IID

A1L453_P00995.1 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	-	ASN	A	125	L	-	TYR	V	43
R	-	ASN	A	125	L	-	PRO	V	45
R	-	THR	A	127	L	S	SER	V	76
R	-	THR	A	127	L	-	GLY	V	77
R	S	GLN	A	128	L	S	SER	V	76
R	S	GLN	A	128	L	-	GLY	V	77
R	S	GLN	A	128	L	-	PRO	V	78
R	S	TRP	A	129	L	-	ARG	V	28
R	S	TRP	A	129	L	S	SER	V	76
R	S	TYR	A	130	L	S	LYS	V	75
R	-	LYS	A	157	L	-	SER	V	25
R	-	THR	A	158	L	S	GLN	V	74
R	-	THR	A	158	L	S	LYS	V	75
R	-	ARG	A	159	L	S	LYS	V	75
R	-	VAL	A	161	L	S	LYS	V	75
R	-	VAL	A	161	L	-	PRO	V	78
R	-	VAL	A	161	L	-	CYS	V	79
R	-	ALA	A	299	L	-	SER	V	25
R	-	GLN	A	300	L	-	ASP	V	24
R	-	PRO	A	301	L	-	ASP	V	24
R	-	PRO	A	301	L	-	SER	V	25
R	-	PRO	A	301	L	-	LEU	V	26
R	-	PRO	A	301	L	-	GLY	V	27
R	-	PRO	A	301	L	S	GLN	V	74
R	-	ALA	A	302	L	-	ASP	V	24
R	-	ALA	A	302	L	-	LEU	V	26
R	-	PRO	A	303	L	-	THR	V	49
R	-	ALA	A	304	L	-	LEU	V	26
R	-	ALA	A	304	L	-	THR	V	49
R	-	ALA	A	304	L	-	SER	V	70
R	-	ALA	A	304	L	-	ILE	V	71
R	-	ALA	A	304	L	-	LEU	V	72
R	-	SER	A	306	L	-	THR	V	69
R	-	SER	A	306	L	-	SER	V	70
R	-	SER	A	306	L	-	ILE	V	71
R	-	PRO	A	307	L	-	GLN	V	68
R	-	PRO	A	307	L	-	THR	V	69
R	-	PRO	A	307	L	-	SER	V	70
R	-	GLY	A	310	L	-	GLN	V	68
R	H	PRO	A	311	L	-	GLN	V	68
R	H	SER	A	314	L	-	GLN	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

A1L453_P00995.1 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	-	CA	ASN	A	125	L	-	HD1	TYR	V	43
R	-	CA	ASN	A	125	L	-	HD3	PRO	V	45
R	-	C	ASN	A	125	L	-	HD3	PRO	V	45
R	-	CB	ASN	A	125	L	-	CD1	TYR	V	43
R	-	CB	ASN	A	125	L	-	HD1	TYR	V	43
R	-	CB	ASN	A	125	L	-	HE1	TYR	V	43
R	-	O	ASN	A	125	L	-	HE1	TYR	V	43
R	-	O	ASN	A	125	L	-	CG	PRO	V	45
R	-	O	ASN	A	125	L	-	CD	PRO	V	45
R	-	O	ASN	A	125	L	-	HG2	PRO	V	45
R	-	O	ASN	A	125	L	-	HG3	PRO	V	45
R	-	O	ASN	A	125	L	-	HD2	PRO	V	45
R	-	O	ASN	A	125	L	-	HD3	PRO	V	45
R	-	CG	ASN	A	125	L	-	O	TYR	V	43
R	-	CG	ASN	A	125	L	-	CD1	TYR	V	43
R	-	CG	ASN	A	125	L	-	HB3	TYR	V	43
R	-	CG	ASN	A	125	L	-	HD1	TYR	V	43
R	-	ND2	ASN	A	125	L	-	CD1	TYR	V	43
R	-	ND2	ASN	A	125	L	-	HB3	TYR	V	43
R	-	ND2	ASN	A	125	L	-	HD1	TYR	V	43
R	-	OD1	ASN	A	125	L	-	C	TYR	V	43
R	-	OD1	ASN	A	125	L	-	CB	TYR	V	43
R	-	OD1	ASN	A	125	L	-	O	TYR	V	43
R	-	OD1	ASN	A	125	L	-	CD1	TYR	V	43
R	-	OD1	ASN	A	125	L	-	HB3	TYR	V	43
R	-	OD1	ASN	A	125	L	-	HD1	TYR	V	43
R	-	O	THR	A	127	L	S	HB3	SER	V	76
R	-	O	THR	A	127	L	-	HA2	GLY	V	77
R	S	CA	GLN	A	128	L	S	CB	SER	V	76
R	S	CA	GLN	A	128	L	S	O	SER	V	76
R	S	CA	GLN	A	128	L	S	HB2	SER	V	76
R	S	CA	GLN	A	128	L	S	HB3	SER	V	76
R	S	C	GLN	A	128	L	S	CB	SER	V	76
R	S	C	GLN	A	128	L	S	HB2	SER	V	76
R	S	CB	GLN	A	128	L	S	O	SER	V	76
R	S	CB	GLN	A	128	L	S	HB2	SER	V	76
R	S	CG	GLN	A	128	L	S	O	SER	V	76
R	S	CG	GLN	A	128	L	-	HA3	GLY	V	77
R	S	CD	GLN	A	128	L	-	HA3	GLY	V	77
R	S	NE2	GLN	A	128	L	-	HD3	PRO	V	78
R	S	N	TRP	A	129	L	S	CB	SER	V	76
R	S	N	TRP	A	129	L	S	OG	SER	V	76
R	S	N	TRP	A	129	L	S	HB2	SER	V	76
R	S	N	TRP	A	129	L	S	HB3	SER	V	76
R	S	N	TRP	A	129	L	S	HG	SER	V	76
R	S	CA	TRP	A	129	L	S	OG	SER	V	76
R	S	CA	TRP	A	129	L	S	HB2	SER	V	76
R	S	CA	TRP	A	129	L	S	HG	SER	V	76
R	S	C	TRP	A	129	L	S	HB2	SER	V	76
R	S	CB	TRP	A	129	L	S	CB	SER	V	76
R	S	CB	TRP	A	129	L	S	OG	SER	V	76
R	S	CB	TRP	A	129	L	S	HB2	SER	V	76
R	S	CB	TRP	A	129	L	S	HG	SER	V	76
R	S	O	TRP	A	129	L	S	N	SER	V	76
R	S	O	TRP	A	129	L	S	OG	SER	V	76
R	S	O	TRP	A	129	L	S	H	SER	V	76
R	S	O	TRP	A	129	L	S	HB2	SER	V	76
R	S	CG	TRP	A	129	L	S	HG	SER	V	76
R	S	CD2	TRP	A	129	L	S	HG	SER	V	76
R	S	CE3	TRP	A	129	L	-	HD3	ARG	V	28
R	S	CE3	TRP	A	129	L	-	HE	ARG	V	28
R	S	CE3	TRP	A	129	L	S	OG	SER	V	76
R	S	CE3	TRP	A	129	L	S	HG	SER	V	76
R	S	CH2	TRP	A	129	L	-	HD3	ARG	V	28
R	S	CZ3	TRP	A	129	L	-	CD	ARG	V	28
R	S	CZ3	TRP	A	129	L	-	NE	ARG	V	28
R	S	CZ3	TRP	A	129	L	-	HD3	ARG	V	28
R	S	CZ3	TRP	A	129	L	-	HE	ARG	V	28
R	S	CE1	TYR	A	130	L	S	HB2	LYS	V	75
R	S	OH	TYR	A	130	L	S	HB2	LYS	V	75
R	S	OH	TYR	A	130	L	S	HD2	LYS	V	75
R	S	CZ	TYR	A	130	L	S	HB2	LYS	V	75
R	-	CB	LYS	A	157	L	-	HG	SER	V	25
R	-	CG	LYS	A	157	L	-	HG	SER	V	25
R	-	CD	LYS	A	157	L	-	OG	SER	V	25
R	-	CD	LYS	A	157	L	-	HG	SER	V	25
R	-	CE	LYS	A	157	L	-	HG	SER	V	25
R	-	NZ	LYS	A	157	L	-	HG	SER	V	25
R	-	CB	THR	A	158	L	S	HB3	LYS	V	75
R	-	CG2	THR	A	158	L	S	O	GLN	V	74
R	-	CG2	THR	A	158	L	S	HG2	GLN	V	74
R	-	CG2	THR	A	158	L	S	HB3	LYS	V	75
R	-	OG1	THR	A	158	L	S	HB3	LYS	V	75
R	-	O	ARG	A	159	L	S	CD	LYS	V	75
R	-	O	ARG	A	159	L	S	HD2	LYS	V	75
R	-	O	ARG	A	159	L	S	HD3	LYS	V	75
R	-	O	ARG	A	159	L	S	HZ3	LYS	V	75
R	-	NH1	ARG	A	159	L	S	HZ1	LYS	V	75
R	-	NH1	ARG	A	159	L	S	HZ3	LYS	V	75
R	-	CZ	ARG	A	159	L	S	HZ3	LYS	V	75
R	-	N	VAL	A	161	L	S	HZ2	LYS	V	75
R	-	N	VAL	A	161	L	S	HZ3	LYS	V	75
R	-	CA	VAL	A	161	L	S	NZ	LYS	V	75
R	-	CA	VAL	A	161	L	S	HZ2	LYS	V	75
R	-	CA	VAL	A	161	L	S	HZ3	LYS	V	75
R	-	CB	VAL	A	161	L	S	CE	LYS	V	75
R	-	CB	VAL	A	161	L	S	NZ	LYS	V	75
R	-	CB	VAL	A	161	L	S	HZ1	LYS	V	75
R	-	CB	VAL	A	161	L	S	HZ2	LYS	V	75
R	-	CB	VAL	A	161	L	S	HZ3	LYS	V	75
R	-	CB	VAL	A	161	L	-	O	PRO	V	78
R	-	CB	VAL	A	161	L	-	O	CYS	V	79
R	-	CG1	VAL	A	161	L	S	NZ	LYS	V	75
R	-	CG1	VAL	A	161	L	S	HZ1	LYS	V	75
R	-	CG1	VAL	A	161	L	S	HZ2	LYS	V	75
R	-	CG1	VAL	A	161	L	S	HZ3	LYS	V	75
R	-	CG1	VAL	A	161	L	-	O	PRO	V	78
R	-	CG1	VAL	A	161	L	-	HG2	PRO	V	78
R	-	CG1	VAL	A	161	L	-	O	CYS	V	79
R	-	CG2	VAL	A	161	L	S	CD	LYS	V	75
R	-	CG2	VAL	A	161	L	S	CE	LYS	V	75
R	-	CG2	VAL	A	161	L	S	NZ	LYS	V	75
R	-	CG2	VAL	A	161	L	S	HD2	LYS	V	75
R	-	CG2	VAL	A	161	L	S	HD3	LYS	V	75
R	-	CG2	VAL	A	161	L	S	HE2	LYS	V	75
R	-	CG2	VAL	A	161	L	S	HE3	LYS	V	75
R	-	CG2	VAL	A	161	L	S	HZ1	LYS	V	75
R	-	CG2	VAL	A	161	L	S	HZ2	LYS	V	75
R	-	CG2	VAL	A	161	L	S	HZ3	LYS	V	75
R	-	CG2	VAL	A	161	L	-	O	PRO	V	78
R	-	CG2	VAL	A	161	L	-	O	CYS	V	79
R	-	CG2	VAL	A	161	L	-	HA	CYS	V	79
R	-	O	ALA	A	299	L	-	H	SER	V	25
R	-	O	ALA	A	299	L	-	HB2	SER	V	25
R	-	O	GLN	A	300	L	-	OD1	ASP	V	24
R	-	N	PRO	A	301	L	-	O	SER	V	25
R	-	N	PRO	A	301	L	S	HE21	GLN	V	74
R	-	CA	PRO	A	301	L	-	HB2	ASP	V	24
R	-	CA	PRO	A	301	L	-	C	SER	V	25
R	-	CA	PRO	A	301	L	-	O	SER	V	25
R	-	CA	PRO	A	301	L	-	N	LEU	V	26
R	-	CA	PRO	A	301	L	-	CA	LEU	V	26
R	-	CA	PRO	A	301	L	-	HA	LEU	V	26
R	-	C	PRO	A	301	L	-	HA	LEU	V	26
R	-	CB	PRO	A	301	L	-	C	SER	V	25
R	-	CB	PRO	A	301	L	-	O	SER	V	25
R	-	CB	PRO	A	301	L	-	N	LEU	V	26
R	-	CB	PRO	A	301	L	-	CA	LEU	V	26
R	-	CB	PRO	A	301	L	-	C	LEU	V	26
R	-	CB	PRO	A	301	L	-	O	LEU	V	26
R	-	CB	PRO	A	301	L	-	HA	LEU	V	26
R	-	CB	PRO	A	301	L	-	N	GLY	V	27
R	-	CB	PRO	A	301	L	-	H	GLY	V	27
R	-	CB	PRO	A	301	L	S	HE21	GLN	V	74
R	-	O	PRO	A	301	L	S	HE21	GLN	V	74
R	-	CG	PRO	A	301	L	-	CA	SER	V	25
R	-	CG	PRO	A	301	L	-	C	SER	V	25
R	-	CG	PRO	A	301	L	-	CB	SER	V	25
R	-	CG	PRO	A	301	L	-	O	SER	V	25
R	-	CG	PRO	A	301	L	-	HB2	SER	V	25
R	-	CG	PRO	A	301	L	-	HB3	SER	V	25
R	-	CG	PRO	A	301	L	-	N	LEU	V	26
R	-	CG	PRO	A	301	L	-	CA	LEU	V	26
R	-	CG	PRO	A	301	L	-	C	LEU	V	26
R	-	CG	PRO	A	301	L	-	HA	LEU	V	26
R	-	CG	PRO	A	301	L	-	N	GLY	V	27
R	-	CG	PRO	A	301	L	-	H	GLY	V	27
R	-	CG	PRO	A	301	L	S	HG3	GLN	V	74
R	-	CG	PRO	A	301	L	S	HE21	GLN	V	74
R	-	CD	PRO	A	301	L	-	C	SER	V	25
R	-	CD	PRO	A	301	L	-	O	SER	V	25
R	-	CD	PRO	A	301	L	-	HB2	SER	V	25
R	-	CD	PRO	A	301	L	S	HG3	GLN	V	74
R	-	CD	PRO	A	301	L	S	HE21	GLN	V	74
R	-	N	ALA	A	302	L	-	HB2	ASP	V	24
R	-	N	ALA	A	302	L	-	HA	LEU	V	26
R	-	N	ALA	A	302	L	-	HD11	LEU	V	26
R	-	CA	ALA	A	302	L	-	HD11	LEU	V	26
R	-	C	ALA	A	302	L	-	HG	LEU	V	26
R	-	C	ALA	A	302	L	-	HD11	LEU	V	26
R	-	C	ALA	A	302	L	-	HD13	LEU	V	26
R	-	CB	ALA	A	302	L	-	HD11	LEU	V	26
R	-	CB	ALA	A	302	L	-	HD13	LEU	V	26
R	-	O	ALA	A	302	L	-	CG	LEU	V	26
R	-	O	ALA	A	302	L	-	CD1	LEU	V	26
R	-	O	ALA	A	302	L	-	HA	LEU	V	26
R	-	O	ALA	A	302	L	-	HG	LEU	V	26
R	-	O	ALA	A	302	L	-	HD11	LEU	V	26
R	-	O	ALA	A	302	L	-	HD13	LEU	V	26
R	-	CA	PRO	A	303	L	-	O	THR	V	49
R	-	CA	PRO	A	303	L	-	HB	THR	V	49
R	-	C	PRO	A	303	L	-	HB	THR	V	49
R	-	CB	PRO	A	303	L	-	O	THR	V	49
R	-	N	ALA	A	304	L	-	HG	LEU	V	26
R	-	N	ALA	A	304	L	-	HD22	LEU	V	26
R	-	N	ALA	A	304	L	-	CB	THR	V	49
R	-	N	ALA	A	304	L	-	OG1	THR	V	49
R	-	N	ALA	A	304	L	-	HB	THR	V	49
R	-	N	ALA	A	304	L	-	HG1	THR	V	49
R	-	N	ALA	A	304	L	-	HG21	THR	V	49
R	-	CA	ALA	A	304	L	-	HD22	LEU	V	26
R	-	CA	ALA	A	304	L	-	HB	THR	V	49
R	-	CA	ALA	A	304	L	-	HG1	THR	V	49
R	-	C	ALA	A	304	L	-	HG1	THR	V	49
R	-	CB	ALA	A	304	L	-	HD21	LEU	V	26
R	-	CB	ALA	A	304	L	-	HD22	LEU	V	26
R	-	CB	ALA	A	304	L	-	CB	THR	V	49
R	-	CB	ALA	A	304	L	-	OG1	THR	V	49
R	-	CB	ALA	A	304	L	-	HB	THR	V	49
R	-	CB	ALA	A	304	L	-	HG1	THR	V	49
R	-	CB	ALA	A	304	L	-	HG21	THR	V	49
R	-	CB	ALA	A	304	L	-	O	SER	V	70
R	-	CB	ALA	A	304	L	-	HA	ILE	V	71
R	-	CB	ALA	A	304	L	-	H	LEU	V	72
R	-	CB	ALA	A	304	L	-	HG	LEU	V	72
R	-	O	ALA	A	304	L	-	HG1	THR	V	49
R	-	CA	SER	A	306	L	-	H	SER	V	70
R	-	CB	SER	A	306	L	-	HB	THR	V	69
R	-	CB	SER	A	306	L	-	HG22	THR	V	69
R	-	OG	SER	A	306	L	-	HB	THR	V	69
R	-	OG	SER	A	306	L	-	HG12	ILE	V	71
R	-	N	PRO	A	307	L	-	HA	THR	V	69
R	-	N	PRO	A	307	L	-	H	SER	V	70
R	-	CA	PRO	A	307	L	-	HA	THR	V	69
R	-	C	PRO	A	307	L	-	O	GLN	V	68
R	-	C	PRO	A	307	L	-	HA	THR	V	69
R	-	C	PRO	A	307	L	-	HG22	THR	V	69
R	-	CB	PRO	A	307	L	-	O	GLN	V	68
R	-	CB	PRO	A	307	L	-	HA	THR	V	69
R	-	O	PRO	A	307	L	-	C	GLN	V	68
R	-	O	PRO	A	307	L	-	O	GLN	V	68
R	-	O	PRO	A	307	L	-	HA	THR	V	69
R	-	O	PRO	A	307	L	-	HG22	THR	V	69
R	-	CG	PRO	A	307	L	-	O	GLN	V	68
R	-	CG	PRO	A	307	L	-	CA	THR	V	69
R	-	CG	PRO	A	307	L	-	C	THR	V	69
R	-	CG	PRO	A	307	L	-	HA	THR	V	69
R	-	CG	PRO	A	307	L	-	N	SER	V	70
R	-	CG	PRO	A	307	L	-	CB	SER	V	70
R	-	CG	PRO	A	307	L	-	H	SER	V	70
R	-	CG	PRO	A	307	L	-	HB2	SER	V	70
R	-	CG	PRO	A	307	L	-	HB3	SER	V	70
R	-	CD	PRO	A	307	L	-	CA	THR	V	69
R	-	CD	PRO	A	307	L	-	C	THR	V	69
R	-	CD	PRO	A	307	L	-	HA	THR	V	69
R	-	CD	PRO	A	307	L	-	HB	THR	V	69
R	-	CD	PRO	A	307	L	-	N	SER	V	70
R	-	CD	PRO	A	307	L	-	CA	SER	V	70
R	-	CD	PRO	A	307	L	-	CB	SER	V	70
R	-	CD	PRO	A	307	L	-	H	SER	V	70
R	-	CD	PRO	A	307	L	-	HB2	SER	V	70
R	-	CD	PRO	A	307	L	-	HB3	SER	V	70
R	-	CA	GLY	A	310	L	-	HB3	GLN	V	68
R	-	C	GLY	A	310	L	-	CD	GLN	V	68
R	-	C	GLY	A	310	L	-	NE2	GLN	V	68
R	-	C	GLY	A	310	L	-	OE1	GLN	V	68
R	-	C	GLY	A	310	L	-	HE22	GLN	V	68
R	-	O	GLY	A	310	L	-	NE2	GLN	V	68
R	-	O	GLY	A	310	L	-	OE1	GLN	V	68
R	-	O	GLY	A	310	L	-	HE22	GLN	V	68
R	H	N	PRO	A	311	L	-	CD	GLN	V	68
R	H	N	PRO	A	311	L	-	NE2	GLN	V	68
R	H	N	PRO	A	311	L	-	OE1	GLN	V	68
R	H	N	PRO	A	311	L	-	HE22	GLN	V	68
R	H	CA	PRO	A	311	L	-	CD	GLN	V	68
R	H	CA	PRO	A	311	L	-	OE1	GLN	V	68
R	H	CA	PRO	A	311	L	-	HE22	GLN	V	68
R	H	CB	PRO	A	311	L	-	CD	GLN	V	68
R	H	CB	PRO	A	311	L	-	OE1	GLN	V	68
R	H	CB	PRO	A	311	L	-	HE22	GLN	V	68
R	H	CG	PRO	A	311	L	-	CD	GLN	V	68
R	H	CG	PRO	A	311	L	-	OE1	GLN	V	68
R	H	CG	PRO	A	311	L	-	HB2	GLN	V	68
R	H	CD	PRO	A	311	L	-	CD	GLN	V	68
R	H	CD	PRO	A	311	L	-	OE1	GLN	V	68
R	H	CD	PRO	A	311	L	-	HB2	GLN	V	68
R	H	OG	SER	A	314	L	-	HE22	GLN	V	68

- 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