IID

Q96R30_A6ND48.1 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	TYR	A	121	L	H	TYR	V	140
R	H	TYR	A	121	L	H	VAL	V	144
R	H	TYR	A	124	L	H	TYR	V	140
R	H	VAL	A	125	L	H	TYR	V	140
R	-	HIS	A	129	L	H	GLY	V	137
R	-	HIS	A	129	L	H	TYR	V	140
R	-	HIS	A	132	L	H	GLN	V	141
R	H	LEU	A	136	L	H	TYR	V	140
R	H	LEU	A	136	L	H	VAL	V	144
R	H	VAL	A	141	L	H	LEU	V	148
R	H	GLN	A	144	L	H	LEU	V	148
R	H	GLN	A	144	L	H	PHE	V	151
R	H	GLY	A	147	L	H	PHE	V	101
R	H	SER	A	148	L	H	PHE	V	101
R	H	ALA	A	151	L	H	PHE	V	101
R	H	LEU	A	158	L	H	ARG	V	81
R	H	ILE	A	159	L	H	PRO	V	77
R	H	ILE	A	159	L	H	LYS	V	78
R	H	ILE	A	159	L	H	ARG	V	81
R	H	VAL	A	162	L	H	ARG	V	81
R	H	VAL	A	162	L	H	THR	V	85
R	H	VAL	A	162	L	-	ARG	V	87
R	H	VAL	A	163	L	H	ARG	V	81
R	H	VAL	A	163	L	H	THR	V	85
R	H	ASN	A	166	L	H	THR	V	85
R	H	ASN	A	166	L	-	ARG	V	87
R	H	LEU	A	195	L	H	VAL	V	23
R	H	LEU	A	195	L	H	ALA	V	26
R	H	LEU	A	195	L	H	GLY	V	27
R	H	LEU	A	195	L	H	LEU	V	30
R	H	LEU	A	195	L	H	LEU	V	84
R	H	PHE	A	196	L	H	LEU	V	84
R	H	LYS	A	198	L	H	LEU	V	30
R	H	LYS	A	198	L	H	LEU	V	34
R	H	VAL	A	199	L	H	LEU	V	30
R	H	VAL	A	199	L	H	ILE	V	80
R	H	ALA	A	202	L	H	LEU	V	30
R	H	ALA	A	202	L	H	TYR	V	33
R	H	ALA	A	202	L	H	LEU	V	34
R	H	ALA	A	202	L	H	LEU	V	37
R	H	CYS	A	203	L	H	TYR	V	33
R	H	CYS	A	203	L	H	PRO	V	77
R	H	VAL	A	205	L	H	LEU	V	37
R	H	VAL	A	205	L	H	LEU	V	41
R	H	PHE	A	206	L	H	TYR	V	33
R	H	PHE	A	206	L	H	LEU	V	37
R	H	PHE	A	206	L	H	LEU	V	41
R	H	PHE	A	206	L	H	LEU	V	69
R	H	PHE	A	206	L	H	SER	V	73
R	H	LEU	A	209	L	H	LEU	V	41
R	H	PHE	A	210	L	H	LEU	V	41
R	H	PHE	A	210	L	H	VAL	V	66
R	H	PHE	A	210	L	H	LEU	V	69
R	H	PHE	A	210	L	H	CYS	V	70
R	H	SER	A	213	L	H	LEU	V	41
R	H	SER	A	213	L	H	ILE	V	44
R	H	VAL	A	216	L	H	THR	V	48
R	H	ALA	A	217	L	H	THR	V	48
R	H	ALA	A	217	L	H	LYS	V	62
R	H	ALA	A	220	L	H	THR	V	48
R	H	HIS	A	221	L	H	LYS	V	62

- 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

Q96R30_A6ND48.1 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	TYR	A	121	L	H	HH	TYR	V	140
R	H	CE2	TYR	A	121	L	H	CE2	TYR	V	140
R	H	CE2	TYR	A	121	L	H	OH	TYR	V	140
R	H	CE2	TYR	A	121	L	H	HE2	TYR	V	140
R	H	CE2	TYR	A	121	L	H	HH	TYR	V	140
R	H	OH	TYR	A	121	L	H	CE2	TYR	V	140
R	H	OH	TYR	A	121	L	H	OH	TYR	V	140
R	H	OH	TYR	A	121	L	H	CZ	TYR	V	140
R	H	OH	TYR	A	121	L	H	HE2	TYR	V	140
R	H	OH	TYR	A	121	L	H	HH	TYR	V	140
R	H	OH	TYR	A	121	L	H	CG2	VAL	V	144
R	H	OH	TYR	A	121	L	H	HG21	VAL	V	144
R	H	OH	TYR	A	121	L	H	HG22	VAL	V	144
R	H	OH	TYR	A	121	L	H	HG23	VAL	V	144
R	H	CZ	TYR	A	121	L	H	OH	TYR	V	140
R	H	CZ	TYR	A	121	L	H	HE2	TYR	V	140
R	H	CZ	TYR	A	121	L	H	HH	TYR	V	140
R	H	CZ	TYR	A	121	L	H	HG22	VAL	V	144
R	H	CD1	TYR	A	124	L	H	HE2	TYR	V	140
R	H	CE1	TYR	A	124	L	H	CD2	TYR	V	140
R	H	CE1	TYR	A	124	L	H	CE2	TYR	V	140
R	H	CE1	TYR	A	124	L	H	CZ	TYR	V	140
R	H	CE1	TYR	A	124	L	H	HD2	TYR	V	140
R	H	CE1	TYR	A	124	L	H	HE2	TYR	V	140
R	H	OH	TYR	A	124	L	H	CD2	TYR	V	140
R	H	OH	TYR	A	124	L	H	CE2	TYR	V	140
R	H	OH	TYR	A	124	L	H	HB2	TYR	V	140
R	H	OH	TYR	A	124	L	H	HD2	TYR	V	140
R	H	OH	TYR	A	124	L	H	HE2	TYR	V	140
R	H	CZ	TYR	A	124	L	H	CE2	TYR	V	140
R	H	CZ	TYR	A	124	L	H	HD2	TYR	V	140
R	H	CZ	TYR	A	124	L	H	HE2	TYR	V	140
R	H	CB	VAL	A	125	L	H	OH	TYR	V	140
R	H	CB	VAL	A	125	L	H	HH	TYR	V	140
R	H	CG1	VAL	A	125	L	H	OH	TYR	V	140
R	H	CG1	VAL	A	125	L	H	HE1	TYR	V	140
R	H	CG2	VAL	A	125	L	H	OH	TYR	V	140
R	H	CG2	VAL	A	125	L	H	CZ	TYR	V	140
R	H	CG2	VAL	A	125	L	H	HH	TYR	V	140
R	-	ND1	HIS	A	129	L	H	CE1	TYR	V	140
R	-	CE1	HIS	A	129	L	H	CG	TYR	V	140
R	-	CE1	HIS	A	129	L	H	CD1	TYR	V	140
R	-	NE2	HIS	A	129	L	H	HA2	GLY	V	137
R	-	NE2	HIS	A	129	L	H	HB3	TYR	V	140
R	-	CG	HIS	A	132	L	H	HE21	GLN	V	141
R	-	CD2	HIS	A	132	L	H	NE2	GLN	V	141
R	-	CD2	HIS	A	132	L	H	HE21	GLN	V	141
R	-	CD2	HIS	A	132	L	H	HE22	GLN	V	141
R	-	ND1	HIS	A	132	L	H	HE21	GLN	V	141
R	-	CE1	HIS	A	132	L	H	HE21	GLN	V	141
R	-	CE1	HIS	A	132	L	H	HE22	GLN	V	141
R	-	NE2	HIS	A	132	L	H	NE2	GLN	V	141
R	-	NE2	HIS	A	132	L	H	HE21	GLN	V	141
R	-	NE2	HIS	A	132	L	H	HE22	GLN	V	141
R	H	CG	LEU	A	136	L	H	HE1	TYR	V	140
R	H	CG	LEU	A	136	L	H	HG13	VAL	V	144
R	H	CD1	LEU	A	136	L	H	CE1	TYR	V	140
R	H	CD1	LEU	A	136	L	H	HE1	TYR	V	140
R	H	CD2	LEU	A	136	L	H	HE1	TYR	V	140
R	H	CD2	LEU	A	136	L	H	CG1	VAL	V	144
R	H	CD2	LEU	A	136	L	H	HB	VAL	V	144
R	H	CD2	LEU	A	136	L	H	HG11	VAL	V	144
R	H	CD2	LEU	A	136	L	H	HG13	VAL	V	144
R	H	CD2	LEU	A	136	L	H	HG23	VAL	V	144
R	H	CB	VAL	A	141	L	H	HD23	LEU	V	148
R	H	CG1	VAL	A	141	L	H	HD23	LEU	V	148
R	H	CG2	VAL	A	141	L	H	CD2	LEU	V	148
R	H	CG2	VAL	A	141	L	H	HD12	LEU	V	148
R	H	CG2	VAL	A	141	L	H	HD21	LEU	V	148
R	H	CG2	VAL	A	141	L	H	HD22	LEU	V	148
R	H	CG2	VAL	A	141	L	H	HD23	LEU	V	148
R	H	CD	GLN	A	144	L	H	HD21	LEU	V	148
R	H	CD	GLN	A	144	L	H	HB3	PHE	V	151
R	H	NE2	GLN	A	144	L	H	CB	PHE	V	151
R	H	NE2	GLN	A	144	L	H	HB2	PHE	V	151
R	H	NE2	GLN	A	144	L	H	HB3	PHE	V	151
R	H	OE1	GLN	A	144	L	H	CD2	LEU	V	148
R	H	OE1	GLN	A	144	L	H	HD21	LEU	V	148
R	H	OE1	GLN	A	144	L	H	HD22	LEU	V	148
R	H	OE1	GLN	A	144	L	H	HD23	LEU	V	148
R	H	O	GLY	A	147	L	H	HZ	PHE	V	101
R	H	CA	SER	A	148	L	H	HZ	PHE	V	101
R	H	CB	SER	A	148	L	H	HE1	PHE	V	101
R	H	CB	SER	A	148	L	H	HZ	PHE	V	101
R	H	CB	ALA	A	151	L	H	CE2	PHE	V	101
R	H	CB	ALA	A	151	L	H	HE2	PHE	V	101
R	H	CB	ALA	A	151	L	H	HZ	PHE	V	101
R	H	C	LEU	A	158	L	H	NH1	ARG	V	81
R	H	C	LEU	A	158	L	H	HH11	ARG	V	81
R	H	C	LEU	A	158	L	H	HH12	ARG	V	81
R	H	CB	LEU	A	158	L	H	HH11	ARG	V	81
R	H	CB	LEU	A	158	L	H	HH12	ARG	V	81
R	H	O	LEU	A	158	L	H	NH1	ARG	V	81
R	H	O	LEU	A	158	L	H	HD2	ARG	V	81
R	H	O	LEU	A	158	L	H	HH11	ARG	V	81
R	H	N	ILE	A	159	L	H	NH1	ARG	V	81
R	H	N	ILE	A	159	L	H	HD2	ARG	V	81
R	H	N	ILE	A	159	L	H	HD3	ARG	V	81
R	H	N	ILE	A	159	L	H	HH11	ARG	V	81
R	H	N	ILE	A	159	L	H	HH12	ARG	V	81
R	H	CA	ILE	A	159	L	H	CD	ARG	V	81
R	H	CA	ILE	A	159	L	H	NE	ARG	V	81
R	H	CA	ILE	A	159	L	H	NH1	ARG	V	81
R	H	CA	ILE	A	159	L	H	HD2	ARG	V	81
R	H	CA	ILE	A	159	L	H	HD3	ARG	V	81
R	H	CA	ILE	A	159	L	H	HH11	ARG	V	81
R	H	C	ILE	A	159	L	H	CD	ARG	V	81
R	H	C	ILE	A	159	L	H	HG3	ARG	V	81
R	H	C	ILE	A	159	L	H	HD2	ARG	V	81
R	H	C	ILE	A	159	L	H	HD3	ARG	V	81
R	H	C	ILE	A	159	L	H	HH11	ARG	V	81
R	H	CB	ILE	A	159	L	H	CD	ARG	V	81
R	H	CB	ILE	A	159	L	H	NH1	ARG	V	81
R	H	CB	ILE	A	159	L	H	HB3	ARG	V	81
R	H	CB	ILE	A	159	L	H	HD2	ARG	V	81
R	H	CB	ILE	A	159	L	H	HD3	ARG	V	81
R	H	CB	ILE	A	159	L	H	HH11	ARG	V	81
R	H	O	ILE	A	159	L	H	CG	ARG	V	81
R	H	O	ILE	A	159	L	H	CD	ARG	V	81
R	H	O	ILE	A	159	L	H	HG3	ARG	V	81
R	H	O	ILE	A	159	L	H	HD2	ARG	V	81
R	H	O	ILE	A	159	L	H	HD3	ARG	V	81
R	H	CG1	ILE	A	159	L	H	HA	LYS	V	78
R	H	CG1	ILE	A	159	L	H	CD	ARG	V	81
R	H	CG1	ILE	A	159	L	H	NE	ARG	V	81
R	H	CG1	ILE	A	159	L	H	NH1	ARG	V	81
R	H	CG1	ILE	A	159	L	H	CZ	ARG	V	81
R	H	CG1	ILE	A	159	L	H	HB3	ARG	V	81
R	H	CG1	ILE	A	159	L	H	HD3	ARG	V	81
R	H	CG1	ILE	A	159	L	H	HH11	ARG	V	81
R	H	CG1	ILE	A	159	L	H	HH12	ARG	V	81
R	H	CG2	ILE	A	159	L	H	CB	ARG	V	81
R	H	CG2	ILE	A	159	L	H	CG	ARG	V	81
R	H	CG2	ILE	A	159	L	H	CD	ARG	V	81
R	H	CG2	ILE	A	159	L	H	HB3	ARG	V	81
R	H	CG2	ILE	A	159	L	H	HG3	ARG	V	81
R	H	CG2	ILE	A	159	L	H	HD2	ARG	V	81
R	H	CG2	ILE	A	159	L	H	HD3	ARG	V	81
R	H	CD1	ILE	A	159	L	H	CB	PRO	V	77
R	H	CD1	ILE	A	159	L	H	HB2	PRO	V	77
R	H	CD1	ILE	A	159	L	H	HB3	PRO	V	77
R	H	CD1	ILE	A	159	L	H	N	LYS	V	78
R	H	CD1	ILE	A	159	L	H	HA	LYS	V	78
R	H	CD1	ILE	A	159	L	H	HB2	LYS	V	78
R	H	CD1	ILE	A	159	L	H	HD3	ARG	V	81
R	H	C	VAL	A	162	L	H	HG21	THR	V	85
R	H	CB	VAL	A	162	L	H	HD2	ARG	V	81
R	H	CB	VAL	A	162	L	H	HG21	THR	V	85
R	H	O	VAL	A	162	L	H	HG21	THR	V	85
R	H	O	VAL	A	162	L	H	HG23	THR	V	85
R	H	CG1	VAL	A	162	L	H	HD2	ARG	V	81
R	H	CG1	VAL	A	162	L	H	CG2	THR	V	85
R	H	CG1	VAL	A	162	L	H	HG21	THR	V	85
R	H	CG1	VAL	A	162	L	-	HB2	ARG	V	87
R	H	CG1	VAL	A	162	L	-	HD2	ARG	V	87
R	H	CG2	VAL	A	162	L	H	HD2	ARG	V	81
R	H	N	VAL	A	163	L	H	HG3	ARG	V	81
R	H	N	VAL	A	163	L	H	HD2	ARG	V	81
R	H	N	VAL	A	163	L	H	HG21	THR	V	85
R	H	N	VAL	A	163	L	H	HG23	THR	V	85
R	H	CA	VAL	A	163	L	H	CG2	THR	V	85
R	H	CA	VAL	A	163	L	H	HG21	THR	V	85
R	H	CA	VAL	A	163	L	H	HG22	THR	V	85
R	H	CA	VAL	A	163	L	H	HG23	THR	V	85
R	H	C	VAL	A	163	L	H	HG23	THR	V	85
R	H	CB	VAL	A	163	L	H	HG3	ARG	V	81
R	H	CB	VAL	A	163	L	H	HG21	THR	V	85
R	H	CB	VAL	A	163	L	H	HG22	THR	V	85
R	H	CB	VAL	A	163	L	H	HG23	THR	V	85
R	H	O	VAL	A	163	L	H	HG23	THR	V	85
R	H	CG1	VAL	A	163	L	H	HG22	THR	V	85
R	H	CG1	VAL	A	163	L	H	HG23	THR	V	85
R	H	CG2	VAL	A	163	L	H	CB	ARG	V	81
R	H	CG2	VAL	A	163	L	H	CG	ARG	V	81
R	H	CG2	VAL	A	163	L	H	CD	ARG	V	81
R	H	CG2	VAL	A	163	L	H	HA	ARG	V	81
R	H	CG2	VAL	A	163	L	H	HB3	ARG	V	81
R	H	CG2	VAL	A	163	L	H	HG2	ARG	V	81
R	H	CG2	VAL	A	163	L	H	HG3	ARG	V	81
R	H	CG2	VAL	A	163	L	H	HD2	ARG	V	81
R	H	CG2	VAL	A	163	L	H	CG2	THR	V	85
R	H	CG2	VAL	A	163	L	H	HG21	THR	V	85
R	H	CG2	VAL	A	163	L	H	HG22	THR	V	85
R	H	CG2	VAL	A	163	L	H	HG23	THR	V	85
R	H	CB	ASN	A	166	L	H	CG2	THR	V	85
R	H	CB	ASN	A	166	L	H	HA	THR	V	85
R	H	CB	ASN	A	166	L	H	HB	THR	V	85
R	H	CB	ASN	A	166	L	H	HG23	THR	V	85
R	H	CG	ASN	A	166	L	H	CB	THR	V	85
R	H	CG	ASN	A	166	L	H	O	THR	V	85
R	H	CG	ASN	A	166	L	H	CG2	THR	V	85
R	H	CG	ASN	A	166	L	H	HA	THR	V	85
R	H	CG	ASN	A	166	L	H	HB	THR	V	85
R	H	CG	ASN	A	166	L	H	HG23	THR	V	85
R	H	CG	ASN	A	166	L	-	NE	ARG	V	87
R	H	CG	ASN	A	166	L	-	HG3	ARG	V	87
R	H	CG	ASN	A	166	L	-	HD2	ARG	V	87
R	H	CG	ASN	A	166	L	-	HE	ARG	V	87
R	H	ND2	ASN	A	166	L	H	CB	THR	V	85
R	H	ND2	ASN	A	166	L	H	CG2	THR	V	85
R	H	ND2	ASN	A	166	L	H	HB	THR	V	85
R	H	ND2	ASN	A	166	L	H	HG21	THR	V	85
R	H	ND2	ASN	A	166	L	H	HG23	THR	V	85
R	H	ND2	ASN	A	166	L	-	CD	ARG	V	87
R	H	ND2	ASN	A	166	L	-	NE	ARG	V	87
R	H	ND2	ASN	A	166	L	-	CZ	ARG	V	87
R	H	ND2	ASN	A	166	L	-	HG3	ARG	V	87
R	H	ND2	ASN	A	166	L	-	HD2	ARG	V	87
R	H	ND2	ASN	A	166	L	-	HE	ARG	V	87
R	H	OD1	ASN	A	166	L	H	O	THR	V	85
R	H	OD1	ASN	A	166	L	H	HB	THR	V	85
R	H	OD1	ASN	A	166	L	-	CG	ARG	V	87
R	H	OD1	ASN	A	166	L	-	CD	ARG	V	87
R	H	OD1	ASN	A	166	L	-	NE	ARG	V	87
R	H	OD1	ASN	A	166	L	-	NH2	ARG	V	87
R	H	OD1	ASN	A	166	L	-	CZ	ARG	V	87
R	H	OD1	ASN	A	166	L	-	HG3	ARG	V	87
R	H	OD1	ASN	A	166	L	-	HD2	ARG	V	87
R	H	OD1	ASN	A	166	L	-	HE	ARG	V	87
R	H	OD1	ASN	A	166	L	-	HH21	ARG	V	87
R	H	C	LEU	A	195	L	H	HD22	LEU	V	30
R	H	O	LEU	A	195	L	H	CD2	LEU	V	30
R	H	O	LEU	A	195	L	H	HD21	LEU	V	30
R	H	O	LEU	A	195	L	H	HD22	LEU	V	30
R	H	O	LEU	A	195	L	H	HD23	LEU	V	30
R	H	CG	LEU	A	195	L	H	HA2	GLY	V	27
R	H	CG	LEU	A	195	L	H	HD22	LEU	V	30
R	H	CG	LEU	A	195	L	H	HD13	LEU	V	84
R	H	CG	LEU	A	195	L	H	HD23	LEU	V	84
R	H	CD1	LEU	A	195	L	H	N	GLY	V	27
R	H	CD1	LEU	A	195	L	H	CA	GLY	V	27
R	H	CD1	LEU	A	195	L	H	HA2	GLY	V	27
R	H	CD1	LEU	A	195	L	H	HA3	GLY	V	27
R	H	CD1	LEU	A	195	L	H	CD2	LEU	V	30
R	H	CD1	LEU	A	195	L	H	HB3	LEU	V	30
R	H	CD1	LEU	A	195	L	H	HD21	LEU	V	30
R	H	CD1	LEU	A	195	L	H	HD22	LEU	V	30
R	H	CD2	LEU	A	195	L	H	O	VAL	V	23
R	H	CD2	LEU	A	195	L	H	HA	VAL	V	23
R	H	CD2	LEU	A	195	L	H	HG12	VAL	V	23
R	H	CD2	LEU	A	195	L	H	CB	ALA	V	26
R	H	CD2	LEU	A	195	L	H	HB1	ALA	V	26
R	H	CD2	LEU	A	195	L	H	HB2	ALA	V	26
R	H	CD2	LEU	A	195	L	H	N	GLY	V	27
R	H	CD2	LEU	A	195	L	H	H	GLY	V	27
R	H	CD2	LEU	A	195	L	H	HA2	GLY	V	27
R	H	CD2	LEU	A	195	L	H	CD2	LEU	V	84
R	H	CD2	LEU	A	195	L	H	HD13	LEU	V	84
R	H	CD2	LEU	A	195	L	H	HD21	LEU	V	84
R	H	CD2	LEU	A	195	L	H	HD22	LEU	V	84
R	H	CD2	LEU	A	195	L	H	HD23	LEU	V	84
R	H	CA	PHE	A	196	L	H	HD12	LEU	V	84
R	H	CB	PHE	A	196	L	H	HD12	LEU	V	84
R	H	CD2	PHE	A	196	L	H	HD12	LEU	V	84
R	H	N	LYS	A	198	L	H	HD23	LEU	V	30
R	H	CA	LYS	A	198	L	H	HD23	LEU	V	30
R	H	C	LYS	A	198	L	H	CD1	LEU	V	30
R	H	C	LYS	A	198	L	H	CD2	LEU	V	30
R	H	C	LYS	A	198	L	H	HD12	LEU	V	30
R	H	C	LYS	A	198	L	H	HD22	LEU	V	30
R	H	C	LYS	A	198	L	H	HD23	LEU	V	30
R	H	C	LYS	A	198	L	H	HD12	LEU	V	34
R	H	CB	LYS	A	198	L	H	CD2	LEU	V	30
R	H	CB	LYS	A	198	L	H	HD21	LEU	V	30
R	H	CB	LYS	A	198	L	H	HD22	LEU	V	30
R	H	CB	LYS	A	198	L	H	HD23	LEU	V	30
R	H	O	LYS	A	198	L	H	CD1	LEU	V	30
R	H	O	LYS	A	198	L	H	HD12	LEU	V	30
R	H	O	LYS	A	198	L	H	HD23	LEU	V	30
R	H	O	LYS	A	198	L	H	HD12	LEU	V	34
R	H	O	LYS	A	198	L	H	HD23	LEU	V	34
R	H	CG	LYS	A	198	L	H	HD23	LEU	V	30
R	H	N	VAL	A	199	L	H	CG	LEU	V	30
R	H	N	VAL	A	199	L	H	CD1	LEU	V	30
R	H	N	VAL	A	199	L	H	CD2	LEU	V	30
R	H	N	VAL	A	199	L	H	HD12	LEU	V	30
R	H	N	VAL	A	199	L	H	HD13	LEU	V	30
R	H	N	VAL	A	199	L	H	HD22	LEU	V	30
R	H	N	VAL	A	199	L	H	HD23	LEU	V	30
R	H	CA	VAL	A	199	L	H	CG	LEU	V	30
R	H	CA	VAL	A	199	L	H	CD1	LEU	V	30
R	H	CA	VAL	A	199	L	H	CD2	LEU	V	30
R	H	CA	VAL	A	199	L	H	HD11	LEU	V	30
R	H	CA	VAL	A	199	L	H	HD12	LEU	V	30
R	H	CA	VAL	A	199	L	H	HD13	LEU	V	30
R	H	CA	VAL	A	199	L	H	HD22	LEU	V	30
R	H	CA	VAL	A	199	L	H	HD23	LEU	V	30
R	H	C	VAL	A	199	L	H	CD1	LEU	V	30
R	H	C	VAL	A	199	L	H	HD12	LEU	V	30
R	H	C	VAL	A	199	L	H	HD13	LEU	V	30
R	H	CB	VAL	A	199	L	H	CD1	LEU	V	30
R	H	CB	VAL	A	199	L	H	CD2	LEU	V	30
R	H	CB	VAL	A	199	L	H	HD11	LEU	V	30
R	H	CB	VAL	A	199	L	H	HD12	LEU	V	30
R	H	CB	VAL	A	199	L	H	HD13	LEU	V	30
R	H	CB	VAL	A	199	L	H	HD22	LEU	V	30
R	H	CB	VAL	A	199	L	H	HD23	LEU	V	30
R	H	CB	VAL	A	199	L	H	HG22	ILE	V	80
R	H	CB	VAL	A	199	L	H	HD12	ILE	V	80
R	H	O	VAL	A	199	L	H	HD12	LEU	V	30
R	H	O	VAL	A	199	L	H	HD13	LEU	V	30
R	H	CG1	VAL	A	199	L	H	CD1	LEU	V	30
R	H	CG1	VAL	A	199	L	H	HD12	LEU	V	30
R	H	CG1	VAL	A	199	L	H	HD13	LEU	V	30
R	H	CG1	VAL	A	199	L	H	CG2	ILE	V	80
R	H	CG1	VAL	A	199	L	H	HG21	ILE	V	80
R	H	CG1	VAL	A	199	L	H	HG22	ILE	V	80
R	H	CG1	VAL	A	199	L	H	HD12	ILE	V	80
R	H	CG2	VAL	A	199	L	H	CB	LEU	V	30
R	H	CG2	VAL	A	199	L	H	CG	LEU	V	30
R	H	CG2	VAL	A	199	L	H	CD1	LEU	V	30
R	H	CG2	VAL	A	199	L	H	CD2	LEU	V	30
R	H	CG2	VAL	A	199	L	H	HB2	LEU	V	30
R	H	CG2	VAL	A	199	L	H	HD11	LEU	V	30
R	H	CG2	VAL	A	199	L	H	HD12	LEU	V	30
R	H	CG2	VAL	A	199	L	H	HD13	LEU	V	30
R	H	CG2	VAL	A	199	L	H	HD21	LEU	V	30
R	H	CG2	VAL	A	199	L	H	HD22	LEU	V	30
R	H	CG2	VAL	A	199	L	H	HD23	LEU	V	30
R	H	CG2	VAL	A	199	L	H	CG2	ILE	V	80
R	H	CG2	VAL	A	199	L	H	HG21	ILE	V	80
R	H	CG2	VAL	A	199	L	H	HG22	ILE	V	80
R	H	CG2	VAL	A	199	L	H	HG23	ILE	V	80
R	H	CG2	VAL	A	199	L	H	HD12	ILE	V	80
R	H	N	ALA	A	202	L	H	CD2	LEU	V	34
R	H	N	ALA	A	202	L	H	HD22	LEU	V	34
R	H	N	ALA	A	202	L	H	HD23	LEU	V	34
R	H	CA	ALA	A	202	L	H	HE1	TYR	V	33
R	H	CA	ALA	A	202	L	H	CD2	LEU	V	34
R	H	CA	ALA	A	202	L	H	HD21	LEU	V	34
R	H	CA	ALA	A	202	L	H	HD22	LEU	V	34
R	H	CA	ALA	A	202	L	H	HD23	LEU	V	34
R	H	C	ALA	A	202	L	H	HE1	TYR	V	33
R	H	C	ALA	A	202	L	H	CD2	LEU	V	34
R	H	C	ALA	A	202	L	H	HD21	LEU	V	34
R	H	C	ALA	A	202	L	H	HD23	LEU	V	34
R	H	C	ALA	A	202	L	H	HD21	LEU	V	37
R	H	C	ALA	A	202	L	H	HD23	LEU	V	37
R	H	CB	ALA	A	202	L	H	HD11	LEU	V	30
R	H	CB	ALA	A	202	L	H	HD12	LEU	V	30
R	H	CB	ALA	A	202	L	H	HD1	TYR	V	33
R	H	CB	ALA	A	202	L	H	HE1	TYR	V	33
R	H	CB	ALA	A	202	L	H	CG	LEU	V	34
R	H	CB	ALA	A	202	L	H	CD1	LEU	V	34
R	H	CB	ALA	A	202	L	H	CD2	LEU	V	34
R	H	CB	ALA	A	202	L	H	HG	LEU	V	34
R	H	CB	ALA	A	202	L	H	HD12	LEU	V	34
R	H	CB	ALA	A	202	L	H	HD21	LEU	V	34
R	H	CB	ALA	A	202	L	H	HD22	LEU	V	34
R	H	CB	ALA	A	202	L	H	HD23	LEU	V	34
R	H	O	ALA	A	202	L	H	HE1	TYR	V	33
R	H	O	ALA	A	202	L	H	HD21	LEU	V	34
R	H	O	ALA	A	202	L	H	CD2	LEU	V	37
R	H	O	ALA	A	202	L	H	HD21	LEU	V	37
R	H	O	ALA	A	202	L	H	HD22	LEU	V	37
R	H	O	ALA	A	202	L	H	HD23	LEU	V	37
R	H	N	CYS	A	203	L	H	HE1	TYR	V	33
R	H	CA	CYS	A	203	L	H	HE1	TYR	V	33
R	H	SG	CYS	A	203	L	H	HE1	TYR	V	33
R	H	SG	CYS	A	203	L	H	HB2	PRO	V	77
R	H	CA	VAL	A	205	L	H	HD22	LEU	V	37
R	H	C	VAL	A	205	L	H	HD22	LEU	V	37
R	H	CB	VAL	A	205	L	H	HD22	LEU	V	37
R	H	O	VAL	A	205	L	H	HD22	LEU	V	37
R	H	O	VAL	A	205	L	H	HD12	LEU	V	41
R	H	CG1	VAL	A	205	L	H	HD22	LEU	V	37
R	H	N	PHE	A	206	L	H	CD2	LEU	V	37
R	H	N	PHE	A	206	L	H	HD12	LEU	V	37
R	H	N	PHE	A	206	L	H	HD21	LEU	V	37
R	H	N	PHE	A	206	L	H	HD22	LEU	V	37
R	H	N	PHE	A	206	L	H	HD23	LEU	V	37
R	H	CA	PHE	A	206	L	H	CG	LEU	V	37
R	H	CA	PHE	A	206	L	H	CD1	LEU	V	37
R	H	CA	PHE	A	206	L	H	CD2	LEU	V	37
R	H	CA	PHE	A	206	L	H	HD12	LEU	V	37
R	H	CA	PHE	A	206	L	H	HD13	LEU	V	37
R	H	CA	PHE	A	206	L	H	HD22	LEU	V	37
R	H	CA	PHE	A	206	L	H	HD23	LEU	V	37
R	H	CA	PHE	A	206	L	H	HD12	LEU	V	41
R	H	C	PHE	A	206	L	H	HD12	LEU	V	37
R	H	C	PHE	A	206	L	H	HD22	LEU	V	37
R	H	CB	PHE	A	206	L	H	OH	TYR	V	33
R	H	CB	PHE	A	206	L	H	CG	LEU	V	37
R	H	CB	PHE	A	206	L	H	CD1	LEU	V	37
R	H	CB	PHE	A	206	L	H	CD2	LEU	V	37
R	H	CB	PHE	A	206	L	H	HD12	LEU	V	37
R	H	CB	PHE	A	206	L	H	HD13	LEU	V	37
R	H	CB	PHE	A	206	L	H	HD21	LEU	V	37
R	H	CB	PHE	A	206	L	H	HD22	LEU	V	37
R	H	CB	PHE	A	206	L	H	HD23	LEU	V	37
R	H	O	PHE	A	206	L	H	HD12	LEU	V	37
R	H	CG	PHE	A	206	L	H	OH	TYR	V	33
R	H	CG	PHE	A	206	L	H	HH	TYR	V	33
R	H	CG	PHE	A	206	L	H	CG	LEU	V	37
R	H	CG	PHE	A	206	L	H	CD1	LEU	V	37
R	H	CG	PHE	A	206	L	H	CD2	LEU	V	37
R	H	CG	PHE	A	206	L	H	HD11	LEU	V	37
R	H	CG	PHE	A	206	L	H	HD12	LEU	V	37
R	H	CG	PHE	A	206	L	H	HD13	LEU	V	37
R	H	CG	PHE	A	206	L	H	HD22	LEU	V	37
R	H	CG	PHE	A	206	L	H	HD23	LEU	V	37
R	H	CD1	PHE	A	206	L	H	OH	TYR	V	33
R	H	CD1	PHE	A	206	L	H	HH	TYR	V	33
R	H	CD1	PHE	A	206	L	H	HD12	LEU	V	37
R	H	CD1	PHE	A	206	L	H	HD13	LEU	V	37
R	H	CD1	PHE	A	206	L	H	OG	SER	V	73
R	H	CD1	PHE	A	206	L	H	HG	SER	V	73
R	H	CD2	PHE	A	206	L	H	CB	LEU	V	37
R	H	CD2	PHE	A	206	L	H	CG	LEU	V	37
R	H	CD2	PHE	A	206	L	H	CD1	LEU	V	37
R	H	CD2	PHE	A	206	L	H	CD2	LEU	V	37
R	H	CD2	PHE	A	206	L	H	HA	LEU	V	37
R	H	CD2	PHE	A	206	L	H	HB2	LEU	V	37
R	H	CD2	PHE	A	206	L	H	HG	LEU	V	37
R	H	CD2	PHE	A	206	L	H	HD11	LEU	V	37
R	H	CD2	PHE	A	206	L	H	HD12	LEU	V	37
R	H	CD2	PHE	A	206	L	H	HD13	LEU	V	37
R	H	CD2	PHE	A	206	L	H	HD22	LEU	V	37
R	H	CD2	PHE	A	206	L	H	HD23	LEU	V	37
R	H	CD2	PHE	A	206	L	H	CD2	LEU	V	69
R	H	CD2	PHE	A	206	L	H	HB2	LEU	V	69
R	H	CD2	PHE	A	206	L	H	HD13	LEU	V	69
R	H	CD2	PHE	A	206	L	H	HD22	LEU	V	69
R	H	CE1	PHE	A	206	L	H	OH	TYR	V	33
R	H	CE1	PHE	A	206	L	H	HD13	LEU	V	37
R	H	CE1	PHE	A	206	L	H	O	LEU	V	69
R	H	CE1	PHE	A	206	L	H	HB2	LEU	V	69
R	H	CE1	PHE	A	206	L	H	CB	SER	V	73
R	H	CE1	PHE	A	206	L	H	OG	SER	V	73
R	H	CE1	PHE	A	206	L	H	HB2	SER	V	73
R	H	CE1	PHE	A	206	L	H	HB3	SER	V	73
R	H	CE1	PHE	A	206	L	H	HG	SER	V	73
R	H	CE2	PHE	A	206	L	H	CD1	LEU	V	37
R	H	CE2	PHE	A	206	L	H	HD11	LEU	V	37
R	H	CE2	PHE	A	206	L	H	HD12	LEU	V	37
R	H	CE2	PHE	A	206	L	H	HD13	LEU	V	37
R	H	CE2	PHE	A	206	L	H	CA	LEU	V	69
R	H	CE2	PHE	A	206	L	H	C	LEU	V	69
R	H	CE2	PHE	A	206	L	H	CB	LEU	V	69
R	H	CE2	PHE	A	206	L	H	O	LEU	V	69
R	H	CE2	PHE	A	206	L	H	CG	LEU	V	69
R	H	CE2	PHE	A	206	L	H	CD1	LEU	V	69
R	H	CE2	PHE	A	206	L	H	CD2	LEU	V	69
R	H	CE2	PHE	A	206	L	H	HA	LEU	V	69
R	H	CE2	PHE	A	206	L	H	HB2	LEU	V	69
R	H	CE2	PHE	A	206	L	H	HB3	LEU	V	69
R	H	CE2	PHE	A	206	L	H	HD13	LEU	V	69
R	H	CE2	PHE	A	206	L	H	HD21	LEU	V	69
R	H	CE2	PHE	A	206	L	H	HD22	LEU	V	69
R	H	CE2	PHE	A	206	L	H	HD23	LEU	V	69
R	H	CE2	PHE	A	206	L	H	OG	SER	V	73
R	H	CE2	PHE	A	206	L	H	HG	SER	V	73
R	H	CZ	PHE	A	206	L	H	HD13	LEU	V	37
R	H	CZ	PHE	A	206	L	H	CA	LEU	V	69
R	H	CZ	PHE	A	206	L	H	C	LEU	V	69
R	H	CZ	PHE	A	206	L	H	CB	LEU	V	69
R	H	CZ	PHE	A	206	L	H	O	LEU	V	69
R	H	CZ	PHE	A	206	L	H	HA	LEU	V	69
R	H	CZ	PHE	A	206	L	H	HB2	LEU	V	69
R	H	CZ	PHE	A	206	L	H	HB3	LEU	V	69
R	H	CZ	PHE	A	206	L	H	HD13	LEU	V	69
R	H	CZ	PHE	A	206	L	H	HD22	LEU	V	69
R	H	CZ	PHE	A	206	L	H	OG	SER	V	73
R	H	CZ	PHE	A	206	L	H	HG	SER	V	73
R	H	CA	LEU	A	209	L	H	HD13	LEU	V	41
R	H	CA	LEU	A	209	L	H	HD22	LEU	V	41
R	H	CA	LEU	A	209	L	H	HD23	LEU	V	41
R	H	C	LEU	A	209	L	H	CD2	LEU	V	41
R	H	C	LEU	A	209	L	H	HD22	LEU	V	41
R	H	C	LEU	A	209	L	H	HD23	LEU	V	41
R	H	CB	LEU	A	209	L	H	CG	LEU	V	41
R	H	CB	LEU	A	209	L	H	CD1	LEU	V	41
R	H	CB	LEU	A	209	L	H	CD2	LEU	V	41
R	H	CB	LEU	A	209	L	H	HD11	LEU	V	41
R	H	CB	LEU	A	209	L	H	HD12	LEU	V	41
R	H	CB	LEU	A	209	L	H	HD13	LEU	V	41
R	H	CB	LEU	A	209	L	H	HD22	LEU	V	41
R	H	CB	LEU	A	209	L	H	HD23	LEU	V	41
R	H	O	LEU	A	209	L	H	CD2	LEU	V	41
R	H	O	LEU	A	209	L	H	HD22	LEU	V	41
R	H	O	LEU	A	209	L	H	HD23	LEU	V	41
R	H	CG	LEU	A	209	L	H	CD1	LEU	V	41
R	H	CG	LEU	A	209	L	H	HD12	LEU	V	41
R	H	CG	LEU	A	209	L	H	HD13	LEU	V	41
R	H	CG	LEU	A	209	L	H	HD22	LEU	V	41
R	H	CD1	LEU	A	209	L	H	CD1	LEU	V	41
R	H	CD1	LEU	A	209	L	H	HB3	LEU	V	41
R	H	CD1	LEU	A	209	L	H	HD11	LEU	V	41
R	H	CD1	LEU	A	209	L	H	HD12	LEU	V	41
R	H	CD1	LEU	A	209	L	H	HD13	LEU	V	41
R	H	CD2	LEU	A	209	L	H	HD13	LEU	V	41
R	H	N	PHE	A	210	L	H	CD2	LEU	V	41
R	H	N	PHE	A	210	L	H	HD22	LEU	V	41
R	H	N	PHE	A	210	L	H	HD23	LEU	V	41
R	H	CA	PHE	A	210	L	H	HD23	LEU	V	41
R	H	CB	PHE	A	210	L	H	HD23	LEU	V	41
R	H	CB	PHE	A	210	L	H	HD13	LEU	V	69
R	H	CG	PHE	A	210	L	H	HD13	LEU	V	69
R	H	CD2	PHE	A	210	L	H	HG13	VAL	V	66
R	H	CD2	PHE	A	210	L	H	CD1	LEU	V	69
R	H	CD2	PHE	A	210	L	H	HB2	LEU	V	69
R	H	CD2	PHE	A	210	L	H	HB3	LEU	V	69
R	H	CD2	PHE	A	210	L	H	HD11	LEU	V	69
R	H	CD2	PHE	A	210	L	H	HD13	LEU	V	69
R	H	CE2	PHE	A	210	L	H	O	VAL	V	66
R	H	CE2	PHE	A	210	L	H	CG1	VAL	V	66
R	H	CE2	PHE	A	210	L	H	HA	VAL	V	66
R	H	CE2	PHE	A	210	L	H	HG11	VAL	V	66
R	H	CE2	PHE	A	210	L	H	HG12	VAL	V	66
R	H	CE2	PHE	A	210	L	H	HG13	VAL	V	66
R	H	CE2	PHE	A	210	L	H	HG22	VAL	V	66
R	H	CE2	PHE	A	210	L	H	HB3	LEU	V	69
R	H	CE2	PHE	A	210	L	H	HD11	LEU	V	69
R	H	CE2	PHE	A	210	L	H	SG	CYS	V	70
R	H	CE2	PHE	A	210	L	H	HG	CYS	V	70
R	H	CZ	PHE	A	210	L	H	CG1	VAL	V	66
R	H	CZ	PHE	A	210	L	H	HG11	VAL	V	66
R	H	CZ	PHE	A	210	L	H	HG13	VAL	V	66
R	H	CZ	PHE	A	210	L	H	SG	CYS	V	70
R	H	CZ	PHE	A	210	L	H	HG	CYS	V	70
R	H	CB	SER	A	213	L	H	CG2	ILE	V	44
R	H	CB	SER	A	213	L	H	HG21	ILE	V	44
R	H	CB	SER	A	213	L	H	HG22	ILE	V	44
R	H	OG	SER	A	213	L	H	CD2	LEU	V	41
R	H	OG	SER	A	213	L	H	HD21	LEU	V	41
R	H	OG	SER	A	213	L	H	HD22	LEU	V	41
R	H	OG	SER	A	213	L	H	CG2	ILE	V	44
R	H	OG	SER	A	213	L	H	HG21	ILE	V	44
R	H	OG	SER	A	213	L	H	HG22	ILE	V	44
R	H	C	VAL	A	216	L	H	HG21	THR	V	48
R	H	CB	VAL	A	216	L	H	HG21	THR	V	48
R	H	O	VAL	A	216	L	H	HG21	THR	V	48
R	H	CG1	VAL	A	216	L	H	CG2	THR	V	48
R	H	CG1	VAL	A	216	L	H	HG21	THR	V	48
R	H	CG1	VAL	A	216	L	H	HG23	THR	V	48
R	H	N	ALA	A	217	L	H	CG2	THR	V	48
R	H	N	ALA	A	217	L	H	HG21	THR	V	48
R	H	N	ALA	A	217	L	H	HG22	THR	V	48
R	H	CA	ALA	A	217	L	H	CG2	THR	V	48
R	H	CA	ALA	A	217	L	H	HG21	THR	V	48
R	H	CA	ALA	A	217	L	H	HG22	THR	V	48
R	H	CA	ALA	A	217	L	H	HZ3	LYS	V	62
R	H	CB	ALA	A	217	L	H	HG21	THR	V	48
R	H	CB	ALA	A	217	L	H	HG22	THR	V	48
R	H	CB	ALA	A	217	L	H	NZ	LYS	V	62
R	H	CB	ALA	A	217	L	H	HD2	LYS	V	62
R	H	CB	ALA	A	217	L	H	HZ1	LYS	V	62
R	H	CB	ALA	A	217	L	H	HZ2	LYS	V	62
R	H	CB	ALA	A	217	L	H	HZ3	LYS	V	62
R	H	CB	ALA	A	220	L	H	HG22	THR	V	48
R	H	CD2	HIS	A	221	L	H	HZ1	LYS	V	62
R	H	NE2	HIS	A	221	L	H	NZ	LYS	V	62
R	H	NE2	HIS	A	221	L	H	HZ1	LYS	V	62
R	H	NE2	HIS	A	221	L	H	HZ2	LYS	V	62

- 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