IID

P98187_P47211.1 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	-	ARG	A	12	L	H	HIS	V	321
R	-	PRO	A	13	L	H	HIS	V	321
R	-	VAL	A	14	L	H	HIS	V	321
R	-	ALA	A	15	L	H	HIS	V	321
R	-	ALA	A	15	L	-	ARG	V	60
R	-	SER	A	17	L	-	ARG	V	60
R	H	TRP	A	19	L	H	ALA	V	59
R	H	LEU	A	20	L	H	ILE	V	55
R	H	LEU	A	20	L	H	THR	V	56
R	H	LEU	A	23	L	H	ILE	V	55
R	H	LEU	A	23	L	H	ALA	V	59
R	H	LEU	A	23	L	H	LEU	V	75
R	H	LEU	A	23	L	H	ILE	V	79
R	H	PHE	A	240	L	H	LEU	V	162
R	H	ALA	A	27	L	H	ILE	V	79
R	H	SER	A	28	L	H	PHE	V	87
R	H	LEU	A	31	L	H	PHE	V	110
R	H	LEU	A	31	L	H	PHE	V	114
R	H	LEU	A	31	L	H	PHE	V	87
R	H	ILE	A	34	L	H	TYR	V	113
R	H	ILE	A	34	L	H	TRP	V	160
R	H	ILE	A	34	L	H	ILE	V	164
R	H	LEU	A	35	L	H	PHE	V	106
R	H	LEU	A	35	L	H	PHE	V	110
R	H	ALA	A	36	L	H	PHE	V	106
R	H	TRP	A	37	L	H	TYR	V	113
R	H	TRP	A	37	L	H	ILE	V	164
R	H	TRP	A	37	L	H	ALA	V	165
R	H	TRP	A	37	L	H	SER	V	168
R	H	THR	A	38	L	H	TYR	V	113
R	H	THR	A	38	L	H	ALA	V	171
R	H	TYR	A	39	L	H	PHE	V	106
R	H	PHE	A	41	L	H	SER	V	168
R	H	PHE	A	41	L	H	TYR	V	172
R	H	TYR	A	42	L	H	LYS	V	109
R	H	TYR	A	42	L	H	ALA	V	171
R	H	TYR	A	42	L	H	TYR	V	172
R	H	TYR	A	42	L	S	GLN	V	174
R	H	GLY	A	45	L	H	TYR	V	172
R	H	ARG	A	46	L	H	TYR	V	172
R	H	ARG	A	49	L	H	TYR	V	172
R	-	GLN	A	53	L	H	HIS	V	196
R	-	ARG	A	55	L	H	ARG	V	195
R	-	ARG	A	55	L	H	HIS	V	196
R	-	LYS	A	56	L	H	HIS	V	196
R	-	ASN	A	58	L	H	ALA	V	199
R	-	TRP	A	59	L	H	MET	V	166
R	-	TRP	A	59	L	H	PRO	V	169
R	-	TRP	A	59	L	H	ALA	V	199
R	-	TRP	A	59	L	H	TYR	V	200
R	-	TRP	A	59	L	H	CYS	V	203
R	-	TRP	A	59	L	H	THR	V	204
R	-	PHE	A	60	L	H	ALA	V	165
R	-	PHE	A	60	L	H	MET	V	166
R	-	PRO	A	94	L	H	ALA	V	165
R	-	PRO	A	94	L	H	SER	V	168
R	-	PRO	A	94	L	H	PRO	V	169
R	-	ILE	A	95	L	H	SER	V	168

- 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

P98187_P47211.1 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	-	NH1	ARG	A	12	L	H	HB3	HIS	V	321
R	-	C	PRO	A	13	L	H	HE1	HIS	V	321
R	-	O	PRO	A	13	L	H	ND1	HIS	V	321
R	-	O	PRO	A	13	L	H	CE1	HIS	V	321
R	-	O	PRO	A	13	L	H	HE1	HIS	V	321
R	-	N	VAL	A	14	L	H	HE1	HIS	V	321
R	-	CA	VAL	A	14	L	H	CE1	HIS	V	321
R	-	CA	VAL	A	14	L	H	HE1	HIS	V	321
R	-	C	VAL	A	14	L	H	HE1	HIS	V	321
R	-	CB	VAL	A	14	L	H	HE1	HIS	V	321
R	-	CG1	VAL	A	14	L	H	NE2	HIS	V	321
R	-	CG1	VAL	A	14	L	H	HE1	HIS	V	321
R	-	CG1	VAL	A	14	L	H	HE2	HIS	V	321
R	-	CG2	VAL	A	14	L	H	HE1	HIS	V	321
R	-	N	ALA	A	15	L	H	CE1	HIS	V	321
R	-	N	ALA	A	15	L	H	HE1	HIS	V	321
R	-	O	ALA	A	15	L	-	NH2	ARG	V	60
R	-	O	ALA	A	15	L	-	HH21	ARG	V	60
R	-	O	ALA	A	15	L	-	HH22	ARG	V	60
R	-	CB	SER	A	17	L	-	HH21	ARG	V	60
R	H	CB	TRP	A	19	L	H	CB	ALA	V	59
R	H	CB	TRP	A	19	L	H	HB1	ALA	V	59
R	H	CB	TRP	A	19	L	H	HB2	ALA	V	59
R	H	CG	TRP	A	19	L	H	HB1	ALA	V	59
R	H	CD1	TRP	A	19	L	H	HB1	ALA	V	59
R	H	CG	LEU	A	20	L	H	HG21	ILE	V	55
R	H	CG	LEU	A	20	L	H	OG1	THR	V	56
R	H	CG	LEU	A	20	L	H	HA	THR	V	56
R	H	CD1	LEU	A	20	L	H	OG1	THR	V	56
R	H	CD1	LEU	A	20	L	H	HA	THR	V	56
R	H	CD1	LEU	A	20	L	H	HG1	THR	V	56
R	H	CD1	LEU	A	20	L	H	HG23	THR	V	56
R	H	CD2	LEU	A	20	L	H	CG2	ILE	V	55
R	H	CD2	LEU	A	20	L	H	HB	ILE	V	55
R	H	CD2	LEU	A	20	L	H	HG21	ILE	V	55
R	H	CD2	LEU	A	20	L	H	HG22	ILE	V	55
R	H	CD2	LEU	A	20	L	H	OG1	THR	V	56
R	H	CD2	LEU	A	20	L	H	HG1	THR	V	56
R	H	CB	LEU	A	23	L	H	HG22	ILE	V	55
R	H	CG	LEU	A	23	L	H	HG23	ILE	V	55
R	H	CG	LEU	A	23	L	H	HD11	ILE	V	79
R	H	CD1	LEU	A	23	L	H	CG2	ILE	V	55
R	H	CD1	LEU	A	23	L	H	HG21	ILE	V	55
R	H	CD1	LEU	A	23	L	H	HG22	ILE	V	55
R	H	CD1	LEU	A	23	L	H	HG23	ILE	V	55
R	H	CD1	LEU	A	23	L	H	HB2	ALA	V	59
R	H	CD1	LEU	A	23	L	H	HD13	LEU	V	75
R	H	CD1	LEU	A	23	L	H	HD11	ILE	V	79
R	H	CD2	LEU	A	23	L	H	HD13	LEU	V	75
R	H	CD2	LEU	A	23	L	H	CD1	ILE	V	79
R	H	CD2	LEU	A	23	L	H	HD11	ILE	V	79
R	H	CD2	LEU	A	23	L	H	HD12	ILE	V	79
R	H	CB	ALA	A	27	L	H	HG23	ILE	V	79
R	H	OG	SER	A	28	L	H	HZ	PHE	V	87
R	H	CB	LEU	A	31	L	H	HZ	PHE	V	110
R	H	O	LEU	A	31	L	H	HE2	PHE	V	110
R	H	CG	LEU	A	31	L	H	CE2	PHE	V	87
R	H	CG	LEU	A	31	L	H	CE2	PHE	V	110
R	H	CG	LEU	A	31	L	H	CZ	PHE	V	110
R	H	CG	LEU	A	31	L	H	HE2	PHE	V	110
R	H	CG	LEU	A	31	L	H	HZ	PHE	V	110
R	H	CD1	LEU	A	31	L	H	CE1	PHE	V	110
R	H	CD1	LEU	A	31	L	H	CE2	PHE	V	110
R	H	CD1	LEU	A	31	L	H	CZ	PHE	V	110
R	H	CD1	LEU	A	31	L	H	HE2	PHE	V	110
R	H	CD1	LEU	A	31	L	H	HZ	PHE	V	110
R	H	CD1	LEU	A	31	L	H	CD2	PHE	V	114
R	H	CD1	LEU	A	31	L	H	CE2	PHE	V	114
R	H	CD1	LEU	A	31	L	H	CZ	PHE	V	114
R	H	CD1	LEU	A	31	L	H	HD2	PHE	V	114
R	H	CD1	LEU	A	31	L	H	HE2	PHE	V	114
R	H	CD2	LEU	A	31	L	H	CG	PHE	V	87
R	H	CD2	LEU	A	31	L	H	CD1	PHE	V	87
R	H	CD2	LEU	A	31	L	H	CD2	PHE	V	87
R	H	CD2	LEU	A	31	L	H	CE1	PHE	V	87
R	H	CD2	LEU	A	31	L	H	CE2	PHE	V	87
R	H	CD2	LEU	A	31	L	H	CZ	PHE	V	87
R	H	CD2	LEU	A	31	L	H	HB3	PHE	V	87
R	H	CD2	LEU	A	31	L	H	HD2	PHE	V	87
R	H	CD2	LEU	A	31	L	H	HE1	PHE	V	87
R	H	CD2	LEU	A	31	L	H	HE2	PHE	V	87
R	H	CD2	LEU	A	31	L	H	HZ	PHE	V	87
R	H	CD2	LEU	A	31	L	H	CZ	PHE	V	110
R	H	CD2	LEU	A	31	L	H	HE1	PHE	V	110
R	H	CD2	LEU	A	31	L	H	HZ	PHE	V	110
R	H	C	ILE	A	34	L	H	HE1	TYR	V	113
R	H	CB	ILE	A	34	L	H	HE1	TYR	V	113
R	H	O	ILE	A	34	L	H	HE1	TYR	V	113
R	H	CG1	ILE	A	34	L	H	CD1	ILE	V	164
R	H	CG1	ILE	A	34	L	H	HG13	ILE	V	164
R	H	CG1	ILE	A	34	L	H	HD11	ILE	V	164
R	H	CG1	ILE	A	34	L	H	HD13	ILE	V	164
R	H	CG2	ILE	A	34	L	H	CD1	TYR	V	113
R	H	CG2	ILE	A	34	L	H	CE1	TYR	V	113
R	H	CG2	ILE	A	34	L	H	OH	TYR	V	113
R	H	CG2	ILE	A	34	L	H	CZ	TYR	V	113
R	H	CG2	ILE	A	34	L	H	HE1	TYR	V	113
R	H	CG2	ILE	A	34	L	H	HH	TYR	V	113
R	H	CG2	ILE	A	34	L	H	HG13	ILE	V	164
R	H	CD1	ILE	A	34	L	H	HE3	TRP	V	160
R	H	CD1	ILE	A	34	L	H	HZ3	TRP	V	160
R	H	CD1	ILE	A	34	L	H	CD1	ILE	V	164
R	H	CD1	ILE	A	34	L	H	HG13	ILE	V	164
R	H	CD1	ILE	A	34	L	H	HD11	ILE	V	164
R	H	CD1	ILE	A	34	L	H	HD13	ILE	V	164
R	H	N	LEU	A	35	L	H	HE2	PHE	V	110
R	H	CA	LEU	A	35	L	H	HE2	PHE	V	106
R	H	CA	LEU	A	35	L	H	HZ	PHE	V	106
R	H	CA	LEU	A	35	L	H	HD2	PHE	V	110
R	H	CA	LEU	A	35	L	H	HE2	PHE	V	110
R	H	C	LEU	A	35	L	H	HE2	PHE	V	106
R	H	C	LEU	A	35	L	H	HZ	PHE	V	106
R	H	CB	LEU	A	35	L	H	CE2	PHE	V	106
R	H	CB	LEU	A	35	L	H	CZ	PHE	V	106
R	H	CB	LEU	A	35	L	H	HE2	PHE	V	106
R	H	CB	LEU	A	35	L	H	HZ	PHE	V	106
R	H	CB	LEU	A	35	L	H	CD2	PHE	V	110
R	H	CB	LEU	A	35	L	H	CE2	PHE	V	110
R	H	CB	LEU	A	35	L	H	HD2	PHE	V	110
R	H	CB	LEU	A	35	L	H	HE2	PHE	V	110
R	H	O	LEU	A	35	L	H	CE2	PHE	V	106
R	H	O	LEU	A	35	L	H	HE2	PHE	V	106
R	H	CG	LEU	A	35	L	H	CZ	PHE	V	106
R	H	CG	LEU	A	35	L	H	HZ	PHE	V	106
R	H	CG	LEU	A	35	L	H	CG	PHE	V	110
R	H	CG	LEU	A	35	L	H	CD2	PHE	V	110
R	H	CG	LEU	A	35	L	H	CE2	PHE	V	110
R	H	CG	LEU	A	35	L	H	CZ	PHE	V	110
R	H	CG	LEU	A	35	L	H	HB3	PHE	V	110
R	H	CG	LEU	A	35	L	H	HD2	PHE	V	110
R	H	CG	LEU	A	35	L	H	HE2	PHE	V	110
R	H	CG	LEU	A	35	L	H	HZ	PHE	V	110
R	H	CD1	LEU	A	35	L	H	CE1	PHE	V	106
R	H	CD1	LEU	A	35	L	H	CZ	PHE	V	106
R	H	CD1	LEU	A	35	L	H	HE1	PHE	V	106
R	H	CD1	LEU	A	35	L	H	HZ	PHE	V	106
R	H	CD1	LEU	A	35	L	H	CG	PHE	V	110
R	H	CD1	LEU	A	35	L	H	CD1	PHE	V	110
R	H	CD1	LEU	A	35	L	H	CD2	PHE	V	110
R	H	CD1	LEU	A	35	L	H	CE1	PHE	V	110
R	H	CD1	LEU	A	35	L	H	CE2	PHE	V	110
R	H	CD1	LEU	A	35	L	H	CZ	PHE	V	110
R	H	CD1	LEU	A	35	L	H	HD2	PHE	V	110
R	H	CD1	LEU	A	35	L	H	HE2	PHE	V	110
R	H	CD1	LEU	A	35	L	H	HZ	PHE	V	110
R	H	CD2	LEU	A	35	L	H	CZ	PHE	V	106
R	H	CD2	LEU	A	35	L	H	HZ	PHE	V	106
R	H	CD2	LEU	A	35	L	H	CA	PHE	V	110
R	H	CD2	LEU	A	35	L	H	CB	PHE	V	110
R	H	CD2	LEU	A	35	L	H	CG	PHE	V	110
R	H	CD2	LEU	A	35	L	H	CD1	PHE	V	110
R	H	CD2	LEU	A	35	L	H	CD2	PHE	V	110
R	H	CD2	LEU	A	35	L	H	CE1	PHE	V	110
R	H	CD2	LEU	A	35	L	H	CE2	PHE	V	110
R	H	CD2	LEU	A	35	L	H	CZ	PHE	V	110
R	H	CD2	LEU	A	35	L	H	HA	PHE	V	110
R	H	CD2	LEU	A	35	L	H	HB2	PHE	V	110
R	H	CD2	LEU	A	35	L	H	HB3	PHE	V	110
R	H	CD2	LEU	A	35	L	H	HD2	PHE	V	110
R	H	CD2	LEU	A	35	L	H	HE2	PHE	V	110
R	H	N	ALA	A	36	L	H	HE2	PHE	V	106
R	H	CE3	TRP	A	37	L	H	HH	TYR	V	113
R	H	CE3	TRP	A	37	L	H	HG23	ILE	V	164
R	H	CH2	TRP	A	37	L	H	HG21	ILE	V	164
R	H	CH2	TRP	A	37	L	H	HG23	ILE	V	164
R	H	CH2	TRP	A	37	L	H	HA	ALA	V	165
R	H	CH2	TRP	A	37	L	H	HB2	SER	V	168
R	H	CH2	TRP	A	37	L	H	HB3	SER	V	168
R	H	CZ3	TRP	A	37	L	H	OH	TYR	V	113
R	H	CZ3	TRP	A	37	L	H	HH	TYR	V	113
R	H	CZ3	TRP	A	37	L	H	CG2	ILE	V	164
R	H	CZ3	TRP	A	37	L	H	HG21	ILE	V	164
R	H	CZ3	TRP	A	37	L	H	HG22	ILE	V	164
R	H	CZ3	TRP	A	37	L	H	HG23	ILE	V	164
R	H	CZ3	TRP	A	37	L	H	HB2	SER	V	168
R	H	CA	THR	A	38	L	H	HB1	ALA	V	171
R	H	C	THR	A	38	L	H	HB1	ALA	V	171
R	H	CB	THR	A	38	L	H	CB	ALA	V	171
R	H	CB	THR	A	38	L	H	HB1	ALA	V	171
R	H	CB	THR	A	38	L	H	HB2	ALA	V	171
R	H	CB	THR	A	38	L	H	HB3	ALA	V	171
R	H	O	THR	A	38	L	H	HB1	ALA	V	171
R	H	CG2	THR	A	38	L	H	CG	TYR	V	113
R	H	CG2	THR	A	38	L	H	CD1	TYR	V	113
R	H	CG2	THR	A	38	L	H	CD2	TYR	V	113
R	H	CG2	THR	A	38	L	H	CE1	TYR	V	113
R	H	CG2	THR	A	38	L	H	CE2	TYR	V	113
R	H	CG2	THR	A	38	L	H	OH	TYR	V	113
R	H	CG2	THR	A	38	L	H	CZ	TYR	V	113
R	H	CG2	THR	A	38	L	H	HD1	TYR	V	113
R	H	CG2	THR	A	38	L	H	HE1	TYR	V	113
R	H	CG2	THR	A	38	L	H	HE2	TYR	V	113
R	H	CG2	THR	A	38	L	H	HH	TYR	V	113
R	H	CG2	THR	A	38	L	H	CB	ALA	V	171
R	H	CG2	THR	A	38	L	H	HB1	ALA	V	171
R	H	CG2	THR	A	38	L	H	HB2	ALA	V	171
R	H	CG2	THR	A	38	L	H	HB3	ALA	V	171
R	H	OG1	THR	A	38	L	H	HB1	ALA	V	171
R	H	CB	TYR	A	39	L	H	HD2	PHE	V	106
R	H	CB	TYR	A	39	L	H	HE2	PHE	V	106
R	H	CG	TYR	A	39	L	H	HD2	PHE	V	106
R	H	CD2	TYR	A	39	L	H	HD2	PHE	V	106
R	H	CE2	TYR	A	39	L	H	HD2	PHE	V	106
R	H	O	PHE	A	41	L	H	HD2	TYR	V	172
R	H	CD1	PHE	A	41	L	H	HB3	SER	V	168
R	H	CD1	PHE	A	41	L	H	HB2	TYR	V	172
R	H	CD1	PHE	A	41	L	H	HD2	TYR	V	172
R	H	CE1	PHE	A	41	L	H	O	SER	V	168
R	H	CE1	PHE	A	41	L	H	HB3	SER	V	168
R	H	CE1	PHE	A	41	L	H	CB	TYR	V	172
R	H	CE1	PHE	A	41	L	H	HB2	TYR	V	172
R	H	CE1	PHE	A	41	L	H	HD2	TYR	V	172
R	H	CZ	PHE	A	41	L	H	HB3	SER	V	168
R	H	CZ	PHE	A	41	L	H	HB2	TYR	V	172
R	H	N	TYR	A	42	L	H	HD2	TYR	V	172
R	H	CA	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CA	TYR	A	42	L	H	HA	TYR	V	172
R	H	CA	TYR	A	42	L	H	HD2	TYR	V	172
R	H	C	TYR	A	42	L	H	HD2	TYR	V	172
R	H	CB	TYR	A	42	L	H	NZ	LYS	V	109
R	H	CB	TYR	A	42	L	H	HD2	LYS	V	109
R	H	CB	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CB	TYR	A	42	L	H	O	ALA	V	171
R	H	CB	TYR	A	42	L	H	HA	TYR	V	172
R	H	CB	TYR	A	42	L	H	HD2	TYR	V	172
R	H	O	TYR	A	42	L	H	CD2	TYR	V	172
R	H	O	TYR	A	42	L	H	CE2	TYR	V	172
R	H	O	TYR	A	42	L	H	HD2	TYR	V	172
R	H	O	TYR	A	42	L	H	HE2	TYR	V	172
R	H	CG	TYR	A	42	L	H	CD	LYS	V	109
R	H	CG	TYR	A	42	L	H	CE	LYS	V	109
R	H	CG	TYR	A	42	L	H	NZ	LYS	V	109
R	H	CG	TYR	A	42	L	H	HD2	LYS	V	109
R	H	CG	TYR	A	42	L	H	HE3	LYS	V	109
R	H	CG	TYR	A	42	L	H	HZ1	LYS	V	109
R	H	CG	TYR	A	42	L	H	HZ2	LYS	V	109
R	H	CG	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CG	TYR	A	42	L	H	O	ALA	V	171
R	H	CG	TYR	A	42	L	H	HA	TYR	V	172
R	H	CD1	TYR	A	42	L	H	CD	LYS	V	109
R	H	CD1	TYR	A	42	L	H	CE	LYS	V	109
R	H	CD1	TYR	A	42	L	H	NZ	LYS	V	109
R	H	CD1	TYR	A	42	L	H	HD2	LYS	V	109
R	H	CD1	TYR	A	42	L	H	HE3	LYS	V	109
R	H	CD1	TYR	A	42	L	H	HZ1	LYS	V	109
R	H	CD1	TYR	A	42	L	H	HZ2	LYS	V	109
R	H	CD1	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CD2	TYR	A	42	L	H	CE	LYS	V	109
R	H	CD2	TYR	A	42	L	H	NZ	LYS	V	109
R	H	CD2	TYR	A	42	L	H	HD2	LYS	V	109
R	H	CD2	TYR	A	42	L	H	HE3	LYS	V	109
R	H	CD2	TYR	A	42	L	H	HZ1	LYS	V	109
R	H	CD2	TYR	A	42	L	H	HZ2	LYS	V	109
R	H	CD2	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CD2	TYR	A	42	L	H	C	ALA	V	171
R	H	CD2	TYR	A	42	L	H	O	ALA	V	171
R	H	CD2	TYR	A	42	L	H	N	TYR	V	172
R	H	CD2	TYR	A	42	L	H	CA	TYR	V	172
R	H	CD2	TYR	A	42	L	H	C	TYR	V	172
R	H	CD2	TYR	A	42	L	H	O	TYR	V	172
R	H	CD2	TYR	A	42	L	H	HA	TYR	V	172
R	H	CD2	TYR	A	42	L	H	HD2	TYR	V	172
R	H	CE1	TYR	A	42	L	H	CD	LYS	V	109
R	H	CE1	TYR	A	42	L	H	CE	LYS	V	109
R	H	CE1	TYR	A	42	L	H	NZ	LYS	V	109
R	H	CE1	TYR	A	42	L	H	HD2	LYS	V	109
R	H	CE1	TYR	A	42	L	H	HE2	LYS	V	109
R	H	CE1	TYR	A	42	L	H	HE3	LYS	V	109
R	H	CE1	TYR	A	42	L	H	HZ1	LYS	V	109
R	H	CE1	TYR	A	42	L	H	HZ2	LYS	V	109
R	H	CE1	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CE2	TYR	A	42	L	H	CE	LYS	V	109
R	H	CE2	TYR	A	42	L	H	NZ	LYS	V	109
R	H	CE2	TYR	A	42	L	H	HE2	LYS	V	109
R	H	CE2	TYR	A	42	L	H	HE3	LYS	V	109
R	H	CE2	TYR	A	42	L	H	HZ1	LYS	V	109
R	H	CE2	TYR	A	42	L	H	HZ2	LYS	V	109
R	H	CE2	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CE2	TYR	A	42	L	H	O	ALA	V	171
R	H	CE2	TYR	A	42	L	H	CA	TYR	V	172
R	H	CE2	TYR	A	42	L	H	C	TYR	V	172
R	H	CE2	TYR	A	42	L	H	O	TYR	V	172
R	H	CE2	TYR	A	42	L	H	HA	TYR	V	172
R	H	CE2	TYR	A	42	L	S	O	GLN	V	174
R	H	OH	TYR	A	42	L	H	CE	LYS	V	109
R	H	OH	TYR	A	42	L	H	NZ	LYS	V	109
R	H	OH	TYR	A	42	L	H	HE2	LYS	V	109
R	H	OH	TYR	A	42	L	H	HE3	LYS	V	109
R	H	OH	TYR	A	42	L	H	HZ1	LYS	V	109
R	H	OH	TYR	A	42	L	H	HZ2	LYS	V	109
R	H	OH	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CZ	TYR	A	42	L	H	CE	LYS	V	109
R	H	CZ	TYR	A	42	L	H	NZ	LYS	V	109
R	H	CZ	TYR	A	42	L	H	HE2	LYS	V	109
R	H	CZ	TYR	A	42	L	H	HE3	LYS	V	109
R	H	CZ	TYR	A	42	L	H	HZ1	LYS	V	109
R	H	CZ	TYR	A	42	L	H	HZ2	LYS	V	109
R	H	CZ	TYR	A	42	L	H	HZ3	LYS	V	109
R	H	CZ	TYR	A	42	L	H	O	TYR	V	172
R	H	N	GLY	A	45	L	H	HE2	TYR	V	172
R	H	CA	GLY	A	45	L	H	CD2	TYR	V	172
R	H	CA	GLY	A	45	L	H	CE2	TYR	V	172
R	H	CA	GLY	A	45	L	H	HD2	TYR	V	172
R	H	CA	GLY	A	45	L	H	HE2	TYR	V	172
R	H	C	GLY	A	45	L	H	CE2	TYR	V	172
R	H	C	GLY	A	45	L	H	OH	TYR	V	172
R	H	C	GLY	A	45	L	H	CZ	TYR	V	172
R	H	C	GLY	A	45	L	H	HE2	TYR	V	172
R	H	C	GLY	A	45	L	H	HH	TYR	V	172
R	H	O	GLY	A	45	L	H	CE2	TYR	V	172
R	H	O	GLY	A	45	L	H	OH	TYR	V	172
R	H	O	GLY	A	45	L	H	CZ	TYR	V	172
R	H	O	GLY	A	45	L	H	HE2	TYR	V	172
R	H	O	GLY	A	45	L	H	HH	TYR	V	172
R	H	N	ARG	A	46	L	H	CE2	TYR	V	172
R	H	N	ARG	A	46	L	H	HE2	TYR	V	172
R	H	CA	ARG	A	46	L	H	HE2	TYR	V	172
R	H	CG	ARG	A	49	L	H	OH	TYR	V	172
R	H	CG	ARG	A	49	L	H	HH	TYR	V	172
R	H	CD	ARG	A	49	L	H	OH	TYR	V	172
R	H	NE	ARG	A	49	L	H	OH	TYR	V	172
R	H	NE	ARG	A	49	L	H	CZ	TYR	V	172
R	H	NE	ARG	A	49	L	H	HH	TYR	V	172
R	H	NH2	ARG	A	49	L	H	OH	TYR	V	172
R	H	NH2	ARG	A	49	L	H	HE1	TYR	V	172
R	H	CZ	ARG	A	49	L	H	OH	TYR	V	172
R	-	NE2	GLN	A	53	L	H	HE1	HIS	V	196
R	-	CA	ARG	A	55	L	H	HE2	HIS	V	196
R	-	C	ARG	A	55	L	H	HE2	HIS	V	196
R	-	CB	ARG	A	55	L	H	HE2	HIS	V	196
R	-	CG	ARG	A	55	L	H	HE2	HIS	V	196
R	-	CD	ARG	A	55	L	H	NH1	ARG	V	195
R	-	CD	ARG	A	55	L	H	NH2	ARG	V	195
R	-	CD	ARG	A	55	L	H	CZ	ARG	V	195
R	-	CD	ARG	A	55	L	H	HH12	ARG	V	195
R	-	NE	ARG	A	55	L	H	CD	ARG	V	195
R	-	NE	ARG	A	55	L	H	NE	ARG	V	195
R	-	NE	ARG	A	55	L	H	NH1	ARG	V	195
R	-	NE	ARG	A	55	L	H	CZ	ARG	V	195
R	-	NE	ARG	A	55	L	H	HD2	ARG	V	195
R	-	NE	ARG	A	55	L	H	HH11	ARG	V	195
R	-	NH1	ARG	A	55	L	H	CD	ARG	V	195
R	-	NH1	ARG	A	55	L	H	NE	ARG	V	195
R	-	NH1	ARG	A	55	L	H	NH1	ARG	V	195
R	-	NH1	ARG	A	55	L	H	CZ	ARG	V	195
R	-	NH1	ARG	A	55	L	H	HD2	ARG	V	195
R	-	NH1	ARG	A	55	L	H	HD3	ARG	V	195
R	-	NH1	ARG	A	55	L	H	HH11	ARG	V	195
R	-	NH1	ARG	A	55	L	H	HH12	ARG	V	195
R	-	NH2	ARG	A	55	L	H	CB	ARG	V	195
R	-	NH2	ARG	A	55	L	H	CG	ARG	V	195
R	-	NH2	ARG	A	55	L	H	CD	ARG	V	195
R	-	NH2	ARG	A	55	L	H	HB2	ARG	V	195
R	-	NH2	ARG	A	55	L	H	HD2	ARG	V	195
R	-	NH2	ARG	A	55	L	H	HD3	ARG	V	195
R	-	NH2	ARG	A	55	L	H	HH11	ARG	V	195
R	-	CZ	ARG	A	55	L	H	CD	ARG	V	195
R	-	CZ	ARG	A	55	L	H	NE	ARG	V	195
R	-	CZ	ARG	A	55	L	H	NH1	ARG	V	195
R	-	CZ	ARG	A	55	L	H	CZ	ARG	V	195
R	-	CZ	ARG	A	55	L	H	HB2	ARG	V	195
R	-	CZ	ARG	A	55	L	H	HD2	ARG	V	195
R	-	CZ	ARG	A	55	L	H	HD3	ARG	V	195
R	-	CZ	ARG	A	55	L	H	HH11	ARG	V	195
R	-	N	LYS	A	56	L	H	NE2	HIS	V	196
R	-	N	LYS	A	56	L	H	HE2	HIS	V	196
R	-	CA	LYS	A	56	L	H	HE2	HIS	V	196
R	-	CB	LYS	A	56	L	H	NE2	HIS	V	196
R	-	CB	LYS	A	56	L	H	HE2	HIS	V	196
R	-	O	LYS	A	56	L	H	HE2	HIS	V	196
R	-	CA	ASN	A	58	L	H	HB1	ALA	V	199
R	-	CB	ASN	A	58	L	H	HB1	ALA	V	199
R	-	N	TRP	A	59	L	H	HB1	ALA	V	199
R	-	CA	TRP	A	59	L	H	HD2	TYR	V	200
R	-	CB	TRP	A	59	L	H	HG2	PRO	V	169
R	-	CB	TRP	A	59	L	H	CA	TYR	V	200
R	-	CB	TRP	A	59	L	H	CB	TYR	V	200
R	-	CB	TRP	A	59	L	H	CD2	TYR	V	200
R	-	CB	TRP	A	59	L	H	HA	TYR	V	200
R	-	CB	TRP	A	59	L	H	HB2	TYR	V	200
R	-	CB	TRP	A	59	L	H	HD2	TYR	V	200
R	-	O	TRP	A	59	L	H	HG2	PRO	V	169
R	-	O	TRP	A	59	L	H	HG3	PRO	V	169
R	-	CG	TRP	A	59	L	H	HG2	PRO	V	169
R	-	CG	TRP	A	59	L	H	N	TYR	V	200
R	-	CG	TRP	A	59	L	H	CA	TYR	V	200
R	-	CG	TRP	A	59	L	H	CB	TYR	V	200
R	-	CG	TRP	A	59	L	H	CG	TYR	V	200
R	-	CG	TRP	A	59	L	H	CD2	TYR	V	200
R	-	CG	TRP	A	59	L	H	CE2	TYR	V	200
R	-	CG	TRP	A	59	L	H	HA	TYR	V	200
R	-	CG	TRP	A	59	L	H	HB2	TYR	V	200
R	-	CG	TRP	A	59	L	H	HD2	TYR	V	200
R	-	CG	TRP	A	59	L	H	HE2	TYR	V	200
R	-	CG	TRP	A	59	L	H	CB	CYS	V	203
R	-	CG	TRP	A	59	L	H	HB2	CYS	V	203
R	-	CD1	TRP	A	59	L	H	C	ALA	V	199
R	-	CD1	TRP	A	59	L	H	O	ALA	V	199
R	-	CD1	TRP	A	59	L	H	N	TYR	V	200
R	-	CD1	TRP	A	59	L	H	CA	TYR	V	200
R	-	CD1	TRP	A	59	L	H	C	TYR	V	200
R	-	CD1	TRP	A	59	L	H	CB	TYR	V	200
R	-	CD1	TRP	A	59	L	H	O	TYR	V	200
R	-	CD1	TRP	A	59	L	H	CD2	TYR	V	200
R	-	CD1	TRP	A	59	L	H	HA	TYR	V	200
R	-	CD1	TRP	A	59	L	H	HB2	TYR	V	200
R	-	CD1	TRP	A	59	L	H	HD2	TYR	V	200
R	-	CD1	TRP	A	59	L	H	CB	CYS	V	203
R	-	CD1	TRP	A	59	L	H	SG	CYS	V	203
R	-	CD1	TRP	A	59	L	H	H	CYS	V	203
R	-	CD1	TRP	A	59	L	H	HB2	CYS	V	203
R	-	CD1	TRP	A	59	L	H	HB3	CYS	V	203
R	-	CD1	TRP	A	59	L	H	HG	CYS	V	203
R	-	CD2	TRP	A	59	L	H	HG2	PRO	V	169
R	-	CD2	TRP	A	59	L	H	CG	TYR	V	200
R	-	CD2	TRP	A	59	L	H	CD2	TYR	V	200
R	-	CD2	TRP	A	59	L	H	CE2	TYR	V	200
R	-	CD2	TRP	A	59	L	H	HA	TYR	V	200
R	-	CD2	TRP	A	59	L	H	HD2	TYR	V	200
R	-	CD2	TRP	A	59	L	H	HE2	TYR	V	200
R	-	CD2	TRP	A	59	L	H	HB2	CYS	V	203
R	-	CD2	TRP	A	59	L	H	HB3	CYS	V	203
R	-	CE2	TRP	A	59	L	H	CD2	TYR	V	200
R	-	CE2	TRP	A	59	L	H	CE2	TYR	V	200
R	-	CE2	TRP	A	59	L	H	HA	TYR	V	200
R	-	CE2	TRP	A	59	L	H	HD2	TYR	V	200
R	-	CE2	TRP	A	59	L	H	HE2	TYR	V	200
R	-	CE2	TRP	A	59	L	H	CB	CYS	V	203
R	-	CE2	TRP	A	59	L	H	HB2	CYS	V	203
R	-	CE2	TRP	A	59	L	H	HB3	CYS	V	203
R	-	CE2	TRP	A	59	L	H	HG22	THR	V	204
R	-	CE3	TRP	A	59	L	H	O	MET	V	166
R	-	CE3	TRP	A	59	L	H	HA	MET	V	166
R	-	CE3	TRP	A	59	L	H	CG	PRO	V	169
R	-	CE3	TRP	A	59	L	H	CD	PRO	V	169
R	-	CE3	TRP	A	59	L	H	HG2	PRO	V	169
R	-	CE3	TRP	A	59	L	H	HG3	PRO	V	169
R	-	CE3	TRP	A	59	L	H	HD2	PRO	V	169
R	-	CE3	TRP	A	59	L	H	HD3	PRO	V	169
R	-	CE3	TRP	A	59	L	H	CD2	TYR	V	200
R	-	CE3	TRP	A	59	L	H	CE2	TYR	V	200
R	-	CE3	TRP	A	59	L	H	HD2	TYR	V	200
R	-	CE3	TRP	A	59	L	H	HE2	TYR	V	200
R	-	NE1	TRP	A	59	L	H	O	ALA	V	199
R	-	NE1	TRP	A	59	L	H	CA	TYR	V	200
R	-	NE1	TRP	A	59	L	H	C	TYR	V	200
R	-	NE1	TRP	A	59	L	H	O	TYR	V	200
R	-	NE1	TRP	A	59	L	H	CD2	TYR	V	200
R	-	NE1	TRP	A	59	L	H	HA	TYR	V	200
R	-	NE1	TRP	A	59	L	H	HD2	TYR	V	200
R	-	NE1	TRP	A	59	L	H	N	CYS	V	203
R	-	NE1	TRP	A	59	L	H	CA	CYS	V	203
R	-	NE1	TRP	A	59	L	H	C	CYS	V	203
R	-	NE1	TRP	A	59	L	H	CB	CYS	V	203
R	-	NE1	TRP	A	59	L	H	SG	CYS	V	203
R	-	NE1	TRP	A	59	L	H	H	CYS	V	203
R	-	NE1	TRP	A	59	L	H	HB2	CYS	V	203
R	-	NE1	TRP	A	59	L	H	HB3	CYS	V	203
R	-	NE1	TRP	A	59	L	H	HG	CYS	V	203
R	-	NE1	TRP	A	59	L	H	N	THR	V	204
R	-	NE1	TRP	A	59	L	H	H	THR	V	204
R	-	NE1	TRP	A	59	L	H	HG22	THR	V	204
R	-	CH2	TRP	A	59	L	H	CA	MET	V	166
R	-	CH2	TRP	A	59	L	H	C	MET	V	166
R	-	CH2	TRP	A	59	L	H	CB	MET	V	166
R	-	CH2	TRP	A	59	L	H	O	MET	V	166
R	-	CH2	TRP	A	59	L	H	CG	MET	V	166
R	-	CH2	TRP	A	59	L	H	HA	MET	V	166
R	-	CH2	TRP	A	59	L	H	HB3	MET	V	166
R	-	CH2	TRP	A	59	L	H	HG2	MET	V	166
R	-	CH2	TRP	A	59	L	H	HE1	MET	V	166
R	-	CH2	TRP	A	59	L	H	HG2	PRO	V	169
R	-	CH2	TRP	A	59	L	H	CE2	TYR	V	200
R	-	CH2	TRP	A	59	L	H	HE2	TYR	V	200
R	-	CH2	TRP	A	59	L	H	HH	TYR	V	200
R	-	CZ2	TRP	A	59	L	H	O	MET	V	166
R	-	CZ2	TRP	A	59	L	H	HA	MET	V	166
R	-	CZ2	TRP	A	59	L	H	HB3	MET	V	166
R	-	CZ2	TRP	A	59	L	H	HG2	MET	V	166
R	-	CZ2	TRP	A	59	L	H	HE1	MET	V	166
R	-	CZ2	TRP	A	59	L	H	HE3	MET	V	166
R	-	CZ2	TRP	A	59	L	H	CD2	TYR	V	200
R	-	CZ2	TRP	A	59	L	H	CE2	TYR	V	200
R	-	CZ2	TRP	A	59	L	H	HD2	TYR	V	200
R	-	CZ2	TRP	A	59	L	H	HE2	TYR	V	200
R	-	CZ2	TRP	A	59	L	H	CB	CYS	V	203
R	-	CZ2	TRP	A	59	L	H	HB2	CYS	V	203
R	-	CZ2	TRP	A	59	L	H	HB3	CYS	V	203
R	-	CZ2	TRP	A	59	L	H	HG22	THR	V	204
R	-	CZ2	TRP	A	59	L	H	HG23	THR	V	204
R	-	CZ3	TRP	A	59	L	H	CA	MET	V	166
R	-	CZ3	TRP	A	59	L	H	C	MET	V	166
R	-	CZ3	TRP	A	59	L	H	O	MET	V	166
R	-	CZ3	TRP	A	59	L	H	HA	MET	V	166
R	-	CZ3	TRP	A	59	L	H	HB3	MET	V	166
R	-	CZ3	TRP	A	59	L	H	CG	PRO	V	169
R	-	CZ3	TRP	A	59	L	H	CD	PRO	V	169
R	-	CZ3	TRP	A	59	L	H	HG2	PRO	V	169
R	-	CZ3	TRP	A	59	L	H	HG3	PRO	V	169
R	-	CZ3	TRP	A	59	L	H	HD2	PRO	V	169
R	-	CZ3	TRP	A	59	L	H	HD3	PRO	V	169
R	-	CZ3	TRP	A	59	L	H	CD2	TYR	V	200
R	-	CZ3	TRP	A	59	L	H	CE2	TYR	V	200
R	-	CZ3	TRP	A	59	L	H	HD2	TYR	V	200
R	-	CZ3	TRP	A	59	L	H	HE2	TYR	V	200
R	-	CZ3	TRP	A	59	L	H	HH	TYR	V	200
R	-	CG	PHE	A	60	L	H	HG2	MET	V	166
R	-	CD2	PHE	A	60	L	H	CA	MET	V	166
R	-	CD2	PHE	A	60	L	H	CG	MET	V	166
R	-	CD2	PHE	A	60	L	H	HA	MET	V	166
R	-	CD2	PHE	A	60	L	H	HG2	MET	V	166
R	-	CD2	PHE	A	60	L	H	HG3	MET	V	166
R	-	CE2	PHE	A	60	L	H	HB1	ALA	V	165
R	-	CE2	PHE	A	60	L	H	HB3	ALA	V	165
R	-	CE2	PHE	A	60	L	H	CG	MET	V	166
R	-	CE2	PHE	A	60	L	H	HA	MET	V	166
R	-	CE2	PHE	A	60	L	H	HG2	MET	V	166
R	-	CE2	PHE	A	60	L	H	HG3	MET	V	166
R	-	CZ	PHE	A	60	L	H	HG2	MET	V	166
R	-	CZ	PHE	A	60	L	H	HG3	MET	V	166
R	-	CA	PRO	A	94	L	H	HG	SER	V	168
R	-	CB	PRO	A	94	L	H	O	ALA	V	165
R	-	CB	PRO	A	94	L	H	OG	SER	V	168
R	-	CB	PRO	A	94	L	H	HG	SER	V	168
R	-	CB	PRO	A	94	L	H	HG3	PRO	V	169
R	-	CB	PRO	A	94	L	H	HD2	PRO	V	169
R	-	O	PRO	A	94	L	H	OG	SER	V	168
R	-	CG	PRO	A	94	L	H	C	ALA	V	165
R	-	CG	PRO	A	94	L	H	O	ALA	V	165
R	-	CG	PRO	A	94	L	H	HA	ALA	V	165
R	-	CG	PRO	A	94	L	H	HB1	ALA	V	165
R	-	CG	PRO	A	94	L	H	OG	SER	V	168
R	-	CG	PRO	A	94	L	H	HG	SER	V	168
R	-	CD	PRO	A	94	L	H	HB1	ALA	V	165
R	-	CG2	ILE	A	95	L	H	CB	SER	V	168
R	-	CG2	ILE	A	95	L	H	OG	SER	V	168
R	-	CG2	ILE	A	95	L	H	HB2	SER	V	168
R	-	CG2	ILE	A	95	L	H	HB3	SER	V	168
R	-	CG2	ILE	A	95	L	H	HG	SER	V	168
R	H	CD1	PHE	A	240	L	H	HD12	LEU	V	162
R	H	CE1	PHE	A	240	L	H	CD1	LEU	V	162
R	H	CE1	PHE	A	240	L	H	HD11	LEU	V	162
R	H	CE1	PHE	A	240	L	H	HD12	LEU	V	162
R	H	CE1	PHE	A	240	L	H	HD13	LEU	V	162
R	H	CZ	PHE	A	240	L	H	HD12	LEU	V	162

- 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