IID

Q96A58_P11233.1 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	36	L	H	ASP	V	121
R	-	LYS	A	47	L	-	LYS	V	29
R	-	LYS	A	47	L	-	ARG	V	30
R	S	ALA	A	48	L	-	CYS	V	150
R	S	ALA	A	48	L	H	ARG	V	25
R	S	ALA	A	48	L	-	ARG	V	30
R	S	ALA	A	48	L	-	PHE	V	31
R	S	ASP	A	49	L	-	CYS	V	150
R	S	ASP	A	49	L	-	THR	V	151
R	S	ASP	A	49	L	-	GLY	V	152
R	S	ASP	A	49	L	H	ARG	V	25
R	S	SER	A	50	L	H	ASP	V	121
R	S	SER	A	50	L	-	CYS	V	150
R	S	SER	A	50	L	-	THR	V	151
R	S	SER	A	50	L	-	PHE	V	31
R	S	SER	A	50	L	-	TRP	V	33
R	S	TYR	A	51	L	H	ASP	V	121
R	S	TYR	A	51	L	-	CYS	V	150
R	S	TYR	A	51	L	-	THR	V	151
R	S	ARG	A	52	L	H	ASP	V	121
R	S	ARG	A	52	L	H	LEU	V	122
R	S	ARG	A	52	L	H	HIS	V	124
R	S	ARG	A	52	L	-	TRP	V	33
R	S	LYS	A	53	L	H	HIS	V	124
R	S	LYS	A	54	L	H	HIS	V	124
R	S	LYS	A	54	L	H	SER	V	125
R	S	GLN	A	63	L	H	HIS	V	124
R	S	ASP	A	65	L	-	CYS	V	150
R	S	ASP	A	65	L	-	TRP	V	33
R	S	ILE	A	66	L	-	TRP	V	33
R	S	LEU	A	67	L	-	PHE	V	31
R	S	LEU	A	67	L	-	TRP	V	33
R	-	GLU	A	73	L	-	ARG	V	30
R	-	ASP	A	74	L	-	ARG	V	30
R	-	TYR	A	75	L	-	ARG	V	30
R	H	ILE	A	78	L	-	ARG	V	30
R	H	ILE	A	78	L	-	ILE	V	32
R	H	ASN	A	81	L	-	ILE	V	32
R	H	ASN	A	81	L	-	GLU	V	34
R	H	TYR	A	82	L	-	ARG	V	30
R	H	TYR	A	82	L	-	PHE	V	31
R	H	TYR	A	82	L	-	ILE	V	32
R	H	TYR	A	82	L	-	TRP	V	33
R	H	ARG	A	84	L	-	GLU	V	34
R	H	SER	A	85	L	-	TRP	V	33
R	H	SER	A	85	L	-	GLU	V	34

- 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

Q96A58_P11233.1 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	OH	TYR	A	36	L	H	HA	ASP	V	121
R	-	CA	LYS	A	47	L	-	HG2	ARG	V	30
R	-	C	LYS	A	47	L	-	HG2	ARG	V	30
R	-	CB	LYS	A	47	L	-	C	LYS	V	29
R	-	CB	LYS	A	47	L	-	O	LYS	V	29
R	-	CB	LYS	A	47	L	-	HB3	LYS	V	29
R	-	CB	LYS	A	47	L	-	HA	ARG	V	30
R	-	CB	LYS	A	47	L	-	HG2	ARG	V	30
R	-	O	LYS	A	47	L	-	HG2	ARG	V	30
R	-	CG	LYS	A	47	L	-	CB	LYS	V	29
R	-	CG	LYS	A	47	L	-	O	LYS	V	29
R	-	CG	LYS	A	47	L	-	HB2	LYS	V	29
R	-	CG	LYS	A	47	L	-	HB3	LYS	V	29
R	-	CD	LYS	A	47	L	-	CA	LYS	V	29
R	-	CD	LYS	A	47	L	-	C	LYS	V	29
R	-	CD	LYS	A	47	L	-	CB	LYS	V	29
R	-	CD	LYS	A	47	L	-	O	LYS	V	29
R	-	CD	LYS	A	47	L	-	CG	LYS	V	29
R	-	CD	LYS	A	47	L	-	HA	LYS	V	29
R	-	CD	LYS	A	47	L	-	HB2	LYS	V	29
R	-	CD	LYS	A	47	L	-	HB3	LYS	V	29
R	-	CD	LYS	A	47	L	-	HG3	LYS	V	29
R	-	CE	LYS	A	47	L	-	CB	LYS	V	29
R	-	CE	LYS	A	47	L	-	CG	LYS	V	29
R	-	CE	LYS	A	47	L	-	HB2	LYS	V	29
R	-	CE	LYS	A	47	L	-	HB3	LYS	V	29
R	-	CE	LYS	A	47	L	-	HG3	LYS	V	29
R	-	NZ	LYS	A	47	L	-	CA	LYS	V	29
R	-	NZ	LYS	A	47	L	-	CB	LYS	V	29
R	-	NZ	LYS	A	47	L	-	CG	LYS	V	29
R	-	NZ	LYS	A	47	L	-	CD	LYS	V	29
R	-	NZ	LYS	A	47	L	-	CE	LYS	V	29
R	-	NZ	LYS	A	47	L	-	HA	LYS	V	29
R	-	NZ	LYS	A	47	L	-	HB2	LYS	V	29
R	-	NZ	LYS	A	47	L	-	HB3	LYS	V	29
R	-	NZ	LYS	A	47	L	-	HG2	LYS	V	29
R	-	NZ	LYS	A	47	L	-	HG3	LYS	V	29
R	-	NZ	LYS	A	47	L	-	HD2	LYS	V	29
R	-	NZ	LYS	A	47	L	-	HD3	LYS	V	29
R	-	NZ	LYS	A	47	L	-	HE3	LYS	V	29
R	S	N	ALA	A	48	L	-	HA	ARG	V	30
R	S	N	ALA	A	48	L	-	HG2	ARG	V	30
R	S	CA	ALA	A	48	L	-	H	PHE	V	31
R	S	C	ALA	A	48	L	H	NH1	ARG	V	25
R	S	C	ALA	A	48	L	H	HH11	ARG	V	25
R	S	C	ALA	A	48	L	H	HH12	ARG	V	25
R	S	C	ALA	A	48	L	H	HH22	ARG	V	25
R	S	C	ALA	A	48	L	-	H	PHE	V	31
R	S	C	ALA	A	48	L	-	HB3	PHE	V	31
R	S	C	ALA	A	48	L	-	O	CYS	V	150
R	S	CB	ALA	A	48	L	-	HA	ARG	V	30
R	S	CB	ALA	A	48	L	-	HB3	ARG	V	30
R	S	CB	ALA	A	48	L	-	H	PHE	V	31
R	S	O	ALA	A	48	L	H	NH1	ARG	V	25
R	S	O	ALA	A	48	L	H	NH2	ARG	V	25
R	S	O	ALA	A	48	L	H	CZ	ARG	V	25
R	S	O	ALA	A	48	L	H	HH11	ARG	V	25
R	S	O	ALA	A	48	L	H	HH12	ARG	V	25
R	S	O	ALA	A	48	L	H	HH22	ARG	V	25
R	S	O	ALA	A	48	L	-	HA	ARG	V	30
R	S	O	ALA	A	48	L	-	N	PHE	V	31
R	S	O	ALA	A	48	L	-	CB	PHE	V	31
R	S	O	ALA	A	48	L	-	H	PHE	V	31
R	S	O	ALA	A	48	L	-	HB2	PHE	V	31
R	S	O	ALA	A	48	L	-	HB3	PHE	V	31
R	S	O	ALA	A	48	L	-	O	CYS	V	150
R	S	N	ASP	A	49	L	H	HH12	ARG	V	25
R	S	N	ASP	A	49	L	H	HH22	ARG	V	25
R	S	N	ASP	A	49	L	-	O	CYS	V	150
R	S	CA	ASP	A	49	L	H	NH1	ARG	V	25
R	S	CA	ASP	A	49	L	H	HH12	ARG	V	25
R	S	CA	ASP	A	49	L	H	HH22	ARG	V	25
R	S	CA	ASP	A	49	L	-	C	CYS	V	150
R	S	CA	ASP	A	49	L	-	O	CYS	V	150
R	S	CA	ASP	A	49	L	-	CA	THR	V	151
R	S	CA	ASP	A	49	L	-	O	THR	V	151
R	S	CA	ASP	A	49	L	-	HA	THR	V	151
R	S	C	ASP	A	49	L	-	C	CYS	V	150
R	S	C	ASP	A	49	L	-	O	CYS	V	150
R	S	C	ASP	A	49	L	-	SG	CYS	V	150
R	S	C	ASP	A	49	L	-	HA	THR	V	151
R	S	CB	ASP	A	49	L	H	HH12	ARG	V	25
R	S	CB	ASP	A	49	L	H	HH22	ARG	V	25
R	S	CB	ASP	A	49	L	-	O	CYS	V	150
R	S	CB	ASP	A	49	L	-	CA	THR	V	151
R	S	CB	ASP	A	49	L	-	C	THR	V	151
R	S	CB	ASP	A	49	L	-	CB	THR	V	151
R	S	CB	ASP	A	49	L	-	O	THR	V	151
R	S	CB	ASP	A	49	L	-	HA	THR	V	151
R	S	CB	ASP	A	49	L	-	HB	THR	V	151
R	S	CB	ASP	A	49	L	-	HG23	THR	V	151
R	S	CG	ASP	A	49	L	H	NH1	ARG	V	25
R	S	CG	ASP	A	49	L	H	NH2	ARG	V	25
R	S	CG	ASP	A	49	L	H	CZ	ARG	V	25
R	S	CG	ASP	A	49	L	H	HH12	ARG	V	25
R	S	CG	ASP	A	49	L	H	HH21	ARG	V	25
R	S	CG	ASP	A	49	L	H	HH22	ARG	V	25
R	S	CG	ASP	A	49	L	-	O	CYS	V	150
R	S	CG	ASP	A	49	L	-	CA	THR	V	151
R	S	CG	ASP	A	49	L	-	C	THR	V	151
R	S	CG	ASP	A	49	L	-	O	THR	V	151
R	S	CG	ASP	A	49	L	-	HA	THR	V	151
R	S	CG	ASP	A	49	L	-	HB	THR	V	151
R	S	CG	ASP	A	49	L	-	N	GLY	V	152
R	S	OD1	ASP	A	49	L	H	NH1	ARG	V	25
R	S	OD1	ASP	A	49	L	H	NH2	ARG	V	25
R	S	OD1	ASP	A	49	L	H	CZ	ARG	V	25
R	S	OD1	ASP	A	49	L	H	HH11	ARG	V	25
R	S	OD1	ASP	A	49	L	H	HH12	ARG	V	25
R	S	OD1	ASP	A	49	L	H	HH21	ARG	V	25
R	S	OD1	ASP	A	49	L	H	HH22	ARG	V	25
R	S	OD1	ASP	A	49	L	-	C	CYS	V	150
R	S	OD1	ASP	A	49	L	-	O	CYS	V	150
R	S	OD1	ASP	A	49	L	-	N	THR	V	151
R	S	OD1	ASP	A	49	L	-	CA	THR	V	151
R	S	OD1	ASP	A	49	L	-	C	THR	V	151
R	S	OD1	ASP	A	49	L	-	CB	THR	V	151
R	S	OD1	ASP	A	49	L	-	O	THR	V	151
R	S	OD1	ASP	A	49	L	-	HA	THR	V	151
R	S	OD1	ASP	A	49	L	-	HB	THR	V	151
R	S	OD1	ASP	A	49	L	-	N	GLY	V	152
R	S	OD1	ASP	A	49	L	-	CA	GLY	V	152
R	S	OD1	ASP	A	49	L	-	H	GLY	V	152
R	S	OD1	ASP	A	49	L	-	HA3	GLY	V	152
R	S	OD2	ASP	A	49	L	H	NH2	ARG	V	25
R	S	OD2	ASP	A	49	L	H	HH12	ARG	V	25
R	S	OD2	ASP	A	49	L	H	HH21	ARG	V	25
R	S	OD2	ASP	A	49	L	H	HH22	ARG	V	25
R	S	OD2	ASP	A	49	L	-	C	THR	V	151
R	S	OD2	ASP	A	49	L	-	O	THR	V	151
R	S	OD2	ASP	A	49	L	-	HA	THR	V	151
R	S	N	SER	A	50	L	-	CA	CYS	V	150
R	S	N	SER	A	50	L	-	C	CYS	V	150
R	S	N	SER	A	50	L	-	CB	CYS	V	150
R	S	N	SER	A	50	L	-	O	CYS	V	150
R	S	N	SER	A	50	L	-	SG	CYS	V	150
R	S	N	SER	A	50	L	-	HA	CYS	V	150
R	S	N	SER	A	50	L	-	HG	CYS	V	150
R	S	N	SER	A	50	L	-	N	THR	V	151
R	S	N	SER	A	50	L	-	CA	THR	V	151
R	S	N	SER	A	50	L	-	HA	THR	V	151
R	S	N	SER	A	50	L	-	HG23	THR	V	151
R	S	CA	SER	A	50	L	-	HZ2	TRP	V	33
R	S	CA	SER	A	50	L	-	C	CYS	V	150
R	S	CA	SER	A	50	L	-	CB	CYS	V	150
R	S	CA	SER	A	50	L	-	O	CYS	V	150
R	S	CA	SER	A	50	L	-	SG	CYS	V	150
R	S	CA	SER	A	50	L	-	HG	CYS	V	150
R	S	CA	SER	A	50	L	-	HG23	THR	V	151
R	S	C	SER	A	50	L	-	CB	CYS	V	150
R	S	C	SER	A	50	L	-	SG	CYS	V	150
R	S	C	SER	A	50	L	-	HB3	CYS	V	150
R	S	C	SER	A	50	L	-	HG	CYS	V	150
R	S	C	SER	A	50	L	-	CG2	THR	V	151
R	S	C	SER	A	50	L	-	HG22	THR	V	151
R	S	C	SER	A	50	L	-	HG23	THR	V	151
R	S	CB	SER	A	50	L	-	CD1	PHE	V	31
R	S	CB	SER	A	50	L	-	CE1	PHE	V	31
R	S	CB	SER	A	50	L	-	HD1	PHE	V	31
R	S	CB	SER	A	50	L	-	HE1	PHE	V	31
R	S	CB	SER	A	50	L	-	CE2	TRP	V	33
R	S	CB	SER	A	50	L	-	CH2	TRP	V	33
R	S	CB	SER	A	50	L	-	CZ2	TRP	V	33
R	S	CB	SER	A	50	L	-	HH2	TRP	V	33
R	S	CB	SER	A	50	L	-	HZ2	TRP	V	33
R	S	CB	SER	A	50	L	-	CA	CYS	V	150
R	S	CB	SER	A	50	L	-	CB	CYS	V	150
R	S	CB	SER	A	50	L	-	SG	CYS	V	150
R	S	CB	SER	A	50	L	-	HA	CYS	V	150
R	S	CB	SER	A	50	L	-	HB2	CYS	V	150
R	S	CB	SER	A	50	L	-	HB3	CYS	V	150
R	S	CB	SER	A	50	L	-	HG	CYS	V	150
R	S	O	SER	A	50	L	H	CG	ASP	V	121
R	S	O	SER	A	50	L	H	OD2	ASP	V	121
R	S	O	SER	A	50	L	H	HB3	ASP	V	121
R	S	O	SER	A	50	L	-	C	CYS	V	150
R	S	O	SER	A	50	L	-	CB	CYS	V	150
R	S	O	SER	A	50	L	-	SG	CYS	V	150
R	S	O	SER	A	50	L	-	HB3	CYS	V	150
R	S	O	SER	A	50	L	-	HG	CYS	V	150
R	S	O	SER	A	50	L	-	N	THR	V	151
R	S	O	SER	A	50	L	-	CB	THR	V	151
R	S	O	SER	A	50	L	-	CG2	THR	V	151
R	S	O	SER	A	50	L	-	H	THR	V	151
R	S	O	SER	A	50	L	-	HA	THR	V	151
R	S	O	SER	A	50	L	-	HG21	THR	V	151
R	S	O	SER	A	50	L	-	HG22	THR	V	151
R	S	O	SER	A	50	L	-	HG23	THR	V	151
R	S	OG	SER	A	50	L	-	HE1	PHE	V	31
R	S	OG	SER	A	50	L	-	CE2	TRP	V	33
R	S	OG	SER	A	50	L	-	CH2	TRP	V	33
R	S	OG	SER	A	50	L	-	CZ2	TRP	V	33
R	S	OG	SER	A	50	L	-	CZ3	TRP	V	33
R	S	OG	SER	A	50	L	-	HH2	TRP	V	33
R	S	OG	SER	A	50	L	-	HZ2	TRP	V	33
R	S	OG	SER	A	50	L	-	CB	CYS	V	150
R	S	OG	SER	A	50	L	-	SG	CYS	V	150
R	S	OG	SER	A	50	L	-	HB2	CYS	V	150
R	S	OG	SER	A	50	L	-	HG	CYS	V	150
R	S	N	TYR	A	51	L	-	SG	CYS	V	150
R	S	N	TYR	A	51	L	-	HG	CYS	V	150
R	S	N	TYR	A	51	L	-	HG23	THR	V	151
R	S	CA	TYR	A	51	L	H	HB3	ASP	V	121
R	S	CA	TYR	A	51	L	-	HG23	THR	V	151
R	S	CB	TYR	A	51	L	-	HG23	THR	V	151
R	S	CG	TYR	A	51	L	-	CG2	THR	V	151
R	S	CG	TYR	A	51	L	-	HG21	THR	V	151
R	S	CG	TYR	A	51	L	-	HG23	THR	V	151
R	S	CD1	TYR	A	51	L	-	CG2	THR	V	151
R	S	CD1	TYR	A	51	L	-	HB	THR	V	151
R	S	CD1	TYR	A	51	L	-	HG21	THR	V	151
R	S	CD1	TYR	A	51	L	-	HG23	THR	V	151
R	S	CD2	TYR	A	51	L	-	HG23	THR	V	151
R	S	CE1	TYR	A	51	L	-	CB	THR	V	151
R	S	CE1	TYR	A	51	L	-	CG2	THR	V	151
R	S	CE1	TYR	A	51	L	-	HB	THR	V	151
R	S	CE1	TYR	A	51	L	-	HG21	THR	V	151
R	S	CE1	TYR	A	51	L	-	HG23	THR	V	151
R	S	CE2	TYR	A	51	L	-	HG23	THR	V	151
R	S	OH	TYR	A	51	L	-	HB	THR	V	151
R	S	CZ	TYR	A	51	L	-	CG2	THR	V	151
R	S	CZ	TYR	A	51	L	-	HB	THR	V	151
R	S	CZ	TYR	A	51	L	-	HG23	THR	V	151
R	S	N	ARG	A	52	L	H	HB3	ASP	V	121
R	S	N	ARG	A	52	L	H	HD21	LEU	V	122
R	S	CA	ARG	A	52	L	H	CD2	LEU	V	122
R	S	CA	ARG	A	52	L	H	HD21	LEU	V	122
R	S	CA	ARG	A	52	L	H	HD23	LEU	V	122
R	S	CA	ARG	A	52	L	H	HE1	HIS	V	124
R	S	C	ARG	A	52	L	H	HD21	LEU	V	122
R	S	C	ARG	A	52	L	H	CE1	HIS	V	124
R	S	C	ARG	A	52	L	H	HE1	HIS	V	124
R	S	CB	ARG	A	52	L	H	CD2	LEU	V	122
R	S	CB	ARG	A	52	L	H	HD21	LEU	V	122
R	S	CB	ARG	A	52	L	H	HD22	LEU	V	122
R	S	CB	ARG	A	52	L	H	HD23	LEU	V	122
R	S	CB	ARG	A	52	L	H	HE1	HIS	V	124
R	S	O	ARG	A	52	L	H	O	ASP	V	121
R	S	O	ARG	A	52	L	H	HA	LEU	V	122
R	S	O	ARG	A	52	L	H	HD21	LEU	V	122
R	S	O	ARG	A	52	L	H	ND1	HIS	V	124
R	S	O	ARG	A	52	L	H	CE1	HIS	V	124
R	S	O	ARG	A	52	L	H	HE1	HIS	V	124
R	S	CG	ARG	A	52	L	H	CD2	LEU	V	122
R	S	CG	ARG	A	52	L	H	HD21	LEU	V	122
R	S	CG	ARG	A	52	L	H	HD22	LEU	V	122
R	S	CG	ARG	A	52	L	H	HD23	LEU	V	122
R	S	CD	ARG	A	52	L	H	CD2	LEU	V	122
R	S	CD	ARG	A	52	L	H	HD13	LEU	V	122
R	S	CD	ARG	A	52	L	H	HD21	LEU	V	122
R	S	CD	ARG	A	52	L	H	HD22	LEU	V	122
R	S	CD	ARG	A	52	L	H	HD23	LEU	V	122
R	S	NE	ARG	A	52	L	-	HH2	TRP	V	33
R	S	NE	ARG	A	52	L	-	HZ3	TRP	V	33
R	S	NE	ARG	A	52	L	H	HD23	LEU	V	122
R	S	NH1	ARG	A	52	L	-	HZ3	TRP	V	33
R	S	NH1	ARG	A	52	L	H	HD13	LEU	V	122
R	S	NH1	ARG	A	52	L	H	HD23	LEU	V	122
R	S	NH2	ARG	A	52	L	-	CE3	TRP	V	33
R	S	NH2	ARG	A	52	L	-	CH2	TRP	V	33
R	S	NH2	ARG	A	52	L	-	CZ3	TRP	V	33
R	S	NH2	ARG	A	52	L	-	HH2	TRP	V	33
R	S	NH2	ARG	A	52	L	-	HZ3	TRP	V	33
R	S	CZ	ARG	A	52	L	-	CZ3	TRP	V	33
R	S	CZ	ARG	A	52	L	-	HH2	TRP	V	33
R	S	CZ	ARG	A	52	L	-	HZ3	TRP	V	33
R	S	CZ	ARG	A	52	L	H	HD13	LEU	V	122
R	S	N	LYS	A	53	L	H	HE1	HIS	V	124
R	S	CA	LYS	A	53	L	H	CE1	HIS	V	124
R	S	CA	LYS	A	53	L	H	HE1	HIS	V	124
R	S	N	LYS	A	54	L	H	CD2	HIS	V	124
R	S	N	LYS	A	54	L	H	NE2	HIS	V	124
R	S	CB	LYS	A	54	L	H	CD2	HIS	V	124
R	S	CB	LYS	A	54	L	H	HD2	HIS	V	124
R	S	CG	LYS	A	54	L	H	CD2	HIS	V	124
R	S	CG	LYS	A	54	L	H	NE2	HIS	V	124
R	S	CG	LYS	A	54	L	H	HD2	HIS	V	124
R	S	CG	LYS	A	54	L	H	HE2	HIS	V	124
R	S	CD	LYS	A	54	L	H	CD2	HIS	V	124
R	S	CD	LYS	A	54	L	H	HD2	HIS	V	124
R	S	CE	LYS	A	54	L	H	CD2	HIS	V	124
R	S	CE	LYS	A	54	L	H	HD2	HIS	V	124
R	S	CE	LYS	A	54	L	H	HE2	HIS	V	124
R	S	CE	LYS	A	54	L	H	OG	SER	V	125
R	S	CE	LYS	A	54	L	H	HG	SER	V	125
R	S	NZ	LYS	A	54	L	H	HD2	HIS	V	124
R	S	CG	GLN	A	63	L	H	HE2	HIS	V	124
R	S	CD	GLN	A	63	L	H	HE2	HIS	V	124
R	S	OE1	GLN	A	63	L	H	HE2	HIS	V	124
R	S	CB	ASP	A	65	L	-	HH2	TRP	V	33
R	S	CG	ASP	A	65	L	-	CH2	TRP	V	33
R	S	CG	ASP	A	65	L	-	CZ2	TRP	V	33
R	S	CG	ASP	A	65	L	-	CZ3	TRP	V	33
R	S	CG	ASP	A	65	L	-	HH2	TRP	V	33
R	S	CG	ASP	A	65	L	-	HZ2	TRP	V	33
R	S	CG	ASP	A	65	L	-	HZ3	TRP	V	33
R	S	OD1	ASP	A	65	L	-	CH2	TRP	V	33
R	S	OD1	ASP	A	65	L	-	CZ2	TRP	V	33
R	S	OD1	ASP	A	65	L	-	CZ3	TRP	V	33
R	S	OD1	ASP	A	65	L	-	HH2	TRP	V	33
R	S	OD1	ASP	A	65	L	-	HZ2	TRP	V	33
R	S	OD1	ASP	A	65	L	-	HG	CYS	V	150
R	S	OD2	ASP	A	65	L	-	CE3	TRP	V	33
R	S	OD2	ASP	A	65	L	-	CH2	TRP	V	33
R	S	OD2	ASP	A	65	L	-	CZ2	TRP	V	33
R	S	OD2	ASP	A	65	L	-	CZ3	TRP	V	33
R	S	OD2	ASP	A	65	L	-	HH2	TRP	V	33
R	S	OD2	ASP	A	65	L	-	HZ2	TRP	V	33
R	S	OD2	ASP	A	65	L	-	HZ3	TRP	V	33
R	S	O	ILE	A	66	L	-	HZ2	TRP	V	33
R	S	N	LEU	A	67	L	-	HZ2	TRP	V	33
R	S	CA	LEU	A	67	L	-	HZ2	TRP	V	33
R	S	CA	LEU	A	67	L	-	HE1	TRP	V	33
R	S	CB	LEU	A	67	L	-	NE1	TRP	V	33
R	S	CB	LEU	A	67	L	-	HZ2	TRP	V	33
R	S	CB	LEU	A	67	L	-	HE1	TRP	V	33
R	S	CG	LEU	A	67	L	-	NE1	TRP	V	33
R	S	CG	LEU	A	67	L	-	HE1	TRP	V	33
R	S	CD1	LEU	A	67	L	-	HD1	PHE	V	31
R	S	CD1	LEU	A	67	L	-	CD1	TRP	V	33
R	S	CD1	LEU	A	67	L	-	CE2	TRP	V	33
R	S	CD1	LEU	A	67	L	-	NE1	TRP	V	33
R	S	CD1	LEU	A	67	L	-	CZ2	TRP	V	33
R	S	CD1	LEU	A	67	L	-	HZ2	TRP	V	33
R	S	CD1	LEU	A	67	L	-	HE1	TRP	V	33
R	S	CD2	LEU	A	67	L	-	CD1	TRP	V	33
R	S	CD2	LEU	A	67	L	-	NE1	TRP	V	33
R	S	CD2	LEU	A	67	L	-	HD1	TRP	V	33
R	S	CD2	LEU	A	67	L	-	HE1	TRP	V	33
R	-	CA	GLU	A	73	L	-	NH2	ARG	V	30
R	-	CA	GLU	A	73	L	-	HH12	ARG	V	30
R	-	CA	GLU	A	73	L	-	HH22	ARG	V	30
R	-	C	GLU	A	73	L	-	HH22	ARG	V	30
R	-	CB	GLU	A	73	L	-	NH1	ARG	V	30
R	-	CB	GLU	A	73	L	-	NH2	ARG	V	30
R	-	CB	GLU	A	73	L	-	CZ	ARG	V	30
R	-	CB	GLU	A	73	L	-	HH12	ARG	V	30
R	-	CB	GLU	A	73	L	-	HH21	ARG	V	30
R	-	CB	GLU	A	73	L	-	HH22	ARG	V	30
R	-	OE2	GLU	A	73	L	-	CD	ARG	V	30
R	-	OE2	GLU	A	73	L	-	NE	ARG	V	30
R	-	OE2	GLU	A	73	L	-	NH1	ARG	V	30
R	-	OE2	GLU	A	73	L	-	CZ	ARG	V	30
R	-	OE2	GLU	A	73	L	-	HD2	ARG	V	30
R	-	OE2	GLU	A	73	L	-	HH11	ARG	V	30
R	-	OE2	GLU	A	73	L	-	HH12	ARG	V	30
R	-	N	ASP	A	74	L	-	HH22	ARG	V	30
R	-	N	TYR	A	75	L	-	HH12	ARG	V	30
R	-	N	TYR	A	75	L	-	HH22	ARG	V	30
R	-	CA	TYR	A	75	L	-	HH12	ARG	V	30
R	-	CB	TYR	A	75	L	-	NH1	ARG	V	30
R	-	CB	TYR	A	75	L	-	HH11	ARG	V	30
R	-	CB	TYR	A	75	L	-	HH12	ARG	V	30
R	-	O	TYR	A	75	L	-	HH12	ARG	V	30
R	-	CG	TYR	A	75	L	-	NH1	ARG	V	30
R	-	CG	TYR	A	75	L	-	HH12	ARG	V	30
R	-	CG	TYR	A	75	L	-	HH22	ARG	V	30
R	-	CD2	TYR	A	75	L	-	NH1	ARG	V	30
R	-	CD2	TYR	A	75	L	-	NH2	ARG	V	30
R	-	CD2	TYR	A	75	L	-	CZ	ARG	V	30
R	-	CD2	TYR	A	75	L	-	HH11	ARG	V	30
R	-	CD2	TYR	A	75	L	-	HH12	ARG	V	30
R	-	CD2	TYR	A	75	L	-	HH21	ARG	V	30
R	-	CD2	TYR	A	75	L	-	HH22	ARG	V	30
R	-	CE2	TYR	A	75	L	-	NH2	ARG	V	30
R	-	CE2	TYR	A	75	L	-	HH12	ARG	V	30
R	-	CE2	TYR	A	75	L	-	HH22	ARG	V	30
R	H	CB	ILE	A	78	L	-	NH1	ARG	V	30
R	H	CB	ILE	A	78	L	-	HH11	ARG	V	30
R	H	CB	ILE	A	78	L	-	HH12	ARG	V	30
R	H	CG1	ILE	A	78	L	-	HH11	ARG	V	30
R	H	CG2	ILE	A	78	L	-	NH1	ARG	V	30
R	H	CG2	ILE	A	78	L	-	HD2	ARG	V	30
R	H	CG2	ILE	A	78	L	-	HH11	ARG	V	30
R	H	CG2	ILE	A	78	L	-	HG12	ILE	V	32
R	H	CD1	ILE	A	78	L	-	CD	ARG	V	30
R	H	CD1	ILE	A	78	L	-	NH1	ARG	V	30
R	H	CD1	ILE	A	78	L	-	HD2	ARG	V	30
R	H	CD1	ILE	A	78	L	-	HD3	ARG	V	30
R	H	CD1	ILE	A	78	L	-	HH11	ARG	V	30
R	H	CD1	ILE	A	78	L	-	HH12	ARG	V	30
R	H	CB	ASN	A	81	L	-	HG22	ILE	V	32
R	H	O	ASN	A	81	L	-	OE1	GLU	V	34
R	H	OD1	ASN	A	81	L	-	OE2	GLU	V	34
R	H	CA	TYR	A	82	L	-	HD1	TRP	V	33
R	H	CG	TYR	A	82	L	-	HD1	TRP	V	33
R	H	CD1	TYR	A	82	L	-	HA	ILE	V	32
R	H	CD1	TYR	A	82	L	-	H	TRP	V	33
R	H	CD1	TYR	A	82	L	-	HD1	TRP	V	33
R	H	CE1	TYR	A	82	L	-	C	PHE	V	31
R	H	CE1	TYR	A	82	L	-	O	PHE	V	31
R	H	CE1	TYR	A	82	L	-	CA	ILE	V	32
R	H	CE1	TYR	A	82	L	-	HA	ILE	V	32
R	H	CE1	TYR	A	82	L	-	HG12	ILE	V	32
R	H	CE1	TYR	A	82	L	-	H	TRP	V	33
R	H	CE1	TYR	A	82	L	-	HD1	TRP	V	33
R	H	OH	TYR	A	82	L	-	CB	ARG	V	30
R	H	OH	TYR	A	82	L	-	HB3	ARG	V	30
R	H	OH	TYR	A	82	L	-	HD2	ARG	V	30
R	H	OH	TYR	A	82	L	-	C	PHE	V	31
R	H	OH	TYR	A	82	L	-	O	PHE	V	31
R	H	OH	TYR	A	82	L	-	H	PHE	V	31
R	H	OH	TYR	A	82	L	-	HA	ILE	V	32
R	H	OH	TYR	A	82	L	-	HG12	ILE	V	32
R	H	CZ	TYR	A	82	L	-	HB3	ARG	V	30
R	H	CZ	TYR	A	82	L	-	O	PHE	V	31
R	H	CZ	TYR	A	82	L	-	HA	ILE	V	32
R	H	CZ	TYR	A	82	L	-	HG12	ILE	V	32
R	H	CB	ARG	A	84	L	-	OE1	GLU	V	34
R	H	CG	ARG	A	84	L	-	OE1	GLU	V	34
R	H	CD	ARG	A	84	L	-	OE1	GLU	V	34
R	H	NH1	ARG	A	84	L	-	OE2	GLU	V	34
R	H	CB	SER	A	85	L	-	HB2	TRP	V	33
R	H	CB	SER	A	85	L	-	HB3	TRP	V	33
R	H	CB	SER	A	85	L	-	HG3	GLU	V	34
R	H	OG	SER	A	85	L	-	CB	TRP	V	33
R	H	OG	SER	A	85	L	-	CG	TRP	V	33
R	H	OG	SER	A	85	L	-	CD1	TRP	V	33
R	H	OG	SER	A	85	L	-	HB2	TRP	V	33
R	H	OG	SER	A	85	L	-	HB3	TRP	V	33
R	H	OG	SER	A	85	L	-	HD1	TRP	V	33

- 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