A	257	L	H	H	VAL	V	157
R	H	CZ	PHE	A	257	L	H	HA	VAL	V	157
R	H	CZ	PHE	A	257	L	H	HG21	VAL	V	157
R	H	CZ	PHE	A	257	L	H	HG22	VAL	V	157
R	H	CZ	PHE	A	257	L	H	HG23	VAL	V	157
R	H	CZ	PHE	A	257	L	H	HG23	VAL	V	160
R	H	CG1	VAL	A	273	L	H	HG12	VAL	V	160
R	H	CE1	PHE	A	277	L	H	HG22	VAL	V	160
R	H	CE1	PHE	A	277	L	-	CD1	LEU	V	163
R	H	CE1	PHE	A	277	L	-	HD11	LEU	V	163
R	H	CE1	PHE	A	277	L	-	HD12	LEU	V	163
R	H	CE1	PHE	A	277	L	-	HD13	LEU	V	163
R	H	CE2	PHE	A	277	L	H	HA	VAL	V	160
R	H	CE2	PHE	A	277	L	H	HG12	VAL	V	160
R	H	CE2	PHE	A	277	L	H	HG22	VAL	V	160
R	H	CE2	PHE	A	277	L	-	HD11	LEU	V	163
R	H	CZ	PHE	A	277	L	H	CG2	VAL	V	160
R	H	CZ	PHE	A	277	L	H	HA	VAL	V	160
R	H	CZ	PHE	A	277	L	H	HG12	VAL	V	160
R	H	CZ	PHE	A	277	L	H	HG22	VAL	V	160
R	H	CZ	PHE	A	277	L	-	CD1	LEU	V	163
R	H	CZ	PHE	A	277	L	-	HD11	LEU	V	163
R	H	CZ	PHE	A	277	L	-	HD12	LEU	V	163
R	H	CZ	PHE	A	277	L	-	HD13	LEU	V	163
R	H	CG2	ILE	A	281	L	-	HD12	LEU	V	163
R	H	CG2	ILE	A	281	L	-	HD23	LEU	V	163
R	H	CD1	ILE	A	281	L	-	HB3	LEU	V	163
R	H	CD1	ILE	A	281	L	-	HD12	LEU	V	163
R	H	CD2	LEU	A	285	L	H	HD1	PHE	V	93
R	H	CD2	LEU	A	285	L	H	CA	ALA	V	94
R	H	CD2	LEU	A	285	L	H	CB	ALA	V	94
R	H	CD2	LEU	A	285	L	H	HA	ALA	V	94
R	H	CD2	LEU	A	285	L	H	HB1	ALA	V	94
R	H	CD2	LEU	A	285	L	H	HB3	ALA	V	94
R	H	CB	ILE	A	288	L	H	CB	ALA	V	94
R	H	CB	ILE	A	288	L	H	HB1	ALA	V	94
R	H	CB	ILE	A	288	L	H	HB2	ALA	V	94
R	H	CB	ILE	A	288	L	H	HB3	ALA	V	94
R	H	CG1	ILE	A	288	L	H	CB	ALA	V	94
R	H	CG1	ILE	A	288	L	H	HB1	ALA	V	94
R	H	CG1	ILE	A	288	L	H	HB2	ALA	V	94
R	H	CG1	ILE	A	288	L	H	HB3	ALA	V	94
R	H	CG2	ILE	A	288	L	-	OG	SER	V	92
R	H	CG2	ILE	A	288	L	-	HG	SER	V	92
R	H	CG2	ILE	A	288	L	H	CA	ALA	V	94
R	H	CG2	ILE	A	288	L	H	C	ALA	V	94
R	H	CG2	ILE	A	288	L	H	CB	ALA	V	94
R	H	CG2	ILE	A	288	L	H	HB1	ALA	V	94
R	H	CG2	ILE	A	288	L	H	HB2	ALA	V	94
R	H	CG2	ILE	A	288	L	H	HB3	ALA	V	94
R	H	CG2	ILE	A	288	L	H	N	GLY	V	95
R	H	CG2	ILE	A	288	L	H	H	GLY	V	95
R	H	CD1	ILE	A	288	L	H	CB	ALA	V	94
R	H	CD1	ILE	A	288	L	H	H	ALA	V	94
R	H	CD1	ILE	A	288	L	H	HB1	ALA	V	94
R	H	CD1	ILE	A	288	L	H	HB2	ALA	V	94
R	H	CD1	ILE	A	288	L	H	HB3	ALA	V	94
R	-	NH1	ARG	A	293	L	H	CG2	THR	V	98
R	-	NH1	ARG	A	293	L	H	HG21	THR	V	98
R	-	NH1	ARG	A	293	L	H	HG23	THR	V	98

- 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