IID

P51161_P05112.1 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	PRO	A	10	L	-	ALA	V	2
R	H	PRO	A	10	L	-	PHE	V	3
R	H	PRO	A	10	L	S	GLN	V	43
R	H	PRO	A	10	L	S	MET	V	86
R	H	PRO	A	10	L	-	GLY	V	89
R	H	LEU	A	11	L	-	GLY	V	88
R	H	PHE	A	13	L	-	MET	V	1
R	H	PHE	A	13	L	-	GLY	V	45
R	H	LEU	A	14	L	-	GLN	V	46
R	H	LEU	A	14	L	S	MET	V	86
R	-	LEU	A	3	L	S	VAL	V	105
R	-	LEU	A	3	L	-	GLY	V	106
R	-	LEU	A	3	L	-	ASP	V	107
R	-	LEU	A	3	L	S	LYS	V	108
R	-	THR	A	4	L	-	GLY	V	106
R	-	SER	A	5	L	S	ILE	V	104
R	-	SER	A	5	L	S	VAL	V	105
R	-	SER	A	5	L	-	GLY	V	106
R	-	GLN	A	6	L	S	ILE	V	104
R	-	GLN	A	6	L	-	GLY	V	106
R	-	GLN	A	6	L	-	ASP	V	107
R	-	GLN	A	6	L	S	ARG	V	126
R	-	LEU	A	7	L	S	GLU	V	103
R	-	LEU	A	7	L	S	ILE	V	104
R	-	LEU	A	7	L	-	GLY	V	88
R	-	LEU	A	7	L	-	GLY	V	89
R	-	LEU	A	7	L	S	LYS	V	90
R	H	PRO	A	9	L	-	MET	V	1
R	H	PRO	A	9	L	-	ALA	V	2

- 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

P51161_P05112.1 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	-	C	LEU	A	3	L	S	HG11	VAL	V	105
R	-	CB	LEU	A	3	L	S	HG11	VAL	V	105
R	-	CB	LEU	A	3	L	-	HA3	GLY	V	106
R	-	O	LEU	A	3	L	S	CG1	VAL	V	105
R	-	O	LEU	A	3	L	S	HG11	VAL	V	105
R	-	O	LEU	A	3	L	S	HG12	VAL	V	105
R	-	O	LEU	A	3	L	S	HG13	VAL	V	105
R	-	CG	LEU	A	3	L	S	HE3	LYS	V	108
R	-	CD1	LEU	A	3	L	S	CD	LYS	V	108
R	-	CD1	LEU	A	3	L	S	CE	LYS	V	108
R	-	CD1	LEU	A	3	L	S	HG3	LYS	V	108
R	-	CD1	LEU	A	3	L	S	HD2	LYS	V	108
R	-	CD1	LEU	A	3	L	S	HE3	LYS	V	108
R	-	CD1	LEU	A	3	L	S	HZ3	LYS	V	108
R	-	CD2	LEU	A	3	L	-	HA3	GLY	V	106
R	-	CD2	LEU	A	3	L	-	H	ASP	V	107
R	-	CD2	LEU	A	3	L	S	HG3	LYS	V	108
R	-	CD2	LEU	A	3	L	S	HE3	LYS	V	108
R	-	C	THR	A	4	L	-	H	GLY	V	106
R	-	C	THR	A	4	L	-	HA2	GLY	V	106
R	-	N	SER	A	5	L	-	N	GLY	V	106
R	-	N	SER	A	5	L	-	CA	GLY	V	106
R	-	N	SER	A	5	L	-	H	GLY	V	106
R	-	N	SER	A	5	L	-	HA2	GLY	V	106
R	-	N	SER	A	5	L	-	HA3	GLY	V	106
R	-	CA	SER	A	5	L	-	N	GLY	V	106
R	-	CA	SER	A	5	L	-	CA	GLY	V	106
R	-	CA	SER	A	5	L	-	H	GLY	V	106
R	-	CA	SER	A	5	L	-	HA2	GLY	V	106
R	-	C	SER	A	5	L	-	N	GLY	V	106
R	-	C	SER	A	5	L	-	CA	GLY	V	106
R	-	C	SER	A	5	L	-	O	GLY	V	106
R	-	C	SER	A	5	L	-	H	GLY	V	106
R	-	C	SER	A	5	L	-	HA2	GLY	V	106
R	-	CB	SER	A	5	L	-	CA	GLY	V	106
R	-	CB	SER	A	5	L	-	HA2	GLY	V	106
R	-	O	SER	A	5	L	S	O	ILE	V	104
R	-	O	SER	A	5	L	S	HG21	ILE	V	104
R	-	O	SER	A	5	L	S	C	VAL	V	105
R	-	O	SER	A	5	L	S	HA	VAL	V	105
R	-	O	SER	A	5	L	-	N	GLY	V	106
R	-	O	SER	A	5	L	-	CA	GLY	V	106
R	-	O	SER	A	5	L	-	C	GLY	V	106
R	-	O	SER	A	5	L	-	O	GLY	V	106
R	-	O	SER	A	5	L	-	H	GLY	V	106
R	-	O	SER	A	5	L	-	HA2	GLY	V	106
R	-	O	SER	A	5	L	-	HA3	GLY	V	106
R	-	OG	SER	A	5	L	-	HA2	GLY	V	106
R	-	N	GLN	A	6	L	-	H	GLY	V	106
R	-	N	GLN	A	6	L	-	HA2	GLY	V	106
R	-	C	GLN	A	6	L	S	O	ILE	V	104
R	-	CB	GLN	A	6	L	S	CG2	ILE	V	104
R	-	CB	GLN	A	6	L	S	HG21	ILE	V	104
R	-	CB	GLN	A	6	L	S	HG23	ILE	V	104
R	-	CB	GLN	A	6	L	-	O	GLY	V	106
R	-	O	GLN	A	6	L	S	C	ILE	V	104
R	-	O	GLN	A	6	L	S	CB	ILE	V	104
R	-	O	GLN	A	6	L	S	O	ILE	V	104
R	-	O	GLN	A	6	L	S	CG2	ILE	V	104
R	-	O	GLN	A	6	L	S	HB	ILE	V	104
R	-	O	GLN	A	6	L	S	HG21	ILE	V	104
R	-	O	GLN	A	6	L	S	HG23	ILE	V	104
R	-	CG	GLN	A	6	L	-	O	GLY	V	106
R	-	CD	GLN	A	6	L	S	HG23	ILE	V	104
R	-	CD	GLN	A	6	L	-	O	GLY	V	106
R	-	CD	GLN	A	6	L	-	OD1	ASP	V	107
R	-	CD	GLN	A	6	L	-	HA	ASP	V	107
R	-	NE2	GLN	A	6	L	-	O	GLY	V	106
R	-	NE2	GLN	A	6	L	-	OD1	ASP	V	107
R	-	OE1	GLN	A	6	L	S	CG2	ILE	V	104
R	-	OE1	GLN	A	6	L	S	HG21	ILE	V	104
R	-	OE1	GLN	A	6	L	S	HG22	ILE	V	104
R	-	OE1	GLN	A	6	L	S	HG23	ILE	V	104
R	-	OE1	GLN	A	6	L	-	C	GLY	V	106
R	-	OE1	GLN	A	6	L	-	O	GLY	V	106
R	-	OE1	GLN	A	6	L	-	OD1	ASP	V	107
R	-	OE1	GLN	A	6	L	-	HA	ASP	V	107
R	-	OE1	GLN	A	6	L	S	NH2	ARG	V	126
R	-	OE1	GLN	A	6	L	S	HE	ARG	V	126
R	-	OE1	GLN	A	6	L	S	HH21	ARG	V	126
R	-	C	LEU	A	7	L	-	HA3	GLY	V	89
R	-	CB	LEU	A	7	L	-	HA3	GLY	V	89
R	-	O	LEU	A	7	L	-	HA3	GLY	V	89
R	-	CG	LEU	A	7	L	S	O	ILE	V	104
R	-	CD1	LEU	A	7	L	S	HE2	LYS	V	90
R	-	CD1	LEU	A	7	L	S	OE2	GLU	V	103
R	-	CD1	LEU	A	7	L	S	HB2	GLU	V	103
R	-	CD2	LEU	A	7	L	-	O	GLY	V	88
R	-	CD2	LEU	A	7	L	-	CA	GLY	V	89
R	-	CD2	LEU	A	7	L	-	C	GLY	V	89
R	-	CD2	LEU	A	7	L	-	O	GLY	V	89
R	-	CD2	LEU	A	7	L	-	HA3	GLY	V	89
R	-	CD2	LEU	A	7	L	S	HG2	LYS	V	90
R	-	CD2	LEU	A	7	L	S	HB2	GLU	V	103
R	-	CD2	LEU	A	7	L	S	H	ILE	V	104
R	H	N	PRO	A	9	L	-	HB3	ALA	V	2
R	H	CA	PRO	A	9	L	-	HB3	ALA	V	2
R	H	CB	PRO	A	9	L	-	HA	MET	V	1
R	H	CB	PRO	A	9	L	-	N	ALA	V	2
R	H	CB	PRO	A	9	L	-	H	ALA	V	2
R	H	CB	PRO	A	9	L	-	HB3	ALA	V	2
R	H	CG	PRO	A	9	L	-	HA	ALA	V	2
R	H	CG	PRO	A	9	L	-	HB3	ALA	V	2
R	H	CD	PRO	A	9	L	-	HB3	ALA	V	2
R	H	N	PRO	A	10	L	-	H	ALA	V	2
R	H	N	PRO	A	10	L	-	HB3	ALA	V	2
R	H	CA	PRO	A	10	L	S	HE22	GLN	V	43
R	H	CB	PRO	A	10	L	S	HE22	GLN	V	43
R	H	CB	PRO	A	10	L	S	CE	MET	V	86
R	H	CB	PRO	A	10	L	S	HE1	MET	V	86
R	H	CB	PRO	A	10	L	-	HA2	GLY	V	89
R	H	CG	PRO	A	10	L	-	CB	ALA	V	2
R	H	CG	PRO	A	10	L	-	H	ALA	V	2
R	H	CG	PRO	A	10	L	-	HB2	ALA	V	2
R	H	CG	PRO	A	10	L	-	HB3	ALA	V	2
R	H	CG	PRO	A	10	L	-	HE2	PHE	V	3
R	H	CG	PRO	A	10	L	-	HA2	GLY	V	89
R	H	CD	PRO	A	10	L	-	CB	ALA	V	2
R	H	CD	PRO	A	10	L	-	H	ALA	V	2
R	H	CD	PRO	A	10	L	-	HB2	ALA	V	2
R	H	CD	PRO	A	10	L	-	HB3	ALA	V	2
R	H	CD1	LEU	A	11	L	-	HA2	GLY	V	88
R	H	CB	PHE	A	13	L	-	HA3	GLY	V	45
R	H	CG	PHE	A	13	L	-	HG2	MET	V	1
R	H	CG	PHE	A	13	L	-	HE3	MET	V	1
R	H	CG	PHE	A	13	L	-	HA3	GLY	V	45
R	H	CD1	PHE	A	13	L	-	SD	MET	V	1
R	H	CD1	PHE	A	13	L	-	CE	MET	V	1
R	H	CD1	PHE	A	13	L	-	HE3	MET	V	1
R	H	CD1	PHE	A	13	L	-	CA	GLY	V	45
R	H	CD1	PHE	A	13	L	-	H	GLY	V	45
R	H	CD1	PHE	A	13	L	-	HA3	GLY	V	45
R	H	CD2	PHE	A	13	L	-	HG2	MET	V	1
R	H	CD2	PHE	A	13	L	-	HE3	MET	V	1
R	H	CE1	PHE	A	13	L	-	CE	MET	V	1
R	H	CE1	PHE	A	13	L	-	HE1	MET	V	1
R	H	CE1	PHE	A	13	L	-	HE2	MET	V	1
R	H	CE1	PHE	A	13	L	-	HE3	MET	V	1
R	H	CE1	PHE	A	13	L	-	H	GLY	V	45
R	H	CE1	PHE	A	13	L	-	HA3	GLY	V	45
R	H	CE2	PHE	A	13	L	-	HG2	MET	V	1
R	H	CE2	PHE	A	13	L	-	HE1	MET	V	1
R	H	CE2	PHE	A	13	L	-	HE3	MET	V	1
R	H	CZ	PHE	A	13	L	-	CE	MET	V	1
R	H	CZ	PHE	A	13	L	-	HG2	MET	V	1
R	H	CZ	PHE	A	13	L	-	HE1	MET	V	1
R	H	CZ	PHE	A	13	L	-	HE3	MET	V	1
R	H	CB	LEU	A	14	L	-	HE21	GLN	V	46
R	H	CG	LEU	A	14	L	-	HG2	GLN	V	46
R	H	CG	LEU	A	14	L	-	HE21	GLN	V	46
R	H	CD1	LEU	A	14	L	-	HE21	GLN	V	46
R	H	CD1	LEU	A	14	L	S	HB3	MET	V	86
R	H	CD1	LEU	A	14	L	S	HG3	MET	V	86
R	H	CD2	LEU	A	14	L	-	CG	GLN	V	46
R	H	CD2	LEU	A	14	L	-	CD	GLN	V	46
R	H	CD2	LEU	A	14	L	-	NE2	GLN	V	46
R	H	CD2	LEU	A	14	L	-	HA	GLN	V	46
R	H	CD2	LEU	A	14	L	-	HG2	GLN	V	46
R	H	CD2	LEU	A	14	L	-	HG3	GLN	V	46
R	H	CD2	LEU	A	14	L	-	HE21	GLN	V	46
R	H	CD2	LEU	A	14	L	-	HE22	GLN	V	46

- 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