IID

A2RU54_Q8NFW5.1 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	LEU	A	11	L	-	PHE	V	86
R	H	MET	A	14	L	-	PHE	V	86
R	H	ASN	A	15	L	-	PHE	V	86
R	H	ASN	A	15	L	-	PRO	V	87
R	H	SER	A	18	L	-	PHE	V	86
R	H	ALA	A	19	L	-	PRO	V	87
R	H	ALA	A	19	L	-	LEU	V	89
R	H	ASN	A	22	L	-	PHE	V	86
R	H	ASN	A	22	L	-	CYS	V	88
R	-	PRO	A	230	L	-	GLY	V	101
R	-	PRO	A	230	L	-	GLY	V	102
R	-	PRO	A	230	L	-	LEU	V	103
R	-	LYS	A	231	L	-	GLY	V	101
R	-	LYS	A	231	L	-	GLY	V	102
R	-	ALA	A	232	L	-	GLY	V	101
R	-	ALA	A	232	L	-	GLY	V	102
R	-	ALA	A	232	L	-	LEU	V	103
R	-	PRO	A	235	L	-	ARG	V	105
R	-	PRO	A	235	L	-	THR	V	106
R	-	SER	A	237	L	-	LEU	V	109
R	-	LEU	A	238	L	-	LEU	V	109
R	-	THR	A	239	L	-	LEU	V	109
R	-	ILE	A	240	L	-	PRO	V	111
R	-	THR	A	241	L	-	LEU	V	109
R	-	PRO	A	245	L	-	SER	V	157
R	-	GLY	A	246	L	-	VAL	V	155
R	-	GLY	A	246	L	-	SER	V	157
R	-	GLY	A	247	L	-	VAL	V	155
R	-	GLY	A	247	L	-	PHE	V	156
R	-	GLY	A	247	L	-	SER	V	157
R	-	GLY	A	247	L	H	GLN	V	160
R	-	GLY	A	248	L	H	GLN	V	160
R	-	GLY	A	248	L	-	GLN	V	187
R	-	GLY	A	248	L	-	LEU	V	188
R	-	GLY	A	248	L	H	GLN	V	192
R	-	LEU	A	249	L	-	GLN	V	187
R	-	LEU	A	249	L	-	LEU	V	188
R	-	LEU	A	249	L	-	THR	V	189
R	-	LEU	A	249	L	H	GLN	V	192
R	-	LEU	A	250	L	-	GLN	V	187
R	-	GLY	A	251	L	H	SER	V	184
R	-	GLY	A	251	L	-	GLN	V	187
R	-	PRO	A	252	L	H	SER	V	184
R	-	SER	A	253	L	H	SER	V	184
R	-	HIS	A	254	L	H	SER	V	184
R	-	SER	A	255	L	-	PRO	V	68
R	-	SER	A	255	L	-	GLN	V	70
R	-	TYR	A	256	L	-	CYS	V	67
R	-	TYR	A	256	L	-	PRO	V	68
R	-	SER	A	257	L	-	PRO	V	68
R	H	GLN	A	26	L	-	CYS	V	88
R	H	LEU	A	263	L	-	ILE	V	84
R	H	LEU	A	263	L	-	PHE	V	86
R	-	ALA	A	34	L	H	TYR	V	162
R	-	PRO	A	35	L	H	SER	V	159
R	-	PRO	A	35	L	H	TYR	V	162
R	-	ASP	A	36	L	H	TYR	V	162
R	-	TYR	A	37	L	H	TYR	V	162
R	H	LEU	A	375	L	-	PRO	V	92
R	-	GLY	A	376	L	-	PRO	V	92
R	-	GLY	A	376	L	-	LYS	V	93
R	-	LEU	A	377	L	-	PRO	V	92
R	-	ASP	A	378	L	-	LYS	V	93
R	-	THR	A	379	L	-	LYS	V	93
R	-	ARG	A	38	L	H	TYR	V	162

- 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

A2RU54_Q8NFW5.1 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	O	LEU	A	11	L	-	HE1	PHE	V	86
R	H	CD1	LEU	A	11	L	-	HE1	PHE	V	86
R	H	C	MET	A	14	L	-	CE1	PHE	V	86
R	H	C	MET	A	14	L	-	HE1	PHE	V	86
R	H	CB	MET	A	14	L	-	HE1	PHE	V	86
R	H	CB	MET	A	14	L	-	HZ	PHE	V	86
R	H	O	MET	A	14	L	-	CD1	PHE	V	86
R	H	O	MET	A	14	L	-	CE1	PHE	V	86
R	H	O	MET	A	14	L	-	HD1	PHE	V	86
R	H	O	MET	A	14	L	-	HE1	PHE	V	86
R	H	CE	MET	A	14	L	-	HZ	PHE	V	86
R	H	N	ASN	A	15	L	-	CD1	PHE	V	86
R	H	N	ASN	A	15	L	-	CE1	PHE	V	86
R	H	N	ASN	A	15	L	-	HD1	PHE	V	86
R	H	N	ASN	A	15	L	-	HE1	PHE	V	86
R	H	CA	ASN	A	15	L	-	CD1	PHE	V	86
R	H	CA	ASN	A	15	L	-	CE1	PHE	V	86
R	H	CA	ASN	A	15	L	-	HD1	PHE	V	86
R	H	CA	ASN	A	15	L	-	HE1	PHE	V	86
R	H	C	ASN	A	15	L	-	HD1	PHE	V	86
R	H	C	ASN	A	15	L	-	HD3	PRO	V	87
R	H	CB	ASN	A	15	L	-	CD1	PHE	V	86
R	H	CB	ASN	A	15	L	-	CE1	PHE	V	86
R	H	CB	ASN	A	15	L	-	HD1	PHE	V	86
R	H	CB	ASN	A	15	L	-	HE1	PHE	V	86
R	H	O	ASN	A	15	L	-	HB3	PHE	V	86
R	H	O	ASN	A	15	L	-	HD1	PHE	V	86
R	H	O	ASN	A	15	L	-	CD	PRO	V	87
R	H	O	ASN	A	15	L	-	HD3	PRO	V	87
R	H	CG	ASN	A	15	L	-	CD1	PHE	V	86
R	H	CG	ASN	A	15	L	-	CE1	PHE	V	86
R	H	CG	ASN	A	15	L	-	HD1	PHE	V	86
R	H	CG	ASN	A	15	L	-	HE1	PHE	V	86
R	H	ND2	ASN	A	15	L	-	HD1	PHE	V	86
R	H	ND2	ASN	A	15	L	-	HE1	PHE	V	86
R	H	OD1	ASN	A	15	L	-	CD1	PHE	V	86
R	H	OD1	ASN	A	15	L	-	CE1	PHE	V	86
R	H	OD1	ASN	A	15	L	-	CZ	PHE	V	86
R	H	OD1	ASN	A	15	L	-	HD1	PHE	V	86
R	H	OD1	ASN	A	15	L	-	HE1	PHE	V	86
R	H	OD1	ASN	A	15	L	-	HZ	PHE	V	86
R	H	CA	SER	A	18	L	-	HB3	PHE	V	86
R	H	C	SER	A	18	L	-	HB3	PHE	V	86
R	H	CB	SER	A	18	L	-	CB	PHE	V	86
R	H	CB	SER	A	18	L	-	CG	PHE	V	86
R	H	CB	SER	A	18	L	-	CD1	PHE	V	86
R	H	CB	SER	A	18	L	-	CD2	PHE	V	86
R	H	CB	SER	A	18	L	-	HB2	PHE	V	86
R	H	CB	SER	A	18	L	-	HB3	PHE	V	86
R	H	CB	SER	A	18	L	-	HD1	PHE	V	86
R	H	OG	SER	A	18	L	-	CB	PHE	V	86
R	H	OG	SER	A	18	L	-	CG	PHE	V	86
R	H	OG	SER	A	18	L	-	CD1	PHE	V	86
R	H	OG	SER	A	18	L	-	CD2	PHE	V	86
R	H	OG	SER	A	18	L	-	CE1	PHE	V	86
R	H	OG	SER	A	18	L	-	CE2	PHE	V	86
R	H	OG	SER	A	18	L	-	HB2	PHE	V	86
R	H	OG	SER	A	18	L	-	HB3	PHE	V	86
R	H	OG	SER	A	18	L	-	HD1	PHE	V	86
R	H	OG	SER	A	18	L	-	HD2	PHE	V	86
R	H	N	ALA	A	19	L	-	HD3	PRO	V	87
R	H	CA	ALA	A	19	L	-	O	PRO	V	87
R	H	CA	ALA	A	19	L	-	HD3	PRO	V	87
R	H	CB	ALA	A	19	L	-	O	PRO	V	87
R	H	CB	ALA	A	19	L	-	HG2	PRO	V	87
R	H	CB	ALA	A	19	L	-	HD3	PRO	V	87
R	H	CB	ALA	A	19	L	-	HD11	LEU	V	89
R	H	CB	ASN	A	22	L	-	SG	CYS	V	88
R	H	ND2	ASN	A	22	L	-	C	PHE	V	86
R	H	ND2	ASN	A	22	L	-	O	PHE	V	86
R	H	CG	GLN	A	26	L	-	HG	CYS	V	88
R	H	CD	GLN	A	26	L	-	SG	CYS	V	88
R	H	CD	GLN	A	26	L	-	HG	CYS	V	88
R	H	NE2	GLN	A	26	L	-	CB	CYS	V	88
R	H	NE2	GLN	A	26	L	-	SG	CYS	V	88
R	H	NE2	GLN	A	26	L	-	HB3	CYS	V	88
R	H	NE2	GLN	A	26	L	-	HG	CYS	V	88
R	H	OE1	GLN	A	26	L	-	SG	CYS	V	88
R	H	OE1	GLN	A	26	L	-	HG	CYS	V	88
R	-	C	ALA	A	34	L	H	HE1	TYR	V	162
R	-	O	ALA	A	34	L	H	HE1	TYR	V	162
R	-	N	PRO	A	35	L	H	CE1	TYR	V	162
R	-	N	PRO	A	35	L	H	HD1	TYR	V	162
R	-	N	PRO	A	35	L	H	HE1	TYR	V	162
R	-	CA	PRO	A	35	L	H	CG	TYR	V	162
R	-	CA	PRO	A	35	L	H	CD1	TYR	V	162
R	-	CA	PRO	A	35	L	H	CE1	TYR	V	162
R	-	CA	PRO	A	35	L	H	CZ	TYR	V	162
R	-	CA	PRO	A	35	L	H	HD1	TYR	V	162
R	-	CA	PRO	A	35	L	H	HE1	TYR	V	162
R	-	C	PRO	A	35	L	H	CG	TYR	V	162
R	-	C	PRO	A	35	L	H	CD1	TYR	V	162
R	-	C	PRO	A	35	L	H	CD2	TYR	V	162
R	-	C	PRO	A	35	L	H	CE1	TYR	V	162
R	-	C	PRO	A	35	L	H	CE2	TYR	V	162
R	-	C	PRO	A	35	L	H	OH	TYR	V	162
R	-	C	PRO	A	35	L	H	CZ	TYR	V	162
R	-	C	PRO	A	35	L	H	HD1	TYR	V	162
R	-	C	PRO	A	35	L	H	HE1	TYR	V	162
R	-	C	PRO	A	35	L	H	HH	TYR	V	162
R	-	CB	PRO	A	35	L	H	HA	SER	V	159
R	-	CB	PRO	A	35	L	H	CG	TYR	V	162
R	-	CB	PRO	A	35	L	H	CD1	TYR	V	162
R	-	CB	PRO	A	35	L	H	CE1	TYR	V	162
R	-	CB	PRO	A	35	L	H	HB3	TYR	V	162
R	-	CB	PRO	A	35	L	H	HD1	TYR	V	162
R	-	CB	PRO	A	35	L	H	HE1	TYR	V	162
R	-	O	PRO	A	35	L	H	CG	TYR	V	162
R	-	O	PRO	A	35	L	H	CD1	TYR	V	162
R	-	O	PRO	A	35	L	H	CD2	TYR	V	162
R	-	O	PRO	A	35	L	H	CE1	TYR	V	162
R	-	O	PRO	A	35	L	H	CE2	TYR	V	162
R	-	O	PRO	A	35	L	H	OH	TYR	V	162
R	-	O	PRO	A	35	L	H	CZ	TYR	V	162
R	-	O	PRO	A	35	L	H	HD1	TYR	V	162
R	-	O	PRO	A	35	L	H	HE1	TYR	V	162
R	-	O	PRO	A	35	L	H	HE2	TYR	V	162
R	-	O	PRO	A	35	L	H	HH	TYR	V	162
R	-	CG	PRO	A	35	L	H	HD1	TYR	V	162
R	-	N	ASP	A	36	L	H	CD1	TYR	V	162
R	-	N	ASP	A	36	L	H	CE1	TYR	V	162
R	-	N	ASP	A	36	L	H	CE2	TYR	V	162
R	-	N	ASP	A	36	L	H	OH	TYR	V	162
R	-	N	ASP	A	36	L	H	CZ	TYR	V	162
R	-	N	ASP	A	36	L	H	HE1	TYR	V	162
R	-	N	ASP	A	36	L	H	HH	TYR	V	162
R	-	CA	ASP	A	36	L	H	CE1	TYR	V	162
R	-	CA	ASP	A	36	L	H	CE2	TYR	V	162
R	-	CA	ASP	A	36	L	H	OH	TYR	V	162
R	-	CA	ASP	A	36	L	H	CZ	TYR	V	162
R	-	CA	ASP	A	36	L	H	HE1	TYR	V	162
R	-	CA	ASP	A	36	L	H	HE2	TYR	V	162
R	-	CA	ASP	A	36	L	H	HH	TYR	V	162
R	-	C	ASP	A	36	L	H	OH	TYR	V	162
R	-	C	ASP	A	36	L	H	CZ	TYR	V	162
R	-	C	ASP	A	36	L	H	HH	TYR	V	162
R	-	CB	ASP	A	36	L	H	OH	TYR	V	162
R	-	O	ASP	A	36	L	H	OH	TYR	V	162
R	-	O	ASP	A	36	L	H	HH	TYR	V	162
R	-	OD1	ASP	A	36	L	H	CD2	TYR	V	162
R	-	OD1	ASP	A	36	L	H	CE2	TYR	V	162
R	-	OD1	ASP	A	36	L	H	CZ	TYR	V	162
R	-	OD1	ASP	A	36	L	H	HE2	TYR	V	162
R	-	N	TYR	A	37	L	H	OH	TYR	V	162
R	-	N	TYR	A	37	L	H	HE1	TYR	V	162
R	-	N	TYR	A	37	L	H	HH	TYR	V	162
R	-	C	TYR	A	37	L	H	HH	TYR	V	162
R	-	N	ARG	A	38	L	H	HH	TYR	V	162
R	-	CA	PRO	A	230	L	-	CA	GLY	V	101
R	-	CA	PRO	A	230	L	-	HA2	GLY	V	101
R	-	CA	PRO	A	230	L	-	HA3	GLY	V	101
R	-	CA	PRO	A	230	L	-	H	GLY	V	102
R	-	C	PRO	A	230	L	-	HA3	GLY	V	101
R	-	CB	PRO	A	230	L	-	CA	GLY	V	101
R	-	CB	PRO	A	230	L	-	HA2	GLY	V	101
R	-	CB	PRO	A	230	L	-	HA3	GLY	V	101
R	-	CB	PRO	A	230	L	-	N	GLY	V	102
R	-	CB	PRO	A	230	L	-	H	GLY	V	102
R	-	CB	PRO	A	230	L	-	HA2	GLY	V	102
R	-	CB	PRO	A	230	L	-	HD11	LEU	V	103
R	-	CG	PRO	A	230	L	-	H	GLY	V	102
R	-	CG	PRO	A	230	L	-	CD1	LEU	V	103
R	-	CG	PRO	A	230	L	-	HD11	LEU	V	103
R	-	CG	PRO	A	230	L	-	HD13	LEU	V	103
R	-	CD	PRO	A	230	L	-	HD11	LEU	V	103
R	-	N	LYS	A	231	L	-	CA	GLY	V	101
R	-	N	LYS	A	231	L	-	C	GLY	V	101
R	-	N	LYS	A	231	L	-	HA3	GLY	V	101
R	-	N	LYS	A	231	L	-	N	GLY	V	102
R	-	N	LYS	A	231	L	-	CA	GLY	V	102
R	-	N	LYS	A	231	L	-	H	GLY	V	102
R	-	N	LYS	A	231	L	-	HA2	GLY	V	102
R	-	N	LYS	A	231	L	-	HA3	GLY	V	102
R	-	CA	LYS	A	231	L	-	C	GLY	V	101
R	-	CA	LYS	A	231	L	-	N	GLY	V	102
R	-	CA	LYS	A	231	L	-	CA	GLY	V	102
R	-	CA	LYS	A	231	L	-	HA2	GLY	V	102
R	-	CA	LYS	A	231	L	-	HA3	GLY	V	102
R	-	C	LYS	A	231	L	-	C	GLY	V	101
R	-	C	LYS	A	231	L	-	O	GLY	V	101
R	-	C	LYS	A	231	L	-	HA3	GLY	V	101
R	-	C	LYS	A	231	L	-	N	GLY	V	102
R	-	C	LYS	A	231	L	-	CA	GLY	V	102
R	-	C	LYS	A	231	L	-	H	GLY	V	102
R	-	C	LYS	A	231	L	-	HA2	GLY	V	102
R	-	C	LYS	A	231	L	-	HA3	GLY	V	102
R	-	O	LYS	A	231	L	-	CA	GLY	V	101
R	-	O	LYS	A	231	L	-	C	GLY	V	101
R	-	O	LYS	A	231	L	-	O	GLY	V	101
R	-	O	LYS	A	231	L	-	HA3	GLY	V	101
R	-	O	LYS	A	231	L	-	N	GLY	V	102
R	-	O	LYS	A	231	L	-	CA	GLY	V	102
R	-	O	LYS	A	231	L	-	H	GLY	V	102
R	-	O	LYS	A	231	L	-	HA2	GLY	V	102
R	-	O	LYS	A	231	L	-	HA3	GLY	V	102
R	-	N	ALA	A	232	L	-	C	GLY	V	101
R	-	N	ALA	A	232	L	-	O	GLY	V	101
R	-	N	ALA	A	232	L	-	N	GLY	V	102
R	-	N	ALA	A	232	L	-	CA	GLY	V	102
R	-	N	ALA	A	232	L	-	C	GLY	V	102
R	-	N	ALA	A	232	L	-	O	GLY	V	102
R	-	N	ALA	A	232	L	-	HA2	GLY	V	102
R	-	N	ALA	A	232	L	-	HA3	GLY	V	102
R	-	N	ALA	A	232	L	-	HB2	LEU	V	103
R	-	CA	ALA	A	232	L	-	CA	GLY	V	102
R	-	CA	ALA	A	232	L	-	HA2	GLY	V	102
R	-	CA	ALA	A	232	L	-	HA3	GLY	V	102
R	-	C	ALA	A	232	L	-	HA3	GLY	V	102
R	-	CB	ALA	A	232	L	-	HA2	GLY	V	102
R	-	CB	ALA	A	232	L	-	HA3	GLY	V	102
R	-	O	ALA	A	232	L	-	HA3	GLY	V	102
R	-	CB	PRO	A	235	L	-	HG1	THR	V	106
R	-	CG	PRO	A	235	L	-	O	ARG	V	105
R	-	CG	PRO	A	235	L	-	HG1	THR	V	106
R	-	CG	PRO	A	235	L	-	HG22	THR	V	106
R	-	OG	SER	A	237	L	-	HD12	LEU	V	109
R	-	CD2	LEU	A	238	L	-	CD1	LEU	V	109
R	-	CD2	LEU	A	238	L	-	HD11	LEU	V	109
R	-	CD2	LEU	A	238	L	-	HD12	LEU	V	109
R	-	CD2	LEU	A	238	L	-	HD13	LEU	V	109
R	-	N	THR	A	239	L	-	HD11	LEU	V	109
R	-	CA	THR	A	239	L	-	HD11	LEU	V	109
R	-	C	THR	A	239	L	-	HB3	LEU	V	109
R	-	C	THR	A	239	L	-	HD11	LEU	V	109
R	-	O	THR	A	239	L	-	CB	LEU	V	109
R	-	O	THR	A	239	L	-	CD1	LEU	V	109
R	-	O	THR	A	239	L	-	HB2	LEU	V	109
R	-	O	THR	A	239	L	-	HB3	LEU	V	109
R	-	O	THR	A	239	L	-	HD11	LEU	V	109
R	-	O	THR	A	239	L	-	HD13	LEU	V	109
R	-	CG1	ILE	A	240	L	-	HG3	PRO	V	111
R	-	CG2	ILE	A	240	L	-	CG	PRO	V	111
R	-	CG2	ILE	A	240	L	-	HG2	PRO	V	111
R	-	CG2	ILE	A	240	L	-	HG3	PRO	V	111
R	-	CD1	ILE	A	240	L	-	HG3	PRO	V	111
R	-	OG1	THR	A	241	L	-	O	LEU	V	109
R	-	O	PRO	A	245	L	-	HA	SER	V	157
R	-	N	GLY	A	246	L	-	HA	SER	V	157
R	-	C	GLY	A	246	L	-	O	VAL	V	155
R	-	O	GLY	A	246	L	-	N	VAL	V	155
R	-	O	GLY	A	246	L	-	C	VAL	V	155
R	-	O	GLY	A	246	L	-	O	VAL	V	155
R	-	O	GLY	A	246	L	-	H	VAL	V	155
R	-	O	GLY	A	246	L	-	HB	VAL	V	155
R	-	C	GLY	A	247	L	-	O	VAL	V	155
R	-	C	GLY	A	247	L	-	HA	PHE	V	156
R	-	C	GLY	A	247	L	H	HE22	GLN	V	160
R	-	O	GLY	A	247	L	-	O	VAL	V	155
R	-	O	GLY	A	247	L	-	CA	PHE	V	156
R	-	O	GLY	A	247	L	-	HA	PHE	V	156
R	-	O	GLY	A	247	L	-	HD1	PHE	V	156
R	-	O	GLY	A	247	L	-	N	SER	V	157
R	-	O	GLY	A	247	L	-	H	SER	V	157
R	-	O	GLY	A	247	L	-	HB3	SER	V	157
R	-	O	GLY	A	247	L	H	OE1	GLN	V	160
R	-	O	GLY	A	247	L	H	HE22	GLN	V	160
R	-	N	GLY	A	248	L	H	HE22	GLN	V	160
R	-	C	GLY	A	248	L	H	HE22	GLN	V	160
R	-	C	GLY	A	248	L	-	O	GLN	V	187
R	-	C	GLY	A	248	L	-	HD21	LEU	V	188
R	-	O	GLY	A	248	L	H	HE22	GLN	V	160
R	-	O	GLY	A	248	L	-	C	GLN	V	187
R	-	O	GLY	A	248	L	-	O	GLN	V	187
R	-	O	GLY	A	248	L	-	CD2	LEU	V	188
R	-	O	GLY	A	248	L	-	HA	LEU	V	188
R	-	O	GLY	A	248	L	-	HD21	LEU	V	188
R	-	O	GLY	A	248	L	-	HD22	LEU	V	188
R	-	O	GLY	A	248	L	-	HD23	LEU	V	188
R	-	O	GLY	A	248	L	H	HE22	GLN	V	192
R	-	N	LEU	A	249	L	-	O	GLN	V	187
R	-	CA	LEU	A	249	L	-	O	GLN	V	187
R	-	C	LEU	A	249	L	-	C	GLN	V	187
R	-	C	LEU	A	249	L	-	O	GLN	V	187
R	-	C	LEU	A	249	L	-	HB3	GLN	V	187
R	-	C	LEU	A	249	L	-	N	LEU	V	188
R	-	C	LEU	A	249	L	-	HA	LEU	V	188
R	-	CB	LEU	A	249	L	-	HG22	THR	V	189
R	-	CB	LEU	A	249	L	H	HE22	GLN	V	192
R	-	O	LEU	A	249	L	-	CA	GLN	V	187
R	-	O	LEU	A	249	L	-	C	GLN	V	187
R	-	O	LEU	A	249	L	-	O	GLN	V	187
R	-	O	LEU	A	249	L	-	HA	GLN	V	187
R	-	O	LEU	A	249	L	-	HB3	GLN	V	187
R	-	O	LEU	A	249	L	-	N	LEU	V	188
R	-	O	LEU	A	249	L	-	CA	LEU	V	188
R	-	O	LEU	A	249	L	-	C	LEU	V	188
R	-	O	LEU	A	249	L	-	O	LEU	V	188
R	-	O	LEU	A	249	L	-	H	LEU	V	188
R	-	O	LEU	A	249	L	-	HA	LEU	V	188
R	-	O	LEU	A	249	L	-	HD21	LEU	V	188
R	-	O	LEU	A	249	L	-	N	THR	V	189
R	-	O	LEU	A	249	L	-	H	THR	V	189
R	-	O	LEU	A	249	L	-	HG22	THR	V	189
R	-	CG	LEU	A	249	L	H	HE22	GLN	V	192
R	-	CD1	LEU	A	249	L	H	HE22	GLN	V	192
R	-	N	LEU	A	250	L	-	CA	GLN	V	187
R	-	N	LEU	A	250	L	-	C	GLN	V	187
R	-	N	LEU	A	250	L	-	CB	GLN	V	187
R	-	N	LEU	A	250	L	-	O	GLN	V	187
R	-	N	LEU	A	250	L	-	HA	GLN	V	187
R	-	N	LEU	A	250	L	-	HB3	GLN	V	187
R	-	CA	LEU	A	250	L	-	CB	GLN	V	187
R	-	CA	LEU	A	250	L	-	O	GLN	V	187
R	-	CA	LEU	A	250	L	-	HA	GLN	V	187
R	-	CA	LEU	A	250	L	-	HB3	GLN	V	187
R	-	C	LEU	A	250	L	-	C	GLN	V	187
R	-	C	LEU	A	250	L	-	HA	GLN	V	187
R	-	C	LEU	A	250	L	-	HB3	GLN	V	187
R	-	N	GLY	A	251	L	H	HA	SER	V	184
R	-	N	GLY	A	251	L	-	CA	GLN	V	187
R	-	N	GLY	A	251	L	-	C	GLN	V	187
R	-	N	GLY	A	251	L	-	HA	GLN	V	187
R	-	CA	GLY	A	251	L	H	HA	SER	V	184
R	-	CA	GLY	A	251	L	-	HA	GLN	V	187
R	-	C	GLY	A	251	L	H	HA	SER	V	184
R	-	C	GLY	A	251	L	H	HB3	SER	V	184
R	-	O	GLY	A	251	L	H	O	SER	V	184
R	-	O	GLY	A	251	L	H	HA	SER	V	184
R	-	O	GLY	A	251	L	-	HA	GLN	V	187
R	-	N	PRO	A	252	L	H	OG	SER	V	184
R	-	N	PRO	A	252	L	H	HA	SER	V	184
R	-	N	PRO	A	252	L	H	HB3	SER	V	184
R	-	CA	PRO	A	252	L	H	HB3	SER	V	184
R	-	C	PRO	A	252	L	H	CB	SER	V	184
R	-	C	PRO	A	252	L	H	OG	SER	V	184
R	-	C	PRO	A	252	L	H	HB3	SER	V	184
R	-	O	PRO	A	252	L	H	CA	SER	V	184
R	-	O	PRO	A	252	L	H	CB	SER	V	184
R	-	O	PRO	A	252	L	H	OG	SER	V	184
R	-	O	PRO	A	252	L	H	HA	SER	V	184
R	-	O	PRO	A	252	L	H	HB2	SER	V	184
R	-	O	PRO	A	252	L	H	HB3	SER	V	184
R	-	O	PRO	A	252	L	H	HG	SER	V	184
R	-	CG	PRO	A	252	L	H	OG	SER	V	184
R	-	CD	PRO	A	252	L	H	OG	SER	V	184
R	-	CD	PRO	A	252	L	H	HA	SER	V	184
R	-	N	SER	A	253	L	H	HB3	SER	V	184
R	-	CA	SER	A	253	L	H	HB3	SER	V	184
R	-	N	HIS	A	254	L	H	HB3	SER	V	184
R	-	CD2	HIS	A	254	L	H	OG	SER	V	184
R	-	CD2	HIS	A	254	L	H	HG	SER	V	184
R	-	CA	SER	A	255	L	-	HG2	GLN	V	70
R	-	CA	SER	A	255	L	-	HE21	GLN	V	70
R	-	C	SER	A	255	L	-	HG2	GLN	V	70
R	-	C	SER	A	255	L	-	HE21	GLN	V	70
R	-	CB	SER	A	255	L	-	NE2	GLN	V	70
R	-	CB	SER	A	255	L	-	HG2	GLN	V	70
R	-	CB	SER	A	255	L	-	HE21	GLN	V	70
R	-	CB	SER	A	255	L	-	HE22	GLN	V	70
R	-	O	SER	A	255	L	-	HG2	PRO	V	68
R	-	O	SER	A	255	L	-	CG	GLN	V	70
R	-	O	SER	A	255	L	-	CD	GLN	V	70
R	-	O	SER	A	255	L	-	NE2	GLN	V	70
R	-	O	SER	A	255	L	-	HG2	GLN	V	70
R	-	O	SER	A	255	L	-	HG3	GLN	V	70
R	-	O	SER	A	255	L	-	HE21	GLN	V	70
R	-	OG	SER	A	255	L	-	HE21	GLN	V	70
R	-	CA	TYR	A	256	L	-	HG2	PRO	V	68
R	-	CG	TYR	A	256	L	-	HD3	PRO	V	68
R	-	CD1	TYR	A	256	L	-	HA	CYS	V	67
R	-	CD1	TYR	A	256	L	-	CD	PRO	V	68
R	-	CD1	TYR	A	256	L	-	HD3	PRO	V	68
R	-	CE1	TYR	A	256	L	-	CA	CYS	V	67
R	-	CE1	TYR	A	256	L	-	CB	CYS	V	67
R	-	CE1	TYR	A	256	L	-	SG	CYS	V	67
R	-	CE1	TYR	A	256	L	-	HA	CYS	V	67
R	-	CE1	TYR	A	256	L	-	HB3	CYS	V	67
R	-	CE1	TYR	A	256	L	-	HG	CYS	V	67
R	-	CE1	TYR	A	256	L	-	HD3	PRO	V	68
R	-	CE2	TYR	A	256	L	-	HB3	CYS	V	67
R	-	CE2	TYR	A	256	L	-	HG	CYS	V	67
R	-	OH	TYR	A	256	L	-	CA	CYS	V	67
R	-	OH	TYR	A	256	L	-	CB	CYS	V	67
R	-	OH	TYR	A	256	L	-	SG	CYS	V	67
R	-	OH	TYR	A	256	L	-	HA	CYS	V	67
R	-	OH	TYR	A	256	L	-	HB2	CYS	V	67
R	-	OH	TYR	A	256	L	-	HB3	CYS	V	67
R	-	OH	TYR	A	256	L	-	HG	CYS	V	67
R	-	CZ	TYR	A	256	L	-	CB	CYS	V	67
R	-	CZ	TYR	A	256	L	-	SG	CYS	V	67
R	-	CZ	TYR	A	256	L	-	HA	CYS	V	67
R	-	CZ	TYR	A	256	L	-	HB3	CYS	V	67
R	-	CZ	TYR	A	256	L	-	HG	CYS	V	67
R	-	CZ	TYR	A	256	L	-	HD3	PRO	V	68
R	-	N	SER	A	257	L	-	HG2	PRO	V	68
R	-	O	SER	A	257	L	-	HG3	PRO	V	68
R	H	CA	LEU	A	263	L	-	HE2	PHE	V	86
R	H	CB	LEU	A	263	L	-	HG22	ILE	V	84
R	H	CB	LEU	A	263	L	-	CE2	PHE	V	86
R	H	CB	LEU	A	263	L	-	HE2	PHE	V	86
R	H	CG	LEU	A	263	L	-	HG22	ILE	V	84
R	H	CG	LEU	A	263	L	-	CE2	PHE	V	86
R	H	CG	LEU	A	263	L	-	HE2	PHE	V	86
R	H	CG	LEU	A	263	L	-	HZ	PHE	V	86
R	H	CD1	LEU	A	263	L	-	CG2	ILE	V	84
R	H	CD1	LEU	A	263	L	-	HG21	ILE	V	84
R	H	CD1	LEU	A	263	L	-	HG22	ILE	V	84
R	H	CD1	LEU	A	263	L	-	HD13	ILE	V	84
R	H	CD1	LEU	A	263	L	-	CD2	PHE	V	86
R	H	CD1	LEU	A	263	L	-	CE2	PHE	V	86
R	H	CD1	LEU	A	263	L	-	CZ	PHE	V	86
R	H	CD1	LEU	A	263	L	-	HD2	PHE	V	86
R	H	CD1	LEU	A	263	L	-	HE2	PHE	V	86
R	H	CD1	LEU	A	263	L	-	HZ	PHE	V	86
R	H	CD2	LEU	A	263	L	-	HE2	PHE	V	86
R	H	C	LEU	A	375	L	-	HB2	PRO	V	92
R	H	C	LEU	A	375	L	-	HB3	PRO	V	92
R	H	C	LEU	A	375	L	-	HG3	PRO	V	92
R	H	O	LEU	A	375	L	-	CB	PRO	V	92
R	H	O	LEU	A	375	L	-	CG	PRO	V	92
R	H	O	LEU	A	375	L	-	HB2	PRO	V	92
R	H	O	LEU	A	375	L	-	HB3	PRO	V	92
R	H	O	LEU	A	375	L	-	HG2	PRO	V	92
R	H	O	LEU	A	375	L	-	HG3	PRO	V	92
R	-	N	GLY	A	376	L	-	HB2	PRO	V	92
R	-	CA	GLY	A	376	L	-	CB	PRO	V	92
R	-	CA	GLY	A	376	L	-	HB2	PRO	V	92
R	-	CA	GLY	A	376	L	-	HB3	PRO	V	92
R	-	CA	GLY	A	376	L	-	HB3	LYS	V	93
R	-	CA	GLY	A	376	L	-	HD3	LYS	V	93
R	-	C	GLY	A	376	L	-	CB	PRO	V	92
R	-	C	GLY	A	376	L	-	HB2	PRO	V	92
R	-	C	GLY	A	376	L	-	HB3	PRO	V	92
R	-	C	GLY	A	376	L	-	CD	LYS	V	93
R	-	C	GLY	A	376	L	-	HB2	LYS	V	93
R	-	C	GLY	A	376	L	-	HB3	LYS	V	93
R	-	C	GLY	A	376	L	-	HD2	LYS	V	93
R	-	C	GLY	A	376	L	-	HD3	LYS	V	93
R	-	O	GLY	A	376	L	-	CA	PRO	V	92
R	-	O	GLY	A	376	L	-	CB	PRO	V	92
R	-	O	GLY	A	376	L	-	HA	PRO	V	92
R	-	O	GLY	A	376	L	-	HB2	PRO	V	92
R	-	O	GLY	A	376	L	-	HB3	PRO	V	92
R	-	O	GLY	A	376	L	-	CB	LYS	V	93
R	-	O	GLY	A	376	L	-	CG	LYS	V	93
R	-	O	GLY	A	376	L	-	CD	LYS	V	93
R	-	O	GLY	A	376	L	-	HB2	LYS	V	93
R	-	O	GLY	A	376	L	-	HB3	LYS	V	93
R	-	O	GLY	A	376	L	-	HD2	LYS	V	93
R	-	O	GLY	A	376	L	-	HD3	LYS	V	93
R	-	N	LEU	A	377	L	-	HB3	PRO	V	92
R	-	CA	LEU	A	377	L	-	HB3	PRO	V	92
R	-	CG	LEU	A	377	L	-	HB3	PRO	V	92
R	-	CG	LEU	A	377	L	-	HG3	PRO	V	92
R	-	CD2	LEU	A	377	L	-	HB3	PRO	V	92
R	-	CD2	LEU	A	377	L	-	HG3	PRO	V	92
R	-	CD2	LEU	A	377	L	-	HD2	PRO	V	92
R	-	C	ASP	A	378	L	-	HZ2	LYS	V	93
R	-	C	ASP	A	378	L	-	HZ3	LYS	V	93
R	-	O	ASP	A	378	L	-	NZ	LYS	V	93
R	-	O	ASP	A	378	L	-	HZ2	LYS	V	93
R	-	O	ASP	A	378	L	-	HZ3	LYS	V	93
R	-	N	THR	A	379	L	-	HD2	LYS	V	93
R	-	N	THR	A	379	L	-	HZ2	LYS	V	93
R	-	CA	THR	A	379	L	-	HD2	LYS	V	93
R	-	CA	THR	A	379	L	-	HZ2	LYS	V	93
R	-	CB	THR	A	379	L	-	CG	LYS	V	93
R	-	CB	THR	A	379	L	-	CD	LYS	V	93
R	-	CB	THR	A	379	L	-	CE	LYS	V	93
R	-	CB	THR	A	379	L	-	NZ	LYS	V	93
R	-	CB	THR	A	379	L	-	HB2	LYS	V	93
R	-	CB	THR	A	379	L	-	HG2	LYS	V	93
R	-	CB	THR	A	379	L	-	HD2	LYS	V	93
R	-	CB	THR	A	379	L	-	HD3	LYS	V	93
R	-	CB	THR	A	379	L	-	HE3	LYS	V	93
R	-	CB	THR	A	379	L	-	HZ1	LYS	V	93
R	-	CB	THR	A	379	L	-	HZ2	LYS	V	93
R	-	CB	THR	A	379	L	-	HZ3	LYS	V	93
R	-	CG2	THR	A	379	L	-	CG	LYS	V	93
R	-	CG2	THR	A	379	L	-	CD	LYS	V	93
R	-	CG2	THR	A	379	L	-	CE	LYS	V	93
R	-	CG2	THR	A	379	L	-	NZ	LYS	V	93
R	-	CG2	THR	A	379	L	-	HG2	LYS	V	93
R	-	CG2	THR	A	379	L	-	HD2	LYS	V	93
R	-	CG2	THR	A	379	L	-	HD3	LYS	V	93
R	-	CG2	THR	A	379	L	-	HE2	LYS	V	93
R	-	CG2	THR	A	379	L	-	HE3	LYS	V	93
R	-	CG2	THR	A	379	L	-	HZ1	LYS	V	93
R	-	CG2	THR	A	379	L	-	HZ2	LYS	V	93
R	-	CG2	THR	A	379	L	-	HZ3	LYS	V	93
R	-	OG1	THR	A	379	L	-	CB	LYS	V	93
R	-	OG1	THR	A	379	L	-	CG	LYS	V	93
R	-	OG1	THR	A	379	L	-	CD	LYS	V	93
R	-	OG1	THR	A	379	L	-	CE	LYS	V	93
R	-	OG1	THR	A	379	L	-	HB2	LYS	V	93
R	-	OG1	THR	A	379	L	-	HG2	LYS	V	93
R	-	OG1	THR	A	379	L	-	HD2	LYS	V	93
R	-	OG1	THR	A	379	L	-	HD3	LYS	V	93
R	-	OG1	THR	A	379	L	-	HE3	LYS	V	93
R	-	OG1	THR	A	379	L	-	HZ2	LYS	V	93

- 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