IID

Q8N729_P46782.1 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	-	MET	A	1	L	-	THR	V	44
R	-	MET	A	1	L	H	ARG	V	47
R	-	MET	A	1	L	H	ALA	V	48
R	-	ALA	A	10	L	H	ALA	V	69
R	-	ALA	A	10	L	-	PRO	V	92
R	-	VAL	A	11	L	-	PRO	V	92
R	-	VAL	A	11	L	H	TRP	V	94
R	-	ALA	A	12	L	H	ALA	V	69
R	-	ALA	A	12	L	-	GLY	V	71
R	-	ALA	A	12	L	-	LEU	V	73
R	-	GLU	A	13	L	-	LEU	V	73
R	-	PRO	A	15	L	-	LEU	V	73
R	-	PRO	A	15	L	-	ASP	V	76
R	-	PRO	A	15	L	-	THR	V	77
R	-	LYS	A	18	L	-	SER	V	79
R	-	LYS	A	18	L	-	GLU	V	81
R	-	LYS	A	18	L	-	PRO	V	82
R	-	THR	A	2	L	H	ALA	V	48
R	-	THR	A	2	L	H	LEU	V	51
R	-	THR	A	2	L	H	LEU	V	52
R	H	PHE	A	20	L	-	SER	V	79
R	H	GLY	A	21	L	-	SER	V	79
R	H	GLY	A	21	L	-	PRO	V	80
R	H	GLY	A	21	L	-	GLU	V	81
R	-	LYS	A	22	L	-	SER	V	79
R	-	LYS	A	22	L	-	GLU	V	81
R	-	GLU	A	3	L	H	ARG	V	102
R	-	TRP	A	4	L	H	ARG	V	102
R	-	TRP	A	4	L	H	LEU	V	51
R	-	TRP	A	4	L	H	LEU	V	55
R	-	TYR	A	48	L	-	ASP	V	76
R	-	TYR	A	48	L	-	THR	V	77
R	-	TYR	A	48	L	-	SER	V	79
R	-	GLU	A	5	L	H	ARG	V	102
R	-	GLU	A	5	L	H	TRP	V	99
R	-	THR	A	6	L	H	ARG	V	102
R	-	THR	A	6	L	H	LEU	V	98
R	-	ALA	A	7	L	H	VAL	V	95
R	-	ALA	A	7	L	H	LEU	V	98
R	-	ALA	A	8	L	H	TRP	V	94
R	-	ALA	A	8	L	H	VAL	V	95
R	-	ALA	A	8	L	H	LEU	V	98
R	-	PRO	A	9	L	H	ALA	V	65
R	-	PRO	A	9	L	H	ALA	V	69
R	-	PRO	A	9	L	-	PRO	V	92
R	-	PRO	A	9	L	H	TRP	V	94
R	-	PRO	A	9	L	H	VAL	V	95
R	-	PRO	A	9	L	H	LEU	V	98

- 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

Q8N729_P46782.1 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	MET	A	1	L	H	CB	ALA	V	48
R	-	N	MET	A	1	L	H	HB1	ALA	V	48
R	-	N	MET	A	1	L	H	HB2	ALA	V	48
R	-	N	MET	A	1	L	H	HB3	ALA	V	48
R	-	CA	MET	A	1	L	H	CA	ALA	V	48
R	-	CA	MET	A	1	L	H	CB	ALA	V	48
R	-	CA	MET	A	1	L	H	HA	ALA	V	48
R	-	CA	MET	A	1	L	H	HB1	ALA	V	48
R	-	CA	MET	A	1	L	H	HB2	ALA	V	48
R	-	CA	MET	A	1	L	H	HB3	ALA	V	48
R	-	C	MET	A	1	L	H	CB	ALA	V	48
R	-	C	MET	A	1	L	H	HB1	ALA	V	48
R	-	C	MET	A	1	L	H	HB2	ALA	V	48
R	-	CB	MET	A	1	L	H	CB	ALA	V	48
R	-	CB	MET	A	1	L	H	HA	ALA	V	48
R	-	CB	MET	A	1	L	H	HB1	ALA	V	48
R	-	CB	MET	A	1	L	H	HB2	ALA	V	48
R	-	CG	MET	A	1	L	-	O	THR	V	44
R	-	CG	MET	A	1	L	H	CB	ALA	V	48
R	-	CG	MET	A	1	L	H	H	ALA	V	48
R	-	CG	MET	A	1	L	H	HA	ALA	V	48
R	-	CG	MET	A	1	L	H	HB1	ALA	V	48
R	-	CG	MET	A	1	L	H	HB2	ALA	V	48
R	-	SD	MET	A	1	L	-	HB	THR	V	44
R	-	SD	MET	A	1	L	-	HG23	THR	V	44
R	-	CE	MET	A	1	L	-	CA	THR	V	44
R	-	CE	MET	A	1	L	-	C	THR	V	44
R	-	CE	MET	A	1	L	-	CB	THR	V	44
R	-	CE	MET	A	1	L	-	O	THR	V	44
R	-	CE	MET	A	1	L	-	CG2	THR	V	44
R	-	CE	MET	A	1	L	-	HA	THR	V	44
R	-	CE	MET	A	1	L	-	HB	THR	V	44
R	-	CE	MET	A	1	L	-	HG21	THR	V	44
R	-	CE	MET	A	1	L	-	HG23	THR	V	44
R	-	CE	MET	A	1	L	H	HB3	ARG	V	47
R	-	N	THR	A	2	L	H	HA	ALA	V	48
R	-	N	THR	A	2	L	H	HB1	ALA	V	48
R	-	CB	THR	A	2	L	H	HB2	LEU	V	52
R	-	CB	THR	A	2	L	H	HD12	LEU	V	52
R	-	O	THR	A	2	L	H	HB2	LEU	V	51
R	-	O	THR	A	2	L	H	HB3	LEU	V	51
R	-	O	THR	A	2	L	H	HD11	LEU	V	51
R	-	O	THR	A	2	L	H	HD13	LEU	V	51
R	-	CG2	THR	A	2	L	H	HD12	LEU	V	52
R	-	OG1	THR	A	2	L	H	O	ALA	V	48
R	-	OG1	THR	A	2	L	H	HB2	LEU	V	51
R	-	OG1	THR	A	2	L	H	CB	LEU	V	52
R	-	OG1	THR	A	2	L	H	H	LEU	V	52
R	-	OG1	THR	A	2	L	H	HA	LEU	V	52
R	-	OG1	THR	A	2	L	H	HB2	LEU	V	52
R	-	OG1	THR	A	2	L	H	HD12	LEU	V	52
R	-	OG1	THR	A	2	L	H	HD23	LEU	V	52
R	-	CA	GLU	A	3	L	H	NH1	ARG	V	102
R	-	CA	GLU	A	3	L	H	HH12	ARG	V	102
R	-	CA	GLU	A	3	L	H	HH22	ARG	V	102
R	-	C	GLU	A	3	L	H	NH1	ARG	V	102
R	-	C	GLU	A	3	L	H	NH2	ARG	V	102
R	-	C	GLU	A	3	L	H	HH12	ARG	V	102
R	-	C	GLU	A	3	L	H	HH22	ARG	V	102
R	-	CB	GLU	A	3	L	H	NH1	ARG	V	102
R	-	CB	GLU	A	3	L	H	HH11	ARG	V	102
R	-	CB	GLU	A	3	L	H	HH12	ARG	V	102
R	-	CB	GLU	A	3	L	H	HH22	ARG	V	102
R	-	O	GLU	A	3	L	H	HH12	ARG	V	102
R	-	O	GLU	A	3	L	H	HH22	ARG	V	102
R	-	CG	GLU	A	3	L	H	NH1	ARG	V	102
R	-	CG	GLU	A	3	L	H	HH11	ARG	V	102
R	-	CG	GLU	A	3	L	H	HH12	ARG	V	102
R	-	CD	GLU	A	3	L	H	NH1	ARG	V	102
R	-	CD	GLU	A	3	L	H	HH11	ARG	V	102
R	-	CD	GLU	A	3	L	H	HH12	ARG	V	102
R	-	OE1	GLU	A	3	L	H	HH11	ARG	V	102
R	-	OE1	GLU	A	3	L	H	HH12	ARG	V	102
R	-	OE2	GLU	A	3	L	H	NH1	ARG	V	102
R	-	OE2	GLU	A	3	L	H	HH11	ARG	V	102
R	-	OE2	GLU	A	3	L	H	HH12	ARG	V	102
R	-	N	TRP	A	4	L	H	NH2	ARG	V	102
R	-	N	TRP	A	4	L	H	HH12	ARG	V	102
R	-	N	TRP	A	4	L	H	HH21	ARG	V	102
R	-	N	TRP	A	4	L	H	HH22	ARG	V	102
R	-	CA	TRP	A	4	L	H	HD13	LEU	V	55
R	-	CA	TRP	A	4	L	H	NH2	ARG	V	102
R	-	CA	TRP	A	4	L	H	HH21	ARG	V	102
R	-	CA	TRP	A	4	L	H	HH22	ARG	V	102
R	-	C	TRP	A	4	L	H	NH1	ARG	V	102
R	-	C	TRP	A	4	L	H	NH2	ARG	V	102
R	-	C	TRP	A	4	L	H	CZ	ARG	V	102
R	-	C	TRP	A	4	L	H	HH12	ARG	V	102
R	-	C	TRP	A	4	L	H	HH21	ARG	V	102
R	-	C	TRP	A	4	L	H	HH22	ARG	V	102
R	-	CB	TRP	A	4	L	H	CD1	LEU	V	55
R	-	CB	TRP	A	4	L	H	HD12	LEU	V	55
R	-	CB	TRP	A	4	L	H	HD13	LEU	V	55
R	-	CB	TRP	A	4	L	H	NH2	ARG	V	102
R	-	CB	TRP	A	4	L	H	HH21	ARG	V	102
R	-	CB	TRP	A	4	L	H	HH22	ARG	V	102
R	-	O	TRP	A	4	L	H	NE	ARG	V	102
R	-	O	TRP	A	4	L	H	NH1	ARG	V	102
R	-	O	TRP	A	4	L	H	NH2	ARG	V	102
R	-	O	TRP	A	4	L	H	CZ	ARG	V	102
R	-	O	TRP	A	4	L	H	HE	ARG	V	102
R	-	O	TRP	A	4	L	H	HH12	ARG	V	102
R	-	O	TRP	A	4	L	H	HH21	ARG	V	102
R	-	O	TRP	A	4	L	H	HH22	ARG	V	102
R	-	CG	TRP	A	4	L	H	HD13	LEU	V	55
R	-	CG	TRP	A	4	L	H	NH2	ARG	V	102
R	-	CG	TRP	A	4	L	H	HH21	ARG	V	102
R	-	CG	TRP	A	4	L	H	HH22	ARG	V	102
R	-	CD1	TRP	A	4	L	H	HD13	LEU	V	51
R	-	CD1	TRP	A	4	L	H	HD22	LEU	V	51
R	-	CD1	TRP	A	4	L	H	HH22	ARG	V	102
R	-	CD2	TRP	A	4	L	H	NH2	ARG	V	102
R	-	CD2	TRP	A	4	L	H	HH21	ARG	V	102
R	-	CD2	TRP	A	4	L	H	HH22	ARG	V	102
R	-	CE2	TRP	A	4	L	H	HH21	ARG	V	102
R	-	CE2	TRP	A	4	L	H	HH22	ARG	V	102
R	-	CE3	TRP	A	4	L	H	NH2	ARG	V	102
R	-	CE3	TRP	A	4	L	H	HH21	ARG	V	102
R	-	CE3	TRP	A	4	L	H	HH22	ARG	V	102
R	-	NE1	TRP	A	4	L	H	HD22	LEU	V	51
R	-	NE1	TRP	A	4	L	H	HH22	ARG	V	102
R	-	CZ3	TRP	A	4	L	H	HH21	ARG	V	102
R	-	N	GLU	A	5	L	H	NH2	ARG	V	102
R	-	N	GLU	A	5	L	H	CZ	ARG	V	102
R	-	N	GLU	A	5	L	H	HH21	ARG	V	102
R	-	N	GLU	A	5	L	H	HH22	ARG	V	102
R	-	CA	GLU	A	5	L	H	NE	ARG	V	102
R	-	CA	GLU	A	5	L	H	NH2	ARG	V	102
R	-	CA	GLU	A	5	L	H	CZ	ARG	V	102
R	-	CA	GLU	A	5	L	H	HE	ARG	V	102
R	-	CA	GLU	A	5	L	H	HH21	ARG	V	102
R	-	CA	GLU	A	5	L	H	HH22	ARG	V	102
R	-	C	GLU	A	5	L	H	HH21	ARG	V	102
R	-	CG	GLU	A	5	L	H	CZ3	TRP	V	99
R	-	CG	GLU	A	5	L	H	HZ3	TRP	V	99
R	-	CD	GLU	A	5	L	H	CZ3	TRP	V	99
R	-	CD	GLU	A	5	L	H	HH2	TRP	V	99
R	-	CD	GLU	A	5	L	H	HZ3	TRP	V	99
R	-	OE1	GLU	A	5	L	H	CE3	TRP	V	99
R	-	OE1	GLU	A	5	L	H	CH2	TRP	V	99
R	-	OE1	GLU	A	5	L	H	CZ3	TRP	V	99
R	-	OE1	GLU	A	5	L	H	HE3	TRP	V	99
R	-	OE1	GLU	A	5	L	H	HH2	TRP	V	99
R	-	OE1	GLU	A	5	L	H	HZ3	TRP	V	99
R	-	OE2	GLU	A	5	L	H	HZ3	TRP	V	99
R	-	N	THR	A	6	L	H	HE	ARG	V	102
R	-	N	THR	A	6	L	H	HH21	ARG	V	102
R	-	C	THR	A	6	L	H	HD12	LEU	V	98
R	-	CB	THR	A	6	L	H	CD2	LEU	V	98
R	-	CB	THR	A	6	L	H	HD12	LEU	V	98
R	-	CB	THR	A	6	L	H	HD23	LEU	V	98
R	-	O	THR	A	6	L	H	CD1	LEU	V	98
R	-	O	THR	A	6	L	H	HB3	LEU	V	98
R	-	O	THR	A	6	L	H	HD12	LEU	V	98
R	-	O	THR	A	6	L	H	HD23	LEU	V	98
R	-	CG2	THR	A	6	L	H	HD23	LEU	V	98
R	-	OG1	THR	A	6	L	H	CD2	LEU	V	98
R	-	OG1	THR	A	6	L	H	HB3	LEU	V	98
R	-	OG1	THR	A	6	L	H	HD23	LEU	V	98
R	-	OG1	THR	A	6	L	H	HE	ARG	V	102
R	-	OG1	THR	A	6	L	H	HH21	ARG	V	102
R	-	C	ALA	A	7	L	H	HG22	VAL	V	95
R	-	C	ALA	A	7	L	H	HD12	LEU	V	98
R	-	O	ALA	A	7	L	H	HD12	LEU	V	98
R	-	N	ALA	A	8	L	H	CG2	VAL	V	95
R	-	N	ALA	A	8	L	H	HA	VAL	V	95
R	-	N	ALA	A	8	L	H	HG11	VAL	V	95
R	-	N	ALA	A	8	L	H	HG22	VAL	V	95
R	-	N	ALA	A	8	L	H	CD1	LEU	V	98
R	-	N	ALA	A	8	L	H	HD11	LEU	V	98
R	-	N	ALA	A	8	L	H	HD12	LEU	V	98
R	-	CA	ALA	A	8	L	H	CD1	TRP	V	94
R	-	CA	ALA	A	8	L	H	HD1	TRP	V	94
R	-	CA	ALA	A	8	L	H	CG2	VAL	V	95
R	-	CA	ALA	A	8	L	H	HA	VAL	V	95
R	-	CA	ALA	A	8	L	H	HG11	VAL	V	95
R	-	CA	ALA	A	8	L	H	HG21	VAL	V	95
R	-	CA	ALA	A	8	L	H	HG22	VAL	V	95
R	-	CA	ALA	A	8	L	H	CD1	LEU	V	98
R	-	CA	ALA	A	8	L	H	HD11	LEU	V	98
R	-	CA	ALA	A	8	L	H	HD12	LEU	V	98
R	-	CA	ALA	A	8	L	H	HD13	LEU	V	98
R	-	C	ALA	A	8	L	H	HD1	TRP	V	94
R	-	C	ALA	A	8	L	H	CG2	VAL	V	95
R	-	C	ALA	A	8	L	H	HG21	VAL	V	95
R	-	C	ALA	A	8	L	H	HG22	VAL	V	95
R	-	C	ALA	A	8	L	H	HG23	VAL	V	95
R	-	C	ALA	A	8	L	H	HD11	LEU	V	98
R	-	CB	ALA	A	8	L	H	C	TRP	V	94
R	-	CB	ALA	A	8	L	H	O	TRP	V	94
R	-	CB	ALA	A	8	L	H	CD1	TRP	V	94
R	-	CB	ALA	A	8	L	H	HB3	TRP	V	94
R	-	CB	ALA	A	8	L	H	HD1	TRP	V	94
R	-	CB	ALA	A	8	L	H	N	VAL	V	95
R	-	CB	ALA	A	8	L	H	CA	VAL	V	95
R	-	CB	ALA	A	8	L	H	C	VAL	V	95
R	-	CB	ALA	A	8	L	H	CB	VAL	V	95
R	-	CB	ALA	A	8	L	H	CG1	VAL	V	95
R	-	CB	ALA	A	8	L	H	CG2	VAL	V	95
R	-	CB	ALA	A	8	L	H	H	VAL	V	95
R	-	CB	ALA	A	8	L	H	HA	VAL	V	95
R	-	CB	ALA	A	8	L	H	HB	VAL	V	95
R	-	CB	ALA	A	8	L	H	HG11	VAL	V	95
R	-	CB	ALA	A	8	L	H	HG21	VAL	V	95
R	-	CB	ALA	A	8	L	H	HG22	VAL	V	95
R	-	CB	ALA	A	8	L	H	HG23	VAL	V	95
R	-	CB	ALA	A	8	L	H	CD1	LEU	V	98
R	-	CB	ALA	A	8	L	H	HB2	LEU	V	98
R	-	CB	ALA	A	8	L	H	HD11	LEU	V	98
R	-	CB	ALA	A	8	L	H	HD12	LEU	V	98
R	-	CB	ALA	A	8	L	H	HD13	LEU	V	98
R	-	O	ALA	A	8	L	H	CG2	VAL	V	95
R	-	O	ALA	A	8	L	H	HG21	VAL	V	95
R	-	O	ALA	A	8	L	H	HG22	VAL	V	95
R	-	O	ALA	A	8	L	H	HG23	VAL	V	95
R	-	N	PRO	A	9	L	H	CD1	TRP	V	94
R	-	N	PRO	A	9	L	H	HD1	TRP	V	94
R	-	N	PRO	A	9	L	H	HG22	VAL	V	95
R	-	CA	PRO	A	9	L	H	CB	ALA	V	69
R	-	CA	PRO	A	9	L	H	HB3	ALA	V	69
R	-	CA	PRO	A	9	L	H	HD1	TRP	V	94
R	-	C	PRO	A	9	L	H	CB	ALA	V	69
R	-	C	PRO	A	9	L	H	HB1	ALA	V	69
R	-	C	PRO	A	9	L	H	HB3	ALA	V	69
R	-	C	PRO	A	9	L	H	HG21	VAL	V	95
R	-	CB	PRO	A	9	L	H	O	ALA	V	65
R	-	CB	PRO	A	9	L	H	HB1	ALA	V	65
R	-	CB	PRO	A	9	L	H	HB3	ALA	V	69
R	-	O	PRO	A	9	L	-	HB2	PRO	V	92
R	-	O	PRO	A	9	L	-	HG2	PRO	V	92
R	-	O	PRO	A	9	L	H	HB3	TRP	V	94
R	-	O	PRO	A	9	L	H	HD1	TRP	V	94
R	-	O	PRO	A	9	L	H	HG21	VAL	V	95
R	-	CG	PRO	A	9	L	H	CD1	TRP	V	94
R	-	CG	PRO	A	9	L	H	NE1	TRP	V	94
R	-	CG	PRO	A	9	L	H	HD1	TRP	V	94
R	-	CG	PRO	A	9	L	H	HE1	TRP	V	94
R	-	CD	PRO	A	9	L	H	CD1	TRP	V	94
R	-	CD	PRO	A	9	L	H	NE1	TRP	V	94
R	-	CD	PRO	A	9	L	H	HD1	TRP	V	94
R	-	CD	PRO	A	9	L	H	HE1	TRP	V	94
R	-	CD	PRO	A	9	L	H	HD13	LEU	V	98
R	-	N	ALA	A	10	L	H	CB	ALA	V	69
R	-	N	ALA	A	10	L	H	HA	ALA	V	69
R	-	N	ALA	A	10	L	H	HB1	ALA	V	69
R	-	N	ALA	A	10	L	H	HB2	ALA	V	69
R	-	N	ALA	A	10	L	H	HB3	ALA	V	69
R	-	N	ALA	A	10	L	-	HG2	PRO	V	92
R	-	N	ALA	A	10	L	-	HG3	PRO	V	92
R	-	CA	ALA	A	10	L	H	CB	ALA	V	69
R	-	CA	ALA	A	10	L	H	HA	ALA	V	69
R	-	CA	ALA	A	10	L	H	HB1	ALA	V	69
R	-	CA	ALA	A	10	L	H	HB3	ALA	V	69
R	-	CA	ALA	A	10	L	-	CG	PRO	V	92
R	-	CA	ALA	A	10	L	-	HG2	PRO	V	92
R	-	CA	ALA	A	10	L	-	HG3	PRO	V	92
R	-	C	ALA	A	10	L	H	CA	ALA	V	69
R	-	C	ALA	A	10	L	H	CB	ALA	V	69
R	-	C	ALA	A	10	L	H	HA	ALA	V	69
R	-	C	ALA	A	10	L	H	HB1	ALA	V	69
R	-	C	ALA	A	10	L	H	HB3	ALA	V	69
R	-	C	ALA	A	10	L	-	CG	PRO	V	92
R	-	C	ALA	A	10	L	-	HG3	PRO	V	92
R	-	CB	ALA	A	10	L	H	CB	ALA	V	69
R	-	CB	ALA	A	10	L	H	HB1	ALA	V	69
R	-	CB	ALA	A	10	L	H	HB3	ALA	V	69
R	-	CB	ALA	A	10	L	-	HG3	PRO	V	92
R	-	O	ALA	A	10	L	H	CA	ALA	V	69
R	-	O	ALA	A	10	L	H	C	ALA	V	69
R	-	O	ALA	A	10	L	H	CB	ALA	V	69
R	-	O	ALA	A	10	L	H	O	ALA	V	69
R	-	O	ALA	A	10	L	H	HA	ALA	V	69
R	-	O	ALA	A	10	L	H	HB1	ALA	V	69
R	-	O	ALA	A	10	L	H	HB3	ALA	V	69
R	-	N	VAL	A	11	L	-	CB	PRO	V	92
R	-	N	VAL	A	11	L	-	CG	PRO	V	92
R	-	N	VAL	A	11	L	-	HB2	PRO	V	92
R	-	N	VAL	A	11	L	-	HB3	PRO	V	92
R	-	N	VAL	A	11	L	-	HG2	PRO	V	92
R	-	N	VAL	A	11	L	-	HG3	PRO	V	92
R	-	CA	VAL	A	11	L	-	HB2	PRO	V	92
R	-	CA	VAL	A	11	L	-	HB3	PRO	V	92
R	-	C	VAL	A	11	L	-	HB3	PRO	V	92
R	-	CB	VAL	A	11	L	-	CB	PRO	V	92
R	-	CB	VAL	A	11	L	-	HB2	PRO	V	92
R	-	CB	VAL	A	11	L	-	HB3	PRO	V	92
R	-	O	VAL	A	11	L	-	HB3	PRO	V	92
R	-	CG2	VAL	A	11	L	-	CB	PRO	V	92
R	-	CG2	VAL	A	11	L	-	HB2	PRO	V	92
R	-	CG2	VAL	A	11	L	-	HB3	PRO	V	92
R	-	CG2	VAL	A	11	L	H	HB2	TRP	V	94
R	-	CG2	VAL	A	11	L	H	HB3	TRP	V	94
R	-	N	ALA	A	12	L	H	O	ALA	V	69
R	-	CA	ALA	A	12	L	H	O	ALA	V	69
R	-	CA	ALA	A	12	L	-	CD1	LEU	V	73
R	-	CA	ALA	A	12	L	-	HD11	LEU	V	73
R	-	CA	ALA	A	12	L	-	HD12	LEU	V	73
R	-	C	ALA	A	12	L	-	CD1	LEU	V	73
R	-	C	ALA	A	12	L	-	HD11	LEU	V	73
R	-	C	ALA	A	12	L	-	HD12	LEU	V	73
R	-	CB	ALA	A	12	L	H	O	ALA	V	69
R	-	CB	ALA	A	12	L	-	C	GLY	V	71
R	-	CB	ALA	A	12	L	-	O	GLY	V	71
R	-	CB	ALA	A	12	L	-	CD1	LEU	V	73
R	-	CB	ALA	A	12	L	-	HB2	LEU	V	73
R	-	CB	ALA	A	12	L	-	HD11	LEU	V	73
R	-	O	ALA	A	12	L	-	HD11	LEU	V	73
R	-	N	GLU	A	13	L	-	CD1	LEU	V	73
R	-	N	GLU	A	13	L	-	HD11	LEU	V	73
R	-	N	GLU	A	13	L	-	HD12	LEU	V	73
R	-	CA	GLU	A	13	L	-	HD12	LEU	V	73
R	-	C	GLU	A	13	L	-	CD1	LEU	V	73
R	-	C	GLU	A	13	L	-	HG	LEU	V	73
R	-	C	GLU	A	13	L	-	HD11	LEU	V	73
R	-	C	GLU	A	13	L	-	HD12	LEU	V	73
R	-	CB	GLU	A	13	L	-	HD12	LEU	V	73
R	-	O	GLU	A	13	L	-	CG	LEU	V	73
R	-	O	GLU	A	13	L	-	CD1	LEU	V	73
R	-	O	GLU	A	13	L	-	CD2	LEU	V	73
R	-	O	GLU	A	13	L	-	HG	LEU	V	73
R	-	O	GLU	A	13	L	-	HD11	LEU	V	73
R	-	O	GLU	A	13	L	-	HD12	LEU	V	73
R	-	O	GLU	A	13	L	-	HD23	LEU	V	73
R	-	CB	PRO	A	15	L	-	OG1	THR	V	77
R	-	CB	PRO	A	15	L	-	HG1	THR	V	77
R	-	CG	PRO	A	15	L	-	HB2	ASP	V	76
R	-	CG	PRO	A	15	L	-	OG1	THR	V	77
R	-	CG	PRO	A	15	L	-	HG1	THR	V	77
R	-	CD	PRO	A	15	L	-	HA	LEU	V	73
R	-	CD	PRO	A	15	L	-	HG	LEU	V	73
R	-	O	LYS	A	18	L	-	HG	SER	V	79
R	-	CD	LYS	A	18	L	-	O	GLU	V	81
R	-	CD	LYS	A	18	L	-	CG	PRO	V	82
R	-	CD	LYS	A	18	L	-	CD	PRO	V	82
R	-	CD	LYS	A	18	L	-	HG3	PRO	V	82
R	-	CD	LYS	A	18	L	-	HD2	PRO	V	82
R	-	CE	LYS	A	18	L	-	CG	PRO	V	82
R	-	CE	LYS	A	18	L	-	CD	PRO	V	82
R	-	CE	LYS	A	18	L	-	HG3	PRO	V	82
R	-	CE	LYS	A	18	L	-	HD2	PRO	V	82
R	-	NZ	LYS	A	18	L	-	CG	PRO	V	82
R	-	NZ	LYS	A	18	L	-	CD	PRO	V	82
R	-	NZ	LYS	A	18	L	-	HG2	PRO	V	82
R	-	NZ	LYS	A	18	L	-	HG3	PRO	V	82
R	-	NZ	LYS	A	18	L	-	HD2	PRO	V	82
R	-	NZ	LYS	A	18	L	-	HD3	PRO	V	82
R	H	N	PHE	A	20	L	-	HG	SER	V	79
R	H	CA	PHE	A	20	L	-	HG	SER	V	79
R	H	C	PHE	A	20	L	-	OG	SER	V	79
R	H	C	PHE	A	20	L	-	HG	SER	V	79
R	H	O	PHE	A	20	L	-	OG	SER	V	79
R	H	O	PHE	A	20	L	-	HG	SER	V	79
R	H	N	GLY	A	21	L	-	CB	SER	V	79
R	H	N	GLY	A	21	L	-	OG	SER	V	79
R	H	N	GLY	A	21	L	-	HB2	SER	V	79
R	H	N	GLY	A	21	L	-	HB3	SER	V	79
R	H	N	GLY	A	21	L	-	HG	SER	V	79
R	H	CA	GLY	A	21	L	-	CB	SER	V	79
R	H	CA	GLY	A	21	L	-	OG	SER	V	79
R	H	CA	GLY	A	21	L	-	HB2	SER	V	79
R	H	CA	GLY	A	21	L	-	HB3	SER	V	79
R	H	CA	GLY	A	21	L	-	HG	SER	V	79
R	H	C	GLY	A	21	L	-	OG	SER	V	79
R	H	C	GLY	A	21	L	-	HG	SER	V	79
R	H	C	GLY	A	21	L	-	CB	GLU	V	81
R	H	C	GLY	A	21	L	-	HB2	GLU	V	81
R	H	C	GLY	A	21	L	-	HB3	GLU	V	81
R	H	O	GLY	A	21	L	-	OG	SER	V	79
R	H	O	GLY	A	21	L	-	HG	SER	V	79
R	H	O	GLY	A	21	L	-	C	PRO	V	80
R	H	O	GLY	A	21	L	-	N	GLU	V	81
R	H	O	GLY	A	21	L	-	CA	GLU	V	81
R	H	O	GLY	A	21	L	-	C	GLU	V	81
R	H	O	GLY	A	21	L	-	CB	GLU	V	81
R	H	O	GLY	A	21	L	-	O	GLU	V	81
R	H	O	GLY	A	21	L	-	H	GLU	V	81
R	H	O	GLY	A	21	L	-	HB2	GLU	V	81
R	H	O	GLY	A	21	L	-	HB3	GLU	V	81
R	-	N	LYS	A	22	L	-	HG	SER	V	79
R	-	N	LYS	A	22	L	-	HB2	GLU	V	81
R	-	N	LYS	A	22	L	-	HB3	GLU	V	81
R	-	CA	LYS	A	22	L	-	CB	GLU	V	81
R	-	CA	LYS	A	22	L	-	OE2	GLU	V	81
R	-	CA	LYS	A	22	L	-	HB2	GLU	V	81
R	-	CA	LYS	A	22	L	-	HB3	GLU	V	81
R	-	C	LYS	A	22	L	-	OE2	GLU	V	81
R	-	CB	LYS	A	22	L	-	OE2	GLU	V	81
R	-	CB	LYS	A	22	L	-	HB2	GLU	V	81
R	-	CB	LYS	A	22	L	-	HB3	GLU	V	81
R	-	O	LYS	A	22	L	-	OE2	GLU	V	81
R	-	CG	LYS	A	22	L	-	CB	GLU	V	81
R	-	CG	LYS	A	22	L	-	CG	GLU	V	81
R	-	CG	LYS	A	22	L	-	OE2	GLU	V	81
R	-	CG	LYS	A	22	L	-	HB2	GLU	V	81
R	-	CG	LYS	A	22	L	-	HB3	GLU	V	81
R	-	CG	LYS	A	22	L	-	HG2	GLU	V	81
R	-	CD	LYS	A	22	L	-	HG2	GLU	V	81
R	-	CE	LYS	A	22	L	-	HG2	GLU	V	81
R	-	CD1	TYR	A	48	L	-	HB2	SER	V	79
R	-	CD1	TYR	A	48	L	-	HB3	SER	V	79
R	-	CD2	TYR	A	48	L	-	O	ASP	V	76
R	-	CE1	TYR	A	48	L	-	O	ASP	V	76
R	-	CE1	TYR	A	48	L	-	HA	THR	V	77
R	-	CE1	TYR	A	48	L	-	HG22	THR	V	77
R	-	CE2	TYR	A	48	L	-	O	ASP	V	76
R	-	CE2	TYR	A	48	L	-	HB3	ASP	V	76
R	-	OH	TYR	A	48	L	-	C	ASP	V	76
R	-	OH	TYR	A	48	L	-	CB	ASP	V	76
R	-	OH	TYR	A	48	L	-	O	ASP	V	76
R	-	OH	TYR	A	48	L	-	HB2	ASP	V	76
R	-	OH	TYR	A	48	L	-	HB3	ASP	V	76
R	-	CZ	TYR	A	48	L	-	C	ASP	V	76
R	-	CZ	TYR	A	48	L	-	O	ASP	V	76
R	-	CZ	TYR	A	48	L	-	HB3	ASP	V	76

- 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