IID

P24347_P35030.1 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	-	HIS	A	39	L	-	ASP	V	159
R	-	LEU	A	41	L	-	LYS	V	235
R	-	HIS	A	42	L	-	LYS	V	235
R	-	HIS	A	42	L	-	HIS	V	275
R	-	ALA	A	43	L	-	HIS	V	275
R	-	ALA	A	43	L	-	TRP	V	279
R	-	ALA	A	43	L	-	ARG	V	282
R	-	GLU	A	44	L	-	TRP	V	279
R	-	GLU	A	44	L	-	ARG	V	282
R	-	ARG	A	45	L	-	TRP	V	279
R	-	ARG	A	45	L	-	LYS	V	280
R	-	ARG	A	45	L	-	ARG	V	282
R	-	ARG	A	46	L	-	GLY	V	248
R	-	ARG	A	46	L	-	ALA	V	278
R	-	ARG	A	46	L	-	TRP	V	279
R	-	ARG	A	46	L	-	LYS	V	280
R	-	GLY	A	47	L	-	GLU	V	247
R	-	GLY	A	47	L	-	GLY	V	248
R	-	GLY	A	47	L	-	GLY	V	249
R	-	GLY	A	47	L	-	ALA	V	278
R	-	GLY	A	47	L	-	TRP	V	279
R	-	GLY	A	47	L	-	LYS	V	280
R	-	PRO	A	48	L	-	GLU	V	247
R	-	PRO	A	48	L	-	GLY	V	248
R	-	PRO	A	48	L	-	GLY	V	249
R	-	GLN	A	49	L	-	GLY	V	249
R	-	GLN	A	49	L	-	LYS	V	250
R	-	PRO	A	50	L	-	ASP	V	79
R	-	PRO	A	50	L	-	GLY	V	83
R	-	TRP	A	51	L	-	LYS	V	250
R	-	TRP	A	51	L	-	GLY	V	83
R	-	TRP	A	51	L	-	GLY	V	84
R	-	TRP	A	51	L	-	TYR	V	85
R	-	HIS	A	52	L	-	ASP	V	78
R	-	HIS	A	52	L	-	GLY	V	84
R	-	HIS	A	52	L	-	TYR	V	85
R	-	ALA	A	53	L	-	ASP	V	76
R	-	ALA	A	53	L	-	ASP	V	78
R	-	ALA	A	53	L	-	TYR	V	85
R	-	ALA	A	53	L	-	THR	V	86
R	-	ALA	A	54	L	-	ASP	V	78
R	-	ALA	A	54	L	-	TYR	V	85
R	-	ALA	A	54	L	-	THR	V	86
R	-	LEU	A	55	L	-	ASP	V	78
R	-	LEU	A	55	L	-	THR	V	86
R	-	LEU	A	55	L	-	GLU	V	88
R	-	PRO	A	56	L	-	GLU	V	89
R	-	SER	A	57	L	-	GLU	V	89
R	-	SER	A	58	L	-	GLU	V	89
R	-	PRO	A	59	L	-	GLU	V	139
R	-	PRO	A	59	L	-	ASN	V	141
R	-	ALA	A	60	L	-	GLU	V	139
R	-	ALA	A	60	L	-	GLY	V	140
R	-	ALA	A	60	L	-	ASN	V	141
R	-	ALA	A	60	L	-	GLU	V	142
R	-	PRO	A	61	L	-	LEU	V	138
R	-	PRO	A	61	L	-	GLU	V	139
R	-	PRO	A	61	L	-	GLY	V	140
R	-	ALA	A	62	L	-	LEU	V	138
R	-	ALA	A	62	L	-	GLY	V	140
R	-	THR	A	65	L	S	GLN	V	127
R	-	THR	A	65	L	S	PHE	V	144
R	-	ASP	A	87	L	-	ALA	V	10
R	-	ASP	A	87	L	-	PRO	V	9
R	-	GLY	A	88	L	-	PRO	V	9
R	-	LEU	A	89	L	-	PRO	V	9
R	-	ALA	A	91	L	-	ALA	V	10
R	-	ALA	A	91	L	-	PRO	V	9
R	-	GLN	A	95	L	-	TRP	V	12

- 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

P24347_P35030.1 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	-	CE1	HIS	A	39	L	-	OD1	ASP	V	159
R	-	CD2	LEU	A	41	L	-	HZ2	LYS	V	235
R	-	O	HIS	A	42	L	-	NZ	LYS	V	235
R	-	O	HIS	A	42	L	-	HZ1	LYS	V	235
R	-	O	HIS	A	42	L	-	HZ2	LYS	V	235
R	-	O	HIS	A	42	L	-	ND1	HIS	V	275
R	-	O	HIS	A	42	L	-	CE1	HIS	V	275
R	-	O	HIS	A	42	L	-	NE2	HIS	V	275
R	-	O	HIS	A	42	L	-	HE1	HIS	V	275
R	-	C	ALA	A	43	L	-	HB3	HIS	V	275
R	-	C	ALA	A	43	L	-	HZ3	TRP	V	279
R	-	CB	ALA	A	43	L	-	CG	HIS	V	275
R	-	CB	ALA	A	43	L	-	CD2	HIS	V	275
R	-	CB	ALA	A	43	L	-	NE2	HIS	V	275
R	-	CB	ALA	A	43	L	-	HB3	HIS	V	275
R	-	CB	ALA	A	43	L	-	HD2	HIS	V	275
R	-	CB	ALA	A	43	L	-	HE	ARG	V	282
R	-	O	ALA	A	43	L	-	HB3	HIS	V	275
R	-	O	ALA	A	43	L	-	CE3	TRP	V	279
R	-	O	ALA	A	43	L	-	CH2	TRP	V	279
R	-	O	ALA	A	43	L	-	CZ3	TRP	V	279
R	-	O	ALA	A	43	L	-	HE3	TRP	V	279
R	-	O	ALA	A	43	L	-	HH2	TRP	V	279
R	-	O	ALA	A	43	L	-	HZ3	TRP	V	279
R	-	N	GLU	A	44	L	-	HZ3	TRP	V	279
R	-	N	GLU	A	44	L	-	HE	ARG	V	282
R	-	N	GLU	A	44	L	-	HH21	ARG	V	282
R	-	CA	GLU	A	44	L	-	CZ3	TRP	V	279
R	-	CA	GLU	A	44	L	-	HZ3	TRP	V	279
R	-	CA	GLU	A	44	L	-	HH21	ARG	V	282
R	-	C	GLU	A	44	L	-	CE3	TRP	V	279
R	-	C	GLU	A	44	L	-	CZ3	TRP	V	279
R	-	C	GLU	A	44	L	-	HE3	TRP	V	279
R	-	C	GLU	A	44	L	-	HZ3	TRP	V	279
R	-	C	GLU	A	44	L	-	HG3	ARG	V	282
R	-	C	GLU	A	44	L	-	HE	ARG	V	282
R	-	C	GLU	A	44	L	-	HH21	ARG	V	282
R	-	CB	GLU	A	44	L	-	HH21	ARG	V	282
R	-	O	GLU	A	44	L	-	CE3	TRP	V	279
R	-	O	GLU	A	44	L	-	CZ3	TRP	V	279
R	-	O	GLU	A	44	L	-	HE3	TRP	V	279
R	-	O	GLU	A	44	L	-	HZ3	TRP	V	279
R	-	O	GLU	A	44	L	-	CG	ARG	V	282
R	-	O	GLU	A	44	L	-	CD	ARG	V	282
R	-	O	GLU	A	44	L	-	NE	ARG	V	282
R	-	O	GLU	A	44	L	-	NH2	ARG	V	282
R	-	O	GLU	A	44	L	-	CZ	ARG	V	282
R	-	O	GLU	A	44	L	-	HG2	ARG	V	282
R	-	O	GLU	A	44	L	-	HG3	ARG	V	282
R	-	O	GLU	A	44	L	-	HE	ARG	V	282
R	-	O	GLU	A	44	L	-	HH21	ARG	V	282
R	-	N	ARG	A	45	L	-	CE3	TRP	V	279
R	-	N	ARG	A	45	L	-	CZ3	TRP	V	279
R	-	N	ARG	A	45	L	-	HE3	TRP	V	279
R	-	N	ARG	A	45	L	-	HZ3	TRP	V	279
R	-	CA	ARG	A	45	L	-	HB3	TRP	V	279
R	-	CA	ARG	A	45	L	-	HE3	TRP	V	279
R	-	C	ARG	A	45	L	-	CB	TRP	V	279
R	-	C	ARG	A	45	L	-	CG	TRP	V	279
R	-	C	ARG	A	45	L	-	CD2	TRP	V	279
R	-	C	ARG	A	45	L	-	CE3	TRP	V	279
R	-	C	ARG	A	45	L	-	HB3	TRP	V	279
R	-	C	ARG	A	45	L	-	HE3	TRP	V	279
R	-	C	ARG	A	45	L	-	O	LYS	V	280
R	-	C	ARG	A	45	L	-	H	LYS	V	280
R	-	O	ARG	A	45	L	-	CA	TRP	V	279
R	-	O	ARG	A	45	L	-	C	TRP	V	279
R	-	O	ARG	A	45	L	-	CB	TRP	V	279
R	-	O	ARG	A	45	L	-	CG	TRP	V	279
R	-	O	ARG	A	45	L	-	CD2	TRP	V	279
R	-	O	ARG	A	45	L	-	CE3	TRP	V	279
R	-	O	ARG	A	45	L	-	HA	TRP	V	279
R	-	O	ARG	A	45	L	-	HB2	TRP	V	279
R	-	O	ARG	A	45	L	-	HB3	TRP	V	279
R	-	O	ARG	A	45	L	-	HE3	TRP	V	279
R	-	O	ARG	A	45	L	-	N	LYS	V	280
R	-	O	ARG	A	45	L	-	C	LYS	V	280
R	-	O	ARG	A	45	L	-	O	LYS	V	280
R	-	O	ARG	A	45	L	-	H	LYS	V	280
R	-	O	ARG	A	45	L	-	HB3	LYS	V	280
R	-	O	ARG	A	45	L	-	CG	ARG	V	282
R	-	O	ARG	A	45	L	-	HG2	ARG	V	282
R	-	O	ARG	A	45	L	-	HG3	ARG	V	282
R	-	N	ARG	A	46	L	-	HB3	TRP	V	279
R	-	N	ARG	A	46	L	-	H	LYS	V	280
R	-	N	ARG	A	46	L	-	HB3	LYS	V	280
R	-	CA	ARG	A	46	L	-	HA	TRP	V	279
R	-	CA	ARG	A	46	L	-	HB3	TRP	V	279
R	-	CA	ARG	A	46	L	-	N	LYS	V	280
R	-	CA	ARG	A	46	L	-	CB	LYS	V	280
R	-	CA	ARG	A	46	L	-	H	LYS	V	280
R	-	CA	ARG	A	46	L	-	HB2	LYS	V	280
R	-	CA	ARG	A	46	L	-	HB3	LYS	V	280
R	-	C	ARG	A	46	L	-	CA	TRP	V	279
R	-	C	ARG	A	46	L	-	C	TRP	V	279
R	-	C	ARG	A	46	L	-	CB	TRP	V	279
R	-	C	ARG	A	46	L	-	HA	TRP	V	279
R	-	C	ARG	A	46	L	-	HB3	TRP	V	279
R	-	C	ARG	A	46	L	-	N	LYS	V	280
R	-	C	ARG	A	46	L	-	CA	LYS	V	280
R	-	C	ARG	A	46	L	-	CB	LYS	V	280
R	-	C	ARG	A	46	L	-	H	LYS	V	280
R	-	C	ARG	A	46	L	-	HB2	LYS	V	280
R	-	C	ARG	A	46	L	-	HB3	LYS	V	280
R	-	CB	ARG	A	46	L	-	N	LYS	V	280
R	-	CB	ARG	A	46	L	-	CB	LYS	V	280
R	-	CB	ARG	A	46	L	-	H	LYS	V	280
R	-	CB	ARG	A	46	L	-	HB2	LYS	V	280
R	-	CB	ARG	A	46	L	-	HB3	LYS	V	280
R	-	CB	ARG	A	46	L	-	HD3	LYS	V	280
R	-	O	ARG	A	46	L	-	HA2	GLY	V	248
R	-	O	ARG	A	46	L	-	O	ALA	V	278
R	-	O	ARG	A	46	L	-	N	TRP	V	279
R	-	O	ARG	A	46	L	-	CA	TRP	V	279
R	-	O	ARG	A	46	L	-	C	TRP	V	279
R	-	O	ARG	A	46	L	-	CB	TRP	V	279
R	-	O	ARG	A	46	L	-	O	TRP	V	279
R	-	O	ARG	A	46	L	-	HA	TRP	V	279
R	-	O	ARG	A	46	L	-	HB3	TRP	V	279
R	-	O	ARG	A	46	L	-	N	LYS	V	280
R	-	O	ARG	A	46	L	-	CA	LYS	V	280
R	-	O	ARG	A	46	L	-	C	LYS	V	280
R	-	O	ARG	A	46	L	-	CB	LYS	V	280
R	-	O	ARG	A	46	L	-	O	LYS	V	280
R	-	O	ARG	A	46	L	-	H	LYS	V	280
R	-	O	ARG	A	46	L	-	HA	LYS	V	280
R	-	O	ARG	A	46	L	-	HB2	LYS	V	280
R	-	O	ARG	A	46	L	-	HB3	LYS	V	280
R	-	CG	ARG	A	46	L	-	HB3	LYS	V	280
R	-	CG	ARG	A	46	L	-	HD3	LYS	V	280
R	-	CD	ARG	A	46	L	-	CD	LYS	V	280
R	-	CD	ARG	A	46	L	-	HB3	LYS	V	280
R	-	CD	ARG	A	46	L	-	HD3	LYS	V	280
R	-	NH1	ARG	A	46	L	-	HD3	LYS	V	280
R	-	NH1	ARG	A	46	L	-	HZ2	LYS	V	280
R	-	N	GLY	A	47	L	-	HA	TRP	V	279
R	-	N	GLY	A	47	L	-	N	LYS	V	280
R	-	N	GLY	A	47	L	-	H	LYS	V	280
R	-	N	GLY	A	47	L	-	HB2	LYS	V	280
R	-	CA	GLY	A	47	L	-	HA2	GLY	V	248
R	-	CA	GLY	A	47	L	-	H	GLY	V	249
R	-	CA	GLY	A	47	L	-	O	ALA	V	278
R	-	CA	GLY	A	47	L	-	HA	TRP	V	279
R	-	CA	GLY	A	47	L	-	N	LYS	V	280
R	-	CA	GLY	A	47	L	-	H	LYS	V	280
R	-	CA	GLY	A	47	L	-	HB2	LYS	V	280
R	-	C	GLY	A	47	L	-	O	GLU	V	247
R	-	C	GLY	A	47	L	-	HA2	GLY	V	248
R	-	C	GLY	A	47	L	-	H	GLY	V	249
R	-	C	GLY	A	47	L	-	N	LYS	V	280
R	-	C	GLY	A	47	L	-	H	LYS	V	280
R	-	C	GLY	A	47	L	-	HB2	LYS	V	280
R	-	O	GLY	A	47	L	-	O	GLU	V	247
R	-	O	GLY	A	47	L	-	HA2	GLY	V	248
R	-	O	GLY	A	47	L	-	N	LYS	V	280
R	-	O	GLY	A	47	L	-	CA	LYS	V	280
R	-	O	GLY	A	47	L	-	CB	LYS	V	280
R	-	O	GLY	A	47	L	-	CG	LYS	V	280
R	-	O	GLY	A	47	L	-	H	LYS	V	280
R	-	O	GLY	A	47	L	-	HA	LYS	V	280
R	-	O	GLY	A	47	L	-	HB2	LYS	V	280
R	-	O	GLY	A	47	L	-	HB3	LYS	V	280
R	-	O	GLY	A	47	L	-	HG3	LYS	V	280
R	-	O	GLY	A	47	L	-	HD2	LYS	V	280
R	-	N	PRO	A	48	L	-	O	GLU	V	247
R	-	N	PRO	A	48	L	-	C	GLY	V	248
R	-	N	PRO	A	48	L	-	HA2	GLY	V	248
R	-	N	PRO	A	48	L	-	N	GLY	V	249
R	-	N	PRO	A	48	L	-	H	GLY	V	249
R	-	CA	PRO	A	48	L	-	N	GLY	V	249
R	-	CA	PRO	A	48	L	-	CA	GLY	V	249
R	-	CA	PRO	A	48	L	-	H	GLY	V	249
R	-	CA	PRO	A	48	L	-	HA2	GLY	V	249
R	-	CA	PRO	A	48	L	-	HA3	GLY	V	249
R	-	C	PRO	A	48	L	-	C	GLY	V	248
R	-	C	PRO	A	48	L	-	N	GLY	V	249
R	-	C	PRO	A	48	L	-	CA	GLY	V	249
R	-	C	PRO	A	48	L	-	H	GLY	V	249
R	-	C	PRO	A	48	L	-	HA2	GLY	V	249
R	-	C	PRO	A	48	L	-	HA3	GLY	V	249
R	-	O	PRO	A	48	L	-	C	GLY	V	248
R	-	O	PRO	A	48	L	-	O	GLY	V	248
R	-	O	PRO	A	48	L	-	N	GLY	V	249
R	-	O	PRO	A	48	L	-	CA	GLY	V	249
R	-	O	PRO	A	48	L	-	C	GLY	V	249
R	-	O	PRO	A	48	L	-	H	GLY	V	249
R	-	O	PRO	A	48	L	-	HA2	GLY	V	249
R	-	O	PRO	A	48	L	-	HA3	GLY	V	249
R	-	CG	PRO	A	48	L	-	O	GLU	V	247
R	-	CD	PRO	A	48	L	-	C	GLU	V	247
R	-	CD	PRO	A	48	L	-	O	GLU	V	247
R	-	CD	PRO	A	48	L	-	HB2	GLU	V	247
R	-	CD	PRO	A	48	L	-	HA2	GLY	V	248
R	-	N	GLN	A	49	L	-	CA	GLY	V	249
R	-	N	GLN	A	49	L	-	HA2	GLY	V	249
R	-	N	GLN	A	49	L	-	HA3	GLY	V	249
R	-	CA	GLN	A	49	L	-	HA2	GLY	V	249
R	-	CA	GLN	A	49	L	-	HA3	GLY	V	249
R	-	C	GLN	A	49	L	-	CA	GLY	V	249
R	-	C	GLN	A	49	L	-	O	GLY	V	249
R	-	C	GLN	A	49	L	-	HA2	GLY	V	249
R	-	C	GLN	A	49	L	-	HA3	GLY	V	249
R	-	O	GLN	A	49	L	-	CA	GLY	V	249
R	-	O	GLN	A	49	L	-	C	GLY	V	249
R	-	O	GLN	A	49	L	-	O	GLY	V	249
R	-	O	GLN	A	49	L	-	HA2	GLY	V	249
R	-	O	GLN	A	49	L	-	HA3	GLY	V	249
R	-	O	GLN	A	49	L	-	HG3	LYS	V	250
R	-	CA	PRO	A	50	L	-	CA	GLY	V	83
R	-	CA	PRO	A	50	L	-	HA2	GLY	V	83
R	-	CA	PRO	A	50	L	-	HA3	GLY	V	83
R	-	C	PRO	A	50	L	-	HA3	GLY	V	83
R	-	CB	PRO	A	50	L	-	CG	ASP	V	79
R	-	CB	PRO	A	50	L	-	OD1	ASP	V	79
R	-	CB	PRO	A	50	L	-	OD2	ASP	V	79
R	-	CB	PRO	A	50	L	-	CA	GLY	V	83
R	-	CB	PRO	A	50	L	-	HA2	GLY	V	83
R	-	CB	PRO	A	50	L	-	HA3	GLY	V	83
R	-	CG	PRO	A	50	L	-	CG	ASP	V	79
R	-	CG	PRO	A	50	L	-	OD1	ASP	V	79
R	-	CG	PRO	A	50	L	-	OD2	ASP	V	79
R	-	N	TRP	A	51	L	-	HA3	GLY	V	83
R	-	N	TRP	A	51	L	-	HE2	LYS	V	250
R	-	N	TRP	A	51	L	-	HE3	LYS	V	250
R	-	CB	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	O	TRP	A	51	L	-	O	GLY	V	83
R	-	O	TRP	A	51	L	-	O	GLY	V	84
R	-	O	TRP	A	51	L	-	HB3	TYR	V	85
R	-	O	TRP	A	51	L	-	HE3	LYS	V	250
R	-	CG	TRP	A	51	L	-	CE	LYS	V	250
R	-	CG	TRP	A	51	L	-	NZ	LYS	V	250
R	-	CG	TRP	A	51	L	-	HE2	LYS	V	250
R	-	CG	TRP	A	51	L	-	HE3	LYS	V	250
R	-	CG	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	CD1	TRP	A	51	L	-	HE2	LYS	V	250
R	-	CD1	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	CD2	TRP	A	51	L	-	CE	LYS	V	250
R	-	CD2	TRP	A	51	L	-	NZ	LYS	V	250
R	-	CD2	TRP	A	51	L	-	HE2	LYS	V	250
R	-	CD2	TRP	A	51	L	-	HE3	LYS	V	250
R	-	CD2	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	CD2	TRP	A	51	L	-	HZ2	LYS	V	250
R	-	CD2	TRP	A	51	L	-	HZ3	LYS	V	250
R	-	CE2	TRP	A	51	L	-	CE	LYS	V	250
R	-	CE2	TRP	A	51	L	-	NZ	LYS	V	250
R	-	CE2	TRP	A	51	L	-	HE2	LYS	V	250
R	-	CE2	TRP	A	51	L	-	HE3	LYS	V	250
R	-	CE2	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	CE2	TRP	A	51	L	-	HZ2	LYS	V	250
R	-	CE2	TRP	A	51	L	-	HZ3	LYS	V	250
R	-	CE3	TRP	A	51	L	-	CE	LYS	V	250
R	-	CE3	TRP	A	51	L	-	NZ	LYS	V	250
R	-	CE3	TRP	A	51	L	-	HE2	LYS	V	250
R	-	CE3	TRP	A	51	L	-	HE3	LYS	V	250
R	-	CE3	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	CE3	TRP	A	51	L	-	HZ2	LYS	V	250
R	-	CE3	TRP	A	51	L	-	HZ3	LYS	V	250
R	-	NE1	TRP	A	51	L	-	CE	LYS	V	250
R	-	NE1	TRP	A	51	L	-	NZ	LYS	V	250
R	-	NE1	TRP	A	51	L	-	HE2	LYS	V	250
R	-	NE1	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	NE1	TRP	A	51	L	-	HZ3	LYS	V	250
R	-	CH2	TRP	A	51	L	-	CE	LYS	V	250
R	-	CH2	TRP	A	51	L	-	NZ	LYS	V	250
R	-	CH2	TRP	A	51	L	-	HD2	LYS	V	250
R	-	CH2	TRP	A	51	L	-	HE2	LYS	V	250
R	-	CH2	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	CH2	TRP	A	51	L	-	HZ2	LYS	V	250
R	-	CH2	TRP	A	51	L	-	HZ3	LYS	V	250
R	-	CZ2	TRP	A	51	L	-	CE	LYS	V	250
R	-	CZ2	TRP	A	51	L	-	NZ	LYS	V	250
R	-	CZ2	TRP	A	51	L	-	HD2	LYS	V	250
R	-	CZ2	TRP	A	51	L	-	HE2	LYS	V	250
R	-	CZ2	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	CZ2	TRP	A	51	L	-	HZ2	LYS	V	250
R	-	CZ2	TRP	A	51	L	-	HZ3	LYS	V	250
R	-	CZ3	TRP	A	51	L	-	CE	LYS	V	250
R	-	CZ3	TRP	A	51	L	-	NZ	LYS	V	250
R	-	CZ3	TRP	A	51	L	-	HE2	LYS	V	250
R	-	CZ3	TRP	A	51	L	-	HZ1	LYS	V	250
R	-	CZ3	TRP	A	51	L	-	HZ2	LYS	V	250
R	-	CZ3	TRP	A	51	L	-	HZ3	LYS	V	250
R	-	CA	HIS	A	52	L	-	HB3	TYR	V	85
R	-	C	HIS	A	52	L	-	HB3	ASP	V	78
R	-	C	HIS	A	52	L	-	CB	TYR	V	85
R	-	C	HIS	A	52	L	-	HA	TYR	V	85
R	-	C	HIS	A	52	L	-	HB2	TYR	V	85
R	-	C	HIS	A	52	L	-	HB3	TYR	V	85
R	-	O	HIS	A	52	L	-	O	GLY	V	84
R	-	O	HIS	A	52	L	-	CA	TYR	V	85
R	-	O	HIS	A	52	L	-	CB	TYR	V	85
R	-	O	HIS	A	52	L	-	CG	TYR	V	85
R	-	O	HIS	A	52	L	-	HA	TYR	V	85
R	-	O	HIS	A	52	L	-	HB2	TYR	V	85
R	-	O	HIS	A	52	L	-	HB3	TYR	V	85
R	-	O	HIS	A	52	L	-	HD1	TYR	V	85
R	-	N	ALA	A	53	L	-	CB	ASP	V	78
R	-	N	ALA	A	53	L	-	O	ASP	V	78
R	-	N	ALA	A	53	L	-	HB2	ASP	V	78
R	-	N	ALA	A	53	L	-	HB3	ASP	V	78
R	-	N	ALA	A	53	L	-	CB	TYR	V	85
R	-	N	ALA	A	53	L	-	HA	TYR	V	85
R	-	N	ALA	A	53	L	-	HB2	TYR	V	85
R	-	N	ALA	A	53	L	-	HB3	TYR	V	85
R	-	CA	ALA	A	53	L	-	CB	ASP	V	78
R	-	CA	ALA	A	53	L	-	CG	ASP	V	78
R	-	CA	ALA	A	53	L	-	OD2	ASP	V	78
R	-	CA	ALA	A	53	L	-	HB2	ASP	V	78
R	-	CA	ALA	A	53	L	-	HB3	ASP	V	78
R	-	CA	ALA	A	53	L	-	HB2	TYR	V	85
R	-	C	ALA	A	53	L	-	OD2	ASP	V	78
R	-	C	ALA	A	53	L	-	HB2	ASP	V	78
R	-	C	ALA	A	53	L	-	HB3	ASP	V	78
R	-	C	ALA	A	53	L	-	HB2	TYR	V	85
R	-	C	ALA	A	53	L	-	H	THR	V	86
R	-	CB	ALA	A	53	L	-	OD2	ASP	V	76
R	-	CB	ALA	A	53	L	-	HB2	ASP	V	76
R	-	CB	ALA	A	53	L	-	HB2	ASP	V	78
R	-	O	ALA	A	53	L	-	CB	TYR	V	85
R	-	O	ALA	A	53	L	-	HB2	TYR	V	85
R	-	O	ALA	A	53	L	-	HB3	TYR	V	85
R	-	N	ALA	A	54	L	-	CG	ASP	V	78
R	-	N	ALA	A	54	L	-	OD2	ASP	V	78
R	-	N	ALA	A	54	L	-	HB3	ASP	V	78
R	-	N	ALA	A	54	L	-	HB2	TYR	V	85
R	-	N	ALA	A	54	L	-	H	THR	V	86
R	-	N	ALA	A	54	L	-	HB	THR	V	86
R	-	CA	ALA	A	54	L	-	OD2	ASP	V	78
R	-	CA	ALA	A	54	L	-	HB	THR	V	86
R	-	C	ALA	A	54	L	-	OD2	ASP	V	78
R	-	C	ALA	A	54	L	-	CB	THR	V	86
R	-	C	ALA	A	54	L	-	HB	THR	V	86
R	-	O	ALA	A	54	L	-	CB	THR	V	86
R	-	O	ALA	A	54	L	-	O	THR	V	86
R	-	O	ALA	A	54	L	-	HB	THR	V	86
R	-	N	LEU	A	55	L	-	OD2	ASP	V	78
R	-	N	LEU	A	55	L	-	HB	THR	V	86
R	-	N	LEU	A	55	L	-	HG1	THR	V	86
R	-	O	LEU	A	55	L	-	OE1	GLU	V	88
R	-	O	LEU	A	55	L	-	OE2	GLU	V	88
R	-	C	PRO	A	56	L	-	HB2	GLU	V	89
R	-	N	SER	A	57	L	-	CB	GLU	V	89
R	-	N	SER	A	57	L	-	OE2	GLU	V	89
R	-	N	SER	A	57	L	-	HB2	GLU	V	89
R	-	N	SER	A	57	L	-	HB3	GLU	V	89
R	-	N	SER	A	57	L	-	HG3	GLU	V	89
R	-	CA	SER	A	57	L	-	CB	GLU	V	89
R	-	CA	SER	A	57	L	-	CD	GLU	V	89
R	-	CA	SER	A	57	L	-	OE2	GLU	V	89
R	-	CA	SER	A	57	L	-	HB2	GLU	V	89
R	-	CA	SER	A	57	L	-	HB3	GLU	V	89
R	-	C	SER	A	57	L	-	CB	GLU	V	89
R	-	C	SER	A	57	L	-	CG	GLU	V	89
R	-	C	SER	A	57	L	-	CD	GLU	V	89
R	-	C	SER	A	57	L	-	OE1	GLU	V	89
R	-	C	SER	A	57	L	-	OE2	GLU	V	89
R	-	C	SER	A	57	L	-	HB2	GLU	V	89
R	-	C	SER	A	57	L	-	HB3	GLU	V	89
R	-	C	SER	A	57	L	-	HG3	GLU	V	89
R	-	CB	SER	A	57	L	-	CB	GLU	V	89
R	-	CB	SER	A	57	L	-	CD	GLU	V	89
R	-	CB	SER	A	57	L	-	OE2	GLU	V	89
R	-	CB	SER	A	57	L	-	HB2	GLU	V	89
R	-	CB	SER	A	57	L	-	HB3	GLU	V	89
R	-	O	SER	A	57	L	-	CB	GLU	V	89
R	-	O	SER	A	57	L	-	CG	GLU	V	89
R	-	O	SER	A	57	L	-	CD	GLU	V	89
R	-	O	SER	A	57	L	-	OE1	GLU	V	89
R	-	O	SER	A	57	L	-	OE2	GLU	V	89
R	-	O	SER	A	57	L	-	HB2	GLU	V	89
R	-	O	SER	A	57	L	-	HB3	GLU	V	89
R	-	O	SER	A	57	L	-	HG2	GLU	V	89
R	-	O	SER	A	57	L	-	HG3	GLU	V	89
R	-	OG	SER	A	57	L	-	CB	GLU	V	89
R	-	OG	SER	A	57	L	-	OE2	GLU	V	89
R	-	OG	SER	A	57	L	-	HB2	GLU	V	89
R	-	OG	SER	A	57	L	-	HB3	GLU	V	89
R	-	N	SER	A	58	L	-	CD	GLU	V	89
R	-	N	SER	A	58	L	-	OE2	GLU	V	89
R	-	CA	SER	A	58	L	-	CD	GLU	V	89
R	-	CA	SER	A	58	L	-	OE2	GLU	V	89
R	-	C	SER	A	58	L	-	OE2	GLU	V	89
R	-	O	SER	A	58	L	-	OE2	GLU	V	89
R	-	CA	PRO	A	59	L	-	CA	GLU	V	139
R	-	CA	PRO	A	59	L	-	C	GLU	V	139
R	-	CA	PRO	A	59	L	-	O	GLU	V	139
R	-	CA	PRO	A	59	L	-	HA	GLU	V	139
R	-	CA	PRO	A	59	L	-	HB2	GLU	V	139
R	-	C	PRO	A	59	L	-	C	GLU	V	139
R	-	C	PRO	A	59	L	-	O	GLU	V	139
R	-	C	PRO	A	59	L	-	HA	GLU	V	139
R	-	C	PRO	A	59	L	-	HB2	GLU	V	139
R	-	C	PRO	A	59	L	-	HD22	ASN	V	141
R	-	CB	PRO	A	59	L	-	CA	GLU	V	139
R	-	CB	PRO	A	59	L	-	C	GLU	V	139
R	-	CB	PRO	A	59	L	-	CB	GLU	V	139
R	-	CB	PRO	A	59	L	-	O	GLU	V	139
R	-	CB	PRO	A	59	L	-	HA	GLU	V	139
R	-	CB	PRO	A	59	L	-	HB2	GLU	V	139
R	-	CB	PRO	A	59	L	-	HG2	GLU	V	139
R	-	O	PRO	A	59	L	-	O	GLU	V	139
R	-	CG	PRO	A	59	L	-	HA	GLU	V	139
R	-	N	ALA	A	60	L	-	CA	GLU	V	139
R	-	N	ALA	A	60	L	-	C	GLU	V	139
R	-	N	ALA	A	60	L	-	O	GLU	V	139
R	-	N	ALA	A	60	L	-	HA	GLU	V	139
R	-	N	ALA	A	60	L	-	HB2	GLU	V	139
R	-	N	ALA	A	60	L	-	N	GLY	V	140
R	-	N	ALA	A	60	L	-	CA	GLY	V	140
R	-	N	ALA	A	60	L	-	HA3	GLY	V	140
R	-	N	ALA	A	60	L	-	ND2	ASN	V	141
R	-	N	ALA	A	60	L	-	HD22	ASN	V	141
R	-	CA	ALA	A	60	L	-	C	GLU	V	139
R	-	CA	ALA	A	60	L	-	O	GLU	V	139
R	-	CA	ALA	A	60	L	-	N	GLY	V	140
R	-	CA	ALA	A	60	L	-	CA	GLY	V	140
R	-	CA	ALA	A	60	L	-	C	GLY	V	140
R	-	CA	ALA	A	60	L	-	HA2	GLY	V	140
R	-	CA	ALA	A	60	L	-	HA3	GLY	V	140
R	-	C	ALA	A	60	L	-	C	GLU	V	139
R	-	C	ALA	A	60	L	-	O	GLU	V	139
R	-	C	ALA	A	60	L	-	N	GLY	V	140
R	-	C	ALA	A	60	L	-	CA	GLY	V	140
R	-	C	ALA	A	60	L	-	C	GLY	V	140
R	-	C	ALA	A	60	L	-	O	GLY	V	140
R	-	C	ALA	A	60	L	-	H	GLY	V	140
R	-	C	ALA	A	60	L	-	HA2	GLY	V	140
R	-	C	ALA	A	60	L	-	HA3	GLY	V	140
R	-	C	ALA	A	60	L	-	N	ASN	V	141
R	-	C	ALA	A	60	L	-	H	ASN	V	141
R	-	CB	ALA	A	60	L	-	O	GLU	V	139
R	-	CB	ALA	A	60	L	-	CA	GLY	V	140
R	-	CB	ALA	A	60	L	-	HA3	GLY	V	140
R	-	O	ALA	A	60	L	-	CA	GLU	V	139
R	-	O	ALA	A	60	L	-	C	GLU	V	139
R	-	O	ALA	A	60	L	-	O	GLU	V	139
R	-	O	ALA	A	60	L	-	N	GLY	V	140
R	-	O	ALA	A	60	L	-	CA	GLY	V	140
R	-	O	ALA	A	60	L	-	C	GLY	V	140
R	-	O	ALA	A	60	L	-	O	GLY	V	140
R	-	O	ALA	A	60	L	-	H	GLY	V	140
R	-	O	ALA	A	60	L	-	HA2	GLY	V	140
R	-	O	ALA	A	60	L	-	HA3	GLY	V	140
R	-	O	ALA	A	60	L	-	N	ASN	V	141
R	-	O	ALA	A	60	L	-	CA	ASN	V	141
R	-	O	ALA	A	60	L	-	CG	ASN	V	141
R	-	O	ALA	A	60	L	-	ND2	ASN	V	141
R	-	O	ALA	A	60	L	-	H	ASN	V	141
R	-	O	ALA	A	60	L	-	HA	ASN	V	141
R	-	O	ALA	A	60	L	-	HD21	ASN	V	141
R	-	O	ALA	A	60	L	-	HD22	ASN	V	141
R	-	O	ALA	A	60	L	-	OE2	GLU	V	142
R	-	N	PRO	A	61	L	-	C	GLU	V	139
R	-	N	PRO	A	61	L	-	O	GLU	V	139
R	-	N	PRO	A	61	L	-	N	GLY	V	140
R	-	N	PRO	A	61	L	-	CA	GLY	V	140
R	-	N	PRO	A	61	L	-	C	GLY	V	140
R	-	N	PRO	A	61	L	-	O	GLY	V	140
R	-	N	PRO	A	61	L	-	H	GLY	V	140
R	-	N	PRO	A	61	L	-	HA2	GLY	V	140
R	-	N	PRO	A	61	L	-	HA3	GLY	V	140
R	-	CA	PRO	A	61	L	-	HB3	LEU	V	138
R	-	CA	PRO	A	61	L	-	C	GLU	V	139
R	-	CA	PRO	A	61	L	-	N	GLY	V	140
R	-	CA	PRO	A	61	L	-	CA	GLY	V	140
R	-	CA	PRO	A	61	L	-	C	GLY	V	140
R	-	CA	PRO	A	61	L	-	O	GLY	V	140
R	-	CA	PRO	A	61	L	-	H	GLY	V	140
R	-	CA	PRO	A	61	L	-	HA2	GLY	V	140
R	-	CA	PRO	A	61	L	-	HA3	GLY	V	140
R	-	C	PRO	A	61	L	-	CA	GLY	V	140
R	-	C	PRO	A	61	L	-	C	GLY	V	140
R	-	C	PRO	A	61	L	-	O	GLY	V	140
R	-	C	PRO	A	61	L	-	HA2	GLY	V	140
R	-	C	PRO	A	61	L	-	HA3	GLY	V	140
R	-	CB	PRO	A	61	L	-	HB3	LEU	V	138
R	-	CB	PRO	A	61	L	-	N	GLY	V	140
R	-	CB	PRO	A	61	L	-	CA	GLY	V	140
R	-	CB	PRO	A	61	L	-	HA2	GLY	V	140
R	-	CB	PRO	A	61	L	-	HA3	GLY	V	140
R	-	O	PRO	A	61	L	-	CA	GLY	V	140
R	-	O	PRO	A	61	L	-	C	GLY	V	140
R	-	O	PRO	A	61	L	-	O	GLY	V	140
R	-	O	PRO	A	61	L	-	HA2	GLY	V	140
R	-	O	PRO	A	61	L	-	HA3	GLY	V	140
R	-	CG	PRO	A	61	L	-	HA2	GLY	V	140
R	-	CG	PRO	A	61	L	-	HA3	GLY	V	140
R	-	CD	PRO	A	61	L	-	CA	GLY	V	140
R	-	CD	PRO	A	61	L	-	HA2	GLY	V	140
R	-	CD	PRO	A	61	L	-	HA3	GLY	V	140
R	-	N	ALA	A	62	L	-	CA	GLY	V	140
R	-	N	ALA	A	62	L	-	C	GLY	V	140
R	-	N	ALA	A	62	L	-	O	GLY	V	140
R	-	N	ALA	A	62	L	-	HA2	GLY	V	140
R	-	O	ALA	A	62	L	-	HD13	LEU	V	138
R	-	O	ALA	A	62	L	-	HD22	LEU	V	138
R	-	CB	THR	A	65	L	S	HE22	GLN	V	127
R	-	CB	THR	A	65	L	S	HD2	PHE	V	144
R	-	CG2	THR	A	65	L	S	NE2	GLN	V	127
R	-	CG2	THR	A	65	L	S	HE21	GLN	V	127
R	-	CG2	THR	A	65	L	S	HE22	GLN	V	127
R	-	OG1	THR	A	65	L	S	NE2	GLN	V	127
R	-	OG1	THR	A	65	L	S	HE22	GLN	V	127
R	-	OG1	THR	A	65	L	S	CD2	PHE	V	144
R	-	OG1	THR	A	65	L	S	HB3	PHE	V	144
R	-	OG1	THR	A	65	L	S	HD2	PHE	V	144
R	-	CA	ASP	A	87	L	-	HG3	PRO	V	9
R	-	C	ASP	A	87	L	-	CB	PRO	V	9
R	-	C	ASP	A	87	L	-	CG	PRO	V	9
R	-	C	ASP	A	87	L	-	HB2	PRO	V	9
R	-	C	ASP	A	87	L	-	HB3	PRO	V	9
R	-	C	ASP	A	87	L	-	HG2	PRO	V	9
R	-	C	ASP	A	87	L	-	HG3	PRO	V	9
R	-	CB	ASP	A	87	L	-	HG3	PRO	V	9
R	-	O	ASP	A	87	L	-	CB	PRO	V	9
R	-	O	ASP	A	87	L	-	CG	PRO	V	9
R	-	O	ASP	A	87	L	-	HB2	PRO	V	9
R	-	O	ASP	A	87	L	-	HB3	PRO	V	9
R	-	O	ASP	A	87	L	-	HG2	PRO	V	9
R	-	O	ASP	A	87	L	-	HG3	PRO	V	9
R	-	O	ASP	A	87	L	-	HB3	ALA	V	10
R	-	N	GLY	A	88	L	-	CB	PRO	V	9
R	-	N	GLY	A	88	L	-	CG	PRO	V	9
R	-	N	GLY	A	88	L	-	HB2	PRO	V	9
R	-	N	GLY	A	88	L	-	HB3	PRO	V	9
R	-	N	GLY	A	88	L	-	HG2	PRO	V	9
R	-	N	GLY	A	88	L	-	HG3	PRO	V	9
R	-	CA	GLY	A	88	L	-	CB	PRO	V	9
R	-	CA	GLY	A	88	L	-	CG	PRO	V	9
R	-	CA	GLY	A	88	L	-	CD	PRO	V	9
R	-	CA	GLY	A	88	L	-	HB2	PRO	V	9
R	-	CA	GLY	A	88	L	-	HB3	PRO	V	9
R	-	CA	GLY	A	88	L	-	HG2	PRO	V	9
R	-	CA	GLY	A	88	L	-	HG3	PRO	V	9
R	-	C	GLY	A	88	L	-	CB	PRO	V	9
R	-	C	GLY	A	88	L	-	CG	PRO	V	9
R	-	C	GLY	A	88	L	-	HB2	PRO	V	9
R	-	C	GLY	A	88	L	-	HB3	PRO	V	9
R	-	C	GLY	A	88	L	-	HG2	PRO	V	9
R	-	O	GLY	A	88	L	-	CB	PRO	V	9
R	-	O	GLY	A	88	L	-	HB2	PRO	V	9
R	-	O	GLY	A	88	L	-	HB3	PRO	V	9
R	-	O	GLY	A	88	L	-	HG2	PRO	V	9
R	-	N	LEU	A	89	L	-	HB3	PRO	V	9
R	-	N	ALA	A	91	L	-	HB2	ALA	V	10
R	-	CA	ALA	A	91	L	-	CB	ALA	V	10
R	-	CA	ALA	A	91	L	-	HB1	ALA	V	10
R	-	CA	ALA	A	91	L	-	HB2	ALA	V	10
R	-	CA	ALA	A	91	L	-	HB3	ALA	V	10
R	-	C	ALA	A	91	L	-	HB1	ALA	V	10
R	-	C	ALA	A	91	L	-	HB2	ALA	V	10
R	-	CB	ALA	A	91	L	-	HB2	PRO	V	9
R	-	CB	ALA	A	91	L	-	N	ALA	V	10
R	-	CB	ALA	A	91	L	-	CA	ALA	V	10
R	-	CB	ALA	A	91	L	-	CB	ALA	V	10
R	-	CB	ALA	A	91	L	-	HA	ALA	V	10
R	-	CB	ALA	A	91	L	-	HB1	ALA	V	10
R	-	CB	ALA	A	91	L	-	HB2	ALA	V	10
R	-	CB	ALA	A	91	L	-	HB3	ALA	V	10
R	-	O	ALA	A	91	L	-	HB1	ALA	V	10
R	-	O	ALA	A	91	L	-	HB2	ALA	V	10
R	-	NE2	GLN	A	95	L	-	HZ3	TRP	V	12

- 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