IID

P47888_Q8NGE3.1 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	S	SER	A	102	L	H	TYR	V	103
R	H	TYR	A	103	L	H	GLN	V	96
R	H	ASP	A	104	L	H	ALA	V	100
R	H	ASP	A	104	L	H	TYR	V	103
R	H	ASP	A	104	L	H	GLN	V	96
R	H	ASP	A	104	L	H	ALA	V	99
R	H	ALA	A	105	L	H	ALA	V	100
R	H	ALA	A	105	L	H	VAL	V	104
R	H	LEU	A	107	L	H	GLN	V	96
R	H	SER	A	108	L	H	ALA	V	100
R	H	PHE	A	111	L	H	ARG	V	80
R	H	PHE	A	112	L	H	THR	V	75
R	H	PHE	A	112	L	H	ASP	V	76
R	H	PHE	A	112	L	H	PRO	V	79
R	H	PHE	A	112	L	H	ARG	V	80
R	H	LEU	A	115	L	H	ALA	V	83
R	H	ALA	A	155	L	-	GLY	V	86
R	H	ALA	A	155	L	-	PRO	V	88
R	H	TRP	A	158	L	H	PHE	V	28
R	H	TRP	A	158	L	H	ALA	V	83
R	H	TRP	A	158	L	-	GLY	V	86
R	H	PHE	A	162	L	H	ARG	V	80
R	H	PHE	A	162	L	H	ALA	V	83
R	H	PHE	A	162	L	S	GLN	V	91
R	H	PHE	A	162	L	S	ALA	V	92
R	H	LEU	A	166	L	H	ARG	V	80
R	H	LEU	A	166	L	S	ALA	V	92
R	H	LEU	A	166	L	S	ILE	V	93
R	H	LEU	A	166	L	-	SER	V	94
R	H	THR	A	169	L	-	SER	V	94
R	H	VAL	A	170	L	-	GLU	V	11
R	H	VAL	A	170	L	-	SER	V	94
R	H	SER	A	173	L	-	SER	V	94
R	H	SER	A	173	L	H	GLN	V	96
R	H	THR	A	174	L	H	GLN	V	96
R	H	PHE	A	37	L	H	GLN	V	50
R	H	LEU	A	41	L	H	LEU	V	47
R	H	TYR	A	44	L	H	LEU	V	39
R	H	TYR	A	44	L	H	SER	V	43
R	H	TYR	A	44	L	H	LEU	V	71
R	H	LEU	A	45	L	H	LEU	V	40
R	H	LEU	A	45	L	H	SER	V	43
R	H	LEU	A	45	L	H	LEU	V	47
R	H	THR	A	48	L	H	LEU	V	40
R	H	GLY	A	49	L	H	LEU	V	40
R	H	LEU	A	52	L	H	LEU	V	36
R	H	LEU	A	52	L	H	LEU	V	40
R	H	LEU	A	55	L	H	TRP	V	29
R	H	LEU	A	55	L	H	LEU	V	32
R	H	LEU	A	55	L	H	LEU	V	36
R	H	PHE	A	70	L	H	TRP	V	29
R	H	GLY	A	73	L	H	TRP	V	29
R	H	ASN	A	74	L	H	PHE	V	28
R	H	ASN	A	74	L	H	TRP	V	29
R	H	VAL	A	77	L	H	TRP	V	29
R	H	VAL	A	77	L	H	LEU	V	32
R	H	VAL	A	77	L	H	LEU	V	36
R	H	VAL	A	77	L	H	LEU	V	82
R	H	VAL	A	80	L	H	LEU	V	36
R	H	VAL	A	80	L	H	LEU	V	39
R	H	GLY	A	81	L	H	TYR	V	35
R	H	THR	A	84	L	H	TYR	V	35
R	H	THR	A	84	L	H	LEU	V	39
R	H	THR	A	84	L	H	THR	V	75
R	H	VAL	A	85	L	H	THR	V	75
R	H	PRO	A	88	L	H	LEU	V	71
R	H	PRO	A	88	L	H	PHE	V	72
R	H	ALA	A	89	L	H	PHE	V	72
R	H	GLY	A	92	L	H	PHE	V	72
R	H	LEU	A	95	L	H	GLN	V	50

- 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

P47888_Q8NGE3.1 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	CE1	PHE	A	37	L	H	CD	GLN	V	50
R	H	CE1	PHE	A	37	L	H	NE2	GLN	V	50
R	H	CE1	PHE	A	37	L	H	OE1	GLN	V	50
R	H	CE1	PHE	A	37	L	H	HE22	GLN	V	50
R	H	CE2	PHE	A	37	L	H	HE22	GLN	V	50
R	H	CZ	PHE	A	37	L	H	CD	GLN	V	50
R	H	CZ	PHE	A	37	L	H	NE2	GLN	V	50
R	H	CZ	PHE	A	37	L	H	OE1	GLN	V	50
R	H	CZ	PHE	A	37	L	H	HE22	GLN	V	50
R	H	CG	LEU	A	41	L	H	CD1	LEU	V	47
R	H	CG	LEU	A	41	L	H	HB3	LEU	V	47
R	H	CG	LEU	A	41	L	H	HD13	LEU	V	47
R	H	CD1	LEU	A	41	L	H	HB3	LEU	V	47
R	H	CD1	LEU	A	41	L	H	HD13	LEU	V	47
R	H	CD2	LEU	A	41	L	H	CD1	LEU	V	47
R	H	CD2	LEU	A	41	L	H	HA	LEU	V	47
R	H	CD2	LEU	A	41	L	H	HB3	LEU	V	47
R	H	CD2	LEU	A	41	L	H	HD11	LEU	V	47
R	H	CD2	LEU	A	41	L	H	HD12	LEU	V	47
R	H	CD2	LEU	A	41	L	H	HD13	LEU	V	47
R	H	CD1	TYR	A	44	L	H	CB	SER	V	43
R	H	CD1	TYR	A	44	L	H	OG	SER	V	43
R	H	CD1	TYR	A	44	L	H	HB2	SER	V	43
R	H	CD1	TYR	A	44	L	H	HB3	SER	V	43
R	H	CD1	TYR	A	44	L	H	HG	SER	V	43
R	H	CE1	TYR	A	44	L	H	HB2	LEU	V	39
R	H	CE1	TYR	A	44	L	H	CB	SER	V	43
R	H	CE1	TYR	A	44	L	H	OG	SER	V	43
R	H	CE1	TYR	A	44	L	H	HB2	SER	V	43
R	H	CE1	TYR	A	44	L	H	HB3	SER	V	43
R	H	CE1	TYR	A	44	L	H	HG	SER	V	43
R	H	CE2	TYR	A	44	L	H	HD12	LEU	V	39
R	H	OH	TYR	A	44	L	H	CA	LEU	V	39
R	H	OH	TYR	A	44	L	H	C	LEU	V	39
R	H	OH	TYR	A	44	L	H	CB	LEU	V	39
R	H	OH	TYR	A	44	L	H	O	LEU	V	39
R	H	OH	TYR	A	44	L	H	CG	LEU	V	39
R	H	OH	TYR	A	44	L	H	CD1	LEU	V	39
R	H	OH	TYR	A	44	L	H	CD2	LEU	V	39
R	H	OH	TYR	A	44	L	H	HA	LEU	V	39
R	H	OH	TYR	A	44	L	H	HB2	LEU	V	39
R	H	OH	TYR	A	44	L	H	HB3	LEU	V	39
R	H	OH	TYR	A	44	L	H	HD12	LEU	V	39
R	H	OH	TYR	A	44	L	H	HD21	LEU	V	39
R	H	OH	TYR	A	44	L	H	HD23	LEU	V	39
R	H	OH	TYR	A	44	L	H	OG	SER	V	43
R	H	OH	TYR	A	44	L	H	HG	SER	V	43
R	H	OH	TYR	A	44	L	H	CD2	LEU	V	71
R	H	OH	TYR	A	44	L	H	HD22	LEU	V	71
R	H	OH	TYR	A	44	L	H	HD23	LEU	V	71
R	H	CZ	TYR	A	44	L	H	HB2	LEU	V	39
R	H	CZ	TYR	A	44	L	H	HD12	LEU	V	39
R	H	CZ	TYR	A	44	L	H	HD23	LEU	V	39
R	H	CZ	TYR	A	44	L	H	OG	SER	V	43
R	H	CZ	TYR	A	44	L	H	HG	SER	V	43
R	H	CG	LEU	A	45	L	H	HD22	LEU	V	47
R	H	CD1	LEU	A	45	L	H	CD2	LEU	V	47
R	H	CD1	LEU	A	45	L	H	HB3	LEU	V	47
R	H	CD1	LEU	A	45	L	H	HD13	LEU	V	47
R	H	CD1	LEU	A	45	L	H	HD21	LEU	V	47
R	H	CD1	LEU	A	45	L	H	HD22	LEU	V	47
R	H	CD1	LEU	A	45	L	H	HD23	LEU	V	47
R	H	CD2	LEU	A	45	L	H	HD11	LEU	V	40
R	H	CD2	LEU	A	45	L	H	CB	SER	V	43
R	H	CD2	LEU	A	45	L	H	HB2	SER	V	43
R	H	CD2	LEU	A	45	L	H	HB3	SER	V	43
R	H	CD2	LEU	A	45	L	H	HD22	LEU	V	47
R	H	OG1	THR	A	48	L	H	HD11	LEU	V	40
R	H	OG1	THR	A	48	L	H	HD12	LEU	V	40
R	H	N	GLY	A	49	L	H	HD12	LEU	V	40
R	H	CA	GLY	A	49	L	H	HD12	LEU	V	40
R	H	N	LEU	A	52	L	H	HD12	LEU	V	36
R	H	CA	LEU	A	52	L	H	HD12	LEU	V	36
R	H	CB	LEU	A	52	L	H	HB3	LEU	V	36
R	H	CB	LEU	A	52	L	H	HD12	LEU	V	36
R	H	CG	LEU	A	52	L	H	CB	LEU	V	36
R	H	CG	LEU	A	52	L	H	CG	LEU	V	36
R	H	CG	LEU	A	52	L	H	CD1	LEU	V	36
R	H	CG	LEU	A	52	L	H	CD2	LEU	V	36
R	H	CG	LEU	A	52	L	H	HB2	LEU	V	36
R	H	CG	LEU	A	52	L	H	HB3	LEU	V	36
R	H	CG	LEU	A	52	L	H	HD12	LEU	V	36
R	H	CG	LEU	A	52	L	H	HD22	LEU	V	36
R	H	CD1	LEU	A	52	L	H	CA	LEU	V	36
R	H	CD1	LEU	A	52	L	H	C	LEU	V	36
R	H	CD1	LEU	A	52	L	H	CB	LEU	V	36
R	H	CD1	LEU	A	52	L	H	O	LEU	V	36
R	H	CD1	LEU	A	52	L	H	HA	LEU	V	36
R	H	CD1	LEU	A	52	L	H	HB2	LEU	V	36
R	H	CD1	LEU	A	52	L	H	HB3	LEU	V	36
R	H	CD1	LEU	A	52	L	H	HD12	LEU	V	36
R	H	CD1	LEU	A	52	L	H	HD22	LEU	V	36
R	H	CD1	LEU	A	52	L	H	HB2	LEU	V	40
R	H	CD1	LEU	A	52	L	H	HD22	LEU	V	40
R	H	CD2	LEU	A	52	L	H	CA	LEU	V	36
R	H	CD2	LEU	A	52	L	H	CB	LEU	V	36
R	H	CD2	LEU	A	52	L	H	CG	LEU	V	36
R	H	CD2	LEU	A	52	L	H	CD1	LEU	V	36
R	H	CD2	LEU	A	52	L	H	CD2	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HA	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HB2	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HB3	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HG	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HD11	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HD12	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HD13	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HD21	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HD22	LEU	V	36
R	H	CD2	LEU	A	52	L	H	HD23	LEU	V	36
R	H	CD1	LEU	A	55	L	H	CZ3	TRP	V	29
R	H	CD1	LEU	A	55	L	H	HZ3	TRP	V	29
R	H	CD2	LEU	A	55	L	H	HG	LEU	V	32
R	H	CD2	LEU	A	55	L	H	HD22	LEU	V	32
R	H	CD2	LEU	A	55	L	H	CD1	LEU	V	36
R	H	CD2	LEU	A	55	L	H	HD11	LEU	V	36
R	H	CD2	LEU	A	55	L	H	HD12	LEU	V	36
R	H	CD2	LEU	A	55	L	H	HD13	LEU	V	36
R	H	O	PHE	A	70	L	H	HH2	TRP	V	29
R	H	CD2	PHE	A	70	L	H	HZ2	TRP	V	29
R	H	CE2	PHE	A	70	L	H	CZ2	TRP	V	29
R	H	CE2	PHE	A	70	L	H	HZ2	TRP	V	29
R	H	CZ	PHE	A	70	L	H	HZ2	TRP	V	29
R	H	C	GLY	A	73	L	H	HH2	TRP	V	29
R	H	C	GLY	A	73	L	H	HZ3	TRP	V	29
R	H	O	GLY	A	73	L	H	HZ3	TRP	V	29
R	H	N	ASN	A	74	L	H	HH2	TRP	V	29
R	H	CA	ASN	A	74	L	H	HH2	TRP	V	29
R	H	CB	ASN	A	74	L	H	HH2	TRP	V	29
R	H	CG	ASN	A	74	L	H	CH2	TRP	V	29
R	H	CG	ASN	A	74	L	H	HH2	TRP	V	29
R	H	ND2	ASN	A	74	L	H	CH2	TRP	V	29
R	H	ND2	ASN	A	74	L	H	CZ2	TRP	V	29
R	H	ND2	ASN	A	74	L	H	HH2	TRP	V	29
R	H	ND2	ASN	A	74	L	H	HZ2	TRP	V	29
R	H	OD1	ASN	A	74	L	H	HE1	PHE	V	28
R	H	OD1	ASN	A	74	L	H	CH2	TRP	V	29
R	H	OD1	ASN	A	74	L	H	HH2	TRP	V	29
R	H	N	VAL	A	77	L	H	HD22	LEU	V	32
R	H	CA	VAL	A	77	L	H	CD1	LEU	V	32
R	H	CA	VAL	A	77	L	H	HD12	LEU	V	32
R	H	CA	VAL	A	77	L	H	HD22	LEU	V	32
R	H	CA	VAL	A	77	L	H	HD13	LEU	V	36
R	H	C	VAL	A	77	L	H	HD12	LEU	V	32
R	H	CB	VAL	A	77	L	H	CG	LEU	V	32
R	H	CB	VAL	A	77	L	H	CD1	LEU	V	32
R	H	CB	VAL	A	77	L	H	CD2	LEU	V	32
R	H	CB	VAL	A	77	L	H	HG	LEU	V	32
R	H	CB	VAL	A	77	L	H	HD12	LEU	V	32
R	H	CB	VAL	A	77	L	H	HD13	LEU	V	32
R	H	CB	VAL	A	77	L	H	HD21	LEU	V	32
R	H	CB	VAL	A	77	L	H	HD22	LEU	V	32
R	H	CB	VAL	A	77	L	H	HD23	LEU	V	32
R	H	O	VAL	A	77	L	H	HD12	LEU	V	32
R	H	O	VAL	A	77	L	H	HD23	LEU	V	36
R	H	CG1	VAL	A	77	L	H	CG	LEU	V	32
R	H	CG1	VAL	A	77	L	H	CD1	LEU	V	32
R	H	CG1	VAL	A	77	L	H	CD2	LEU	V	32
R	H	CG1	VAL	A	77	L	H	HG	LEU	V	32
R	H	CG1	VAL	A	77	L	H	HD11	LEU	V	32
R	H	CG1	VAL	A	77	L	H	HD12	LEU	V	32
R	H	CG1	VAL	A	77	L	H	HD13	LEU	V	32
R	H	CG1	VAL	A	77	L	H	HD21	LEU	V	32
R	H	CG1	VAL	A	77	L	H	HD22	LEU	V	32
R	H	CG1	VAL	A	77	L	H	HD23	LEU	V	32
R	H	CG1	VAL	A	77	L	H	HD13	LEU	V	82
R	H	CG2	VAL	A	77	L	H	HZ3	TRP	V	29
R	H	CG2	VAL	A	77	L	H	CG	LEU	V	32
R	H	CG2	VAL	A	77	L	H	CD1	LEU	V	32
R	H	CG2	VAL	A	77	L	H	CD2	LEU	V	32
R	H	CG2	VAL	A	77	L	H	HG	LEU	V	32
R	H	CG2	VAL	A	77	L	H	HD12	LEU	V	32
R	H	CG2	VAL	A	77	L	H	HD13	LEU	V	32
R	H	CG2	VAL	A	77	L	H	HD21	LEU	V	32
R	H	CG2	VAL	A	77	L	H	HD22	LEU	V	32
R	H	CG2	VAL	A	77	L	H	HD23	LEU	V	32
R	H	CG2	VAL	A	77	L	H	HD13	LEU	V	36
R	H	CA	VAL	A	80	L	H	HD23	LEU	V	36
R	H	CB	VAL	A	80	L	H	CD2	LEU	V	36
R	H	CB	VAL	A	80	L	H	HD21	LEU	V	36
R	H	CB	VAL	A	80	L	H	HD22	LEU	V	36
R	H	CB	VAL	A	80	L	H	HD23	LEU	V	36
R	H	O	VAL	A	80	L	H	HD12	LEU	V	39
R	H	CG1	VAL	A	80	L	H	CG	LEU	V	36
R	H	CG1	VAL	A	80	L	H	CD2	LEU	V	36
R	H	CG1	VAL	A	80	L	H	HA	LEU	V	36
R	H	CG1	VAL	A	80	L	H	HD21	LEU	V	36
R	H	CG1	VAL	A	80	L	H	HD22	LEU	V	36
R	H	CG1	VAL	A	80	L	H	HD23	LEU	V	36
R	H	CG1	VAL	A	80	L	H	CD1	LEU	V	39
R	H	CG1	VAL	A	80	L	H	HD11	LEU	V	39
R	H	CG1	VAL	A	80	L	H	HD12	LEU	V	39
R	H	CG1	VAL	A	80	L	H	HD13	LEU	V	39
R	H	CG2	VAL	A	80	L	H	CD2	LEU	V	36
R	H	CG2	VAL	A	80	L	H	HD12	LEU	V	36
R	H	CG2	VAL	A	80	L	H	HD21	LEU	V	36
R	H	CG2	VAL	A	80	L	H	HD22	LEU	V	36
R	H	CG2	VAL	A	80	L	H	HD23	LEU	V	36
R	H	N	GLY	A	81	L	H	HE1	TYR	V	35
R	H	CA	GLY	A	81	L	H	HE1	TYR	V	35
R	H	C	THR	A	84	L	H	HG21	THR	V	75
R	H	C	THR	A	84	L	H	HG22	THR	V	75
R	H	CB	THR	A	84	L	H	OH	TYR	V	35
R	H	CB	THR	A	84	L	H	HH	TYR	V	35
R	H	CB	THR	A	84	L	H	CD1	LEU	V	39
R	H	CB	THR	A	84	L	H	HD11	LEU	V	39
R	H	CB	THR	A	84	L	H	HD12	LEU	V	39
R	H	CB	THR	A	84	L	H	HD22	LEU	V	39
R	H	CB	THR	A	84	L	H	HD23	LEU	V	39
R	H	O	THR	A	84	L	H	CG2	THR	V	75
R	H	O	THR	A	84	L	H	HG21	THR	V	75
R	H	O	THR	A	84	L	H	HG22	THR	V	75
R	H	CG2	THR	A	84	L	H	OH	TYR	V	35
R	H	CG2	THR	A	84	L	H	CZ	TYR	V	35
R	H	CG2	THR	A	84	L	H	HH	TYR	V	35
R	H	CG2	THR	A	84	L	H	CG	LEU	V	39
R	H	CG2	THR	A	84	L	H	CD1	LEU	V	39
R	H	CG2	THR	A	84	L	H	CD2	LEU	V	39
R	H	CG2	THR	A	84	L	H	HD11	LEU	V	39
R	H	CG2	THR	A	84	L	H	HD12	LEU	V	39
R	H	CG2	THR	A	84	L	H	HD22	LEU	V	39
R	H	CG2	THR	A	84	L	H	HD23	LEU	V	39
R	H	CG2	THR	A	84	L	H	OG1	THR	V	75
R	H	CG2	THR	A	84	L	H	HG1	THR	V	75
R	H	CG2	THR	A	84	L	H	HG21	THR	V	75
R	H	CG2	THR	A	84	L	H	HG22	THR	V	75
R	H	OG1	THR	A	84	L	H	OH	TYR	V	35
R	H	OG1	THR	A	84	L	H	HH	TYR	V	35
R	H	OG1	THR	A	84	L	H	CG	LEU	V	39
R	H	OG1	THR	A	84	L	H	CD1	LEU	V	39
R	H	OG1	THR	A	84	L	H	CD2	LEU	V	39
R	H	OG1	THR	A	84	L	H	HD11	LEU	V	39
R	H	OG1	THR	A	84	L	H	HD12	LEU	V	39
R	H	OG1	THR	A	84	L	H	HD13	LEU	V	39
R	H	OG1	THR	A	84	L	H	HD22	LEU	V	39
R	H	OG1	THR	A	84	L	H	HD23	LEU	V	39
R	H	N	VAL	A	85	L	H	HG21	THR	V	75
R	H	CA	VAL	A	85	L	H	HG21	THR	V	75
R	H	C	PRO	A	88	L	H	HE1	PHE	V	72
R	H	C	PRO	A	88	L	H	HZ	PHE	V	72
R	H	CB	PRO	A	88	L	H	HB3	LEU	V	71
R	H	CB	PRO	A	88	L	H	HD13	LEU	V	71
R	H	O	PRO	A	88	L	H	CZ	PHE	V	72
R	H	O	PRO	A	88	L	H	HZ	PHE	V	72
R	H	CG	PRO	A	88	L	H	HD13	LEU	V	71
R	H	N	ALA	A	89	L	H	CE1	PHE	V	72
R	H	N	ALA	A	89	L	H	CZ	PHE	V	72
R	H	N	ALA	A	89	L	H	HE1	PHE	V	72
R	H	N	ALA	A	89	L	H	HZ	PHE	V	72
R	H	CA	ALA	A	89	L	H	CE1	PHE	V	72
R	H	CA	ALA	A	89	L	H	CZ	PHE	V	72
R	H	CA	ALA	A	89	L	H	HE1	PHE	V	72
R	H	CA	ALA	A	89	L	H	HZ	PHE	V	72
R	H	C	ALA	A	89	L	H	HE1	PHE	V	72
R	H	C	ALA	A	89	L	H	HZ	PHE	V	72
R	H	CB	ALA	A	89	L	H	CE1	PHE	V	72
R	H	CB	ALA	A	89	L	H	CZ	PHE	V	72
R	H	CB	ALA	A	89	L	H	HE1	PHE	V	72
R	H	CB	ALA	A	89	L	H	HZ	PHE	V	72
R	H	O	ALA	A	89	L	H	HZ	PHE	V	72
R	H	CA	GLY	A	92	L	H	HZ	PHE	V	72
R	H	CG	LEU	A	95	L	H	NE2	GLN	V	50
R	H	CG	LEU	A	95	L	H	HE21	GLN	V	50
R	H	CG	LEU	A	95	L	H	HE22	GLN	V	50
R	H	CD1	LEU	A	95	L	H	NE2	GLN	V	50
R	H	CD1	LEU	A	95	L	H	HE21	GLN	V	50
R	H	CD1	LEU	A	95	L	H	HE22	GLN	V	50
R	H	CD2	LEU	A	95	L	H	NE2	GLN	V	50
R	H	CD2	LEU	A	95	L	H	HE21	GLN	V	50
R	H	CD2	LEU	A	95	L	H	HE22	GLN	V	50
R	S	OG	SER	A	102	L	H	HE1	TYR	V	103
R	H	CE1	TYR	A	103	L	H	CD	GLN	V	96
R	H	CE1	TYR	A	103	L	H	OE1	GLN	V	96
R	H	CE1	TYR	A	103	L	H	HB3	GLN	V	96
R	H	OH	TYR	A	103	L	H	CD	GLN	V	96
R	H	OH	TYR	A	103	L	H	NE2	GLN	V	96
R	H	OH	TYR	A	103	L	H	OE1	GLN	V	96
R	H	OH	TYR	A	103	L	H	HB3	GLN	V	96
R	H	OH	TYR	A	103	L	H	HE22	GLN	V	96
R	H	CZ	TYR	A	103	L	H	CD	GLN	V	96
R	H	CZ	TYR	A	103	L	H	OE1	GLN	V	96
R	H	N	ASP	A	104	L	H	HB1	ALA	V	100
R	H	N	ASP	A	104	L	H	HB2	ALA	V	100
R	H	CA	ASP	A	104	L	H	CA	ALA	V	100
R	H	CA	ASP	A	104	L	H	CB	ALA	V	100
R	H	CA	ASP	A	104	L	H	HA	ALA	V	100
R	H	CA	ASP	A	104	L	H	HB1	ALA	V	100
R	H	CA	ASP	A	104	L	H	HB2	ALA	V	100
R	H	CA	ASP	A	104	L	H	HB3	ALA	V	100
R	H	C	ASP	A	104	L	H	CB	ALA	V	100
R	H	C	ASP	A	104	L	H	HB1	ALA	V	100
R	H	C	ASP	A	104	L	H	HB2	ALA	V	100
R	H	C	ASP	A	104	L	H	HB3	ALA	V	100
R	H	CB	ASP	A	104	L	H	N	ALA	V	100
R	H	CB	ASP	A	104	L	H	CA	ALA	V	100
R	H	CB	ASP	A	104	L	H	C	ALA	V	100
R	H	CB	ASP	A	104	L	H	CB	ALA	V	100
R	H	CB	ASP	A	104	L	H	O	ALA	V	100
R	H	CB	ASP	A	104	L	H	H	ALA	V	100
R	H	CB	ASP	A	104	L	H	HA	ALA	V	100
R	H	CB	ASP	A	104	L	H	HB1	ALA	V	100
R	H	CB	ASP	A	104	L	H	HB2	ALA	V	100
R	H	CB	ASP	A	104	L	H	HB3	ALA	V	100
R	H	O	ASP	A	104	L	H	CB	ALA	V	100
R	H	O	ASP	A	104	L	H	HB1	ALA	V	100
R	H	O	ASP	A	104	L	H	HB2	ALA	V	100
R	H	O	ASP	A	104	L	H	HB3	ALA	V	100
R	H	CG	ASP	A	104	L	H	C	ALA	V	99
R	H	CG	ASP	A	104	L	H	N	ALA	V	100
R	H	CG	ASP	A	104	L	H	CA	ALA	V	100
R	H	CG	ASP	A	104	L	H	CB	ALA	V	100
R	H	CG	ASP	A	104	L	H	H	ALA	V	100
R	H	CG	ASP	A	104	L	H	HA	ALA	V	100
R	H	CG	ASP	A	104	L	H	HB1	ALA	V	100
R	H	CG	ASP	A	104	L	H	HB2	ALA	V	100
R	H	CG	ASP	A	104	L	H	HB3	ALA	V	100
R	H	OD1	ASP	A	104	L	H	O	GLN	V	96
R	H	OD1	ASP	A	104	L	H	HB3	GLN	V	96
R	H	OD1	ASP	A	104	L	H	HB2	ALA	V	99
R	H	OD1	ASP	A	104	L	H	N	ALA	V	100
R	H	OD1	ASP	A	104	L	H	CA	ALA	V	100
R	H	OD1	ASP	A	104	L	H	CB	ALA	V	100
R	H	OD1	ASP	A	104	L	H	H	ALA	V	100
R	H	OD1	ASP	A	104	L	H	HA	ALA	V	100
R	H	OD1	ASP	A	104	L	H	HB1	ALA	V	100
R	H	OD1	ASP	A	104	L	H	HB2	ALA	V	100
R	H	OD1	ASP	A	104	L	H	HB3	ALA	V	100
R	H	OD2	ASP	A	104	L	H	C	ALA	V	99
R	H	OD2	ASP	A	104	L	H	O	ALA	V	99
R	H	OD2	ASP	A	104	L	H	N	ALA	V	100
R	H	OD2	ASP	A	104	L	H	CA	ALA	V	100
R	H	OD2	ASP	A	104	L	H	CB	ALA	V	100
R	H	OD2	ASP	A	104	L	H	H	ALA	V	100
R	H	OD2	ASP	A	104	L	H	HA	ALA	V	100
R	H	OD2	ASP	A	104	L	H	HB2	ALA	V	100
R	H	OD2	ASP	A	104	L	H	CB	TYR	V	103
R	H	OD2	ASP	A	104	L	H	HB2	TYR	V	103
R	H	OD2	ASP	A	104	L	H	HB3	TYR	V	103
R	H	N	ALA	A	105	L	H	HB1	ALA	V	100
R	H	CA	ALA	A	105	L	H	HB1	ALA	V	100
R	H	CA	ALA	A	105	L	H	HG22	VAL	V	104
R	H	CB	ALA	A	105	L	H	HG22	VAL	V	104
R	H	CB	ALA	A	105	L	H	HG23	VAL	V	104
R	H	CD1	LEU	A	107	L	H	CB	GLN	V	96
R	H	CD1	LEU	A	107	L	H	OE1	GLN	V	96
R	H	CD1	LEU	A	107	L	H	HB2	GLN	V	96
R	H	CD1	LEU	A	107	L	H	HB3	GLN	V	96
R	H	OG	SER	A	108	L	H	CB	ALA	V	100
R	H	OG	SER	A	108	L	H	HB1	ALA	V	100
R	H	OG	SER	A	108	L	H	HB3	ALA	V	100
R	H	CE1	PHE	A	111	L	H	HG3	ARG	V	80
R	H	CE2	PHE	A	111	L	H	NH2	ARG	V	80
R	H	CE2	PHE	A	111	L	H	HH21	ARG	V	80
R	H	CE2	PHE	A	111	L	H	HH22	ARG	V	80
R	H	CZ	PHE	A	111	L	H	NH2	ARG	V	80
R	H	CZ	PHE	A	111	L	H	CZ	ARG	V	80
R	H	CZ	PHE	A	111	L	H	HG3	ARG	V	80
R	H	CZ	PHE	A	111	L	H	HH21	ARG	V	80
R	H	CB	PHE	A	112	L	H	HB2	PRO	V	79
R	H	CG	PHE	A	112	L	H	CB	PRO	V	79
R	H	CG	PHE	A	112	L	H	HB2	PRO	V	79
R	H	CG	PHE	A	112	L	H	HB3	PRO	V	79
R	H	CG	PHE	A	112	L	H	HG3	PRO	V	79
R	H	CD1	PHE	A	112	L	H	CA	PRO	V	79
R	H	CD1	PHE	A	112	L	H	C	PRO	V	79
R	H	CD1	PHE	A	112	L	H	CB	PRO	V	79
R	H	CD1	PHE	A	112	L	H	CG	PRO	V	79
R	H	CD1	PHE	A	112	L	H	HB2	PRO	V	79
R	H	CD1	PHE	A	112	L	H	HB3	PRO	V	79
R	H	CD1	PHE	A	112	L	H	HG3	PRO	V	79
R	H	CD1	PHE	A	112	L	H	N	ARG	V	80
R	H	CD1	PHE	A	112	L	H	H	ARG	V	80
R	H	CD2	PHE	A	112	L	H	HB2	PRO	V	79
R	H	CE1	PHE	A	112	L	H	CA	PRO	V	79
R	H	CE1	PHE	A	112	L	H	C	PRO	V	79
R	H	CE1	PHE	A	112	L	H	CB	PRO	V	79
R	H	CE1	PHE	A	112	L	H	O	PRO	V	79
R	H	CE1	PHE	A	112	L	H	CG	PRO	V	79
R	H	CE1	PHE	A	112	L	H	HB2	PRO	V	79
R	H	CE1	PHE	A	112	L	H	HB3	PRO	V	79
R	H	CE1	PHE	A	112	L	H	HG3	PRO	V	79
R	H	CE1	PHE	A	112	L	H	HD2	PRO	V	79
R	H	CE1	PHE	A	112	L	H	N	ARG	V	80
R	H	CE1	PHE	A	112	L	H	CA	ARG	V	80
R	H	CE1	PHE	A	112	L	H	CB	ARG	V	80
R	H	CE1	PHE	A	112	L	H	H	ARG	V	80
R	H	CE1	PHE	A	112	L	H	HA	ARG	V	80
R	H	CE1	PHE	A	112	L	H	HB2	ARG	V	80
R	H	CE2	PHE	A	112	L	H	O	THR	V	75
R	H	CE2	PHE	A	112	L	H	O	ASP	V	76
R	H	CE2	PHE	A	112	L	H	HB2	PRO	V	79
R	H	CE2	PHE	A	112	L	H	H	ARG	V	80
R	H	CE2	PHE	A	112	L	H	HB2	ARG	V	80
R	H	CZ	PHE	A	112	L	H	O	ASP	V	76
R	H	CZ	PHE	A	112	L	H	C	PRO	V	79
R	H	CZ	PHE	A	112	L	H	CB	PRO	V	79
R	H	CZ	PHE	A	112	L	H	HB2	PRO	V	79
R	H	CZ	PHE	A	112	L	H	HD2	PRO	V	79
R	H	CZ	PHE	A	112	L	H	N	ARG	V	80
R	H	CZ	PHE	A	112	L	H	CA	ARG	V	80
R	H	CZ	PHE	A	112	L	H	CB	ARG	V	80
R	H	CZ	PHE	A	112	L	H	H	ARG	V	80
R	H	CZ	PHE	A	112	L	H	HA	ARG	V	80
R	H	CZ	PHE	A	112	L	H	HB2	ARG	V	80
R	H	CZ	PHE	A	112	L	H	HB3	ARG	V	80
R	H	CZ	PHE	A	112	L	H	HD2	ARG	V	80
R	H	CG	LEU	A	115	L	H	HB2	ALA	V	83
R	H	CD1	LEU	A	115	L	H	HB1	ALA	V	83
R	H	CD1	LEU	A	115	L	H	HB2	ALA	V	83
R	H	CD2	LEU	A	115	L	H	CB	ALA	V	83
R	H	CD2	LEU	A	115	L	H	HB1	ALA	V	83
R	H	CD2	LEU	A	115	L	H	HB2	ALA	V	83
R	H	CD2	LEU	A	115	L	H	HB3	ALA	V	83
R	H	CA	ALA	A	155	L	-	O	GLY	V	86
R	H	CB	ALA	A	155	L	-	O	GLY	V	86
R	H	CB	ALA	A	155	L	-	HD2	PRO	V	88
R	H	CG	TRP	A	158	L	-	HA3	GLY	V	86
R	H	CD1	TRP	A	158	L	-	HA3	GLY	V	86
R	H	CD2	TRP	A	158	L	H	HA	ALA	V	83
R	H	CE2	TRP	A	158	L	H	HE2	PHE	V	28
R	H	CE2	TRP	A	158	L	H	HZ	PHE	V	28
R	H	CE3	TRP	A	158	L	H	HA	ALA	V	83
R	H	CE3	TRP	A	158	L	H	HB2	ALA	V	83
R	H	NE1	TRP	A	158	L	H	HE2	PHE	V	28
R	H	NE1	TRP	A	158	L	H	HZ	PHE	V	28
R	H	CZ2	TRP	A	158	L	H	HE2	PHE	V	28
R	H	CZ2	TRP	A	158	L	H	HZ	PHE	V	28
R	H	CZ3	TRP	A	158	L	H	HA	ALA	V	83
R	H	CZ3	TRP	A	158	L	H	HB2	ALA	V	83
R	H	CB	PHE	A	162	L	S	OE1	GLN	V	91
R	H	CG	PHE	A	162	L	S	CD	GLN	V	91
R	H	CG	PHE	A	162	L	S	OE1	GLN	V	91
R	H	CG	PHE	A	162	L	S	HB3	GLN	V	91
R	H	CD1	PHE	A	162	L	S	CD	GLN	V	91
R	H	CD1	PHE	A	162	L	S	OE1	GLN	V	91
R	H	CD1	PHE	A	162	L	S	HB3	GLN	V	91
R	H	CD2	PHE	A	162	L	H	HB1	ALA	V	83
R	H	CD2	PHE	A	162	L	S	CD	GLN	V	91
R	H	CD2	PHE	A	162	L	S	OE1	GLN	V	91
R	H	CD2	PHE	A	162	L	S	HB3	GLN	V	91
R	H	CD2	PHE	A	162	L	S	HG3	GLN	V	91
R	H	CE1	PHE	A	162	L	S	CA	GLN	V	91
R	H	CE1	PHE	A	162	L	S	CB	GLN	V	91
R	H	CE1	PHE	A	162	L	S	CG	GLN	V	91
R	H	CE1	PHE	A	162	L	S	CD	GLN	V	91
R	H	CE1	PHE	A	162	L	S	OE1	GLN	V	91
R	H	CE1	PHE	A	162	L	S	HA	GLN	V	91
R	H	CE1	PHE	A	162	L	S	HB3	GLN	V	91
R	H	CE1	PHE	A	162	L	S	N	ALA	V	92
R	H	CE1	PHE	A	162	L	S	O	ALA	V	92
R	H	CE1	PHE	A	162	L	S	H	ALA	V	92
R	H	CE1	PHE	A	162	L	S	HB2	ALA	V	92
R	H	CE2	PHE	A	162	L	H	HH21	ARG	V	80
R	H	CE2	PHE	A	162	L	H	HB1	ALA	V	83
R	H	CE2	PHE	A	162	L	S	CB	GLN	V	91
R	H	CE2	PHE	A	162	L	S	CG	GLN	V	91
R	H	CE2	PHE	A	162	L	S	CD	GLN	V	91
R	H	CE2	PHE	A	162	L	S	OE1	GLN	V	91
R	H	CE2	PHE	A	162	L	S	HB2	GLN	V	91
R	H	CE2	PHE	A	162	L	S	HB3	GLN	V	91
R	H	CE2	PHE	A	162	L	S	HG3	GLN	V	91
R	H	CE2	PHE	A	162	L	S	O	ALA	V	92
R	H	CZ	PHE	A	162	L	H	HH21	ARG	V	80
R	H	CZ	PHE	A	162	L	S	CA	GLN	V	91
R	H	CZ	PHE	A	162	L	S	C	GLN	V	91
R	H	CZ	PHE	A	162	L	S	CB	GLN	V	91
R	H	CZ	PHE	A	162	L	S	CG	GLN	V	91
R	H	CZ	PHE	A	162	L	S	CD	GLN	V	91
R	H	CZ	PHE	A	162	L	S	OE1	GLN	V	91
R	H	CZ	PHE	A	162	L	S	HA	GLN	V	91
R	H	CZ	PHE	A	162	L	S	HB2	GLN	V	91
R	H	CZ	PHE	A	162	L	S	HB3	GLN	V	91
R	H	CZ	PHE	A	162	L	S	HG3	GLN	V	91
R	H	CZ	PHE	A	162	L	S	N	ALA	V	92
R	H	CZ	PHE	A	162	L	S	O	ALA	V	92
R	H	CZ	PHE	A	162	L	S	H	ALA	V	92
R	H	CG	LEU	A	166	L	S	HB2	ALA	V	92
R	H	CD1	LEU	A	166	L	H	HH22	ARG	V	80
R	H	CD1	LEU	A	166	L	S	C	ALA	V	92
R	H	CD1	LEU	A	166	L	S	O	ALA	V	92
R	H	CD1	LEU	A	166	L	S	HB2	ALA	V	92
R	H	CD1	LEU	A	166	L	S	HA	ILE	V	93
R	H	CD1	LEU	A	166	L	-	H	SER	V	94
R	H	CD2	LEU	A	166	L	S	CA	ALA	V	92
R	H	CD2	LEU	A	166	L	S	C	ALA	V	92
R	H	CD2	LEU	A	166	L	S	CB	ALA	V	92
R	H	CD2	LEU	A	166	L	S	O	ALA	V	92
R	H	CD2	LEU	A	166	L	S	H	ALA	V	92
R	H	CD2	LEU	A	166	L	S	HB1	ALA	V	92
R	H	CD2	LEU	A	166	L	S	HB2	ALA	V	92
R	H	CD2	LEU	A	166	L	S	HB3	ALA	V	92
R	H	O	THR	A	169	L	-	HG	SER	V	94
R	H	CG2	THR	A	169	L	-	HG	SER	V	94
R	H	CA	VAL	A	170	L	-	HB3	SER	V	94
R	H	CB	VAL	A	170	L	-	HB3	SER	V	94
R	H	CG1	VAL	A	170	L	-	OE1	GLU	V	11
R	H	CG2	VAL	A	170	L	-	OE1	GLU	V	11
R	H	CG2	VAL	A	170	L	-	CB	SER	V	94
R	H	CG2	VAL	A	170	L	-	HB2	SER	V	94
R	H	CG2	VAL	A	170	L	-	HB3	SER	V	94
R	H	N	SER	A	173	L	H	OE1	GLN	V	96
R	H	CA	SER	A	173	L	H	CD	GLN	V	96
R	H	CA	SER	A	173	L	H	NE2	GLN	V	96
R	H	CA	SER	A	173	L	H	OE1	GLN	V	96
R	H	CA	SER	A	173	L	H	HE22	GLN	V	96
R	H	C	SER	A	173	L	H	CD	GLN	V	96
R	H	C	SER	A	173	L	H	NE2	GLN	V	96
R	H	C	SER	A	173	L	H	OE1	GLN	V	96
R	H	C	SER	A	173	L	H	HE22	GLN	V	96
R	H	CB	SER	A	173	L	-	HG	SER	V	94
R	H	CB	SER	A	173	L	H	CB	GLN	V	96
R	H	CB	SER	A	173	L	H	CG	GLN	V	96
R	H	CB	SER	A	173	L	H	CD	GLN	V	96
R	H	CB	SER	A	173	L	H	NE2	GLN	V	96
R	H	CB	SER	A	173	L	H	OE1	GLN	V	96
R	H	CB	SER	A	173	L	H	HB2	GLN	V	96
R	H	CB	SER	A	173	L	H	HG2	GLN	V	96
R	H	CB	SER	A	173	L	H	HE22	GLN	V	96
R	H	O	SER	A	173	L	H	CD	GLN	V	96
R	H	O	SER	A	173	L	H	NE2	GLN	V	96
R	H	O	SER	A	173	L	H	OE1	GLN	V	96
R	H	O	SER	A	173	L	H	HE21	GLN	V	96
R	H	O	SER	A	173	L	H	HE22	GLN	V	96
R	H	OG	SER	A	173	L	-	HB2	SER	V	94
R	H	OG	SER	A	173	L	-	HG	SER	V	94
R	H	OG	SER	A	173	L	H	CD	GLN	V	96
R	H	OG	SER	A	173	L	H	NE2	GLN	V	96
R	H	OG	SER	A	173	L	H	OE1	GLN	V	96
R	H	OG	SER	A	173	L	H	HB2	GLN	V	96
R	H	OG	SER	A	173	L	H	HE22	GLN	V	96
R	H	N	THR	A	174	L	H	HE22	GLN	V	96

- 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