IID

A6NMS3_Q8NGJ8.1 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	PHE	A	103	L	-	ALA	V	17
R	H	PHE	A	103	L	-	PRO	V	18
R	H	PHE	A	103	L	S	THR	V	19
R	H	LEU	A	106	L	S	THR	V	99
R	H	THR	A	139	L	H	SER	V	33
R	H	ILE	A	142	L	H	SER	V	33
R	H	ILE	A	142	L	H	ALA	V	93
R	H	ILE	A	142	L	H	LEU	V	94
R	H	ILE	A	142	L	H	ALA	V	95
R	H	THR	A	145	L	H	ALA	V	95
R	H	THR	A	146	L	H	ALA	V	95
R	H	THR	A	146	L	-	GLY	V	96
R	H	PHE	A	149	L	H	ALA	V	95
R	H	PHE	A	149	L	-	GLY	V	96
R	H	PHE	A	149	L	-	ALA	V	97
R	H	PHE	A	149	L	-	HIS	V	98
R	H	PHE	A	149	L	S	THR	V	99
R	H	THR	A	311	L	H	ALA	V	58
R	H	PHE	A	318	L	H	ASN	V	146
R	H	PHE	A	318	L	H	PRO	V	61
R	H	PHE	A	318	L	-	HIS	V	64
R	-	LEU	A	319	L	H	ASN	V	146
R	-	LEU	A	319	L	H	GLY	V	147
R	-	LEU	A	319	L	H	ILE	V	149
R	-	LEU	A	319	L	H	SER	V	150
R	-	LEU	A	319	L	H	PHE	V	69
R	-	TYR	A	321	L	H	ASN	V	146
R	H	TYR	A	35	L	H	SER	V	103
R	H	MET	A	39	L	S	PRO	V	101
R	H	MET	A	39	L	H	SER	V	103
R	H	LEU	A	43	L	S	PRO	V	101
R	H	LEU	A	43	L	H	ALA	V	104
R	H	ALA	A	47	L	H	PRO	V	87
R	H	TYR	A	50	L	H	PRO	V	87
R	H	TYR	A	50	L	H	LEU	V	90
R	H	TYR	A	50	L	H	GLY	V	91
R	H	TYR	A	50	L	H	LEU	V	94
R	H	TYR	A	50	L	H	ALA	V	95
R	H	VAL	A	51	L	H	TYR	V	43
R	H	VAL	A	51	L	H	THR	V	83
R	H	VAL	A	51	L	H	PRO	V	87
R	H	ARG	A	53	L	H	ILE	V	40
R	H	ARG	A	53	L	H	ALA	V	41
R	H	ARG	A	53	L	H	TYR	V	43
R	H	ARG	A	53	L	H	LEU	V	44
R	-	LEU	A	56	L	H	ILE	V	40
R	-	LEU	A	56	L	H	LEU	V	94
R	H	ILE	A	61	L	H	LEU	V	94
R	H	ILE	A	61	L	H	ALA	V	95
R	H	ASN	A	65	L	H	ALA	V	95
R	H	ASN	A	65	L	-	ALA	V	97
R	H	LEU	A	68	L	S	VAL	V	100
R	H	LEU	A	68	L	S	PRO	V	101
R	H	LEU	A	68	L	-	ALA	V	97
R	H	LEU	A	68	L	S	THR	V	99
R	H	MET	A	69	L	S	THR	V	99
R	H	SER	A	71	L	S	PRO	V	101
R	H	CYS	A	72	L	S	PRO	V	101
R	H	CYS	A	72	L	-	PRO	V	18
R	H	CYS	A	72	L	S	THR	V	19
R	H	CYS	A	75	L	S	PRO	V	101
R	H	CYS	A	75	L	H	SER	V	103
R	H	CYS	A	75	L	-	PRO	V	18
R	H	ALA	A	76	L	-	PRO	V	18
R	H	TYR	A	95	L	-	SER	V	12
R	H	TYR	A	95	L	-	THR	V	14
R	H	GLU	A	96	L	-	SER	V	15

- 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

A6NMS3_Q8NGJ8.1 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	OH	TYR	A	35	L	H	HG	SER	V	103
R	H	CE	MET	A	39	L	S	HB2	PRO	V	101
R	H	CE	MET	A	39	L	S	HB3	PRO	V	101
R	H	CE	MET	A	39	L	H	OG	SER	V	103
R	H	CE	MET	A	39	L	H	HG	SER	V	103
R	H	CG	LEU	A	43	L	S	HG2	PRO	V	101
R	H	CG	LEU	A	43	L	H	HB2	ALA	V	104
R	H	CD1	LEU	A	43	L	H	CB	ALA	V	104
R	H	CD1	LEU	A	43	L	H	HB2	ALA	V	104
R	H	CD2	LEU	A	43	L	S	CG	PRO	V	101
R	H	CD2	LEU	A	43	L	S	HG2	PRO	V	101
R	H	CD2	LEU	A	43	L	S	HD3	PRO	V	101
R	H	CD2	LEU	A	43	L	H	CB	ALA	V	104
R	H	CD2	LEU	A	43	L	H	HB2	ALA	V	104
R	H	CA	ALA	A	47	L	H	HB3	PRO	V	87
R	H	CA	TYR	A	50	L	H	HD11	LEU	V	90
R	H	C	TYR	A	50	L	H	HD11	LEU	V	90
R	H	C	TYR	A	50	L	H	HD13	LEU	V	90
R	H	CB	TYR	A	50	L	H	CA	PRO	V	87
R	H	CB	TYR	A	50	L	H	HA	PRO	V	87
R	H	CB	TYR	A	50	L	H	HB2	LEU	V	90
R	H	CB	TYR	A	50	L	H	HD11	LEU	V	90
R	H	O	TYR	A	50	L	H	CD1	LEU	V	90
R	H	O	TYR	A	50	L	H	HD11	LEU	V	90
R	H	O	TYR	A	50	L	H	HD12	LEU	V	90
R	H	O	TYR	A	50	L	H	HD13	LEU	V	90
R	H	CG	TYR	A	50	L	H	O	PRO	V	87
R	H	CG	TYR	A	50	L	H	HA	PRO	V	87
R	H	CG	TYR	A	50	L	H	HB2	LEU	V	90
R	H	CG	TYR	A	50	L	H	HB3	LEU	V	90
R	H	CD1	TYR	A	50	L	H	C	LEU	V	90
R	H	CD1	TYR	A	50	L	H	CB	LEU	V	90
R	H	CD1	TYR	A	50	L	H	O	LEU	V	90
R	H	CD1	TYR	A	50	L	H	HB2	LEU	V	90
R	H	CD1	TYR	A	50	L	H	HB3	LEU	V	90
R	H	CD1	TYR	A	50	L	H	N	GLY	V	91
R	H	CD1	TYR	A	50	L	H	CA	GLY	V	91
R	H	CD1	TYR	A	50	L	H	H	GLY	V	91
R	H	CD1	TYR	A	50	L	H	HA2	GLY	V	91
R	H	CD1	TYR	A	50	L	H	HD11	LEU	V	94
R	H	CE1	TYR	A	50	L	H	C	LEU	V	90
R	H	CE1	TYR	A	50	L	H	O	LEU	V	90
R	H	CE1	TYR	A	50	L	H	HB2	LEU	V	90
R	H	CE1	TYR	A	50	L	H	HB3	LEU	V	90
R	H	CE1	TYR	A	50	L	H	N	GLY	V	91
R	H	CE1	TYR	A	50	L	H	CA	GLY	V	91
R	H	CE1	TYR	A	50	L	H	H	GLY	V	91
R	H	CE1	TYR	A	50	L	H	HA2	GLY	V	91
R	H	CE1	TYR	A	50	L	H	HA3	GLY	V	91
R	H	CE1	TYR	A	50	L	H	HB2	LEU	V	94
R	H	CE1	TYR	A	50	L	H	HD11	LEU	V	94
R	H	CE2	TYR	A	50	L	H	HA2	GLY	V	91
R	H	CE2	TYR	A	50	L	H	HA3	GLY	V	91
R	H	OH	TYR	A	50	L	H	CA	GLY	V	91
R	H	OH	TYR	A	50	L	H	O	GLY	V	91
R	H	OH	TYR	A	50	L	H	HA2	GLY	V	91
R	H	OH	TYR	A	50	L	H	HA3	GLY	V	91
R	H	OH	TYR	A	50	L	H	CB	ALA	V	95
R	H	OH	TYR	A	50	L	H	HB1	ALA	V	95
R	H	OH	TYR	A	50	L	H	HB2	ALA	V	95
R	H	OH	TYR	A	50	L	H	HB3	ALA	V	95
R	H	CZ	TYR	A	50	L	H	N	GLY	V	91
R	H	CZ	TYR	A	50	L	H	CA	GLY	V	91
R	H	CZ	TYR	A	50	L	H	HA2	GLY	V	91
R	H	CZ	TYR	A	50	L	H	HA3	GLY	V	91
R	H	CZ	TYR	A	50	L	H	HB3	ALA	V	95
R	H	CA	VAL	A	51	L	H	HE1	TYR	V	43
R	H	CA	VAL	A	51	L	H	HH	TYR	V	43
R	H	C	VAL	A	51	L	H	HE1	TYR	V	43
R	H	CB	VAL	A	51	L	H	OH	TYR	V	43
R	H	CB	VAL	A	51	L	H	HH	TYR	V	43
R	H	O	VAL	A	51	L	H	CE1	TYR	V	43
R	H	O	VAL	A	51	L	H	OH	TYR	V	43
R	H	O	VAL	A	51	L	H	HE1	TYR	V	43
R	H	CG1	VAL	A	51	L	H	OH	TYR	V	43
R	H	CG1	VAL	A	51	L	H	CZ	TYR	V	43
R	H	CG1	VAL	A	51	L	H	HE1	TYR	V	43
R	H	CG1	VAL	A	51	L	H	HH	TYR	V	43
R	H	CG2	VAL	A	51	L	H	OH	TYR	V	43
R	H	CG2	VAL	A	51	L	H	HH	TYR	V	43
R	H	CG2	VAL	A	51	L	H	HG23	THR	V	83
R	H	CG2	VAL	A	51	L	H	HG3	PRO	V	87
R	H	CB	ARG	A	53	L	H	HD13	LEU	V	44
R	H	CB	ARG	A	53	L	H	HD22	LEU	V	44
R	H	CG	ARG	A	53	L	H	CG2	ILE	V	40
R	H	CG	ARG	A	53	L	H	HG22	ILE	V	40
R	H	CG	ARG	A	53	L	H	HG23	ILE	V	40
R	H	CG	ARG	A	53	L	H	CD1	LEU	V	44
R	H	CG	ARG	A	53	L	H	CD2	LEU	V	44
R	H	CG	ARG	A	53	L	H	HG	LEU	V	44
R	H	CG	ARG	A	53	L	H	HD13	LEU	V	44
R	H	CG	ARG	A	53	L	H	HD22	LEU	V	44
R	H	CD	ARG	A	53	L	H	CG2	ILE	V	40
R	H	CD	ARG	A	53	L	H	HG21	ILE	V	40
R	H	CD	ARG	A	53	L	H	HG22	ILE	V	40
R	H	CD	ARG	A	53	L	H	HG23	ILE	V	40
R	H	CD	ARG	A	53	L	H	CG	LEU	V	44
R	H	CD	ARG	A	53	L	H	CD1	LEU	V	44
R	H	CD	ARG	A	53	L	H	CD2	LEU	V	44
R	H	CD	ARG	A	53	L	H	HG	LEU	V	44
R	H	CD	ARG	A	53	L	H	HD11	LEU	V	44
R	H	CD	ARG	A	53	L	H	HD12	LEU	V	44
R	H	CD	ARG	A	53	L	H	HD13	LEU	V	44
R	H	CD	ARG	A	53	L	H	HD22	LEU	V	44
R	H	CD	ARG	A	53	L	H	HD23	LEU	V	44
R	H	NE	ARG	A	53	L	H	CB	ILE	V	40
R	H	NE	ARG	A	53	L	H	O	ILE	V	40
R	H	NE	ARG	A	53	L	H	CG2	ILE	V	40
R	H	NE	ARG	A	53	L	H	HG21	ILE	V	40
R	H	NE	ARG	A	53	L	H	HG22	ILE	V	40
R	H	NE	ARG	A	53	L	H	HG23	ILE	V	40
R	H	NE	ARG	A	53	L	H	HD1	TYR	V	43
R	H	NE	ARG	A	53	L	H	CB	LEU	V	44
R	H	NE	ARG	A	53	L	H	CG	LEU	V	44
R	H	NE	ARG	A	53	L	H	CD1	LEU	V	44
R	H	NE	ARG	A	53	L	H	CD2	LEU	V	44
R	H	NE	ARG	A	53	L	H	HB3	LEU	V	44
R	H	NE	ARG	A	53	L	H	HG	LEU	V	44
R	H	NE	ARG	A	53	L	H	HD11	LEU	V	44
R	H	NE	ARG	A	53	L	H	HD12	LEU	V	44
R	H	NE	ARG	A	53	L	H	HD13	LEU	V	44
R	H	NE	ARG	A	53	L	H	HD21	LEU	V	44
R	H	NE	ARG	A	53	L	H	HD22	LEU	V	44
R	H	NE	ARG	A	53	L	H	HD23	LEU	V	44
R	H	NH1	ARG	A	53	L	H	CG2	ILE	V	40
R	H	NH1	ARG	A	53	L	H	HG21	ILE	V	40
R	H	NH1	ARG	A	53	L	H	HG22	ILE	V	40
R	H	NH1	ARG	A	53	L	H	HG23	ILE	V	40
R	H	NH1	ARG	A	53	L	H	HA	ALA	V	41
R	H	NH1	ARG	A	53	L	H	CB	LEU	V	44
R	H	NH1	ARG	A	53	L	H	CG	LEU	V	44
R	H	NH1	ARG	A	53	L	H	CD1	LEU	V	44
R	H	NH1	ARG	A	53	L	H	CD2	LEU	V	44
R	H	NH1	ARG	A	53	L	H	HB2	LEU	V	44
R	H	NH1	ARG	A	53	L	H	HB3	LEU	V	44
R	H	NH1	ARG	A	53	L	H	HG	LEU	V	44
R	H	NH1	ARG	A	53	L	H	HD11	LEU	V	44
R	H	NH1	ARG	A	53	L	H	HD12	LEU	V	44
R	H	NH1	ARG	A	53	L	H	HD13	LEU	V	44
R	H	NH1	ARG	A	53	L	H	HD22	LEU	V	44
R	H	NH1	ARG	A	53	L	H	HD23	LEU	V	44
R	H	NH2	ARG	A	53	L	H	CA	ILE	V	40
R	H	NH2	ARG	A	53	L	H	C	ILE	V	40
R	H	NH2	ARG	A	53	L	H	CB	ILE	V	40
R	H	NH2	ARG	A	53	L	H	O	ILE	V	40
R	H	NH2	ARG	A	53	L	H	CG2	ILE	V	40
R	H	NH2	ARG	A	53	L	H	HA	ILE	V	40
R	H	NH2	ARG	A	53	L	H	HG21	ILE	V	40
R	H	NH2	ARG	A	53	L	H	HG22	ILE	V	40
R	H	NH2	ARG	A	53	L	H	HG23	ILE	V	40
R	H	NH2	ARG	A	53	L	H	N	ALA	V	41
R	H	NH2	ARG	A	53	L	H	CA	ALA	V	41
R	H	NH2	ARG	A	53	L	H	C	ALA	V	41
R	H	NH2	ARG	A	53	L	H	O	ALA	V	41
R	H	NH2	ARG	A	53	L	H	H	ALA	V	41
R	H	NH2	ARG	A	53	L	H	HA	ALA	V	41
R	H	NH2	ARG	A	53	L	H	N	LEU	V	44
R	H	NH2	ARG	A	53	L	H	CA	LEU	V	44
R	H	NH2	ARG	A	53	L	H	CB	LEU	V	44
R	H	NH2	ARG	A	53	L	H	CG	LEU	V	44
R	H	NH2	ARG	A	53	L	H	CD1	LEU	V	44
R	H	NH2	ARG	A	53	L	H	CD2	LEU	V	44
R	H	NH2	ARG	A	53	L	H	H	LEU	V	44
R	H	NH2	ARG	A	53	L	H	HB2	LEU	V	44
R	H	NH2	ARG	A	53	L	H	HB3	LEU	V	44
R	H	NH2	ARG	A	53	L	H	HG	LEU	V	44
R	H	NH2	ARG	A	53	L	H	HD11	LEU	V	44
R	H	NH2	ARG	A	53	L	H	HD12	LEU	V	44
R	H	NH2	ARG	A	53	L	H	HD13	LEU	V	44
R	H	NH2	ARG	A	53	L	H	HD22	LEU	V	44
R	H	CZ	ARG	A	53	L	H	C	ILE	V	40
R	H	CZ	ARG	A	53	L	H	CB	ILE	V	40
R	H	CZ	ARG	A	53	L	H	O	ILE	V	40
R	H	CZ	ARG	A	53	L	H	CG2	ILE	V	40
R	H	CZ	ARG	A	53	L	H	HG21	ILE	V	40
R	H	CZ	ARG	A	53	L	H	HG22	ILE	V	40
R	H	CZ	ARG	A	53	L	H	HG23	ILE	V	40
R	H	CZ	ARG	A	53	L	H	HA	ALA	V	41
R	H	CZ	ARG	A	53	L	H	CB	LEU	V	44
R	H	CZ	ARG	A	53	L	H	CG	LEU	V	44
R	H	CZ	ARG	A	53	L	H	CD1	LEU	V	44
R	H	CZ	ARG	A	53	L	H	CD2	LEU	V	44
R	H	CZ	ARG	A	53	L	H	H	LEU	V	44
R	H	CZ	ARG	A	53	L	H	HB2	LEU	V	44
R	H	CZ	ARG	A	53	L	H	HB3	LEU	V	44
R	H	CZ	ARG	A	53	L	H	HG	LEU	V	44
R	H	CZ	ARG	A	53	L	H	HD11	LEU	V	44
R	H	CZ	ARG	A	53	L	H	HD12	LEU	V	44
R	H	CZ	ARG	A	53	L	H	HD13	LEU	V	44
R	H	CZ	ARG	A	53	L	H	HD22	LEU	V	44
R	H	CZ	ARG	A	53	L	H	HD23	LEU	V	44
R	-	CG	LEU	A	56	L	H	HD12	LEU	V	94
R	-	CG	LEU	A	56	L	H	HD13	LEU	V	94
R	-	CD1	LEU	A	56	L	H	CD1	ILE	V	40
R	-	CD1	LEU	A	56	L	H	HG12	ILE	V	40
R	-	CD1	LEU	A	56	L	H	HD11	ILE	V	40
R	-	CD1	LEU	A	56	L	H	HD12	ILE	V	40
R	-	CD1	LEU	A	56	L	H	HD12	LEU	V	94
R	-	CD1	LEU	A	56	L	H	HD13	LEU	V	94
R	-	CD2	LEU	A	56	L	H	CD1	LEU	V	94
R	-	CD2	LEU	A	56	L	H	HD11	LEU	V	94
R	-	CD2	LEU	A	56	L	H	HD12	LEU	V	94
R	-	CD2	LEU	A	56	L	H	HD13	LEU	V	94
R	H	O	ILE	A	61	L	H	HB2	ALA	V	95
R	H	CG1	ILE	A	61	L	H	HB3	LEU	V	94
R	H	CG1	ILE	A	61	L	H	HD13	LEU	V	94
R	H	CG2	ILE	A	61	L	H	O	LEU	V	94
R	H	CG2	ILE	A	61	L	H	HB3	LEU	V	94
R	H	CG2	ILE	A	61	L	H	CB	ALA	V	95
R	H	CG2	ILE	A	61	L	H	HA	ALA	V	95
R	H	CG2	ILE	A	61	L	H	HB2	ALA	V	95
R	H	CD1	ILE	A	61	L	H	HB3	LEU	V	94
R	H	CD1	ILE	A	61	L	H	HD13	LEU	V	94
R	H	CD1	ILE	A	61	L	H	HD22	LEU	V	94
R	H	CB	ASN	A	65	L	H	HB1	ALA	V	95
R	H	CG	ASN	A	65	L	H	CB	ALA	V	95
R	H	CG	ASN	A	65	L	H	HB1	ALA	V	95
R	H	CG	ASN	A	65	L	H	HB2	ALA	V	95
R	H	CG	ASN	A	65	L	H	HB3	ALA	V	95
R	H	CG	ASN	A	65	L	-	HB3	ALA	V	97
R	H	ND2	ASN	A	65	L	H	CA	ALA	V	95
R	H	ND2	ASN	A	65	L	H	CB	ALA	V	95
R	H	ND2	ASN	A	65	L	H	HA	ALA	V	95
R	H	ND2	ASN	A	65	L	H	HB1	ALA	V	95
R	H	ND2	ASN	A	65	L	H	HB2	ALA	V	95
R	H	ND2	ASN	A	65	L	H	HB3	ALA	V	95
R	H	ND2	ASN	A	65	L	-	HB3	ALA	V	97
R	H	OD1	ASN	A	65	L	H	CA	ALA	V	95
R	H	OD1	ASN	A	65	L	H	C	ALA	V	95
R	H	OD1	ASN	A	65	L	H	CB	ALA	V	95
R	H	OD1	ASN	A	65	L	H	O	ALA	V	95
R	H	OD1	ASN	A	65	L	H	HB1	ALA	V	95
R	H	OD1	ASN	A	65	L	H	HB2	ALA	V	95
R	H	OD1	ASN	A	65	L	H	HB3	ALA	V	95
R	H	OD1	ASN	A	65	L	-	CA	ALA	V	97
R	H	OD1	ASN	A	65	L	-	CB	ALA	V	97
R	H	OD1	ASN	A	65	L	-	HA	ALA	V	97
R	H	OD1	ASN	A	65	L	-	HB1	ALA	V	97
R	H	OD1	ASN	A	65	L	-	HB2	ALA	V	97
R	H	OD1	ASN	A	65	L	-	HB3	ALA	V	97
R	H	O	LEU	A	68	L	S	HG3	PRO	V	101
R	H	O	LEU	A	68	L	S	HD2	PRO	V	101
R	H	CG	LEU	A	68	L	-	HB1	ALA	V	97
R	H	CG	LEU	A	68	L	S	O	THR	V	99
R	H	CG	LEU	A	68	L	S	HD2	PRO	V	101
R	H	CD1	LEU	A	68	L	S	O	THR	V	99
R	H	CD1	LEU	A	68	L	S	HA	VAL	V	100
R	H	CD1	LEU	A	68	L	S	HG21	VAL	V	100
R	H	CD1	LEU	A	68	L	S	CD	PRO	V	101
R	H	CD1	LEU	A	68	L	S	HD2	PRO	V	101
R	H	CD1	LEU	A	68	L	S	HD3	PRO	V	101
R	H	CD2	LEU	A	68	L	-	CB	ALA	V	97
R	H	CD2	LEU	A	68	L	-	HB1	ALA	V	97
R	H	CD2	LEU	A	68	L	-	HB2	ALA	V	97
R	H	CD2	LEU	A	68	L	-	HB3	ALA	V	97
R	H	CD2	LEU	A	68	L	S	O	THR	V	99
R	H	CD2	LEU	A	68	L	S	HG1	THR	V	99
R	H	CE	MET	A	69	L	S	OG1	THR	V	99
R	H	CE	MET	A	69	L	S	HG1	THR	V	99
R	H	CA	SER	A	71	L	S	HG3	PRO	V	101
R	H	C	SER	A	71	L	S	HG3	PRO	V	101
R	H	CB	SER	A	71	L	S	CG	PRO	V	101
R	H	CB	SER	A	71	L	S	HG2	PRO	V	101
R	H	CB	SER	A	71	L	S	HG3	PRO	V	101
R	H	O	SER	A	71	L	S	HB3	PRO	V	101
R	H	O	SER	A	71	L	S	HG3	PRO	V	101
R	H	OG	SER	A	71	L	S	HG2	PRO	V	101
R	H	N	CYS	A	72	L	S	HG3	PRO	V	101
R	H	CA	CYS	A	72	L	S	CG2	THR	V	19
R	H	CA	CYS	A	72	L	S	HG21	THR	V	19
R	H	CA	CYS	A	72	L	S	HG22	THR	V	19
R	H	CA	CYS	A	72	L	S	HG23	THR	V	19
R	H	CA	CYS	A	72	L	S	HG3	PRO	V	101
R	H	CB	CYS	A	72	L	S	CG2	THR	V	19
R	H	CB	CYS	A	72	L	S	HG21	THR	V	19
R	H	CB	CYS	A	72	L	S	HG22	THR	V	19
R	H	CB	CYS	A	72	L	S	HG23	THR	V	19
R	H	CB	CYS	A	72	L	S	HG3	PRO	V	101
R	H	O	CYS	A	72	L	-	HB2	PRO	V	18
R	H	O	CYS	A	72	L	S	HG22	THR	V	19
R	H	SG	CYS	A	72	L	S	CB	THR	V	19
R	H	SG	CYS	A	72	L	S	CG2	THR	V	19
R	H	SG	CYS	A	72	L	S	OG1	THR	V	19
R	H	SG	CYS	A	72	L	S	HG21	THR	V	19
R	H	SG	CYS	A	72	L	S	HG22	THR	V	19
R	H	SG	CYS	A	72	L	S	HG23	THR	V	19
R	H	CA	CYS	A	75	L	-	HB2	PRO	V	18
R	H	CA	CYS	A	75	L	-	HB3	PRO	V	18
R	H	C	CYS	A	75	L	-	CB	PRO	V	18
R	H	C	CYS	A	75	L	-	HB2	PRO	V	18
R	H	C	CYS	A	75	L	-	HB3	PRO	V	18
R	H	CB	CYS	A	75	L	-	CB	PRO	V	18
R	H	CB	CYS	A	75	L	-	O	PRO	V	18
R	H	CB	CYS	A	75	L	-	HA	PRO	V	18
R	H	CB	CYS	A	75	L	-	HB2	PRO	V	18
R	H	CB	CYS	A	75	L	-	HB3	PRO	V	18
R	H	CB	CYS	A	75	L	S	HB3	PRO	V	101
R	H	O	CYS	A	75	L	-	CB	PRO	V	18
R	H	O	CYS	A	75	L	-	HA	PRO	V	18
R	H	O	CYS	A	75	L	-	HB2	PRO	V	18
R	H	O	CYS	A	75	L	-	HB3	PRO	V	18
R	H	SG	CYS	A	75	L	S	CB	PRO	V	101
R	H	SG	CYS	A	75	L	S	HB3	PRO	V	101
R	H	SG	CYS	A	75	L	H	OG	SER	V	103
R	H	SG	CYS	A	75	L	H	HG	SER	V	103
R	H	N	ALA	A	76	L	-	CB	PRO	V	18
R	H	N	ALA	A	76	L	-	HB2	PRO	V	18
R	H	N	ALA	A	76	L	-	HB3	PRO	V	18
R	H	N	ALA	A	76	L	-	HG3	PRO	V	18
R	H	CA	ALA	A	76	L	-	CB	PRO	V	18
R	H	CA	ALA	A	76	L	-	CG	PRO	V	18
R	H	CA	ALA	A	76	L	-	HB2	PRO	V	18
R	H	CA	ALA	A	76	L	-	HB3	PRO	V	18
R	H	CA	ALA	A	76	L	-	HG3	PRO	V	18
R	H	C	ALA	A	76	L	-	HB3	PRO	V	18
R	H	CB	ALA	A	76	L	-	CB	PRO	V	18
R	H	CB	ALA	A	76	L	-	CG	PRO	V	18
R	H	CB	ALA	A	76	L	-	HB2	PRO	V	18
R	H	CB	ALA	A	76	L	-	HB3	PRO	V	18
R	H	CB	ALA	A	76	L	-	HG2	PRO	V	18
R	H	CB	ALA	A	76	L	-	HG3	PRO	V	18
R	H	CB	TYR	A	95	L	-	CG2	THR	V	14
R	H	CB	TYR	A	95	L	-	HG21	THR	V	14
R	H	CB	TYR	A	95	L	-	HG22	THR	V	14
R	H	CE2	TYR	A	95	L	-	HB2	SER	V	12
R	H	CE2	TYR	A	95	L	-	HB3	SER	V	12
R	H	OH	TYR	A	95	L	-	HB3	SER	V	12
R	H	CZ	TYR	A	95	L	-	HB3	SER	V	12
R	H	CG	GLU	A	96	L	-	OG	SER	V	15
R	H	CG	GLU	A	96	L	-	H	SER	V	15
R	H	CG	GLU	A	96	L	-	HG	SER	V	15
R	H	CD	GLU	A	96	L	-	OG	SER	V	15
R	H	CD	GLU	A	96	L	-	HG	SER	V	15
R	H	OE1	GLU	A	96	L	-	CB	SER	V	15
R	H	OE1	GLU	A	96	L	-	OG	SER	V	15
R	H	OE1	GLU	A	96	L	-	H	SER	V	15
R	H	OE1	GLU	A	96	L	-	HB3	SER	V	15
R	H	OE1	GLU	A	96	L	-	HG	SER	V	15
R	H	CB	PHE	A	103	L	-	CG	PRO	V	18
R	H	CB	PHE	A	103	L	-	HG2	PRO	V	18
R	H	CB	PHE	A	103	L	-	HG3	PRO	V	18
R	H	CG	PHE	A	103	L	-	CG	PRO	V	18
R	H	CG	PHE	A	103	L	-	HG2	PRO	V	18
R	H	CG	PHE	A	103	L	-	HG3	PRO	V	18
R	H	CG	PHE	A	103	L	-	HD3	PRO	V	18
R	H	CG	PHE	A	103	L	S	OG1	THR	V	19
R	H	CG	PHE	A	103	L	S	HG1	THR	V	19
R	H	CG	PHE	A	103	L	S	HG22	THR	V	19
R	H	CD1	PHE	A	103	L	-	HG2	PRO	V	18
R	H	CD1	PHE	A	103	L	S	CB	THR	V	19
R	H	CD1	PHE	A	103	L	S	CG2	THR	V	19
R	H	CD1	PHE	A	103	L	S	OG1	THR	V	19
R	H	CD1	PHE	A	103	L	S	HG1	THR	V	19
R	H	CD1	PHE	A	103	L	S	HG21	THR	V	19
R	H	CD1	PHE	A	103	L	S	HG22	THR	V	19
R	H	CD2	PHE	A	103	L	-	CG	PRO	V	18
R	H	CD2	PHE	A	103	L	-	CD	PRO	V	18
R	H	CD2	PHE	A	103	L	-	HG2	PRO	V	18
R	H	CD2	PHE	A	103	L	-	HG3	PRO	V	18
R	H	CD2	PHE	A	103	L	-	HD3	PRO	V	18
R	H	CD2	PHE	A	103	L	S	OG1	THR	V	19
R	H	CD2	PHE	A	103	L	S	H	THR	V	19
R	H	CD2	PHE	A	103	L	S	HG1	THR	V	19
R	H	CE1	PHE	A	103	L	-	HG2	PRO	V	18
R	H	CE1	PHE	A	103	L	S	CA	THR	V	19
R	H	CE1	PHE	A	103	L	S	CB	THR	V	19
R	H	CE1	PHE	A	103	L	S	O	THR	V	19
R	H	CE1	PHE	A	103	L	S	CG2	THR	V	19
R	H	CE1	PHE	A	103	L	S	OG1	THR	V	19
R	H	CE1	PHE	A	103	L	S	H	THR	V	19
R	H	CE1	PHE	A	103	L	S	HB	THR	V	19
R	H	CE1	PHE	A	103	L	S	HG1	THR	V	19
R	H	CE1	PHE	A	103	L	S	HG21	THR	V	19
R	H	CE1	PHE	A	103	L	S	HG22	THR	V	19
R	H	CE2	PHE	A	103	L	-	CB	ALA	V	17
R	H	CE2	PHE	A	103	L	-	HB1	ALA	V	17
R	H	CE2	PHE	A	103	L	-	HB3	ALA	V	17
R	H	CE2	PHE	A	103	L	-	CG	PRO	V	18
R	H	CE2	PHE	A	103	L	-	CD	PRO	V	18
R	H	CE2	PHE	A	103	L	-	HG2	PRO	V	18
R	H	CE2	PHE	A	103	L	-	HG3	PRO	V	18
R	H	CE2	PHE	A	103	L	-	HD3	PRO	V	18
R	H	CE2	PHE	A	103	L	S	N	THR	V	19
R	H	CE2	PHE	A	103	L	S	OG1	THR	V	19
R	H	CE2	PHE	A	103	L	S	H	THR	V	19
R	H	CE2	PHE	A	103	L	S	HG1	THR	V	19
R	H	CZ	PHE	A	103	L	-	HB1	ALA	V	17
R	H	CZ	PHE	A	103	L	-	HB3	ALA	V	17
R	H	CZ	PHE	A	103	L	-	HG2	PRO	V	18
R	H	CZ	PHE	A	103	L	-	HD3	PRO	V	18
R	H	CZ	PHE	A	103	L	S	N	THR	V	19
R	H	CZ	PHE	A	103	L	S	CA	THR	V	19
R	H	CZ	PHE	A	103	L	S	C	THR	V	19
R	H	CZ	PHE	A	103	L	S	CB	THR	V	19
R	H	CZ	PHE	A	103	L	S	O	THR	V	19
R	H	CZ	PHE	A	103	L	S	OG1	THR	V	19
R	H	CZ	PHE	A	103	L	S	H	THR	V	19
R	H	CZ	PHE	A	103	L	S	HG1	THR	V	19
R	H	CD2	LEU	A	106	L	S	HG21	THR	V	99
R	H	N	THR	A	139	L	H	HG	SER	V	33
R	H	CA	THR	A	139	L	H	HG	SER	V	33
R	H	CB	THR	A	139	L	H	HG	SER	V	33
R	H	CG2	THR	A	139	L	H	HB2	SER	V	33
R	H	OG1	THR	A	139	L	H	CB	SER	V	33
R	H	OG1	THR	A	139	L	H	OG	SER	V	33
R	H	OG1	THR	A	139	L	H	HB2	SER	V	33
R	H	OG1	THR	A	139	L	H	HB3	SER	V	33
R	H	OG1	THR	A	139	L	H	HG	SER	V	33
R	H	N	ILE	A	142	L	H	O	LEU	V	94
R	H	CA	ILE	A	142	L	H	O	LEU	V	94
R	H	CA	ILE	A	142	L	H	HA	ALA	V	95
R	H	CB	ILE	A	142	L	H	O	LEU	V	94
R	H	CG1	ILE	A	142	L	H	O	ALA	V	93
R	H	CG1	ILE	A	142	L	H	CA	LEU	V	94
R	H	CG1	ILE	A	142	L	H	C	LEU	V	94
R	H	CG1	ILE	A	142	L	H	O	LEU	V	94
R	H	CG1	ILE	A	142	L	H	HA	LEU	V	94
R	H	CG1	ILE	A	142	L	H	HD21	LEU	V	94
R	H	CG2	ILE	A	142	L	H	O	LEU	V	94
R	H	CD1	ILE	A	142	L	H	OG	SER	V	33
R	H	CD1	ILE	A	142	L	H	HB2	SER	V	33
R	H	CD1	ILE	A	142	L	H	HG	SER	V	33
R	H	CD1	ILE	A	142	L	H	O	ALA	V	93
R	H	CD1	ILE	A	142	L	H	CA	LEU	V	94
R	H	CD1	ILE	A	142	L	H	C	LEU	V	94
R	H	CD1	ILE	A	142	L	H	O	LEU	V	94
R	H	CD1	ILE	A	142	L	H	HA	LEU	V	94
R	H	CD1	ILE	A	142	L	H	HD21	LEU	V	94
R	H	CA	THR	A	145	L	H	O	ALA	V	95
R	H	C	THR	A	145	L	H	O	ALA	V	95
R	H	CB	THR	A	145	L	H	CA	ALA	V	95
R	H	CB	THR	A	145	L	H	C	ALA	V	95
R	H	CB	THR	A	145	L	H	O	ALA	V	95
R	H	CB	THR	A	145	L	H	HA	ALA	V	95
R	H	CB	THR	A	145	L	H	HB1	ALA	V	95
R	H	CG2	THR	A	145	L	H	CA	ALA	V	95
R	H	CG2	THR	A	145	L	H	C	ALA	V	95
R	H	CG2	THR	A	145	L	H	CB	ALA	V	95
R	H	CG2	THR	A	145	L	H	O	ALA	V	95
R	H	CG2	THR	A	145	L	H	HA	ALA	V	95
R	H	CG2	THR	A	145	L	H	HB1	ALA	V	95
R	H	OG1	THR	A	145	L	H	HA	ALA	V	95
R	H	OG1	THR	A	145	L	H	HB1	ALA	V	95
R	H	N	THR	A	146	L	H	O	ALA	V	95
R	H	N	THR	A	146	L	-	HA2	GLY	V	96
R	H	CA	THR	A	146	L	-	HA2	GLY	V	96
R	H	CB	THR	A	146	L	-	HA2	GLY	V	96
R	H	OG1	THR	A	146	L	-	CA	GLY	V	96
R	H	OG1	THR	A	146	L	-	HA2	GLY	V	96
R	H	OG1	THR	A	146	L	-	HA3	GLY	V	96
R	H	CG	PHE	A	149	L	-	O	GLY	V	96
R	H	CG	PHE	A	149	L	-	HA	ALA	V	97
R	H	CD1	PHE	A	149	L	-	HA	ALA	V	97
R	H	CD1	PHE	A	149	L	-	H	HIS	V	98
R	H	CD2	PHE	A	149	L	H	O	ALA	V	95
R	H	CD2	PHE	A	149	L	-	HA	ALA	V	97
R	H	CE1	PHE	A	149	L	-	HA	ALA	V	97
R	H	CE1	PHE	A	149	L	-	H	HIS	V	98
R	H	CE1	PHE	A	149	L	S	OG1	THR	V	99
R	H	CE1	PHE	A	149	L	S	H	THR	V	99
R	H	CE1	PHE	A	149	L	S	HG1	THR	V	99
R	H	CE2	PHE	A	149	L	H	O	ALA	V	95
R	H	CE2	PHE	A	149	L	-	HA	ALA	V	97
R	H	CE2	PHE	A	149	L	-	HB3	ALA	V	97
R	H	CZ	PHE	A	149	L	-	CA	ALA	V	97
R	H	CZ	PHE	A	149	L	-	HA	ALA	V	97
R	H	CZ	PHE	A	149	L	-	HB1	ALA	V	97
R	H	CZ	PHE	A	149	L	-	HB3	ALA	V	97
R	H	CB	THR	A	311	L	H	HB1	ALA	V	58
R	H	CG2	THR	A	311	L	H	CB	ALA	V	58
R	H	CG2	THR	A	311	L	H	HB1	ALA	V	58
R	H	CB	PHE	A	318	L	-	ND1	HIS	V	64
R	H	CB	PHE	A	318	L	-	HE1	HIS	V	64
R	H	O	PHE	A	318	L	H	CG	ASN	V	146
R	H	O	PHE	A	318	L	H	ND2	ASN	V	146
R	H	O	PHE	A	318	L	H	HB3	ASN	V	146
R	H	O	PHE	A	318	L	H	HD21	ASN	V	146
R	H	O	PHE	A	318	L	H	HD22	ASN	V	146
R	H	CG	PHE	A	318	L	-	ND1	HIS	V	64
R	H	CG	PHE	A	318	L	-	HE1	HIS	V	64
R	H	CD2	PHE	A	318	L	-	CE1	HIS	V	64
R	H	CD2	PHE	A	318	L	-	HE1	HIS	V	64
R	H	CE2	PHE	A	318	L	-	HE1	HIS	V	64
R	H	CZ	PHE	A	318	L	H	HB2	PRO	V	61
R	-	N	LEU	A	319	L	H	HB3	ASN	V	146
R	-	CA	LEU	A	319	L	H	CB	ASN	V	146
R	-	CA	LEU	A	319	L	H	HB3	ASN	V	146
R	-	C	LEU	A	319	L	H	CB	ASN	V	146
R	-	C	LEU	A	319	L	H	HB3	ASN	V	146
R	-	CB	LEU	A	319	L	H	HB3	ASN	V	146
R	-	CB	LEU	A	319	L	H	CB	SER	V	150
R	-	CB	LEU	A	319	L	H	HB2	SER	V	150
R	-	O	LEU	A	319	L	H	C	ASN	V	146
R	-	O	LEU	A	319	L	H	CB	ASN	V	146
R	-	O	LEU	A	319	L	H	O	ASN	V	146
R	-	O	LEU	A	319	L	H	HB2	ASN	V	146
R	-	O	LEU	A	319	L	H	HB3	ASN	V	146
R	-	O	LEU	A	319	L	H	N	GLY	V	147
R	-	O	LEU	A	319	L	H	HA2	GLY	V	147
R	-	O	LEU	A	319	L	H	HB2	SER	V	150
R	-	CG	LEU	A	319	L	H	HB2	SER	V	150
R	-	CD1	LEU	A	319	L	H	CE2	PHE	V	69
R	-	CD1	LEU	A	319	L	H	CZ	PHE	V	69
R	-	CD1	LEU	A	319	L	H	HE2	PHE	V	69
R	-	CD1	LEU	A	319	L	H	HG21	ILE	V	149
R	-	CD1	LEU	A	319	L	H	HA	SER	V	150
R	-	CD1	LEU	A	319	L	H	HB2	SER	V	150
R	-	CD2	LEU	A	319	L	H	O	ASN	V	146
R	-	CD2	LEU	A	319	L	H	HA	ASN	V	146
R	-	CD2	LEU	A	319	L	H	HB3	ASN	V	146
R	-	CD2	LEU	A	319	L	H	CG2	ILE	V	149
R	-	CD2	LEU	A	319	L	H	HB	ILE	V	149
R	-	CD2	LEU	A	319	L	H	HG21	ILE	V	149
R	-	CD2	LEU	A	319	L	H	HG23	ILE	V	149
R	-	CD2	LEU	A	319	L	H	HB2	SER	V	150
R	-	CA	TYR	A	321	L	H	HD21	ASN	V	146
R	-	C	TYR	A	321	L	H	ND2	ASN	V	146
R	-	C	TYR	A	321	L	H	HB2	ASN	V	146
R	-	C	TYR	A	321	L	H	HD21	ASN	V	146
R	-	O	TYR	A	321	L	H	HD21	ASN	V	146
R	-	OXT	TYR	A	321	L	H	CB	ASN	V	146
R	-	OXT	TYR	A	321	L	H	CG	ASN	V	146
R	-	OXT	TYR	A	321	L	H	ND2	ASN	V	146
R	-	OXT	TYR	A	321	L	H	HB2	ASN	V	146
R	-	OXT	TYR	A	321	L	H	HB3	ASN	V	146
R	-	OXT	TYR	A	321	L	H	HD21	ASN	V	146
R	-	OXT	TYR	A	321	L	H	HD22	ASN	V	146

- 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