IID

P16662_P20815.2 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	10	L	-	THR	V	42
R	H	LEU	A	10	L	H	LYS	V	67
R	H	ILE	A	12	L	H	LYS	V	67
R	H	GLN	A	13	L	-	GLY	V	40
R	H	GLN	A	13	L	-	PRO	V	41
R	H	GLN	A	13	L	-	THR	V	42
R	H	GLN	A	13	L	H	SER	V	52
R	H	GLN	A	13	L	H	LYS	V	67
R	H	GLN	A	13	L	H	TYR	V	68
R	H	LEU	A	14	L	-	THR	V	42
R	H	LEU	A	14	L	-	LEU	V	44
R	H	PHE	A	16	L	H	LEU	V	51
R	H	PHE	A	16	L	H	SER	V	52
R	H	PHE	A	16	L	H	GLN	V	55
R	H	PHE	A	16	L	H	GLU	V	63
R	H	CYS	A	17	L	-	PRO	V	41
R	H	CYS	A	17	L	-	THR	V	42
R	H	CYS	A	17	L	-	LEU	V	44
R	H	CYS	A	17	L	-	ASN	V	49
R	H	CYS	A	17	L	H	LEU	V	51
R	H	CYS	A	17	L	H	SER	V	52
R	-	PHE	A	18	L	-	LEU	V	44
R	-	GLY	A	186	L	-	GLN	V	200
R	-	ILE	A	188	L	-	GLN	V	200
R	-	SER	A	19	L	H	LEU	V	51
R	-	SER	A	19	L	H	ARG	V	54
R	-	SER	A	20	L	H	ARG	V	54
R	-	GLY	A	21	L	H	ARG	V	54
R	-	LEU	A	270	L	H	GLU	V	205
R	-	LEU	A	271	L	H	GLU	V	205
R	-	PRO	A	272	L	H	GLU	V	205
R	-	PRO	A	272	L	H	LYS	V	212
R	-	ASN	A	273	L	H	LYS	V	212
R	-	ASP	A	451	L	-	LEU	V	236
R	-	ASP	A	451	L	-	VAL	V	238
R	-	PRO	A	453	L	H	PRO	V	218
R	-	PRO	A	453	L	H	LEU	V	219
R	-	PRO	A	453	L	-	VAL	V	238
R	-	VAL	A	454	L	-	ASP	V	217
R	-	VAL	A	454	L	H	PRO	V	218
R	-	VAL	A	454	L	H	LEU	V	219
R	H	ASP	A	458	L	H	PRO	V	218
R	H	PHE	A	462	L	H	LYS	V	212
R	H	PHE	A	462	L	-	GLN	V	479
R	H	TRP	A	463	L	H	LYS	V	212
R	H	PHE	A	466	L	-	GLN	V	479
R	H	ARG	A	469	L	-	GLN	V	479
R	H	HIS	A	470	L	-	ASP	V	477
R	H	HIS	A	470	L	-	THR	V	478
R	H	HIS	A	470	L	-	GLN	V	479
R	H	HIS	A	470	L	-	GLU	V	485
R	H	HIS	A	470	L	-	LYS	V	486
R	-	LYS	A	471	L	-	LYS	V	486
R	H	LYS	A	474	L	-	PRO	V	487
R	H	HIS	A	475	L	H	LYS	V	208
R	H	HIS	A	475	L	-	PRO	V	487
R	H	LEU	A	476	L	H	LYS	V	212
R	-	VAL	A	478	L	-	GLN	V	200
R	-	VAL	A	478	L	H	GLU	V	205
R	H	ALA	A	479	L	-	PRO	V	199
R	H	ALA	A	480	L	-	PRO	V	199
R	H	ALA	A	480	L	-	GLN	V	200
R	H	ASP	A	482	L	-	LYS	V	168
R	-	LEU	A	483	L	-	PRO	V	199
R	H	GLN	A	487	L	-	LYS	V	166
R	H	TYR	A	488	L	-	GLN	V	200
R	H	VAL	A	8	L	H	LYS	V	67
R	H	ILE	A	9	L	H	LYS	V	67
R	H	ILE	A	9	L	H	TYR	V	68

- 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

P16662_P20815.2 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	O	VAL	A	8	L	H	HZ2	LYS	V	67
R	H	N	ILE	A	9	L	H	HZ2	LYS	V	67
R	H	CA	ILE	A	9	L	H	CE	LYS	V	67
R	H	CA	ILE	A	9	L	H	NZ	LYS	V	67
R	H	CA	ILE	A	9	L	H	HE2	LYS	V	67
R	H	CA	ILE	A	9	L	H	HE3	LYS	V	67
R	H	CA	ILE	A	9	L	H	HZ1	LYS	V	67
R	H	CA	ILE	A	9	L	H	HZ2	LYS	V	67
R	H	C	ILE	A	9	L	H	CE	LYS	V	67
R	H	C	ILE	A	9	L	H	NZ	LYS	V	67
R	H	C	ILE	A	9	L	H	HE2	LYS	V	67
R	H	C	ILE	A	9	L	H	HZ1	LYS	V	67
R	H	C	ILE	A	9	L	H	HZ2	LYS	V	67
R	H	C	ILE	A	9	L	H	HH	TYR	V	68
R	H	CB	ILE	A	9	L	H	CE	LYS	V	67
R	H	CB	ILE	A	9	L	H	HE2	LYS	V	67
R	H	CB	ILE	A	9	L	H	HE3	LYS	V	67
R	H	CB	ILE	A	9	L	H	HZ2	LYS	V	67
R	H	CB	ILE	A	9	L	H	HE1	TYR	V	68
R	H	O	ILE	A	9	L	H	CE	LYS	V	67
R	H	O	ILE	A	9	L	H	NZ	LYS	V	67
R	H	O	ILE	A	9	L	H	HE2	LYS	V	67
R	H	O	ILE	A	9	L	H	HE3	LYS	V	67
R	H	O	ILE	A	9	L	H	HZ1	LYS	V	67
R	H	O	ILE	A	9	L	H	HZ2	LYS	V	67
R	H	O	ILE	A	9	L	H	HZ3	LYS	V	67
R	H	O	ILE	A	9	L	H	OH	TYR	V	68
R	H	O	ILE	A	9	L	H	HH	TYR	V	68
R	H	CG1	ILE	A	9	L	H	CE	LYS	V	67
R	H	CG1	ILE	A	9	L	H	HE2	LYS	V	67
R	H	CG1	ILE	A	9	L	H	HE3	LYS	V	67
R	H	CG2	ILE	A	9	L	H	CE	LYS	V	67
R	H	CG2	ILE	A	9	L	H	NZ	LYS	V	67
R	H	CG2	ILE	A	9	L	H	HG2	LYS	V	67
R	H	CG2	ILE	A	9	L	H	HE2	LYS	V	67
R	H	CG2	ILE	A	9	L	H	HE3	LYS	V	67
R	H	CG2	ILE	A	9	L	H	HZ1	LYS	V	67
R	H	CG2	ILE	A	9	L	H	HZ2	LYS	V	67
R	H	CG2	ILE	A	9	L	H	CD1	TYR	V	68
R	H	CG2	ILE	A	9	L	H	CE1	TYR	V	68
R	H	CG2	ILE	A	9	L	H	OH	TYR	V	68
R	H	CG2	ILE	A	9	L	H	CZ	TYR	V	68
R	H	CG2	ILE	A	9	L	H	HE1	TYR	V	68
R	H	CG2	ILE	A	9	L	H	HH	TYR	V	68
R	H	N	LEU	A	10	L	H	HZ2	LYS	V	67
R	H	CA	LEU	A	10	L	-	OG1	THR	V	42
R	H	CA	LEU	A	10	L	-	HG1	THR	V	42
R	H	C	LEU	A	10	L	-	HG1	THR	V	42
R	H	CB	LEU	A	10	L	-	OG1	THR	V	42
R	H	CB	LEU	A	10	L	-	HG1	THR	V	42
R	H	O	LEU	A	10	L	-	OG1	THR	V	42
R	H	O	LEU	A	10	L	-	H	THR	V	42
R	H	O	LEU	A	10	L	-	HB	THR	V	42
R	H	O	LEU	A	10	L	-	HG1	THR	V	42
R	H	CG	LEU	A	10	L	-	CB	THR	V	42
R	H	CG	LEU	A	10	L	-	OG1	THR	V	42
R	H	CG	LEU	A	10	L	-	HG1	THR	V	42
R	H	CD1	LEU	A	10	L	-	OG1	THR	V	42
R	H	CD2	LEU	A	10	L	-	N	THR	V	42
R	H	CD2	LEU	A	10	L	-	CA	THR	V	42
R	H	CD2	LEU	A	10	L	-	CB	THR	V	42
R	H	CD2	LEU	A	10	L	-	CG2	THR	V	42
R	H	CD2	LEU	A	10	L	-	OG1	THR	V	42
R	H	CD2	LEU	A	10	L	-	H	THR	V	42
R	H	CD2	LEU	A	10	L	-	HA	THR	V	42
R	H	CD2	LEU	A	10	L	-	HB	THR	V	42
R	H	CD2	LEU	A	10	L	-	HG1	THR	V	42
R	H	CD2	LEU	A	10	L	-	HG21	THR	V	42
R	H	CD2	LEU	A	10	L	-	HG23	THR	V	42
R	H	N	ILE	A	12	L	H	HZ2	LYS	V	67
R	H	CA	ILE	A	12	L	H	NZ	LYS	V	67
R	H	CA	ILE	A	12	L	H	HZ1	LYS	V	67
R	H	CA	ILE	A	12	L	H	HZ2	LYS	V	67
R	H	CA	ILE	A	12	L	H	HZ3	LYS	V	67
R	H	C	ILE	A	12	L	H	NZ	LYS	V	67
R	H	C	ILE	A	12	L	H	HZ1	LYS	V	67
R	H	C	ILE	A	12	L	H	HZ2	LYS	V	67
R	H	C	ILE	A	12	L	H	HZ3	LYS	V	67
R	H	CB	ILE	A	12	L	H	CE	LYS	V	67
R	H	CB	ILE	A	12	L	H	NZ	LYS	V	67
R	H	CB	ILE	A	12	L	H	HE3	LYS	V	67
R	H	CB	ILE	A	12	L	H	HZ1	LYS	V	67
R	H	CB	ILE	A	12	L	H	HZ2	LYS	V	67
R	H	CB	ILE	A	12	L	H	HZ3	LYS	V	67
R	H	O	ILE	A	12	L	H	HZ3	LYS	V	67
R	H	CG1	ILE	A	12	L	H	HZ2	LYS	V	67
R	H	CG1	ILE	A	12	L	H	HZ3	LYS	V	67
R	H	CG2	ILE	A	12	L	H	CD	LYS	V	67
R	H	CG2	ILE	A	12	L	H	CE	LYS	V	67
R	H	CG2	ILE	A	12	L	H	NZ	LYS	V	67
R	H	CG2	ILE	A	12	L	H	HD2	LYS	V	67
R	H	CG2	ILE	A	12	L	H	HE3	LYS	V	67
R	H	CG2	ILE	A	12	L	H	HZ1	LYS	V	67
R	H	CG2	ILE	A	12	L	H	HZ2	LYS	V	67
R	H	CG2	ILE	A	12	L	H	HZ3	LYS	V	67
R	H	CD1	ILE	A	12	L	H	HE3	LYS	V	67
R	H	CD1	ILE	A	12	L	H	HZ2	LYS	V	67
R	H	N	GLN	A	13	L	H	NZ	LYS	V	67
R	H	N	GLN	A	13	L	H	HZ1	LYS	V	67
R	H	N	GLN	A	13	L	H	HZ2	LYS	V	67
R	H	N	GLN	A	13	L	H	HZ3	LYS	V	67
R	H	CA	GLN	A	13	L	-	CB	PRO	V	41
R	H	CA	GLN	A	13	L	-	HA	PRO	V	41
R	H	CA	GLN	A	13	L	-	HB2	PRO	V	41
R	H	CA	GLN	A	13	L	-	HB3	PRO	V	41
R	H	CA	GLN	A	13	L	-	H	THR	V	42
R	H	CA	GLN	A	13	L	H	NZ	LYS	V	67
R	H	CA	GLN	A	13	L	H	HZ1	LYS	V	67
R	H	CA	GLN	A	13	L	H	HZ3	LYS	V	67
R	H	C	GLN	A	13	L	-	HB2	PRO	V	41
R	H	CB	GLN	A	13	L	-	CA	PRO	V	41
R	H	CB	GLN	A	13	L	-	C	PRO	V	41
R	H	CB	GLN	A	13	L	-	CB	PRO	V	41
R	H	CB	GLN	A	13	L	-	HA	PRO	V	41
R	H	CB	GLN	A	13	L	-	HB2	PRO	V	41
R	H	CB	GLN	A	13	L	-	HB3	PRO	V	41
R	H	CB	GLN	A	13	L	-	N	THR	V	42
R	H	CB	GLN	A	13	L	-	H	THR	V	42
R	H	CB	GLN	A	13	L	-	HG1	THR	V	42
R	H	CB	GLN	A	13	L	H	HZ1	LYS	V	67
R	H	CB	GLN	A	13	L	H	OH	TYR	V	68
R	H	CB	GLN	A	13	L	H	HH	TYR	V	68
R	H	O	GLN	A	13	L	-	HB2	PRO	V	41
R	H	O	GLN	A	13	L	H	HG	SER	V	52
R	H	CG	GLN	A	13	L	-	C	GLY	V	40
R	H	CG	GLN	A	13	L	-	O	GLY	V	40
R	H	CG	GLN	A	13	L	-	N	PRO	V	41
R	H	CG	GLN	A	13	L	-	CA	PRO	V	41
R	H	CG	GLN	A	13	L	-	C	PRO	V	41
R	H	CG	GLN	A	13	L	-	CB	PRO	V	41
R	H	CG	GLN	A	13	L	-	HA	PRO	V	41
R	H	CG	GLN	A	13	L	-	HB2	PRO	V	41
R	H	CG	GLN	A	13	L	-	HB3	PRO	V	41
R	H	CG	GLN	A	13	L	-	N	THR	V	42
R	H	CG	GLN	A	13	L	-	H	THR	V	42
R	H	CG	GLN	A	13	L	H	NZ	LYS	V	67
R	H	CG	GLN	A	13	L	H	HD3	LYS	V	67
R	H	CG	GLN	A	13	L	H	HE2	LYS	V	67
R	H	CG	GLN	A	13	L	H	HZ1	LYS	V	67
R	H	CG	GLN	A	13	L	H	HZ2	LYS	V	67
R	H	CG	GLN	A	13	L	H	HZ3	LYS	V	67
R	H	CG	GLN	A	13	L	H	CE2	TYR	V	68
R	H	CG	GLN	A	13	L	H	OH	TYR	V	68
R	H	CG	GLN	A	13	L	H	CZ	TYR	V	68
R	H	CG	GLN	A	13	L	H	HE2	TYR	V	68
R	H	CG	GLN	A	13	L	H	HH	TYR	V	68
R	H	CD	GLN	A	13	L	-	CA	GLY	V	40
R	H	CD	GLN	A	13	L	-	C	GLY	V	40
R	H	CD	GLN	A	13	L	-	O	GLY	V	40
R	H	CD	GLN	A	13	L	-	HA3	GLY	V	40
R	H	CD	GLN	A	13	L	-	N	PRO	V	41
R	H	CD	GLN	A	13	L	-	CA	PRO	V	41
R	H	CD	GLN	A	13	L	-	C	PRO	V	41
R	H	CD	GLN	A	13	L	-	CB	PRO	V	41
R	H	CD	GLN	A	13	L	-	O	PRO	V	41
R	H	CD	GLN	A	13	L	-	CG	PRO	V	41
R	H	CD	GLN	A	13	L	-	CD	PRO	V	41
R	H	CD	GLN	A	13	L	-	HA	PRO	V	41
R	H	CD	GLN	A	13	L	-	HB2	PRO	V	41
R	H	CD	GLN	A	13	L	-	HB3	PRO	V	41
R	H	CD	GLN	A	13	L	-	HD2	PRO	V	41
R	H	CD	GLN	A	13	L	-	N	THR	V	42
R	H	CD	GLN	A	13	L	-	H	THR	V	42
R	H	CD	GLN	A	13	L	H	HZ1	LYS	V	67
R	H	CD	GLN	A	13	L	H	CE1	TYR	V	68
R	H	CD	GLN	A	13	L	H	CE2	TYR	V	68
R	H	CD	GLN	A	13	L	H	OH	TYR	V	68
R	H	CD	GLN	A	13	L	H	CZ	TYR	V	68
R	H	CD	GLN	A	13	L	H	HE1	TYR	V	68
R	H	CD	GLN	A	13	L	H	HE2	TYR	V	68
R	H	CD	GLN	A	13	L	H	HH	TYR	V	68
R	H	NE2	GLN	A	13	L	-	N	GLY	V	40
R	H	NE2	GLN	A	13	L	-	CA	GLY	V	40
R	H	NE2	GLN	A	13	L	-	C	GLY	V	40
R	H	NE2	GLN	A	13	L	-	O	GLY	V	40
R	H	NE2	GLN	A	13	L	-	H	GLY	V	40
R	H	NE2	GLN	A	13	L	-	HA2	GLY	V	40
R	H	NE2	GLN	A	13	L	-	HA3	GLY	V	40
R	H	NE2	GLN	A	13	L	-	N	PRO	V	41
R	H	NE2	GLN	A	13	L	-	CA	PRO	V	41
R	H	NE2	GLN	A	13	L	-	C	PRO	V	41
R	H	NE2	GLN	A	13	L	-	CB	PRO	V	41
R	H	NE2	GLN	A	13	L	-	CG	PRO	V	41
R	H	NE2	GLN	A	13	L	-	CD	PRO	V	41
R	H	NE2	GLN	A	13	L	-	HA	PRO	V	41
R	H	NE2	GLN	A	13	L	-	HB2	PRO	V	41
R	H	NE2	GLN	A	13	L	-	HB3	PRO	V	41
R	H	NE2	GLN	A	13	L	-	HG3	PRO	V	41
R	H	NE2	GLN	A	13	L	-	HD2	PRO	V	41
R	H	NE2	GLN	A	13	L	-	HD3	PRO	V	41
R	H	NE2	GLN	A	13	L	H	CG	TYR	V	68
R	H	NE2	GLN	A	13	L	H	CD1	TYR	V	68
R	H	NE2	GLN	A	13	L	H	CD2	TYR	V	68
R	H	NE2	GLN	A	13	L	H	CE1	TYR	V	68
R	H	NE2	GLN	A	13	L	H	CE2	TYR	V	68
R	H	NE2	GLN	A	13	L	H	OH	TYR	V	68
R	H	NE2	GLN	A	13	L	H	CZ	TYR	V	68
R	H	NE2	GLN	A	13	L	H	HE1	TYR	V	68
R	H	NE2	GLN	A	13	L	H	HE2	TYR	V	68
R	H	NE2	GLN	A	13	L	H	HH	TYR	V	68
R	H	OE1	GLN	A	13	L	-	CA	GLY	V	40
R	H	OE1	GLN	A	13	L	-	C	GLY	V	40
R	H	OE1	GLN	A	13	L	-	O	GLY	V	40
R	H	OE1	GLN	A	13	L	-	N	PRO	V	41
R	H	OE1	GLN	A	13	L	-	CA	PRO	V	41
R	H	OE1	GLN	A	13	L	-	C	PRO	V	41
R	H	OE1	GLN	A	13	L	-	CB	PRO	V	41
R	H	OE1	GLN	A	13	L	-	O	PRO	V	41
R	H	OE1	GLN	A	13	L	-	CD	PRO	V	41
R	H	OE1	GLN	A	13	L	-	HA	PRO	V	41
R	H	OE1	GLN	A	13	L	-	HB2	PRO	V	41
R	H	OE1	GLN	A	13	L	-	HB3	PRO	V	41
R	H	OE1	GLN	A	13	L	-	N	THR	V	42
R	H	OE1	GLN	A	13	L	-	CA	THR	V	42
R	H	OE1	GLN	A	13	L	-	H	THR	V	42
R	H	OE1	GLN	A	13	L	-	HG1	THR	V	42
R	H	OE1	GLN	A	13	L	H	CE1	TYR	V	68
R	H	OE1	GLN	A	13	L	H	OH	TYR	V	68
R	H	OE1	GLN	A	13	L	H	CZ	TYR	V	68
R	H	OE1	GLN	A	13	L	H	HE1	TYR	V	68
R	H	OE1	GLN	A	13	L	H	HH	TYR	V	68
R	H	CG	LEU	A	14	L	-	HB	THR	V	42
R	H	CD1	LEU	A	14	L	-	HB	THR	V	42
R	H	CD1	LEU	A	14	L	-	HG21	THR	V	42
R	H	CD2	LEU	A	14	L	-	HB	THR	V	42
R	H	CD2	LEU	A	14	L	-	CD2	LEU	V	44
R	H	CD2	LEU	A	14	L	-	HD21	LEU	V	44
R	H	CD2	LEU	A	14	L	-	HD22	LEU	V	44
R	H	C	PHE	A	16	L	H	CA	SER	V	52
R	H	C	PHE	A	16	L	H	CB	SER	V	52
R	H	C	PHE	A	16	L	H	OG	SER	V	52
R	H	C	PHE	A	16	L	H	HA	SER	V	52
R	H	C	PHE	A	16	L	H	HB3	SER	V	52
R	H	C	PHE	A	16	L	H	HG	SER	V	52
R	H	CB	PHE	A	16	L	H	HB3	SER	V	52
R	H	CB	PHE	A	16	L	H	HG	SER	V	52
R	H	O	PHE	A	16	L	H	O	LEU	V	51
R	H	O	PHE	A	16	L	H	N	SER	V	52
R	H	O	PHE	A	16	L	H	CA	SER	V	52
R	H	O	PHE	A	16	L	H	CB	SER	V	52
R	H	O	PHE	A	16	L	H	OG	SER	V	52
R	H	O	PHE	A	16	L	H	HA	SER	V	52
R	H	O	PHE	A	16	L	H	HB3	SER	V	52
R	H	O	PHE	A	16	L	H	HG	SER	V	52
R	H	CG	PHE	A	16	L	H	HE22	GLN	V	55
R	H	CD1	PHE	A	16	L	H	NE2	GLN	V	55
R	H	CD1	PHE	A	16	L	H	OE1	GLN	V	55
R	H	CD1	PHE	A	16	L	H	HE22	GLN	V	55
R	H	CE1	PHE	A	16	L	H	HE22	GLN	V	55
R	H	CE1	PHE	A	16	L	H	HG3	GLU	V	63
R	H	CZ	PHE	A	16	L	H	HB3	GLU	V	63
R	H	CZ	PHE	A	16	L	H	HG3	GLU	V	63
R	H	N	CYS	A	17	L	H	OG	SER	V	52
R	H	N	CYS	A	17	L	H	HA	SER	V	52
R	H	N	CYS	A	17	L	H	HG	SER	V	52
R	H	CA	CYS	A	17	L	H	HB3	LEU	V	51
R	H	CA	CYS	A	17	L	H	N	SER	V	52
R	H	CA	CYS	A	17	L	H	OG	SER	V	52
R	H	CA	CYS	A	17	L	H	H	SER	V	52
R	H	CA	CYS	A	17	L	H	HA	SER	V	52
R	H	CA	CYS	A	17	L	H	HG	SER	V	52
R	H	C	CYS	A	17	L	-	HD12	LEU	V	44
R	H	C	CYS	A	17	L	H	CB	LEU	V	51
R	H	C	CYS	A	17	L	H	HB2	LEU	V	51
R	H	C	CYS	A	17	L	H	HB3	LEU	V	51
R	H	C	CYS	A	17	L	H	HD11	LEU	V	51
R	H	CB	CYS	A	17	L	-	HG	LEU	V	44
R	H	CB	CYS	A	17	L	-	HD12	LEU	V	44
R	H	CB	CYS	A	17	L	-	HD22	LEU	V	44
R	H	CB	CYS	A	17	L	-	HA	ASN	V	49
R	H	CB	CYS	A	17	L	H	HB3	LEU	V	51
R	H	CB	CYS	A	17	L	H	OG	SER	V	52
R	H	CB	CYS	A	17	L	H	HG	SER	V	52
R	H	O	CYS	A	17	L	-	HD11	LEU	V	44
R	H	O	CYS	A	17	L	-	HD12	LEU	V	44
R	H	O	CYS	A	17	L	H	CA	LEU	V	51
R	H	O	CYS	A	17	L	H	C	LEU	V	51
R	H	O	CYS	A	17	L	H	CB	LEU	V	51
R	H	O	CYS	A	17	L	H	O	LEU	V	51
R	H	O	CYS	A	17	L	H	CG	LEU	V	51
R	H	O	CYS	A	17	L	H	CD1	LEU	V	51
R	H	O	CYS	A	17	L	H	HB2	LEU	V	51
R	H	O	CYS	A	17	L	H	HB3	LEU	V	51
R	H	O	CYS	A	17	L	H	HD11	LEU	V	51
R	H	O	CYS	A	17	L	H	HD12	LEU	V	51
R	H	O	CYS	A	17	L	H	N	SER	V	52
R	H	O	CYS	A	17	L	H	H	SER	V	52
R	H	SG	CYS	A	17	L	-	HB2	PRO	V	41
R	H	SG	CYS	A	17	L	-	O	THR	V	42
R	H	SG	CYS	A	17	L	-	HG	LEU	V	44
R	H	SG	CYS	A	17	L	-	ND2	ASN	V	49
R	H	SG	CYS	A	17	L	-	HA	ASN	V	49
R	H	SG	CYS	A	17	L	-	HB3	ASN	V	49
R	H	SG	CYS	A	17	L	-	HD21	ASN	V	49
R	H	SG	CYS	A	17	L	-	HD22	ASN	V	49
R	H	SG	CYS	A	17	L	H	OG	SER	V	52
R	H	SG	CYS	A	17	L	H	HG	SER	V	52
R	-	N	PHE	A	18	L	-	HD12	LEU	V	44
R	-	CD1	PHE	A	18	L	-	HD12	LEU	V	44
R	-	CD2	PHE	A	18	L	-	HD22	LEU	V	44
R	-	CE1	PHE	A	18	L	-	HD12	LEU	V	44
R	-	CE1	PHE	A	18	L	-	HD22	LEU	V	44
R	-	CE1	PHE	A	18	L	-	HD23	LEU	V	44
R	-	CE2	PHE	A	18	L	-	HD22	LEU	V	44
R	-	CZ	PHE	A	18	L	-	CD2	LEU	V	44
R	-	CZ	PHE	A	18	L	-	HD22	LEU	V	44
R	-	CZ	PHE	A	18	L	-	HD23	LEU	V	44
R	-	N	SER	A	19	L	H	O	LEU	V	51
R	-	N	SER	A	19	L	H	HB2	LEU	V	51
R	-	N	SER	A	19	L	H	HD2	ARG	V	54
R	-	CA	SER	A	19	L	H	O	LEU	V	51
R	-	CA	SER	A	19	L	H	CD	ARG	V	54
R	-	CA	SER	A	19	L	H	HB2	ARG	V	54
R	-	CA	SER	A	19	L	H	HD2	ARG	V	54
R	-	CA	SER	A	19	L	H	HH11	ARG	V	54
R	-	C	SER	A	19	L	H	HD2	ARG	V	54
R	-	C	SER	A	19	L	H	HH11	ARG	V	54
R	-	CB	SER	A	19	L	H	O	LEU	V	51
R	-	CB	SER	A	19	L	H	CB	ARG	V	54
R	-	CB	SER	A	19	L	H	CG	ARG	V	54
R	-	CB	SER	A	19	L	H	CD	ARG	V	54
R	-	CB	SER	A	19	L	H	NE	ARG	V	54
R	-	CB	SER	A	19	L	H	NH1	ARG	V	54
R	-	CB	SER	A	19	L	H	HB2	ARG	V	54
R	-	CB	SER	A	19	L	H	HB3	ARG	V	54
R	-	CB	SER	A	19	L	H	HG3	ARG	V	54
R	-	CB	SER	A	19	L	H	HD2	ARG	V	54
R	-	CB	SER	A	19	L	H	HD3	ARG	V	54
R	-	CB	SER	A	19	L	H	HH11	ARG	V	54
R	-	O	SER	A	19	L	H	CD	ARG	V	54
R	-	O	SER	A	19	L	H	NH1	ARG	V	54
R	-	O	SER	A	19	L	H	CZ	ARG	V	54
R	-	O	SER	A	19	L	H	HD2	ARG	V	54
R	-	O	SER	A	19	L	H	HD3	ARG	V	54
R	-	O	SER	A	19	L	H	HH11	ARG	V	54
R	-	O	SER	A	19	L	H	HH12	ARG	V	54
R	-	OG	SER	A	19	L	H	CB	ARG	V	54
R	-	OG	SER	A	19	L	H	CG	ARG	V	54
R	-	OG	SER	A	19	L	H	CD	ARG	V	54
R	-	OG	SER	A	19	L	H	NE	ARG	V	54
R	-	OG	SER	A	19	L	H	HB2	ARG	V	54
R	-	OG	SER	A	19	L	H	HB3	ARG	V	54
R	-	OG	SER	A	19	L	H	HG2	ARG	V	54
R	-	OG	SER	A	19	L	H	HG3	ARG	V	54
R	-	OG	SER	A	19	L	H	HD2	ARG	V	54
R	-	OG	SER	A	19	L	H	HD3	ARG	V	54
R	-	OG	SER	A	19	L	H	HH11	ARG	V	54
R	-	C	SER	A	20	L	H	HH11	ARG	V	54
R	-	N	GLY	A	21	L	H	NH1	ARG	V	54
R	-	N	GLY	A	21	L	H	HH11	ARG	V	54
R	-	N	GLY	A	21	L	H	HH12	ARG	V	54
R	-	CA	GLY	A	21	L	H	NH1	ARG	V	54
R	-	CA	GLY	A	21	L	H	HH11	ARG	V	54
R	-	CA	GLY	A	21	L	H	HH12	ARG	V	54
R	-	O	GLY	A	186	L	-	HE22	GLN	V	200
R	-	CG1	ILE	A	188	L	-	OE1	GLN	V	200
R	-	CD1	ILE	A	188	L	-	CD	GLN	V	200
R	-	CD1	ILE	A	188	L	-	OE1	GLN	V	200
R	-	O	LEU	A	270	L	H	OE2	GLU	V	205
R	-	CD2	LEU	A	271	L	H	OE1	GLU	V	205
R	-	CA	PRO	A	272	L	H	NZ	LYS	V	212
R	-	CA	PRO	A	272	L	H	HZ1	LYS	V	212
R	-	CA	PRO	A	272	L	H	HZ3	LYS	V	212
R	-	C	PRO	A	272	L	H	NZ	LYS	V	212
R	-	C	PRO	A	272	L	H	HZ1	LYS	V	212
R	-	C	PRO	A	272	L	H	HZ2	LYS	V	212
R	-	C	PRO	A	272	L	H	HZ3	LYS	V	212
R	-	CB	PRO	A	272	L	H	HZ1	LYS	V	212
R	-	O	PRO	A	272	L	H	CE	LYS	V	212
R	-	O	PRO	A	272	L	H	NZ	LYS	V	212
R	-	O	PRO	A	272	L	H	HE2	LYS	V	212
R	-	O	PRO	A	272	L	H	HE3	LYS	V	212
R	-	O	PRO	A	272	L	H	HZ1	LYS	V	212
R	-	O	PRO	A	272	L	H	HZ2	LYS	V	212
R	-	O	PRO	A	272	L	H	HZ3	LYS	V	212
R	-	CG	PRO	A	272	L	H	HA	GLU	V	205
R	-	CG	PRO	A	272	L	H	HB2	GLU	V	205
R	-	CG	PRO	A	272	L	H	HG2	GLU	V	205
R	-	CD	PRO	A	272	L	H	HG2	GLU	V	205
R	-	N	ASN	A	273	L	H	HZ1	LYS	V	212
R	-	CA	ASN	A	273	L	H	HZ1	LYS	V	212
R	-	CG	ASP	A	451	L	-	HB3	LEU	V	236
R	-	CG	ASP	A	451	L	-	HG21	VAL	V	238
R	-	CG	ASP	A	451	L	-	HG22	VAL	V	238
R	-	OD1	ASP	A	451	L	-	HB3	LEU	V	236
R	-	OD1	ASP	A	451	L	-	HD13	LEU	V	236
R	-	OD1	ASP	A	451	L	-	CG2	VAL	V	238
R	-	OD1	ASP	A	451	L	-	HG21	VAL	V	238
R	-	OD1	ASP	A	451	L	-	HG22	VAL	V	238
R	-	OD1	ASP	A	451	L	-	HG23	VAL	V	238
R	-	OD2	ASP	A	451	L	-	O	LEU	V	236
R	-	OD2	ASP	A	451	L	-	HB3	LEU	V	236
R	-	N	PRO	A	453	L	-	HG12	VAL	V	238
R	-	CA	PRO	A	453	L	H	HB3	LEU	V	219
R	-	CA	PRO	A	453	L	H	HD13	LEU	V	219
R	-	CA	PRO	A	453	L	H	HD23	LEU	V	219
R	-	CA	PRO	A	453	L	-	HG12	VAL	V	238
R	-	C	PRO	A	453	L	H	HB3	LEU	V	219
R	-	C	PRO	A	453	L	H	HD13	LEU	V	219
R	-	C	PRO	A	453	L	H	HD23	LEU	V	219
R	-	CB	PRO	A	453	L	H	CD2	LEU	V	219
R	-	CB	PRO	A	453	L	H	HB3	LEU	V	219
R	-	CB	PRO	A	453	L	H	HD21	LEU	V	219
R	-	CB	PRO	A	453	L	H	HD22	LEU	V	219
R	-	CB	PRO	A	453	L	H	HD23	LEU	V	219
R	-	CB	PRO	A	453	L	-	HG12	VAL	V	238
R	-	O	PRO	A	453	L	H	HB2	PRO	V	218
R	-	O	PRO	A	453	L	H	N	LEU	V	219
R	-	O	PRO	A	453	L	H	CA	LEU	V	219
R	-	O	PRO	A	453	L	H	CB	LEU	V	219
R	-	O	PRO	A	453	L	H	H	LEU	V	219
R	-	O	PRO	A	453	L	H	HA	LEU	V	219
R	-	O	PRO	A	453	L	H	HB2	LEU	V	219
R	-	O	PRO	A	453	L	H	HB3	LEU	V	219
R	-	O	PRO	A	453	L	H	HD13	LEU	V	219
R	-	O	PRO	A	453	L	H	HD23	LEU	V	219
R	-	CG	PRO	A	453	L	H	HD23	LEU	V	219
R	-	CA	VAL	A	454	L	H	HB2	PRO	V	218
R	-	CB	VAL	A	454	L	H	HG2	PRO	V	218
R	-	CB	VAL	A	454	L	H	HD3	PRO	V	218
R	-	CG1	VAL	A	454	L	H	CG	PRO	V	218
R	-	CG1	VAL	A	454	L	H	CD	PRO	V	218
R	-	CG1	VAL	A	454	L	H	HB2	PRO	V	218
R	-	CG1	VAL	A	454	L	H	HG2	PRO	V	218
R	-	CG1	VAL	A	454	L	H	HD3	PRO	V	218
R	-	CG2	VAL	A	454	L	-	CG	ASP	V	217
R	-	CG2	VAL	A	454	L	-	OD1	ASP	V	217
R	-	CG2	VAL	A	454	L	-	OD2	ASP	V	217
R	-	CG2	VAL	A	454	L	H	HB2	PRO	V	218
R	-	CG2	VAL	A	454	L	H	HD3	PRO	V	218
R	-	CG2	VAL	A	454	L	H	H	LEU	V	219
R	-	CG2	VAL	A	454	L	H	HB3	LEU	V	219
R	H	CB	ASP	A	458	L	H	HG2	PRO	V	218
R	H	CG	ASP	A	458	L	H	HG2	PRO	V	218
R	H	CE2	PHE	A	462	L	-	HE22	GLN	V	479
R	H	CZ	PHE	A	462	L	H	O	LYS	V	212
R	H	CE2	TRP	A	463	L	H	HD3	LYS	V	212
R	H	CE2	TRP	A	463	L	H	HZ2	LYS	V	212
R	H	CH2	TRP	A	463	L	H	CG	LYS	V	212
R	H	CH2	TRP	A	463	L	H	CD	LYS	V	212
R	H	CH2	TRP	A	463	L	H	CE	LYS	V	212
R	H	CH2	TRP	A	463	L	H	NZ	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HB3	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HG2	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HD2	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HD3	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HE2	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HE3	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HZ1	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HZ2	LYS	V	212
R	H	CH2	TRP	A	463	L	H	HZ3	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	CD	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	CE	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	NZ	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	HB3	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	HD2	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	HD3	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	HE2	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	HZ1	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	HZ2	LYS	V	212
R	H	CZ2	TRP	A	463	L	H	HZ3	LYS	V	212
R	H	CZ3	TRP	A	463	L	H	HD3	LYS	V	212
R	H	CZ3	TRP	A	463	L	H	HE2	LYS	V	212
R	H	CZ3	TRP	A	463	L	H	HZ2	LYS	V	212
R	H	CD2	PHE	A	466	L	-	OE1	GLN	V	479
R	H	CD2	PHE	A	466	L	-	HE22	GLN	V	479
R	H	CE2	PHE	A	466	L	-	OE1	GLN	V	479
R	H	CD	ARG	A	469	L	-	HE21	GLN	V	479
R	H	NE	ARG	A	469	L	-	NE2	GLN	V	479
R	H	NE	ARG	A	469	L	-	HE21	GLN	V	479
R	H	NE	ARG	A	469	L	-	HE22	GLN	V	479
R	H	NH2	ARG	A	469	L	-	NE2	GLN	V	479
R	H	NH2	ARG	A	469	L	-	HE21	GLN	V	479
R	H	NH2	ARG	A	469	L	-	HE22	GLN	V	479
R	H	CZ	ARG	A	469	L	-	NE2	GLN	V	479
R	H	CZ	ARG	A	469	L	-	HE21	GLN	V	479
R	H	CZ	ARG	A	469	L	-	HE22	GLN	V	479
R	H	O	HIS	A	470	L	-	O	GLU	V	485
R	H	O	HIS	A	470	L	-	HG2	GLU	V	485
R	H	O	HIS	A	470	L	-	HG2	LYS	V	486
R	H	O	HIS	A	470	L	-	HE2	LYS	V	486
R	H	CG	HIS	A	470	L	-	OD1	ASP	V	477
R	H	ND1	HIS	A	470	L	-	CG	ASP	V	477
R	H	ND1	HIS	A	470	L	-	OD1	ASP	V	477
R	H	ND1	HIS	A	470	L	-	OD2	ASP	V	477
R	H	ND1	HIS	A	470	L	-	HA	GLU	V	485
R	H	ND1	HIS	A	470	L	-	HG3	GLU	V	485
R	H	CE1	HIS	A	470	L	-	CG	ASP	V	477
R	H	CE1	HIS	A	470	L	-	OD1	ASP	V	477
R	H	CE1	HIS	A	470	L	-	OD2	ASP	V	477
R	H	CE1	HIS	A	470	L	-	H	THR	V	478
R	H	CE1	HIS	A	470	L	-	HG3	GLN	V	479
R	H	NE2	HIS	A	470	L	-	CG	ASP	V	477
R	H	NE2	HIS	A	470	L	-	OD1	ASP	V	477
R	H	NE2	HIS	A	470	L	-	OD2	ASP	V	477
R	H	NE2	HIS	A	470	L	-	CD	GLN	V	479
R	H	NE2	HIS	A	470	L	-	NE2	GLN	V	479
R	H	NE2	HIS	A	470	L	-	HG3	GLN	V	479
R	H	NE2	HIS	A	470	L	-	HE21	GLN	V	479
R	H	NE2	HIS	A	470	L	-	HE22	GLN	V	479
R	-	CB	LYS	A	471	L	-	HE2	LYS	V	486
R	-	CB	LYS	A	471	L	-	HE3	LYS	V	486
R	-	CB	LYS	A	471	L	-	HZ1	LYS	V	486
R	-	O	LYS	A	471	L	-	HE2	LYS	V	486
R	H	C	LYS	A	474	L	-	HG3	PRO	V	487
R	H	CB	LYS	A	474	L	-	HG3	PRO	V	487
R	H	N	HIS	A	475	L	-	CG	PRO	V	487
R	H	N	HIS	A	475	L	-	HG2	PRO	V	487
R	H	N	HIS	A	475	L	-	HG3	PRO	V	487
R	H	CA	HIS	A	475	L	-	CG	PRO	V	487
R	H	CA	HIS	A	475	L	-	HG2	PRO	V	487
R	H	CA	HIS	A	475	L	-	HG3	PRO	V	487
R	H	C	HIS	A	475	L	H	HZ2	LYS	V	208
R	H	CB	HIS	A	475	L	-	CG	PRO	V	487
R	H	CB	HIS	A	475	L	-	HG2	PRO	V	487
R	H	CB	HIS	A	475	L	-	HG3	PRO	V	487
R	H	O	HIS	A	475	L	H	NZ	LYS	V	208
R	H	O	HIS	A	475	L	H	HD3	LYS	V	208
R	H	O	HIS	A	475	L	H	HZ2	LYS	V	208
R	H	CG	HIS	A	475	L	-	HG2	PRO	V	487
R	H	ND1	HIS	A	475	L	-	HG2	PRO	V	487
R	H	ND1	HIS	A	475	L	-	HD2	PRO	V	487
R	H	CG	LEU	A	476	L	H	HE2	LYS	V	212
R	H	CD1	LEU	A	476	L	H	HE2	LYS	V	212
R	H	CD1	LEU	A	476	L	H	HZ1	LYS	V	212
R	H	CD2	LEU	A	476	L	H	HE2	LYS	V	212
R	H	CD2	LEU	A	476	L	H	HE3	LYS	V	212
R	-	CB	VAL	A	478	L	-	HG2	GLN	V	200
R	-	CG1	VAL	A	478	L	-	HG2	GLN	V	200
R	-	CG1	VAL	A	478	L	H	OE1	GLU	V	205
R	-	CG2	VAL	A	478	L	-	HG2	GLN	V	200
R	-	CG2	VAL	A	478	L	-	HE21	GLN	V	200
R	H	N	ALA	A	479	L	-	HB2	PRO	V	199
R	H	CB	ALA	A	479	L	-	HB2	PRO	V	199
R	H	CB	ALA	A	479	L	-	HB3	PRO	V	199
R	H	N	ALA	A	480	L	-	HB2	PRO	V	199
R	H	CA	ALA	A	480	L	-	HE21	GLN	V	200
R	H	CB	ALA	A	480	L	-	NE2	GLN	V	200
R	H	CB	ALA	A	480	L	-	HG3	GLN	V	200
R	H	CB	ALA	A	480	L	-	HE21	GLN	V	200
R	H	CB	ALA	A	480	L	-	HE22	GLN	V	200
R	H	O	ASP	A	482	L	-	NZ	LYS	V	168
R	H	O	ASP	A	482	L	-	HZ1	LYS	V	168
R	H	O	ASP	A	482	L	-	HZ2	LYS	V	168
R	H	O	ASP	A	482	L	-	HZ3	LYS	V	168
R	-	CD1	LEU	A	483	L	-	HG3	PRO	V	199
R	H	NE2	GLN	A	487	L	-	NZ	LYS	V	166
R	H	NE2	GLN	A	487	L	-	HE2	LYS	V	166
R	H	NE2	GLN	A	487	L	-	HZ2	LYS	V	166
R	H	CE2	TYR	A	488	L	-	CD	GLN	V	200
R	H	CE2	TYR	A	488	L	-	NE2	GLN	V	200
R	H	CE2	TYR	A	488	L	-	OE1	GLN	V	200
R	H	CE2	TYR	A	488	L	-	HE21	GLN	V	200
R	H	CE2	TYR	A	488	L	-	HE22	GLN	V	200
R	H	OH	TYR	A	488	L	-	CD	GLN	V	200
R	H	OH	TYR	A	488	L	-	NE2	GLN	V	200
R	H	OH	TYR	A	488	L	-	OE1	GLN	V	200
R	H	OH	TYR	A	488	L	-	HE22	GLN	V	200
R	H	CZ	TYR	A	488	L	-	NE2	GLN	V	200
R	H	CZ	TYR	A	488	L	-	HE22	GLN	V	200

- 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