IID

A2RU54_P54762.1 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	-	GLY	A	325	L	-	GLU	V	75
R	-	PRO	A	326	L	-	GLU	V	75
R	-	PRO	A	326	L	-	GLN	V	76
R	-	ARG	A	327	L	-	GLN	V	76
R	-	ARG	A	327	L	-	GLY	V	77
R	-	ASN	A	328	L	-	GLN	V	76
R	-	ASN	A	328	L	-	GLY	V	77
R	-	ASN	A	328	L	-	PRO	V	78
R	-	VAL	A	329	L	-	GLN	V	76
R	-	VAL	A	329	L	-	GLY	V	77
R	-	VAL	A	329	L	-	PRO	V	78
R	-	VAL	A	329	L	-	LYS	V	79
R	S	ILE	A	330	L	-	PRO	V	78
R	S	ILE	A	330	L	-	LYS	V	79
R	S	SER	A	331	L	-	LYS	V	79
R	S	SER	A	331	L	-	HIS	V	80
R	S	VAL	A	333	L	-	HIS	V	80
R	S	VAL	A	333	L	-	HIS	V	81
R	-	ARG	A	346	L	-	GLN	V	76
R	-	ALA	A	365	L	-	PRO	V	83
R	-	ALA	A	365	L	-	ILE	V	84
R	-	ARG	A	367	L	-	HIS	V	81
R	-	ARG	A	367	L	-	PRO	V	83
R	-	ARG	A	368	L	-	PRO	V	68
R	-	SER	A	369	L	-	PHE	V	66
R	S	CYS	A	370	L	-	PHE	V	66
R	-	HIS	A	399	L	-	PRO	V	82
R	-	HIS	A	399	L	-	ILE	V	84
R	S	PRO	A	401	L	-	PRO	V	83
R	-	PRO	A	419	L	-	GLY	V	72
R	-	PRO	A	419	L	-	PRO	V	73
R	-	PRO	A	420	L	-	PRO	V	73
R	-	GLN	A	421	L	-	PRO	V	73
R	-	GLN	A	421	L	-	LYS	V	74
R	S	HIS	A	422	L	-	GLY	V	72
R	S	HIS	A	422	L	-	PRO	V	73
R	S	HIS	A	422	L	-	LYS	V	74
R	S	HIS	A	422	L	-	GLU	V	75
R	S	VAL	A	423	L	-	GLU	V	75
R	S	VAL	A	423	L	-	GLN	V	76
R	S	VAL	A	423	L	-	GLY	V	77
R	S	VAL	A	425	L	-	PRO	V	78
R	S	VAL	A	425	L	-	LYS	V	79
R	S	ILE	A	427	L	-	LYS	V	79
R	S	ILE	A	427	L	-	HIS	V	80
R	S	ILE	A	427	L	-	HIS	V	81
R	S	THR	A	428	L	-	HIS	V	80
R	S	THR	A	428	L	-	HIS	V	81
R	S	THR	A	428	L	-	PRO	V	82
R	S	THR	A	428	L	-	PRO	V	83
R	-	THR	A	429	L	-	HIS	V	81
R	-	ASN	A	430	L	-	HIS	V	81
R	-	GLN	A	456	L	-	PHE	V	86
R	-	GLY	A	462	L	-	ILE	V	84
R	-	ILE	A	463	L	-	ILE	V	84
R	-	LYS	A	571	L	-	GLY	V	96
R	-	LYS	A	571	L	-	GLY	V	97
R	-	ARG	A	586	L	-	PHE	V	108
R	-	SER	A	588	L	-	ARG	V	105
R	-	SER	A	588	L	-	THR	V	106
R	-	SER	A	588	L	-	PRO	V	107
R	-	PRO	A	589	L	-	THR	V	106
R	-	MET	A	591	L	-	LEU	V	103
R	H	GLU	A	737	L	-	LEU	V	103

- 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

A2RU54_P54762.1 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	-	N	GLY	A	325	L	-	CB	GLU	V	75
R	-	N	GLY	A	325	L	-	HB2	GLU	V	75
R	-	N	GLY	A	325	L	-	HB3	GLU	V	75
R	-	N	GLY	A	325	L	-	HG3	GLU	V	75
R	-	CA	GLY	A	325	L	-	CB	GLU	V	75
R	-	CA	GLY	A	325	L	-	HB2	GLU	V	75
R	-	CA	GLY	A	325	L	-	HB3	GLU	V	75
R	-	C	GLY	A	325	L	-	HB2	GLU	V	75
R	-	C	GLY	A	325	L	-	HB3	GLU	V	75
R	-	O	GLY	A	325	L	-	HB2	GLU	V	75
R	-	O	GLY	A	325	L	-	HB3	GLU	V	75
R	-	C	PRO	A	326	L	-	O	GLN	V	76
R	-	C	PRO	A	326	L	-	HB2	GLN	V	76
R	-	O	PRO	A	326	L	-	C	GLU	V	75
R	-	O	PRO	A	326	L	-	O	GLU	V	75
R	-	O	PRO	A	326	L	-	HB2	GLU	V	75
R	-	O	PRO	A	326	L	-	CA	GLN	V	76
R	-	O	PRO	A	326	L	-	C	GLN	V	76
R	-	O	PRO	A	326	L	-	CB	GLN	V	76
R	-	O	PRO	A	326	L	-	O	GLN	V	76
R	-	O	PRO	A	326	L	-	HB2	GLN	V	76
R	-	O	PRO	A	326	L	-	HB3	GLN	V	76
R	-	N	ARG	A	327	L	-	O	GLN	V	76
R	-	N	ARG	A	327	L	-	HB2	GLN	V	76
R	-	CA	ARG	A	327	L	-	CB	GLN	V	76
R	-	CA	ARG	A	327	L	-	O	GLN	V	76
R	-	CA	ARG	A	327	L	-	HB2	GLN	V	76
R	-	CA	ARG	A	327	L	-	HB3	GLN	V	76
R	-	CA	ARG	A	327	L	-	HA3	GLY	V	77
R	-	C	ARG	A	327	L	-	O	GLN	V	76
R	-	C	ARG	A	327	L	-	HB3	GLN	V	76
R	-	C	ARG	A	327	L	-	CA	GLY	V	77
R	-	C	ARG	A	327	L	-	HA2	GLY	V	77
R	-	C	ARG	A	327	L	-	HA3	GLY	V	77
R	-	CB	ARG	A	327	L	-	OE1	GLN	V	76
R	-	CB	ARG	A	327	L	-	HB2	GLN	V	76
R	-	CB	ARG	A	327	L	-	HB3	GLN	V	76
R	-	O	ARG	A	327	L	-	HA3	GLY	V	77
R	-	CG	ARG	A	327	L	-	CB	GLN	V	76
R	-	CG	ARG	A	327	L	-	CD	GLN	V	76
R	-	CG	ARG	A	327	L	-	OE1	GLN	V	76
R	-	CG	ARG	A	327	L	-	HB2	GLN	V	76
R	-	CG	ARG	A	327	L	-	HB3	GLN	V	76
R	-	CD	ARG	A	327	L	-	CD	GLN	V	76
R	-	CD	ARG	A	327	L	-	OE1	GLN	V	76
R	-	CD	ARG	A	327	L	-	HE22	GLN	V	76
R	-	N	ASN	A	328	L	-	C	GLN	V	76
R	-	N	ASN	A	328	L	-	O	GLN	V	76
R	-	N	ASN	A	328	L	-	HB3	GLN	V	76
R	-	N	ASN	A	328	L	-	N	GLY	V	77
R	-	N	ASN	A	328	L	-	CA	GLY	V	77
R	-	N	ASN	A	328	L	-	HA2	GLY	V	77
R	-	N	ASN	A	328	L	-	HA3	GLY	V	77
R	-	CA	ASN	A	328	L	-	CA	GLY	V	77
R	-	CA	ASN	A	328	L	-	C	GLY	V	77
R	-	CA	ASN	A	328	L	-	HA2	GLY	V	77
R	-	CA	ASN	A	328	L	-	HA3	GLY	V	77
R	-	CA	ASN	A	328	L	-	HD3	PRO	V	78
R	-	C	ASN	A	328	L	-	CA	GLY	V	77
R	-	C	ASN	A	328	L	-	C	GLY	V	77
R	-	C	ASN	A	328	L	-	HA2	GLY	V	77
R	-	C	ASN	A	328	L	-	HA3	GLY	V	77
R	-	C	ASN	A	328	L	-	HD3	PRO	V	78
R	-	OD1	ASN	A	328	L	-	HA2	GLY	V	77
R	-	N	VAL	A	329	L	-	CA	GLY	V	77
R	-	N	VAL	A	329	L	-	C	GLY	V	77
R	-	N	VAL	A	329	L	-	O	GLY	V	77
R	-	N	VAL	A	329	L	-	HA2	GLY	V	77
R	-	N	VAL	A	329	L	-	HA3	GLY	V	77
R	-	N	VAL	A	329	L	-	N	PRO	V	78
R	-	N	VAL	A	329	L	-	O	PRO	V	78
R	-	N	VAL	A	329	L	-	HD3	PRO	V	78
R	-	CA	VAL	A	329	L	-	C	GLY	V	77
R	-	CA	VAL	A	329	L	-	O	GLY	V	77
R	-	CA	VAL	A	329	L	-	HA3	GLY	V	77
R	-	CA	VAL	A	329	L	-	N	PRO	V	78
R	-	CA	VAL	A	329	L	-	O	PRO	V	78
R	-	C	VAL	A	329	L	-	C	GLY	V	77
R	-	C	VAL	A	329	L	-	O	GLY	V	77
R	-	C	VAL	A	329	L	-	N	PRO	V	78
R	-	C	VAL	A	329	L	-	CA	PRO	V	78
R	-	C	VAL	A	329	L	-	C	PRO	V	78
R	-	C	VAL	A	329	L	-	O	PRO	V	78
R	-	C	VAL	A	329	L	-	N	LYS	V	79
R	-	C	VAL	A	329	L	-	H	LYS	V	79
R	-	C	VAL	A	329	L	-	HB2	LYS	V	79
R	-	C	VAL	A	329	L	-	HG3	LYS	V	79
R	-	CB	VAL	A	329	L	-	C	GLY	V	77
R	-	CB	VAL	A	329	L	-	O	GLY	V	77
R	-	CB	VAL	A	329	L	-	HA3	GLY	V	77
R	-	O	VAL	A	329	L	-	C	GLY	V	77
R	-	O	VAL	A	329	L	-	O	GLY	V	77
R	-	O	VAL	A	329	L	-	N	PRO	V	78
R	-	O	VAL	A	329	L	-	CA	PRO	V	78
R	-	O	VAL	A	329	L	-	C	PRO	V	78
R	-	O	VAL	A	329	L	-	O	PRO	V	78
R	-	O	VAL	A	329	L	-	CD	PRO	V	78
R	-	O	VAL	A	329	L	-	HA	PRO	V	78
R	-	O	VAL	A	329	L	-	HG2	PRO	V	78
R	-	O	VAL	A	329	L	-	HD3	PRO	V	78
R	-	O	VAL	A	329	L	-	N	LYS	V	79
R	-	O	VAL	A	329	L	-	CA	LYS	V	79
R	-	O	VAL	A	329	L	-	CB	LYS	V	79
R	-	O	VAL	A	329	L	-	CG	LYS	V	79
R	-	O	VAL	A	329	L	-	H	LYS	V	79
R	-	O	VAL	A	329	L	-	HB2	LYS	V	79
R	-	O	VAL	A	329	L	-	HG2	LYS	V	79
R	-	O	VAL	A	329	L	-	HG3	LYS	V	79
R	-	CG1	VAL	A	329	L	-	O	GLY	V	77
R	-	CG2	VAL	A	329	L	-	O	GLN	V	76
R	-	CG2	VAL	A	329	L	-	CA	GLY	V	77
R	-	CG2	VAL	A	329	L	-	C	GLY	V	77
R	-	CG2	VAL	A	329	L	-	O	GLY	V	77
R	-	CG2	VAL	A	329	L	-	HA3	GLY	V	77
R	S	N	ILE	A	330	L	-	C	PRO	V	78
R	S	N	ILE	A	330	L	-	O	PRO	V	78
R	S	N	ILE	A	330	L	-	HB2	LYS	V	79
R	S	N	ILE	A	330	L	-	HG3	LYS	V	79
R	S	CA	ILE	A	330	L	-	O	PRO	V	78
R	S	CA	ILE	A	330	L	-	CB	LYS	V	79
R	S	CA	ILE	A	330	L	-	CG	LYS	V	79
R	S	CA	ILE	A	330	L	-	HB2	LYS	V	79
R	S	CA	ILE	A	330	L	-	HG3	LYS	V	79
R	S	C	ILE	A	330	L	-	CB	LYS	V	79
R	S	C	ILE	A	330	L	-	HB2	LYS	V	79
R	S	C	ILE	A	330	L	-	HG3	LYS	V	79
R	S	CB	ILE	A	330	L	-	HB2	LYS	V	79
R	S	CB	ILE	A	330	L	-	HG3	LYS	V	79
R	S	O	ILE	A	330	L	-	HB2	LYS	V	79
R	S	CG1	ILE	A	330	L	-	HG3	LYS	V	79
R	S	CG1	ILE	A	330	L	-	HE3	LYS	V	79
R	S	CG2	ILE	A	330	L	-	CG	LYS	V	79
R	S	CG2	ILE	A	330	L	-	CD	LYS	V	79
R	S	CG2	ILE	A	330	L	-	HB2	LYS	V	79
R	S	CG2	ILE	A	330	L	-	HG3	LYS	V	79
R	S	CG2	ILE	A	330	L	-	HD2	LYS	V	79
R	S	CG2	ILE	A	330	L	-	HE3	LYS	V	79
R	S	N	SER	A	331	L	-	CA	LYS	V	79
R	S	N	SER	A	331	L	-	C	LYS	V	79
R	S	N	SER	A	331	L	-	CB	LYS	V	79
R	S	N	SER	A	331	L	-	O	LYS	V	79
R	S	N	SER	A	331	L	-	HB2	LYS	V	79
R	S	N	SER	A	331	L	-	HB3	LYS	V	79
R	S	N	SER	A	331	L	-	HG3	LYS	V	79
R	S	N	SER	A	331	L	-	HB2	HIS	V	80
R	S	CA	SER	A	331	L	-	CB	LYS	V	79
R	S	CA	SER	A	331	L	-	O	LYS	V	79
R	S	CA	SER	A	331	L	-	HB2	LYS	V	79
R	S	CA	SER	A	331	L	-	HB3	LYS	V	79
R	S	CA	SER	A	331	L	-	HB2	HIS	V	80
R	S	C	SER	A	331	L	-	HB2	LYS	V	79
R	S	C	SER	A	331	L	-	HB3	LYS	V	79
R	S	C	SER	A	331	L	-	HB2	HIS	V	80
R	S	CB	SER	A	331	L	-	C	LYS	V	79
R	S	CB	SER	A	331	L	-	O	LYS	V	79
R	S	CB	SER	A	331	L	-	HB2	LYS	V	79
R	S	CB	SER	A	331	L	-	HB3	LYS	V	79
R	S	CB	SER	A	331	L	-	CB	HIS	V	80
R	S	CB	SER	A	331	L	-	HB2	HIS	V	80
R	S	CB	SER	A	331	L	-	HB3	HIS	V	80
R	S	O	SER	A	331	L	-	CB	LYS	V	79
R	S	O	SER	A	331	L	-	O	LYS	V	79
R	S	O	SER	A	331	L	-	HB2	LYS	V	79
R	S	O	SER	A	331	L	-	HB3	LYS	V	79
R	S	O	SER	A	331	L	-	CB	HIS	V	80
R	S	O	SER	A	331	L	-	CG	HIS	V	80
R	S	O	SER	A	331	L	-	CD2	HIS	V	80
R	S	O	SER	A	331	L	-	HB2	HIS	V	80
R	S	O	SER	A	331	L	-	HB3	HIS	V	80
R	S	O	SER	A	331	L	-	HD2	HIS	V	80
R	S	OG	SER	A	331	L	-	N	LYS	V	79
R	S	OG	SER	A	331	L	-	CA	LYS	V	79
R	S	OG	SER	A	331	L	-	C	LYS	V	79
R	S	OG	SER	A	331	L	-	CB	LYS	V	79
R	S	OG	SER	A	331	L	-	O	LYS	V	79
R	S	OG	SER	A	331	L	-	H	LYS	V	79
R	S	OG	SER	A	331	L	-	HA	LYS	V	79
R	S	OG	SER	A	331	L	-	HB2	LYS	V	79
R	S	OG	SER	A	331	L	-	HB3	LYS	V	79
R	S	OG	SER	A	331	L	-	N	HIS	V	80
R	S	OG	SER	A	331	L	-	CA	HIS	V	80
R	S	OG	SER	A	331	L	-	C	HIS	V	80
R	S	OG	SER	A	331	L	-	CB	HIS	V	80
R	S	OG	SER	A	331	L	-	O	HIS	V	80
R	S	OG	SER	A	331	L	-	CG	HIS	V	80
R	S	OG	SER	A	331	L	-	H	HIS	V	80
R	S	OG	SER	A	331	L	-	HA	HIS	V	80
R	S	OG	SER	A	331	L	-	HB2	HIS	V	80
R	S	OG	SER	A	331	L	-	HB3	HIS	V	80
R	S	CA	VAL	A	333	L	-	HD2	HIS	V	81
R	S	CB	VAL	A	333	L	-	HB3	HIS	V	80
R	S	CB	VAL	A	333	L	-	CD2	HIS	V	81
R	S	CB	VAL	A	333	L	-	HB2	HIS	V	81
R	S	CB	VAL	A	333	L	-	HD2	HIS	V	81
R	S	CG1	VAL	A	333	L	-	HB3	HIS	V	80
R	S	CG1	VAL	A	333	L	-	CD2	HIS	V	81
R	S	CG1	VAL	A	333	L	-	HB2	HIS	V	81
R	S	CG1	VAL	A	333	L	-	HD2	HIS	V	81
R	S	CG2	VAL	A	333	L	-	C	HIS	V	80
R	S	CG2	VAL	A	333	L	-	CB	HIS	V	80
R	S	CG2	VAL	A	333	L	-	O	HIS	V	80
R	S	CG2	VAL	A	333	L	-	CG	HIS	V	80
R	S	CG2	VAL	A	333	L	-	HB2	HIS	V	80
R	S	CG2	VAL	A	333	L	-	HB3	HIS	V	80
R	S	CG2	VAL	A	333	L	-	CD2	HIS	V	81
R	S	CG2	VAL	A	333	L	-	HB2	HIS	V	81
R	S	CG2	VAL	A	333	L	-	HD2	HIS	V	81
R	-	CD	ARG	A	346	L	-	HE22	GLN	V	76
R	-	CA	ALA	A	365	L	-	HB2	PRO	V	83
R	-	C	ALA	A	365	L	-	HB2	PRO	V	83
R	-	CB	ALA	A	365	L	-	O	ILE	V	84
R	-	CB	ALA	A	365	L	-	HB	ILE	V	84
R	-	O	ALA	A	365	L	-	CB	PRO	V	83
R	-	O	ALA	A	365	L	-	HB2	PRO	V	83
R	-	O	ALA	A	365	L	-	O	ILE	V	84
R	-	CG	ARG	A	367	L	-	HG3	PRO	V	83
R	-	CD	ARG	A	367	L	-	HG3	PRO	V	83
R	-	NE	ARG	A	367	L	-	CB	PRO	V	83
R	-	NE	ARG	A	367	L	-	CG	PRO	V	83
R	-	NE	ARG	A	367	L	-	CD	PRO	V	83
R	-	NE	ARG	A	367	L	-	HB3	PRO	V	83
R	-	NE	ARG	A	367	L	-	HG2	PRO	V	83
R	-	NE	ARG	A	367	L	-	HG3	PRO	V	83
R	-	NE	ARG	A	367	L	-	HD2	PRO	V	83
R	-	NH2	ARG	A	367	L	-	O	HIS	V	81
R	-	NH2	ARG	A	367	L	-	CB	PRO	V	83
R	-	NH2	ARG	A	367	L	-	CG	PRO	V	83
R	-	NH2	ARG	A	367	L	-	CD	PRO	V	83
R	-	NH2	ARG	A	367	L	-	HB3	PRO	V	83
R	-	NH2	ARG	A	367	L	-	HG3	PRO	V	83
R	-	NH2	ARG	A	367	L	-	HD2	PRO	V	83
R	-	CZ	ARG	A	367	L	-	CG	PRO	V	83
R	-	CZ	ARG	A	367	L	-	HB3	PRO	V	83
R	-	CZ	ARG	A	367	L	-	HG3	PRO	V	83
R	-	CZ	ARG	A	367	L	-	HD2	PRO	V	83
R	-	O	ARG	A	368	L	-	HB3	PRO	V	68
R	-	O	ARG	A	368	L	-	HG3	PRO	V	68
R	-	CA	SER	A	369	L	-	HE1	PHE	V	66
R	-	CB	SER	A	369	L	-	HE1	PHE	V	66
R	S	N	CYS	A	370	L	-	HE1	PHE	V	66
R	S	N	CYS	A	370	L	-	HZ	PHE	V	66
R	S	C	CYS	A	370	L	-	CZ	PHE	V	66
R	S	C	CYS	A	370	L	-	HZ	PHE	V	66
R	S	O	CYS	A	370	L	-	CE1	PHE	V	66
R	S	O	CYS	A	370	L	-	CE2	PHE	V	66
R	S	O	CYS	A	370	L	-	CZ	PHE	V	66
R	S	O	CYS	A	370	L	-	HE1	PHE	V	66
R	S	O	CYS	A	370	L	-	HE2	PHE	V	66
R	S	O	CYS	A	370	L	-	HZ	PHE	V	66
R	-	CB	HIS	A	399	L	-	HD11	ILE	V	84
R	-	O	HIS	A	399	L	-	HG13	ILE	V	84
R	-	O	HIS	A	399	L	-	HD11	ILE	V	84
R	-	O	HIS	A	399	L	-	HD12	ILE	V	84
R	-	CG	HIS	A	399	L	-	CG1	ILE	V	84
R	-	CG	HIS	A	399	L	-	CD1	ILE	V	84
R	-	CG	HIS	A	399	L	-	HG12	ILE	V	84
R	-	CG	HIS	A	399	L	-	HG13	ILE	V	84
R	-	CG	HIS	A	399	L	-	HD11	ILE	V	84
R	-	CG	HIS	A	399	L	-	HD12	ILE	V	84
R	-	CD2	HIS	A	399	L	-	CG1	ILE	V	84
R	-	CD2	HIS	A	399	L	-	CD1	ILE	V	84
R	-	CD2	HIS	A	399	L	-	HG12	ILE	V	84
R	-	CD2	HIS	A	399	L	-	HG13	ILE	V	84
R	-	CD2	HIS	A	399	L	-	HD11	ILE	V	84
R	-	CD2	HIS	A	399	L	-	HD12	ILE	V	84
R	-	CD2	HIS	A	399	L	-	HD13	ILE	V	84
R	-	ND1	HIS	A	399	L	-	CG1	ILE	V	84
R	-	ND1	HIS	A	399	L	-	HG12	ILE	V	84
R	-	ND1	HIS	A	399	L	-	HG13	ILE	V	84
R	-	ND1	HIS	A	399	L	-	HD11	ILE	V	84
R	-	CE1	HIS	A	399	L	-	O	PRO	V	82
R	-	CE1	HIS	A	399	L	-	CG1	ILE	V	84
R	-	CE1	HIS	A	399	L	-	CD1	ILE	V	84
R	-	CE1	HIS	A	399	L	-	H	ILE	V	84
R	-	CE1	HIS	A	399	L	-	HG12	ILE	V	84
R	-	CE1	HIS	A	399	L	-	HG13	ILE	V	84
R	-	CE1	HIS	A	399	L	-	HD11	ILE	V	84
R	-	NE2	HIS	A	399	L	-	N	ILE	V	84
R	-	NE2	HIS	A	399	L	-	CA	ILE	V	84
R	-	NE2	HIS	A	399	L	-	CB	ILE	V	84
R	-	NE2	HIS	A	399	L	-	CG1	ILE	V	84
R	-	NE2	HIS	A	399	L	-	CD1	ILE	V	84
R	-	NE2	HIS	A	399	L	-	H	ILE	V	84
R	-	NE2	HIS	A	399	L	-	HA	ILE	V	84
R	-	NE2	HIS	A	399	L	-	HB	ILE	V	84
R	-	NE2	HIS	A	399	L	-	HG12	ILE	V	84
R	-	NE2	HIS	A	399	L	-	HG13	ILE	V	84
R	-	NE2	HIS	A	399	L	-	HD11	ILE	V	84
R	-	NE2	HIS	A	399	L	-	HD12	ILE	V	84
R	-	NE2	HIS	A	399	L	-	HD13	ILE	V	84
R	S	CB	PRO	A	401	L	-	HB3	PRO	V	83
R	S	CG	PRO	A	401	L	-	HB3	PRO	V	83
R	-	CG	PRO	A	419	L	-	HA3	GLY	V	72
R	-	CG	PRO	A	419	L	-	HD2	PRO	V	73
R	-	O	PRO	A	420	L	-	HD3	PRO	V	73
R	-	CA	GLN	A	421	L	-	HD3	PRO	V	73
R	-	CG	GLN	A	421	L	-	HG2	PRO	V	73
R	-	CD	GLN	A	421	L	-	CB	PRO	V	73
R	-	CD	GLN	A	421	L	-	CG	PRO	V	73
R	-	CD	GLN	A	421	L	-	HB2	PRO	V	73
R	-	CD	GLN	A	421	L	-	HG2	PRO	V	73
R	-	CD	GLN	A	421	L	-	HD3	PRO	V	73
R	-	NE2	GLN	A	421	L	-	CB	PRO	V	73
R	-	NE2	GLN	A	421	L	-	CG	PRO	V	73
R	-	NE2	GLN	A	421	L	-	CD	PRO	V	73
R	-	NE2	GLN	A	421	L	-	HB2	PRO	V	73
R	-	NE2	GLN	A	421	L	-	HG2	PRO	V	73
R	-	NE2	GLN	A	421	L	-	HG3	PRO	V	73
R	-	NE2	GLN	A	421	L	-	HD3	PRO	V	73
R	-	OE1	GLN	A	421	L	-	C	PRO	V	73
R	-	OE1	GLN	A	421	L	-	CB	PRO	V	73
R	-	OE1	GLN	A	421	L	-	O	PRO	V	73
R	-	OE1	GLN	A	421	L	-	CG	PRO	V	73
R	-	OE1	GLN	A	421	L	-	CD	PRO	V	73
R	-	OE1	GLN	A	421	L	-	HB2	PRO	V	73
R	-	OE1	GLN	A	421	L	-	HG2	PRO	V	73
R	-	OE1	GLN	A	421	L	-	HD3	PRO	V	73
R	-	OE1	GLN	A	421	L	-	C	LYS	V	74
R	-	OE1	GLN	A	421	L	-	O	LYS	V	74
R	S	N	HIS	A	422	L	-	O	PRO	V	73
R	S	C	HIS	A	422	L	-	O	GLU	V	75
R	S	C	HIS	A	422	L	-	H	GLU	V	75
R	S	O	HIS	A	422	L	-	O	PRO	V	73
R	S	O	HIS	A	422	L	-	C	LYS	V	74
R	S	O	HIS	A	422	L	-	N	GLU	V	75
R	S	O	HIS	A	422	L	-	O	GLU	V	75
R	S	O	HIS	A	422	L	-	H	GLU	V	75
R	S	ND1	HIS	A	422	L	-	O	PRO	V	73
R	S	ND1	HIS	A	422	L	-	HD3	PRO	V	73
R	S	CE1	HIS	A	422	L	-	CA	GLY	V	72
R	S	CE1	HIS	A	422	L	-	C	GLY	V	72
R	S	CE1	HIS	A	422	L	-	O	GLY	V	72
R	S	CE1	HIS	A	422	L	-	HA2	GLY	V	72
R	S	CE1	HIS	A	422	L	-	N	PRO	V	73
R	S	CE1	HIS	A	422	L	-	O	PRO	V	73
R	S	CE1	HIS	A	422	L	-	HD3	PRO	V	73
R	S	N	VAL	A	423	L	-	O	GLU	V	75
R	S	CA	VAL	A	423	L	-	O	GLU	V	75
R	S	CA	VAL	A	423	L	-	H	GLU	V	75
R	S	CB	VAL	A	423	L	-	C	GLU	V	75
R	S	CB	VAL	A	423	L	-	O	GLU	V	75
R	S	CB	VAL	A	423	L	-	C	GLN	V	76
R	S	CB	VAL	A	423	L	-	O	GLN	V	76
R	S	CG1	VAL	A	423	L	-	O	GLU	V	75
R	S	CG1	VAL	A	423	L	-	O	GLN	V	76
R	S	CG2	VAL	A	423	L	-	C	GLU	V	75
R	S	CG2	VAL	A	423	L	-	O	GLU	V	75
R	S	CG2	VAL	A	423	L	-	N	GLN	V	76
R	S	CG2	VAL	A	423	L	-	CA	GLN	V	76
R	S	CG2	VAL	A	423	L	-	C	GLN	V	76
R	S	CG2	VAL	A	423	L	-	O	GLN	V	76
R	S	CG2	VAL	A	423	L	-	N	GLY	V	77
R	S	CG2	VAL	A	423	L	-	O	GLY	V	77
R	S	CG2	VAL	A	423	L	-	H	GLY	V	77
R	S	CG2	VAL	A	425	L	-	HA	PRO	V	78
R	S	CG2	VAL	A	425	L	-	N	LYS	V	79
R	S	CG2	VAL	A	425	L	-	O	LYS	V	79
R	S	CG2	VAL	A	425	L	-	H	LYS	V	79
R	S	CA	ILE	A	427	L	-	O	HIS	V	80
R	S	CA	ILE	A	427	L	-	O	HIS	V	81
R	S	C	ILE	A	427	L	-	O	HIS	V	80
R	S	C	ILE	A	427	L	-	O	HIS	V	81
R	S	CB	ILE	A	427	L	-	O	HIS	V	80
R	S	CG1	ILE	A	427	L	-	O	LYS	V	79
R	S	CG1	ILE	A	427	L	-	O	HIS	V	80
R	S	CG2	ILE	A	427	L	-	C	HIS	V	80
R	S	CG2	ILE	A	427	L	-	O	HIS	V	80
R	S	CG2	ILE	A	427	L	-	HB2	HIS	V	81
R	S	CD1	ILE	A	427	L	-	O	LYS	V	79
R	S	N	THR	A	428	L	-	O	HIS	V	80
R	S	N	THR	A	428	L	-	CA	HIS	V	81
R	S	N	THR	A	428	L	-	C	HIS	V	81
R	S	N	THR	A	428	L	-	CB	HIS	V	81
R	S	N	THR	A	428	L	-	O	HIS	V	81
R	S	N	THR	A	428	L	-	HB2	HIS	V	81
R	S	N	THR	A	428	L	-	HB3	HIS	V	81
R	S	CA	THR	A	428	L	-	C	HIS	V	81
R	S	CA	THR	A	428	L	-	CB	HIS	V	81
R	S	CA	THR	A	428	L	-	O	HIS	V	81
R	S	CA	THR	A	428	L	-	HB2	HIS	V	81
R	S	CA	THR	A	428	L	-	HB3	HIS	V	81
R	S	C	THR	A	428	L	-	CB	HIS	V	81
R	S	C	THR	A	428	L	-	HB2	HIS	V	81
R	S	C	THR	A	428	L	-	HB3	HIS	V	81
R	S	CB	THR	A	428	L	-	C	HIS	V	81
R	S	CB	THR	A	428	L	-	CB	HIS	V	81
R	S	CB	THR	A	428	L	-	O	HIS	V	81
R	S	CB	THR	A	428	L	-	HB3	HIS	V	81
R	S	CB	THR	A	428	L	-	N	PRO	V	82
R	S	CB	THR	A	428	L	-	CA	PRO	V	82
R	S	CB	THR	A	428	L	-	C	PRO	V	82
R	S	CB	THR	A	428	L	-	O	PRO	V	82
R	S	CB	THR	A	428	L	-	N	PRO	V	83
R	S	CB	THR	A	428	L	-	HA	PRO	V	83
R	S	O	THR	A	428	L	-	CA	HIS	V	81
R	S	O	THR	A	428	L	-	C	HIS	V	81
R	S	O	THR	A	428	L	-	CB	HIS	V	81
R	S	O	THR	A	428	L	-	O	HIS	V	81
R	S	O	THR	A	428	L	-	CG	HIS	V	81
R	S	O	THR	A	428	L	-	CD2	HIS	V	81
R	S	O	THR	A	428	L	-	ND1	HIS	V	81
R	S	O	THR	A	428	L	-	HA	HIS	V	81
R	S	O	THR	A	428	L	-	HB2	HIS	V	81
R	S	O	THR	A	428	L	-	HB3	HIS	V	81
R	S	O	THR	A	428	L	-	HD2	HIS	V	81
R	S	CG2	THR	A	428	L	-	HB3	HIS	V	81
R	S	CG2	THR	A	428	L	-	C	PRO	V	82
R	S	CG2	THR	A	428	L	-	O	PRO	V	82
R	S	CG2	THR	A	428	L	-	CA	PRO	V	83
R	S	CG2	THR	A	428	L	-	HA	PRO	V	83
R	S	OG1	THR	A	428	L	-	C	HIS	V	81
R	S	OG1	THR	A	428	L	-	O	HIS	V	81
R	S	OG1	THR	A	428	L	-	N	PRO	V	82
R	S	OG1	THR	A	428	L	-	CA	PRO	V	82
R	S	OG1	THR	A	428	L	-	C	PRO	V	82
R	S	OG1	THR	A	428	L	-	O	PRO	V	82
R	S	OG1	THR	A	428	L	-	HA	PRO	V	82
R	S	OG1	THR	A	428	L	-	N	PRO	V	83
R	S	OG1	THR	A	428	L	-	CA	PRO	V	83
R	S	OG1	THR	A	428	L	-	CB	PRO	V	83
R	S	OG1	THR	A	428	L	-	CD	PRO	V	83
R	S	OG1	THR	A	428	L	-	HA	PRO	V	83
R	S	OG1	THR	A	428	L	-	HB3	PRO	V	83
R	S	OG1	THR	A	428	L	-	HD2	PRO	V	83
R	-	N	THR	A	429	L	-	HB2	HIS	V	81
R	-	N	THR	A	429	L	-	HB3	HIS	V	81
R	-	C	THR	A	429	L	-	HB3	HIS	V	81
R	-	O	THR	A	429	L	-	HB3	HIS	V	81
R	-	CG	ASN	A	430	L	-	CD2	HIS	V	81
R	-	CG	ASN	A	430	L	-	CE1	HIS	V	81
R	-	CG	ASN	A	430	L	-	NE2	HIS	V	81
R	-	CG	ASN	A	430	L	-	HE1	HIS	V	81
R	-	CG	ASN	A	430	L	-	HE2	HIS	V	81
R	-	ND2	ASN	A	430	L	-	NE2	HIS	V	81
R	-	ND2	ASN	A	430	L	-	HE2	HIS	V	81
R	-	OD1	ASN	A	430	L	-	CG	HIS	V	81
R	-	OD1	ASN	A	430	L	-	CD2	HIS	V	81
R	-	OD1	ASN	A	430	L	-	ND1	HIS	V	81
R	-	OD1	ASN	A	430	L	-	CE1	HIS	V	81
R	-	OD1	ASN	A	430	L	-	NE2	HIS	V	81
R	-	OD1	ASN	A	430	L	-	HD2	HIS	V	81
R	-	OD1	ASN	A	430	L	-	HE1	HIS	V	81
R	-	OD1	ASN	A	430	L	-	HE2	HIS	V	81
R	-	CD	GLN	A	456	L	-	HZ	PHE	V	86
R	-	NE2	GLN	A	456	L	-	HE1	PHE	V	86
R	-	NE2	GLN	A	456	L	-	HZ	PHE	V	86
R	-	OE1	GLN	A	456	L	-	CZ	PHE	V	86
R	-	OE1	GLN	A	456	L	-	HZ	PHE	V	86
R	-	N	GLY	A	462	L	-	HD11	ILE	V	84
R	-	CA	GLY	A	462	L	-	HD11	ILE	V	84
R	-	C	GLY	A	462	L	-	HG12	ILE	V	84
R	-	C	GLY	A	462	L	-	HD11	ILE	V	84
R	-	C	GLY	A	462	L	-	HD13	ILE	V	84
R	-	O	GLY	A	462	L	-	CD1	ILE	V	84
R	-	O	GLY	A	462	L	-	HD11	ILE	V	84
R	-	O	GLY	A	462	L	-	HD13	ILE	V	84
R	-	N	ILE	A	463	L	-	HG12	ILE	V	84
R	-	CG1	ILE	A	463	L	-	HA	ILE	V	84
R	-	CG1	ILE	A	463	L	-	HG12	ILE	V	84
R	-	CG1	ILE	A	463	L	-	HG23	ILE	V	84
R	-	CD1	ILE	A	463	L	-	HA	ILE	V	84
R	-	CD	LYS	A	571	L	-	H	GLY	V	97
R	-	CE	LYS	A	571	L	-	O	GLY	V	96
R	-	CE	LYS	A	571	L	-	H	GLY	V	97
R	-	NZ	LYS	A	571	L	-	C	GLY	V	96
R	-	NZ	LYS	A	571	L	-	O	GLY	V	96
R	-	NZ	LYS	A	571	L	-	N	GLY	V	97
R	-	NZ	LYS	A	571	L	-	O	GLY	V	97
R	-	NZ	LYS	A	571	L	-	H	GLY	V	97
R	-	CA	ARG	A	586	L	-	HE2	PHE	V	108
R	-	CB	ARG	A	586	L	-	HD2	PHE	V	108
R	-	CB	ARG	A	586	L	-	HE2	PHE	V	108
R	-	CG	ARG	A	586	L	-	CD2	PHE	V	108
R	-	CG	ARG	A	586	L	-	CE2	PHE	V	108
R	-	CG	ARG	A	586	L	-	HD2	PHE	V	108
R	-	CG	ARG	A	586	L	-	HE2	PHE	V	108
R	-	CD	ARG	A	586	L	-	CE2	PHE	V	108
R	-	CD	ARG	A	586	L	-	CZ	PHE	V	108
R	-	CD	ARG	A	586	L	-	HE2	PHE	V	108
R	-	CD	ARG	A	586	L	-	HZ	PHE	V	108
R	-	NE	ARG	A	586	L	-	CE2	PHE	V	108
R	-	NE	ARG	A	586	L	-	CZ	PHE	V	108
R	-	NE	ARG	A	586	L	-	HE2	PHE	V	108
R	-	NE	ARG	A	586	L	-	HZ	PHE	V	108
R	-	NH1	ARG	A	586	L	-	CE2	PHE	V	108
R	-	NH1	ARG	A	586	L	-	CZ	PHE	V	108
R	-	NH1	ARG	A	586	L	-	HE2	PHE	V	108
R	-	NH1	ARG	A	586	L	-	HZ	PHE	V	108
R	-	NH2	ARG	A	586	L	-	CE1	PHE	V	108
R	-	NH2	ARG	A	586	L	-	CE2	PHE	V	108
R	-	NH2	ARG	A	586	L	-	CZ	PHE	V	108
R	-	NH2	ARG	A	586	L	-	HE1	PHE	V	108
R	-	NH2	ARG	A	586	L	-	HE2	PHE	V	108
R	-	NH2	ARG	A	586	L	-	HZ	PHE	V	108
R	-	CZ	ARG	A	586	L	-	CE2	PHE	V	108
R	-	CZ	ARG	A	586	L	-	CZ	PHE	V	108
R	-	CZ	ARG	A	586	L	-	HE2	PHE	V	108
R	-	CZ	ARG	A	586	L	-	HZ	PHE	V	108
R	-	N	SER	A	588	L	-	O	THR	V	106
R	-	N	SER	A	588	L	-	HA	PRO	V	107
R	-	CA	SER	A	588	L	-	O	THR	V	106
R	-	CA	SER	A	588	L	-	H	THR	V	106
R	-	CB	SER	A	588	L	-	HA	ARG	V	105
R	-	CB	SER	A	588	L	-	N	THR	V	106
R	-	CB	SER	A	588	L	-	O	THR	V	106
R	-	CB	SER	A	588	L	-	H	THR	V	106
R	-	OG	SER	A	588	L	-	CA	ARG	V	105
R	-	OG	SER	A	588	L	-	C	ARG	V	105
R	-	OG	SER	A	588	L	-	HA	ARG	V	105
R	-	OG	SER	A	588	L	-	HG2	ARG	V	105
R	-	OG	SER	A	588	L	-	N	THR	V	106
R	-	OG	SER	A	588	L	-	CA	THR	V	106
R	-	OG	SER	A	588	L	-	C	THR	V	106
R	-	OG	SER	A	588	L	-	O	THR	V	106
R	-	OG	SER	A	588	L	-	H	THR	V	106
R	-	OG	SER	A	588	L	-	HA	THR	V	106
R	-	CD	PRO	A	589	L	-	O	THR	V	106
R	-	SD	MET	A	591	L	-	CD2	LEU	V	103
R	-	SD	MET	A	591	L	-	HD21	LEU	V	103
R	-	SD	MET	A	591	L	-	HD23	LEU	V	103
R	H	CA	GLU	A	737	L	-	HD13	LEU	V	103
R	H	CB	GLU	A	737	L	-	HD11	LEU	V	103
R	H	CB	GLU	A	737	L	-	HD13	LEU	V	103
R	H	O	GLU	A	737	L	-	HD13	LEU	V	103
R	H	CG	GLU	A	737	L	-	CD1	LEU	V	103
R	H	CG	GLU	A	737	L	-	HD11	LEU	V	103
R	H	CG	GLU	A	737	L	-	HD13	LEU	V	103
R	H	CD	GLU	A	737	L	-	HD11	LEU	V	103
R	H	CD	GLU	A	737	L	-	HD13	LEU	V	103
R	H	OE1	GLU	A	737	L	-	HD11	LEU	V	103

- 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