IID

O76002_Q8NH87.1 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	VAL	A	100	L	H	PHE	V	27
R	H	VAL	A	100	L	H	VAL	V	82
R	H	VAL	A	100	L	H	ILE	V	85
R	H	PHE	A	104	L	H	TYR	V	34
R	H	PHE	A	104	L	H	PRO	V	78
R	H	PHE	A	104	L	H	LEU	V	81
R	H	ARG	A	140	L	H	ILE	V	137
R	H	ARG	A	140	L	H	CYS	V	49
R	H	ARG	A	140	L	-	HIS	V	55
R	H	ARG	A	140	L	H	PHE	V	60
R	H	HIS	A	143	L	H	ILE	V	45
R	H	HIS	A	143	L	H	PHE	V	67
R	H	LEU	A	144	L	H	ILE	V	45
R	H	LEU	A	144	L	H	VAL	V	46
R	H	LEU	A	144	L	H	CYS	V	49
R	H	LEU	A	144	L	H	ASN	V	50
R	H	ALA	A	147	L	H	SER	V	42
R	H	ALA	A	147	L	H	ILE	V	45
R	H	ALA	A	147	L	H	VAL	V	46
R	H	VAL	A	151	L	H	SER	V	42
R	H	PHE	A	154	L	H	TYR	V	34
R	H	PHE	A	154	L	H	VAL	V	38
R	H	TYR	A	36	L	S	SER	V	92
R	H	TYR	A	36	L	H	ALA	V	94
R	H	TYR	A	36	L	H	GLY	V	95
R	H	LEU	A	37	L	H	ALA	V	94
R	H	LEU	A	40	L	S	SER	V	92
R	H	LEU	A	40	L	H	ALA	V	94
R	H	LEU	A	40	L	H	GLY	V	95
R	H	LEU	A	40	L	H	CYS	V	98
R	H	ASN	A	43	L	H	PHE	V	102
R	H	LEU	A	44	L	H	PHE	V	101
R	H	LEU	A	44	L	H	PHE	V	102
R	H	LEU	A	44	L	H	LEU	V	97
R	H	LEU	A	44	L	H	CYS	V	98
R	H	ILE	A	47	L	H	PHE	V	101
R	H	ILE	A	47	L	H	PHE	V	102
R	H	ILE	A	47	L	H	TRP	V	71
R	H	ILE	A	48	L	H	PHE	V	101
R	H	ILE	A	48	L	H	PHE	V	102
R	H	ILE	A	48	L	H	SER	V	156
R	H	TYR	A	51	L	H	TYR	V	148
R	H	TYR	A	51	L	H	CYS	V	149
R	H	TYR	A	51	L	H	PHE	V	152
R	H	TYR	A	51	L	H	PHE	V	67
R	H	TYR	A	51	L	H	TRP	V	71
R	H	VAL	A	52	L	H	CYS	V	149
R	H	VAL	A	52	L	H	PHE	V	152
R	H	VAL	A	52	L	H	ILE	V	153
R	-	HIS	A	57	L	H	ALA	V	145
R	-	HIS	A	57	L	H	CYS	V	149
R	H	PHE	A	62	L	H	PHE	V	67
R	H	SER	A	65	L	H	TRP	V	71
R	H	ASN	A	66	L	H	PHE	V	67
R	H	PHE	A	69	L	H	TRP	V	71
R	H	PHE	A	69	L	H	SER	V	74
R	H	PHE	A	69	L	H	VAL	V	75
R	H	LEU	A	72	L	H	PHE	V	102
R	H	LEU	A	72	L	H	CYS	V	98
R	H	PRO	A	80	L	-	ASP	V	88
R	H	GLN	A	81	L	-	SER	V	86
R	H	GLN	A	81	L	-	ASP	V	88
R	H	VAL	A	84	L	-	ASP	V	88
R	H	VAL	A	84	L	S	SER	V	90
R	S	THR	A	92	L	-	GLU	V	87
R	S	SER	A	94	L	H	ILE	V	85
R	S	SER	A	94	L	-	SER	V	86
R	H	ALA	A	96	L	H	ILE	V	85
R	H	GLY	A	97	L	H	ILE	V	85

- 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

O76002_Q8NH87.1 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	CD1	TYR	A	36	L	S	OG	SER	V	92
R	H	CD1	TYR	A	36	L	S	HB2	SER	V	92
R	H	CD1	TYR	A	36	L	S	HB3	SER	V	92
R	H	CD1	TYR	A	36	L	S	HG	SER	V	92
R	H	CE1	TYR	A	36	L	S	CB	SER	V	92
R	H	CE1	TYR	A	36	L	S	OG	SER	V	92
R	H	CE1	TYR	A	36	L	S	HB2	SER	V	92
R	H	CE1	TYR	A	36	L	S	HB3	SER	V	92
R	H	CE1	TYR	A	36	L	S	HG	SER	V	92
R	H	CE1	TYR	A	36	L	H	HB2	ALA	V	94
R	H	CE2	TYR	A	36	L	S	HG	SER	V	92
R	H	OH	TYR	A	36	L	S	CB	SER	V	92
R	H	OH	TYR	A	36	L	S	OG	SER	V	92
R	H	OH	TYR	A	36	L	S	H	SER	V	92
R	H	OH	TYR	A	36	L	S	HB3	SER	V	92
R	H	OH	TYR	A	36	L	S	HG	SER	V	92
R	H	OH	TYR	A	36	L	H	HA3	GLY	V	95
R	H	CZ	TYR	A	36	L	S	CB	SER	V	92
R	H	CZ	TYR	A	36	L	S	OG	SER	V	92
R	H	CZ	TYR	A	36	L	S	HB3	SER	V	92
R	H	CZ	TYR	A	36	L	S	HG	SER	V	92
R	H	CD2	LEU	A	37	L	H	CB	ALA	V	94
R	H	CD2	LEU	A	37	L	H	H	ALA	V	94
R	H	CD2	LEU	A	37	L	H	HB2	ALA	V	94
R	H	CD2	LEU	A	37	L	H	HB3	ALA	V	94
R	H	CA	LEU	A	40	L	H	HB1	ALA	V	94
R	H	C	LEU	A	40	L	H	HG	CYS	V	98
R	H	CB	LEU	A	40	L	H	CB	ALA	V	94
R	H	CB	LEU	A	40	L	H	HB1	ALA	V	94
R	H	CB	LEU	A	40	L	H	HB2	ALA	V	94
R	H	CB	LEU	A	40	L	H	HB3	ALA	V	94
R	H	CB	LEU	A	40	L	H	HG	CYS	V	98
R	H	O	LEU	A	40	L	H	SG	CYS	V	98
R	H	O	LEU	A	40	L	H	HG	CYS	V	98
R	H	CG	LEU	A	40	L	S	HG	SER	V	92
R	H	CG	LEU	A	40	L	H	CB	ALA	V	94
R	H	CG	LEU	A	40	L	H	HB1	ALA	V	94
R	H	CG	LEU	A	40	L	H	HB2	ALA	V	94
R	H	CG	LEU	A	40	L	H	HB3	ALA	V	94
R	H	CD1	LEU	A	40	L	S	OG	SER	V	92
R	H	CD1	LEU	A	40	L	S	HG	SER	V	92
R	H	CD1	LEU	A	40	L	H	N	ALA	V	94
R	H	CD1	LEU	A	40	L	H	CA	ALA	V	94
R	H	CD1	LEU	A	40	L	H	C	ALA	V	94
R	H	CD1	LEU	A	40	L	H	CB	ALA	V	94
R	H	CD1	LEU	A	40	L	H	O	ALA	V	94
R	H	CD1	LEU	A	40	L	H	H	ALA	V	94
R	H	CD1	LEU	A	40	L	H	HA	ALA	V	94
R	H	CD1	LEU	A	40	L	H	HB1	ALA	V	94
R	H	CD1	LEU	A	40	L	H	HB2	ALA	V	94
R	H	CD1	LEU	A	40	L	H	HB3	ALA	V	94
R	H	CD1	LEU	A	40	L	H	N	GLY	V	95
R	H	CD1	LEU	A	40	L	H	CA	GLY	V	95
R	H	CD1	LEU	A	40	L	H	H	GLY	V	95
R	H	CD1	LEU	A	40	L	H	HA2	GLY	V	95
R	H	CD2	LEU	A	40	L	H	HB1	ALA	V	94
R	H	CD2	LEU	A	40	L	H	HB2	ALA	V	94
R	H	CD2	LEU	A	40	L	H	HA2	GLY	V	95
R	H	O	ASN	A	43	L	H	HZ	PHE	V	102
R	H	CA	LEU	A	44	L	H	HE2	PHE	V	102
R	H	CA	LEU	A	44	L	H	HZ	PHE	V	102
R	H	C	LEU	A	44	L	H	HZ	PHE	V	102
R	H	CB	LEU	A	44	L	H	SG	CYS	V	98
R	H	CB	LEU	A	44	L	H	HE2	PHE	V	102
R	H	O	LEU	A	44	L	H	HE1	PHE	V	101
R	H	O	LEU	A	44	L	H	HZ	PHE	V	102
R	H	CG	LEU	A	44	L	H	SG	CYS	V	98
R	H	CG	LEU	A	44	L	H	HA	CYS	V	98
R	H	CG	LEU	A	44	L	H	CD1	PHE	V	101
R	H	CG	LEU	A	44	L	H	HD1	PHE	V	101
R	H	CG	LEU	A	44	L	H	HE2	PHE	V	102
R	H	CD1	LEU	A	44	L	H	CA	CYS	V	98
R	H	CD1	LEU	A	44	L	H	SG	CYS	V	98
R	H	CD1	LEU	A	44	L	H	HA	CYS	V	98
R	H	CD1	LEU	A	44	L	H	HB3	CYS	V	98
R	H	CD1	LEU	A	44	L	H	CG	PHE	V	101
R	H	CD1	LEU	A	44	L	H	CD1	PHE	V	101
R	H	CD1	LEU	A	44	L	H	CE1	PHE	V	101
R	H	CD1	LEU	A	44	L	H	HB3	PHE	V	101
R	H	CD1	LEU	A	44	L	H	HD1	PHE	V	101
R	H	CD1	LEU	A	44	L	H	HE1	PHE	V	101
R	H	CD1	LEU	A	44	L	H	CD2	PHE	V	102
R	H	CD1	LEU	A	44	L	H	CE1	PHE	V	102
R	H	CD1	LEU	A	44	L	H	CE2	PHE	V	102
R	H	CD1	LEU	A	44	L	H	CZ	PHE	V	102
R	H	CD1	LEU	A	44	L	H	HD2	PHE	V	102
R	H	CD1	LEU	A	44	L	H	HE2	PHE	V	102
R	H	CD1	LEU	A	44	L	H	HZ	PHE	V	102
R	H	CD2	LEU	A	44	L	H	CD2	LEU	V	97
R	H	CD2	LEU	A	44	L	H	HD21	LEU	V	97
R	H	CD2	LEU	A	44	L	H	HD22	LEU	V	97
R	H	CD2	LEU	A	44	L	H	HD23	LEU	V	97
R	H	CD2	LEU	A	44	L	H	N	CYS	V	98
R	H	CD2	LEU	A	44	L	H	CA	CYS	V	98
R	H	CD2	LEU	A	44	L	H	CB	CYS	V	98
R	H	CD2	LEU	A	44	L	H	SG	CYS	V	98
R	H	CD2	LEU	A	44	L	H	HA	CYS	V	98
R	H	CD2	LEU	A	44	L	H	HG	CYS	V	98
R	H	CD2	LEU	A	44	L	H	HB3	PHE	V	101
R	H	CA	ILE	A	47	L	H	HE1	PHE	V	102
R	H	CA	ILE	A	47	L	H	HZ	PHE	V	102
R	H	C	ILE	A	47	L	H	HE1	PHE	V	102
R	H	CB	ILE	A	47	L	H	HZ2	TRP	V	71
R	H	CB	ILE	A	47	L	H	CE1	PHE	V	102
R	H	CB	ILE	A	47	L	H	CZ	PHE	V	102
R	H	CB	ILE	A	47	L	H	HE1	PHE	V	102
R	H	CB	ILE	A	47	L	H	HZ	PHE	V	102
R	H	CG1	ILE	A	47	L	H	CE1	PHE	V	102
R	H	CG1	ILE	A	47	L	H	CZ	PHE	V	102
R	H	CG1	ILE	A	47	L	H	HE1	PHE	V	102
R	H	CG1	ILE	A	47	L	H	HZ	PHE	V	102
R	H	CG2	ILE	A	47	L	H	CH2	TRP	V	71
R	H	CG2	ILE	A	47	L	H	CZ2	TRP	V	71
R	H	CG2	ILE	A	47	L	H	HH2	TRP	V	71
R	H	CG2	ILE	A	47	L	H	HZ2	TRP	V	71
R	H	CG2	ILE	A	47	L	H	HE1	PHE	V	101
R	H	CG2	ILE	A	47	L	H	CD1	PHE	V	102
R	H	CG2	ILE	A	47	L	H	CE1	PHE	V	102
R	H	CG2	ILE	A	47	L	H	CZ	PHE	V	102
R	H	CG2	ILE	A	47	L	H	HD1	PHE	V	102
R	H	CG2	ILE	A	47	L	H	HE1	PHE	V	102
R	H	CG2	ILE	A	47	L	H	HZ	PHE	V	102
R	H	CD1	ILE	A	47	L	H	HZ2	TRP	V	71
R	H	CD1	ILE	A	47	L	H	CE1	PHE	V	102
R	H	CD1	ILE	A	47	L	H	CE2	PHE	V	102
R	H	CD1	ILE	A	47	L	H	CZ	PHE	V	102
R	H	CD1	ILE	A	47	L	H	HE1	PHE	V	102
R	H	CD1	ILE	A	47	L	H	HE2	PHE	V	102
R	H	CD1	ILE	A	47	L	H	HZ	PHE	V	102
R	H	N	ILE	A	48	L	H	HE1	PHE	V	101
R	H	N	ILE	A	48	L	H	HZ	PHE	V	101
R	H	N	ILE	A	48	L	H	HE1	PHE	V	102
R	H	CA	ILE	A	48	L	H	CE1	PHE	V	101
R	H	CA	ILE	A	48	L	H	CZ	PHE	V	101
R	H	CA	ILE	A	48	L	H	HE1	PHE	V	101
R	H	CA	ILE	A	48	L	H	HZ	PHE	V	101
R	H	C	ILE	A	48	L	H	HZ	PHE	V	101
R	H	CB	ILE	A	48	L	H	CE1	PHE	V	101
R	H	CB	ILE	A	48	L	H	CE2	PHE	V	101
R	H	CB	ILE	A	48	L	H	CZ	PHE	V	101
R	H	CB	ILE	A	48	L	H	HE1	PHE	V	101
R	H	CB	ILE	A	48	L	H	HZ	PHE	V	101
R	H	CG1	ILE	A	48	L	H	CG	PHE	V	101
R	H	CG1	ILE	A	48	L	H	CD1	PHE	V	101
R	H	CG1	ILE	A	48	L	H	CD2	PHE	V	101
R	H	CG1	ILE	A	48	L	H	CE1	PHE	V	101
R	H	CG1	ILE	A	48	L	H	CE2	PHE	V	101
R	H	CG1	ILE	A	48	L	H	CZ	PHE	V	101
R	H	CG1	ILE	A	48	L	H	HD1	PHE	V	101
R	H	CG1	ILE	A	48	L	H	HE1	PHE	V	101
R	H	CG1	ILE	A	48	L	H	HE2	PHE	V	101
R	H	CG1	ILE	A	48	L	H	HZ	PHE	V	101
R	H	CG2	ILE	A	48	L	H	CE2	PHE	V	101
R	H	CG2	ILE	A	48	L	H	CZ	PHE	V	101
R	H	CG2	ILE	A	48	L	H	HE2	PHE	V	101
R	H	CG2	ILE	A	48	L	H	HZ	PHE	V	101
R	H	CG2	ILE	A	48	L	H	OG	SER	V	156
R	H	CG2	ILE	A	48	L	H	HG	SER	V	156
R	H	CD1	ILE	A	48	L	H	CG	PHE	V	101
R	H	CD1	ILE	A	48	L	H	CD1	PHE	V	101
R	H	CD1	ILE	A	48	L	H	CD2	PHE	V	101
R	H	CD1	ILE	A	48	L	H	CE1	PHE	V	101
R	H	CD1	ILE	A	48	L	H	CE2	PHE	V	101
R	H	CD1	ILE	A	48	L	H	CZ	PHE	V	101
R	H	CD1	ILE	A	48	L	H	HD1	PHE	V	101
R	H	CD1	ILE	A	48	L	H	HD2	PHE	V	101
R	H	CD1	ILE	A	48	L	H	HE1	PHE	V	101
R	H	CD1	ILE	A	48	L	H	HE2	PHE	V	101
R	H	CD1	ILE	A	48	L	H	HZ	PHE	V	101
R	H	C	TYR	A	51	L	H	HA	CYS	V	149
R	H	CB	TYR	A	51	L	H	CG	PHE	V	152
R	H	CB	TYR	A	51	L	H	CD2	PHE	V	152
R	H	CB	TYR	A	51	L	H	CE2	PHE	V	152
R	H	CB	TYR	A	51	L	H	HB2	PHE	V	152
R	H	CB	TYR	A	51	L	H	HD2	PHE	V	152
R	H	O	TYR	A	51	L	H	CA	CYS	V	149
R	H	O	TYR	A	51	L	H	SG	CYS	V	149
R	H	O	TYR	A	51	L	H	HA	CYS	V	149
R	H	O	TYR	A	51	L	H	HG	CYS	V	149
R	H	CG	TYR	A	51	L	H	HH2	TRP	V	71
R	H	CG	TYR	A	51	L	H	HZ3	TRP	V	71
R	H	CG	TYR	A	51	L	H	CD2	PHE	V	152
R	H	CG	TYR	A	51	L	H	CE2	PHE	V	152
R	H	CG	TYR	A	51	L	H	HD2	PHE	V	152
R	H	CG	TYR	A	51	L	H	HE2	PHE	V	152
R	H	CD1	TYR	A	51	L	H	HH2	TRP	V	71
R	H	CD1	TYR	A	51	L	H	HZ3	TRP	V	71
R	H	CD1	TYR	A	51	L	H	HB3	TYR	V	148
R	H	CD1	TYR	A	51	L	H	HD1	TYR	V	148
R	H	CD1	TYR	A	51	L	H	CE2	PHE	V	152
R	H	CD1	TYR	A	51	L	H	HD2	PHE	V	152
R	H	CD1	TYR	A	51	L	H	HE2	PHE	V	152
R	H	CD2	TYR	A	51	L	H	CH2	TRP	V	71
R	H	CD2	TYR	A	51	L	H	CZ3	TRP	V	71
R	H	CD2	TYR	A	51	L	H	HH2	TRP	V	71
R	H	CD2	TYR	A	51	L	H	HZ3	TRP	V	71
R	H	CD2	TYR	A	51	L	H	CE2	PHE	V	152
R	H	CD2	TYR	A	51	L	H	CZ	PHE	V	152
R	H	CD2	TYR	A	51	L	H	HE2	PHE	V	152
R	H	CE1	TYR	A	51	L	H	HE1	PHE	V	67
R	H	CE1	TYR	A	51	L	H	CH2	TRP	V	71
R	H	CE1	TYR	A	51	L	H	CZ3	TRP	V	71
R	H	CE1	TYR	A	51	L	H	HH2	TRP	V	71
R	H	CE1	TYR	A	51	L	H	HZ3	TRP	V	71
R	H	CE1	TYR	A	51	L	H	HE2	PHE	V	152
R	H	CE2	TYR	A	51	L	H	CH2	TRP	V	71
R	H	CE2	TYR	A	51	L	H	CZ2	TRP	V	71
R	H	CE2	TYR	A	51	L	H	CZ3	TRP	V	71
R	H	CE2	TYR	A	51	L	H	HH2	TRP	V	71
R	H	CE2	TYR	A	51	L	H	HZ2	TRP	V	71
R	H	CE2	TYR	A	51	L	H	HZ3	TRP	V	71
R	H	OH	TYR	A	51	L	H	CE1	PHE	V	67
R	H	OH	TYR	A	51	L	H	CZ	PHE	V	67
R	H	OH	TYR	A	51	L	H	HE1	PHE	V	67
R	H	OH	TYR	A	51	L	H	HZ	PHE	V	67
R	H	OH	TYR	A	51	L	H	CD2	TRP	V	71
R	H	OH	TYR	A	51	L	H	CE3	TRP	V	71
R	H	OH	TYR	A	51	L	H	CH2	TRP	V	71
R	H	OH	TYR	A	51	L	H	CZ2	TRP	V	71
R	H	OH	TYR	A	51	L	H	CZ3	TRP	V	71
R	H	OH	TYR	A	51	L	H	HE3	TRP	V	71
R	H	OH	TYR	A	51	L	H	HH2	TRP	V	71
R	H	OH	TYR	A	51	L	H	HZ3	TRP	V	71
R	H	CZ	TYR	A	51	L	H	HE1	PHE	V	67
R	H	CZ	TYR	A	51	L	H	CE3	TRP	V	71
R	H	CZ	TYR	A	51	L	H	CH2	TRP	V	71
R	H	CZ	TYR	A	51	L	H	CZ2	TRP	V	71
R	H	CZ	TYR	A	51	L	H	CZ3	TRP	V	71
R	H	CZ	TYR	A	51	L	H	HE3	TRP	V	71
R	H	CZ	TYR	A	51	L	H	HH2	TRP	V	71
R	H	CZ	TYR	A	51	L	H	HZ3	TRP	V	71
R	H	CZ	TYR	A	51	L	H	HE2	PHE	V	152
R	H	CA	VAL	A	52	L	H	HA	CYS	V	149
R	H	CB	VAL	A	52	L	H	HG13	ILE	V	153
R	H	O	VAL	A	52	L	H	SG	CYS	V	149
R	H	O	VAL	A	52	L	H	HB3	CYS	V	149
R	H	O	VAL	A	52	L	H	HD11	ILE	V	153
R	H	CG1	VAL	A	52	L	H	CG1	ILE	V	153
R	H	CG1	VAL	A	52	L	H	CD1	ILE	V	153
R	H	CG1	VAL	A	52	L	H	HG12	ILE	V	153
R	H	CG1	VAL	A	52	L	H	HG13	ILE	V	153
R	H	CG1	VAL	A	52	L	H	HD11	ILE	V	153
R	H	CG2	VAL	A	52	L	H	C	PHE	V	152
R	H	CG2	VAL	A	52	L	H	CB	PHE	V	152
R	H	CG2	VAL	A	52	L	H	HB2	PHE	V	152
R	H	CG2	VAL	A	52	L	H	HB3	PHE	V	152
R	H	CG2	VAL	A	52	L	H	N	ILE	V	153
R	H	CG2	VAL	A	52	L	H	H	ILE	V	153
R	H	CG2	VAL	A	52	L	H	HA	ILE	V	153
R	H	CG2	VAL	A	52	L	H	HG12	ILE	V	153
R	H	CG2	VAL	A	52	L	H	HG13	ILE	V	153
R	-	ND1	HIS	A	57	L	H	HB1	ALA	V	145
R	-	CE1	HIS	A	57	L	H	HB1	ALA	V	145
R	-	CE1	HIS	A	57	L	H	SG	CYS	V	149
R	-	CE1	HIS	A	57	L	H	HG	CYS	V	149
R	-	NE2	HIS	A	57	L	H	SG	CYS	V	149
R	-	NE2	HIS	A	57	L	H	HG	CYS	V	149
R	H	CE2	PHE	A	62	L	H	HZ	PHE	V	67
R	H	OG	SER	A	65	L	H	HH2	TRP	V	71
R	H	OD1	ASN	A	66	L	H	HE2	PHE	V	67
R	H	CG	PHE	A	69	L	H	HE1	TRP	V	71
R	H	CD2	PHE	A	69	L	H	NE1	TRP	V	71
R	H	CD2	PHE	A	69	L	H	HE1	TRP	V	71
R	H	CE1	PHE	A	69	L	H	HD1	TRP	V	71
R	H	CE1	PHE	A	69	L	H	CB	SER	V	74
R	H	CE1	PHE	A	69	L	H	HB2	SER	V	74
R	H	CE1	PHE	A	69	L	H	HB3	SER	V	74
R	H	CE2	PHE	A	69	L	H	CD1	TRP	V	71
R	H	CE2	PHE	A	69	L	H	NE1	TRP	V	71
R	H	CE2	PHE	A	69	L	H	HD1	TRP	V	71
R	H	CE2	PHE	A	69	L	H	HE1	TRP	V	71
R	H	CE2	PHE	A	69	L	H	HA	VAL	V	75
R	H	CE2	PHE	A	69	L	H	HG21	VAL	V	75
R	H	CE2	PHE	A	69	L	H	HG23	VAL	V	75
R	H	CZ	PHE	A	69	L	H	CD1	TRP	V	71
R	H	CZ	PHE	A	69	L	H	HD1	TRP	V	71
R	H	CZ	PHE	A	69	L	H	HE1	TRP	V	71
R	H	CZ	PHE	A	69	L	H	C	SER	V	74
R	H	CZ	PHE	A	69	L	H	CB	SER	V	74
R	H	CZ	PHE	A	69	L	H	O	SER	V	74
R	H	CZ	PHE	A	69	L	H	HB2	SER	V	74
R	H	CZ	PHE	A	69	L	H	HB3	SER	V	74
R	H	CZ	PHE	A	69	L	H	HA	VAL	V	75
R	H	CZ	PHE	A	69	L	H	HG21	VAL	V	75
R	H	CD1	LEU	A	72	L	H	HB3	CYS	V	98
R	H	CD1	LEU	A	72	L	H	CE2	PHE	V	102
R	H	CD1	LEU	A	72	L	H	HE2	PHE	V	102
R	H	O	PRO	A	80	L	-	OD2	ASP	V	88
R	H	OE1	GLN	A	81	L	-	OG	SER	V	86
R	H	OE1	GLN	A	81	L	-	HG	SER	V	86
R	H	OE1	GLN	A	81	L	-	CB	ASP	V	88
R	H	OE1	GLN	A	81	L	-	HB2	ASP	V	88
R	H	OE1	GLN	A	81	L	-	HB3	ASP	V	88
R	H	CB	VAL	A	84	L	-	OD2	ASP	V	88
R	H	CG2	VAL	A	84	L	-	CG	ASP	V	88
R	H	CG2	VAL	A	84	L	-	OD2	ASP	V	88
R	H	CG2	VAL	A	84	L	S	HG	SER	V	90
R	S	OG1	THR	A	92	L	-	OE2	GLU	V	87
R	S	CB	SER	A	94	L	H	O	ILE	V	85
R	S	OG	SER	A	94	L	H	C	ILE	V	85
R	S	OG	SER	A	94	L	H	O	ILE	V	85
R	S	OG	SER	A	94	L	H	HB	ILE	V	85
R	S	OG	SER	A	94	L	-	HA	SER	V	86
R	H	CA	ALA	A	96	L	H	HB	ILE	V	85
R	H	CA	ALA	A	96	L	H	HD13	ILE	V	85
R	H	C	ALA	A	96	L	H	CD1	ILE	V	85
R	H	C	ALA	A	96	L	H	HB	ILE	V	85
R	H	C	ALA	A	96	L	H	HD11	ILE	V	85
R	H	C	ALA	A	96	L	H	HD12	ILE	V	85
R	H	C	ALA	A	96	L	H	HD13	ILE	V	85
R	H	CB	ALA	A	96	L	H	CB	ILE	V	85
R	H	CB	ALA	A	96	L	H	CG2	ILE	V	85
R	H	CB	ALA	A	96	L	H	HB	ILE	V	85
R	H	CB	ALA	A	96	L	H	HG21	ILE	V	85
R	H	CB	ALA	A	96	L	H	HG23	ILE	V	85
R	H	CB	ALA	A	96	L	H	HD13	ILE	V	85
R	H	O	ALA	A	96	L	H	CD1	ILE	V	85
R	H	O	ALA	A	96	L	H	HD11	ILE	V	85
R	H	O	ALA	A	96	L	H	HD12	ILE	V	85
R	H	O	ALA	A	96	L	H	HD13	ILE	V	85
R	H	N	GLY	A	97	L	H	CB	ILE	V	85
R	H	N	GLY	A	97	L	H	CG1	ILE	V	85
R	H	N	GLY	A	97	L	H	CD1	ILE	V	85
R	H	N	GLY	A	97	L	H	HB	ILE	V	85
R	H	N	GLY	A	97	L	H	HG13	ILE	V	85
R	H	N	GLY	A	97	L	H	HD11	ILE	V	85
R	H	N	GLY	A	97	L	H	HD12	ILE	V	85
R	H	N	GLY	A	97	L	H	HD13	ILE	V	85
R	H	CA	GLY	A	97	L	H	CG1	ILE	V	85
R	H	CA	GLY	A	97	L	H	CD1	ILE	V	85
R	H	CA	GLY	A	97	L	H	HB	ILE	V	85
R	H	CA	GLY	A	97	L	H	HG13	ILE	V	85
R	H	CA	GLY	A	97	L	H	HD11	ILE	V	85
R	H	CA	GLY	A	97	L	H	HD12	ILE	V	85
R	H	CA	GLY	A	97	L	H	HD13	ILE	V	85
R	H	C	GLY	A	97	L	H	HD11	ILE	V	85
R	H	C	GLY	A	97	L	H	HD13	ILE	V	85
R	H	O	GLY	A	97	L	H	HD11	ILE	V	85
R	H	O	GLY	A	97	L	H	HD13	ILE	V	85
R	H	CA	VAL	A	100	L	H	HD11	ILE	V	85
R	H	CB	VAL	A	100	L	H	HE2	PHE	V	27
R	H	CB	VAL	A	100	L	H	HZ	PHE	V	27
R	H	CB	VAL	A	100	L	H	CD1	ILE	V	85
R	H	CB	VAL	A	100	L	H	HD11	ILE	V	85
R	H	CB	VAL	A	100	L	H	HD12	ILE	V	85
R	H	CB	VAL	A	100	L	H	HD13	ILE	V	85
R	H	CG1	VAL	A	100	L	H	HE2	PHE	V	27
R	H	CG1	VAL	A	100	L	H	HG23	VAL	V	82
R	H	CG1	VAL	A	100	L	H	CD1	ILE	V	85
R	H	CG1	VAL	A	100	L	H	HD11	ILE	V	85
R	H	CG1	VAL	A	100	L	H	HD12	ILE	V	85
R	H	CG2	VAL	A	100	L	H	CE2	PHE	V	27
R	H	CG2	VAL	A	100	L	H	CZ	PHE	V	27
R	H	CG2	VAL	A	100	L	H	HE2	PHE	V	27
R	H	CG2	VAL	A	100	L	H	HZ	PHE	V	27
R	H	CG2	VAL	A	100	L	H	CD1	ILE	V	85
R	H	CG2	VAL	A	100	L	H	HD11	ILE	V	85
R	H	CG2	VAL	A	100	L	H	HD12	ILE	V	85
R	H	CG2	VAL	A	100	L	H	HD13	ILE	V	85
R	H	CD1	PHE	A	104	L	H	HB2	PRO	V	78
R	H	CE1	PHE	A	104	L	H	HE1	TYR	V	34
R	H	CE1	PHE	A	104	L	H	HB2	PRO	V	78
R	H	CE1	PHE	A	104	L	H	HG3	PRO	V	78
R	H	CE2	PHE	A	104	L	H	HD11	LEU	V	81
R	H	CE2	PHE	A	104	L	H	HD12	LEU	V	81
R	H	CZ	PHE	A	104	L	H	HE1	TYR	V	34
R	H	CZ	PHE	A	104	L	H	HA	PRO	V	78
R	H	CZ	PHE	A	104	L	H	HB2	PRO	V	78
R	H	CZ	PHE	A	104	L	H	HG3	PRO	V	78
R	H	CZ	PHE	A	104	L	H	HD11	LEU	V	81
R	H	CZ	PHE	A	104	L	H	HD12	LEU	V	81
R	H	CA	ARG	A	140	L	H	SG	CYS	V	49
R	H	C	ARG	A	140	L	H	SG	CYS	V	49
R	H	C	ARG	A	140	L	H	HB2	CYS	V	49
R	H	CB	ARG	A	140	L	H	SG	CYS	V	49
R	H	CB	ARG	A	140	L	H	HA	CYS	V	49
R	H	O	ARG	A	140	L	H	CB	CYS	V	49
R	H	O	ARG	A	140	L	H	SG	CYS	V	49
R	H	O	ARG	A	140	L	H	HB2	CYS	V	49
R	H	O	ARG	A	140	L	H	HG	CYS	V	49
R	H	CD	ARG	A	140	L	H	HA	CYS	V	49
R	H	CD	ARG	A	140	L	-	NE2	HIS	V	55
R	H	CD	ARG	A	140	L	-	HE2	HIS	V	55
R	H	NE	ARG	A	140	L	-	HA	HIS	V	55
R	H	NE	ARG	A	140	L	H	HD2	PHE	V	60
R	H	NH1	ARG	A	140	L	-	CA	HIS	V	55
R	H	NH1	ARG	A	140	L	-	CB	HIS	V	55
R	H	NH1	ARG	A	140	L	-	CG	HIS	V	55
R	H	NH1	ARG	A	140	L	-	CD2	HIS	V	55
R	H	NH1	ARG	A	140	L	-	ND1	HIS	V	55
R	H	NH1	ARG	A	140	L	-	CE1	HIS	V	55
R	H	NH1	ARG	A	140	L	-	NE2	HIS	V	55
R	H	NH1	ARG	A	140	L	-	HA	HIS	V	55
R	H	NH1	ARG	A	140	L	-	HB2	HIS	V	55
R	H	NH1	ARG	A	140	L	-	HB3	HIS	V	55
R	H	NH1	ARG	A	140	L	-	HD2	HIS	V	55
R	H	NH1	ARG	A	140	L	-	HE2	HIS	V	55
R	H	NH2	ARG	A	140	L	-	CA	HIS	V	55
R	H	NH2	ARG	A	140	L	-	C	HIS	V	55
R	H	NH2	ARG	A	140	L	-	CB	HIS	V	55
R	H	NH2	ARG	A	140	L	-	HA	HIS	V	55
R	H	NH2	ARG	A	140	L	-	HB2	HIS	V	55
R	H	NH2	ARG	A	140	L	H	HB2	PHE	V	60
R	H	NH2	ARG	A	140	L	H	HD2	PHE	V	60
R	H	NH2	ARG	A	140	L	H	HD11	ILE	V	137
R	H	NH2	ARG	A	140	L	H	HD12	ILE	V	137
R	H	CZ	ARG	A	140	L	-	CA	HIS	V	55
R	H	CZ	ARG	A	140	L	-	CB	HIS	V	55
R	H	CZ	ARG	A	140	L	-	CG	HIS	V	55
R	H	CZ	ARG	A	140	L	-	CD2	HIS	V	55
R	H	CZ	ARG	A	140	L	-	HA	HIS	V	55
R	H	CZ	ARG	A	140	L	-	HB2	HIS	V	55
R	H	CZ	ARG	A	140	L	-	HD2	HIS	V	55
R	H	CZ	ARG	A	140	L	H	HD2	PHE	V	60
R	H	C	HIS	A	143	L	H	HG21	ILE	V	45
R	H	C	HIS	A	143	L	H	HG22	ILE	V	45
R	H	CB	HIS	A	143	L	H	HG22	ILE	V	45
R	H	CB	HIS	A	143	L	H	HG23	ILE	V	45
R	H	O	HIS	A	143	L	H	HG21	ILE	V	45
R	H	O	HIS	A	143	L	H	HG22	ILE	V	45
R	H	ND1	HIS	A	143	L	H	CD2	PHE	V	67
R	H	N	LEU	A	144	L	H	HG21	ILE	V	45
R	H	N	LEU	A	144	L	H	SG	CYS	V	49
R	H	CA	LEU	A	144	L	H	HG21	ILE	V	45
R	H	CB	LEU	A	144	L	H	CB	CYS	V	49
R	H	CB	LEU	A	144	L	H	SG	CYS	V	49
R	H	CB	LEU	A	144	L	H	HB2	CYS	V	49
R	H	CB	LEU	A	144	L	H	HB3	CYS	V	49
R	H	O	LEU	A	144	L	H	HG23	VAL	V	46
R	H	CG	LEU	A	144	L	H	HA	VAL	V	46
R	H	CG	LEU	A	144	L	H	HG13	VAL	V	46
R	H	CG	LEU	A	144	L	H	HG23	VAL	V	46
R	H	CG	LEU	A	144	L	H	HB2	CYS	V	49
R	H	CG	LEU	A	144	L	H	HB3	CYS	V	49
R	H	CG	LEU	A	144	L	H	HD22	ASN	V	50
R	H	CD1	LEU	A	144	L	H	CA	VAL	V	46
R	H	CD1	LEU	A	144	L	H	CB	VAL	V	46
R	H	CD1	LEU	A	144	L	H	CG1	VAL	V	46
R	H	CD1	LEU	A	144	L	H	CG2	VAL	V	46
R	H	CD1	LEU	A	144	L	H	HA	VAL	V	46
R	H	CD1	LEU	A	144	L	H	HG13	VAL	V	46
R	H	CD1	LEU	A	144	L	H	HG21	VAL	V	46
R	H	CD1	LEU	A	144	L	H	HG22	VAL	V	46
R	H	CD1	LEU	A	144	L	H	HG23	VAL	V	46
R	H	CD1	LEU	A	144	L	H	HB3	CYS	V	49
R	H	CD1	LEU	A	144	L	H	ND2	ASN	V	50
R	H	CD1	LEU	A	144	L	H	HD22	ASN	V	50
R	H	CD2	LEU	A	144	L	H	CB	CYS	V	49
R	H	CD2	LEU	A	144	L	H	HB2	CYS	V	49
R	H	CD2	LEU	A	144	L	H	HB3	CYS	V	49
R	H	CD2	LEU	A	144	L	H	CG	ASN	V	50
R	H	CD2	LEU	A	144	L	H	ND2	ASN	V	50
R	H	CD2	LEU	A	144	L	H	OD1	ASN	V	50
R	H	CD2	LEU	A	144	L	H	HD22	ASN	V	50
R	H	CB	ALA	A	147	L	H	HA	SER	V	42
R	H	CB	ALA	A	147	L	H	HB3	SER	V	42
R	H	CB	ALA	A	147	L	H	HG22	ILE	V	45
R	H	CB	ALA	A	147	L	H	HG21	VAL	V	46
R	H	CG2	VAL	A	151	L	H	CB	SER	V	42
R	H	CG2	VAL	A	151	L	H	OG	SER	V	42
R	H	CG2	VAL	A	151	L	H	HB2	SER	V	42
R	H	CG2	VAL	A	151	L	H	HB3	SER	V	42
R	H	CD2	PHE	A	154	L	H	HG12	VAL	V	38
R	H	CE1	PHE	A	154	L	H	HE1	TYR	V	34
R	H	CE2	PHE	A	154	L	H	HH	TYR	V	34
R	H	CE2	PHE	A	154	L	H	HG12	VAL	V	38
R	H	CZ	PHE	A	154	L	H	OH	TYR	V	34
R	H	CZ	PHE	A	154	L	H	HE1	TYR	V	34
R	H	CZ	PHE	A	154	L	H	HH	TYR	V	34

- 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