IID

P47898_P78426.1 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	TRP	A	221	L	H	GLN	V	306
R	H	TYR	A	224	L	H	LYS	V	303
R	H	TYR	A	224	L	H	GLN	V	306
R	H	LYS	A	225	L	H	GLN	V	306
R	H	LYS	A	228	L	H	LYS	V	303
R	H	LYS	A	228	L	H	ASP	V	307
R	H	ARG	A	234	L	-	PRO	V	34
R	H	ARG	A	234	L	-	TYR	V	36
R	H	LYS	A	235	L	-	MET	V	31
R	-	SER	A	238	L	-	THR	V	33
R	-	SER	A	238	L	-	PRO	V	34
R	-	VAL	A	239	L	-	LEU	V	35
R	-	THR	A	265	L	-	LEU	V	35
R	-	VAL	A	266	L	-	LEU	V	35
R	-	THR	A	267	L	-	LEU	V	35
R	-	PHE	A	268	L	-	PRO	V	34
R	-	PHE	A	268	L	-	LEU	V	35
R	-	PHE	A	268	L	-	TYR	V	36
R	-	PHE	A	268	L	-	PRO	V	37
R	-	PHE	A	268	L	-	ALA	V	38
R	-	GLN	A	269	L	-	PRO	V	34
R	-	GLN	A	269	L	-	TYR	V	36
R	-	GLN	A	269	L	-	ALA	V	38
R	H	PRO	A	270	L	-	THR	V	33
R	H	PRO	A	270	L	-	PRO	V	34
R	H	ASP	A	273	L	-	PRO	V	34
R	H	ASP	A	273	L	-	TYR	V	36
R	H	THR	A	274	L	-	LYS	V	32
R	H	ARG	A	276	L	-	TYR	V	36
R	H	GLU	A	277	L	-	LYS	V	32
R	H	GLY	A	288	L	H	HIS	V	295
R	H	GLY	A	288	L	H	MET	V	299
R	H	ILE	A	289	L	H	TRP	V	291
R	H	ILE	A	289	L	H	HIS	V	295
R	H	GLY	A	292	L	H	HIS	V	295
R	H	VAL	A	293	L	H	TRP	V	291
R	H	VAL	A	293	L	H	HIS	V	295
R	H	LEU	A	296	L	H	TRP	V	291
R	H	ILE	A	318	L	H	LYS	V	253
R	H	TRP	A	319	L	H	PHE	V	249
R	H	ILE	A	322	L	H	PHE	V	249
R	H	ILE	A	322	L	H	LYS	V	253
R	H	TRP	A	325	L	H	GLN	V	257
R	H	LEU	A	326	L	H	GLU	V	256
R	H	SER	A	329	L	H	GLN	V	257
R	H	PHE	A	332	L	-	THR	V	258
R	H	PHE	A	333	L	H	GLU	V	256
R	H	PHE	A	333	L	H	GLN	V	257
R	H	PHE	A	333	L	-	THR	V	258
R	H	PHE	A	333	L	-	LYS	V	259
R	H	VAL	A	38	L	H	TYR	V	271
R	H	VAL	A	38	L	H	SER	V	272
R	H	PHE	A	39	L	H	GLN	V	246
R	H	PHE	A	39	L	H	ALA	V	250
R	H	PHE	A	39	L	H	SER	V	272
R	H	PHE	A	39	L	H	LEU	V	273
R	H	LEU	A	42	L	H	ARG	V	268
R	H	LEU	A	42	L	H	TYR	V	271
R	H	LEU	A	42	L	H	SER	V	272
R	H	ILE	A	43	L	H	LYS	V	253
R	H	THR	A	45	L	H	ARG	V	268
R	H	LEU	A	46	L	H	THR	V	254
R	H	LEU	A	46	L	H	GLN	V	257
R	H	LEU	A	46	L	H	GLU	V	265
R	H	LEU	A	46	L	H	ARG	V	268
R	H	LEU	A	47	L	H	GLN	V	257
R	H	PHE	A	49	L	H	GLU	V	265
R	H	PHE	A	49	L	H	ARG	V	268
R	H	LEU	A	50	L	H	GLN	V	257

- 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

P47898_P78426.1 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	CG1	VAL	A	38	L	H	HE1	TYR	V	271
R	H	CG1	VAL	A	38	L	H	HA	SER	V	272
R	H	CD2	PHE	A	39	L	H	HE21	GLN	V	246
R	H	CD2	PHE	A	39	L	H	HB3	SER	V	272
R	H	CE1	PHE	A	39	L	H	HE21	GLN	V	246
R	H	CE1	PHE	A	39	L	H	HE22	GLN	V	246
R	H	CE2	PHE	A	39	L	H	HE21	GLN	V	246
R	H	CE2	PHE	A	39	L	H	CB	ALA	V	250
R	H	CE2	PHE	A	39	L	H	HB1	ALA	V	250
R	H	CE2	PHE	A	39	L	H	HB2	ALA	V	250
R	H	CE2	PHE	A	39	L	H	HD22	LEU	V	273
R	H	CZ	PHE	A	39	L	H	NE2	GLN	V	246
R	H	CZ	PHE	A	39	L	H	HE21	GLN	V	246
R	H	CZ	PHE	A	39	L	H	HE22	GLN	V	246
R	H	CZ	PHE	A	39	L	H	CB	ALA	V	250
R	H	CZ	PHE	A	39	L	H	HB1	ALA	V	250
R	H	CZ	PHE	A	39	L	H	HB2	ALA	V	250
R	H	CB	LEU	A	42	L	H	CB	SER	V	272
R	H	CB	LEU	A	42	L	H	OG	SER	V	272
R	H	CB	LEU	A	42	L	H	HB3	SER	V	272
R	H	CB	LEU	A	42	L	H	HG	SER	V	272
R	H	CG	LEU	A	42	L	H	O	ARG	V	268
R	H	CG	LEU	A	42	L	H	HB3	ARG	V	268
R	H	CG	LEU	A	42	L	H	CB	SER	V	272
R	H	CG	LEU	A	42	L	H	OG	SER	V	272
R	H	CG	LEU	A	42	L	H	HB2	SER	V	272
R	H	CG	LEU	A	42	L	H	HB3	SER	V	272
R	H	CG	LEU	A	42	L	H	HG	SER	V	272
R	H	CD1	LEU	A	42	L	H	O	ARG	V	268
R	H	CD1	LEU	A	42	L	H	HD1	TYR	V	271
R	H	CD1	LEU	A	42	L	H	N	SER	V	272
R	H	CD1	LEU	A	42	L	H	CA	SER	V	272
R	H	CD1	LEU	A	42	L	H	CB	SER	V	272
R	H	CD1	LEU	A	42	L	H	OG	SER	V	272
R	H	CD1	LEU	A	42	L	H	H	SER	V	272
R	H	CD1	LEU	A	42	L	H	HA	SER	V	272
R	H	CD1	LEU	A	42	L	H	HB2	SER	V	272
R	H	CD1	LEU	A	42	L	H	HB3	SER	V	272
R	H	CD1	LEU	A	42	L	H	HG	SER	V	272
R	H	CD2	LEU	A	42	L	H	CA	ARG	V	268
R	H	CD2	LEU	A	42	L	H	C	ARG	V	268
R	H	CD2	LEU	A	42	L	H	CB	ARG	V	268
R	H	CD2	LEU	A	42	L	H	O	ARG	V	268
R	H	CD2	LEU	A	42	L	H	HA	ARG	V	268
R	H	CD2	LEU	A	42	L	H	HB3	ARG	V	268
R	H	CD2	LEU	A	42	L	H	HG2	ARG	V	268
R	H	CD2	LEU	A	42	L	H	HD2	ARG	V	268
R	H	CD2	LEU	A	42	L	H	CB	SER	V	272
R	H	CD2	LEU	A	42	L	H	OG	SER	V	272
R	H	CD2	LEU	A	42	L	H	HG	SER	V	272
R	H	CG1	ILE	A	43	L	H	HZ2	LYS	V	253
R	H	CG2	ILE	A	43	L	H	HZ1	LYS	V	253
R	H	CG2	ILE	A	43	L	H	HZ2	LYS	V	253
R	H	CD1	ILE	A	43	L	H	NZ	LYS	V	253
R	H	CD1	ILE	A	43	L	H	HZ1	LYS	V	253
R	H	CD1	ILE	A	43	L	H	HZ2	LYS	V	253
R	H	CA	THR	A	45	L	H	NH1	ARG	V	268
R	H	CA	THR	A	45	L	H	HH11	ARG	V	268
R	H	CA	THR	A	45	L	H	HH12	ARG	V	268
R	H	C	THR	A	45	L	H	NH1	ARG	V	268
R	H	C	THR	A	45	L	H	HH11	ARG	V	268
R	H	C	THR	A	45	L	H	HH12	ARG	V	268
R	H	C	THR	A	45	L	H	HH22	ARG	V	268
R	H	CB	THR	A	45	L	H	NH1	ARG	V	268
R	H	CB	THR	A	45	L	H	CZ	ARG	V	268
R	H	CB	THR	A	45	L	H	HD2	ARG	V	268
R	H	CB	THR	A	45	L	H	HH11	ARG	V	268
R	H	CB	THR	A	45	L	H	HH12	ARG	V	268
R	H	O	THR	A	45	L	H	NH1	ARG	V	268
R	H	O	THR	A	45	L	H	NH2	ARG	V	268
R	H	O	THR	A	45	L	H	HH11	ARG	V	268
R	H	O	THR	A	45	L	H	HH12	ARG	V	268
R	H	O	THR	A	45	L	H	HH22	ARG	V	268
R	H	CG2	THR	A	45	L	H	NH1	ARG	V	268
R	H	CG2	THR	A	45	L	H	HH11	ARG	V	268
R	H	CG2	THR	A	45	L	H	HH12	ARG	V	268
R	H	OG1	THR	A	45	L	H	CD	ARG	V	268
R	H	OG1	THR	A	45	L	H	NE	ARG	V	268
R	H	OG1	THR	A	45	L	H	NH1	ARG	V	268
R	H	OG1	THR	A	45	L	H	CZ	ARG	V	268
R	H	OG1	THR	A	45	L	H	HD2	ARG	V	268
R	H	OG1	THR	A	45	L	H	HH11	ARG	V	268
R	H	OG1	THR	A	45	L	H	HH12	ARG	V	268
R	H	N	LEU	A	46	L	H	NH1	ARG	V	268
R	H	N	LEU	A	46	L	H	HH12	ARG	V	268
R	H	CA	LEU	A	46	L	H	HH22	ARG	V	268
R	H	CG	LEU	A	46	L	H	HG23	THR	V	254
R	H	CG	LEU	A	46	L	H	OE1	GLN	V	257
R	H	CD1	LEU	A	46	L	H	HG23	THR	V	254
R	H	CD1	LEU	A	46	L	H	HB3	GLU	V	265
R	H	CD1	LEU	A	46	L	H	HG2	GLU	V	265
R	H	CD2	LEU	A	46	L	H	CG2	THR	V	254
R	H	CD2	LEU	A	46	L	H	OG1	THR	V	254
R	H	CD2	LEU	A	46	L	H	HA	THR	V	254
R	H	CD2	LEU	A	46	L	H	HG21	THR	V	254
R	H	CD2	LEU	A	46	L	H	HG23	THR	V	254
R	H	CD2	LEU	A	46	L	H	CD	GLN	V	257
R	H	CD2	LEU	A	46	L	H	OE1	GLN	V	257
R	H	CG	LEU	A	47	L	H	HE22	GLN	V	257
R	H	CD2	LEU	A	47	L	H	NE2	GLN	V	257
R	H	CD2	LEU	A	47	L	H	HE21	GLN	V	257
R	H	CD2	LEU	A	47	L	H	HE22	GLN	V	257
R	H	CB	PHE	A	49	L	H	OE1	GLU	V	265
R	H	CB	PHE	A	49	L	H	NH2	ARG	V	268
R	H	CB	PHE	A	49	L	H	HH22	ARG	V	268
R	H	CG	PHE	A	49	L	H	OE1	GLU	V	265
R	H	CG	PHE	A	49	L	H	HG2	GLU	V	265
R	H	CG	PHE	A	49	L	H	HH22	ARG	V	268
R	H	CD1	PHE	A	49	L	H	CG	GLU	V	265
R	H	CD1	PHE	A	49	L	H	CD	GLU	V	265
R	H	CD1	PHE	A	49	L	H	OE1	GLU	V	265
R	H	CD1	PHE	A	49	L	H	HG2	GLU	V	265
R	H	CD2	PHE	A	49	L	H	OE1	GLU	V	265
R	H	CD2	PHE	A	49	L	H	HH22	ARG	V	268
R	H	CE1	PHE	A	49	L	H	CD	GLU	V	265
R	H	CE1	PHE	A	49	L	H	OE1	GLU	V	265
R	H	CE1	PHE	A	49	L	H	OE2	GLU	V	265
R	H	CE2	PHE	A	49	L	H	OE1	GLU	V	265
R	H	CZ	PHE	A	49	L	H	CD	GLU	V	265
R	H	CZ	PHE	A	49	L	H	OE1	GLU	V	265
R	H	CD2	LEU	A	50	L	H	HB3	GLN	V	257
R	H	CD2	LEU	A	50	L	H	HG3	GLN	V	257
R	H	O	TRP	A	221	L	H	HE22	GLN	V	306
R	H	CE2	TRP	A	221	L	H	HG2	GLN	V	306
R	H	NE1	TRP	A	221	L	H	CG	GLN	V	306
R	H	NE1	TRP	A	221	L	H	CD	GLN	V	306
R	H	NE1	TRP	A	221	L	H	NE2	GLN	V	306
R	H	NE1	TRP	A	221	L	H	HG2	GLN	V	306
R	H	NE1	TRP	A	221	L	H	HE21	GLN	V	306
R	H	NE1	TRP	A	221	L	H	HE22	GLN	V	306
R	H	CD1	TYR	A	224	L	H	CD	GLN	V	306
R	H	CD1	TYR	A	224	L	H	OE1	GLN	V	306
R	H	CD1	TYR	A	224	L	H	HE22	GLN	V	306
R	H	CE1	TYR	A	224	L	H	HA	LYS	V	303
R	H	CE1	TYR	A	224	L	H	HB2	LYS	V	303
R	H	CE1	TYR	A	224	L	H	HG3	LYS	V	303
R	H	CE1	TYR	A	224	L	H	OE1	GLN	V	306
R	H	OH	TYR	A	224	L	H	CA	LYS	V	303
R	H	OH	TYR	A	224	L	H	CB	LYS	V	303
R	H	OH	TYR	A	224	L	H	CG	LYS	V	303
R	H	OH	TYR	A	224	L	H	CD	LYS	V	303
R	H	OH	TYR	A	224	L	H	CE	LYS	V	303
R	H	OH	TYR	A	224	L	H	HA	LYS	V	303
R	H	OH	TYR	A	224	L	H	HB2	LYS	V	303
R	H	OH	TYR	A	224	L	H	HB3	LYS	V	303
R	H	OH	TYR	A	224	L	H	HG2	LYS	V	303
R	H	OH	TYR	A	224	L	H	HG3	LYS	V	303
R	H	OH	TYR	A	224	L	H	HD2	LYS	V	303
R	H	OH	TYR	A	224	L	H	HD3	LYS	V	303
R	H	OH	TYR	A	224	L	H	HE3	LYS	V	303
R	H	CZ	TYR	A	224	L	H	CB	LYS	V	303
R	H	CZ	TYR	A	224	L	H	CG	LYS	V	303
R	H	CZ	TYR	A	224	L	H	CD	LYS	V	303
R	H	CZ	TYR	A	224	L	H	HA	LYS	V	303
R	H	CZ	TYR	A	224	L	H	HB2	LYS	V	303
R	H	CZ	TYR	A	224	L	H	HG3	LYS	V	303
R	H	CZ	TYR	A	224	L	H	HD2	LYS	V	303
R	H	N	LYS	A	225	L	H	HE22	GLN	V	306
R	H	CA	LYS	A	225	L	H	NE2	GLN	V	306
R	H	CA	LYS	A	225	L	H	HE22	GLN	V	306
R	H	CB	LYS	A	225	L	H	NE2	GLN	V	306
R	H	CB	LYS	A	225	L	H	HE21	GLN	V	306
R	H	CB	LYS	A	225	L	H	HE22	GLN	V	306
R	H	CG	LYS	A	225	L	H	NE2	GLN	V	306
R	H	CG	LYS	A	225	L	H	HE21	GLN	V	306
R	H	CG	LYS	A	225	L	H	HE22	GLN	V	306
R	H	CD	LYS	A	225	L	H	NE2	GLN	V	306
R	H	CD	LYS	A	225	L	H	HE21	GLN	V	306
R	H	CD	LYS	A	225	L	H	HE22	GLN	V	306
R	H	CE	LYS	A	225	L	H	HE21	GLN	V	306
R	H	CG	LYS	A	228	L	H	HE3	LYS	V	303
R	H	CD	LYS	A	228	L	H	CE	LYS	V	303
R	H	CD	LYS	A	228	L	H	NZ	LYS	V	303
R	H	CD	LYS	A	228	L	H	HG3	LYS	V	303
R	H	CD	LYS	A	228	L	H	HE2	LYS	V	303
R	H	CD	LYS	A	228	L	H	HE3	LYS	V	303
R	H	CD	LYS	A	228	L	H	HZ1	LYS	V	303
R	H	CD	LYS	A	228	L	H	HZ3	LYS	V	303
R	H	CE	LYS	A	228	L	H	CD	LYS	V	303
R	H	CE	LYS	A	228	L	H	CE	LYS	V	303
R	H	CE	LYS	A	228	L	H	NZ	LYS	V	303
R	H	CE	LYS	A	228	L	H	HG3	LYS	V	303
R	H	CE	LYS	A	228	L	H	HE2	LYS	V	303
R	H	CE	LYS	A	228	L	H	HE3	LYS	V	303
R	H	CE	LYS	A	228	L	H	HZ1	LYS	V	303
R	H	CE	LYS	A	228	L	H	HZ2	LYS	V	303
R	H	CE	LYS	A	228	L	H	HZ3	LYS	V	303
R	H	NZ	LYS	A	228	L	H	CG	LYS	V	303
R	H	NZ	LYS	A	228	L	H	CD	LYS	V	303
R	H	NZ	LYS	A	228	L	H	CE	LYS	V	303
R	H	NZ	LYS	A	228	L	H	NZ	LYS	V	303
R	H	NZ	LYS	A	228	L	H	HG2	LYS	V	303
R	H	NZ	LYS	A	228	L	H	HG3	LYS	V	303
R	H	NZ	LYS	A	228	L	H	HD2	LYS	V	303
R	H	NZ	LYS	A	228	L	H	HE2	LYS	V	303
R	H	NZ	LYS	A	228	L	H	HE3	LYS	V	303
R	H	NZ	LYS	A	228	L	H	HZ1	LYS	V	303
R	H	NZ	LYS	A	228	L	H	HZ2	LYS	V	303
R	H	NZ	LYS	A	228	L	H	HZ3	LYS	V	303
R	H	NZ	LYS	A	228	L	H	OD2	ASP	V	307
R	H	NZ	LYS	A	228	L	H	HB3	ASP	V	307
R	H	NE	ARG	A	234	L	-	HB2	PRO	V	34
R	H	NE	ARG	A	234	L	-	HB3	PRO	V	34
R	H	NE	ARG	A	234	L	-	HD2	TYR	V	36
R	H	NE	ARG	A	234	L	-	HE2	TYR	V	36
R	H	NH1	ARG	A	234	L	-	CE2	TYR	V	36
R	H	NH1	ARG	A	234	L	-	HD2	TYR	V	36
R	H	NH1	ARG	A	234	L	-	HE2	TYR	V	36
R	H	NH2	ARG	A	234	L	-	CG	TYR	V	36
R	H	NH2	ARG	A	234	L	-	CD2	TYR	V	36
R	H	NH2	ARG	A	234	L	-	CE2	TYR	V	36
R	H	NH2	ARG	A	234	L	-	CZ	TYR	V	36
R	H	NH2	ARG	A	234	L	-	HD2	TYR	V	36
R	H	NH2	ARG	A	234	L	-	HE2	TYR	V	36
R	H	CZ	ARG	A	234	L	-	CD2	TYR	V	36
R	H	CZ	ARG	A	234	L	-	CE2	TYR	V	36
R	H	CZ	ARG	A	234	L	-	HD2	TYR	V	36
R	H	CZ	ARG	A	234	L	-	HE2	TYR	V	36
R	H	CG	LYS	A	235	L	-	HB2	MET	V	31
R	H	CG	LYS	A	235	L	-	HE3	MET	V	31
R	H	CD	LYS	A	235	L	-	CE	MET	V	31
R	H	CD	LYS	A	235	L	-	HB2	MET	V	31
R	H	CD	LYS	A	235	L	-	HE1	MET	V	31
R	H	CD	LYS	A	235	L	-	HE2	MET	V	31
R	H	CD	LYS	A	235	L	-	HE3	MET	V	31
R	H	CE	LYS	A	235	L	-	CB	MET	V	31
R	H	CE	LYS	A	235	L	-	CG	MET	V	31
R	H	CE	LYS	A	235	L	-	SD	MET	V	31
R	H	CE	LYS	A	235	L	-	CE	MET	V	31
R	H	CE	LYS	A	235	L	-	HB2	MET	V	31
R	H	CE	LYS	A	235	L	-	HB3	MET	V	31
R	H	CE	LYS	A	235	L	-	HG2	MET	V	31
R	H	CE	LYS	A	235	L	-	HE1	MET	V	31
R	H	CE	LYS	A	235	L	-	HE2	MET	V	31
R	H	CE	LYS	A	235	L	-	HE3	MET	V	31
R	H	NZ	LYS	A	235	L	-	CB	MET	V	31
R	H	NZ	LYS	A	235	L	-	CG	MET	V	31
R	H	NZ	LYS	A	235	L	-	SD	MET	V	31
R	H	NZ	LYS	A	235	L	-	CE	MET	V	31
R	H	NZ	LYS	A	235	L	-	HB2	MET	V	31
R	H	NZ	LYS	A	235	L	-	HB3	MET	V	31
R	H	NZ	LYS	A	235	L	-	HG2	MET	V	31
R	H	NZ	LYS	A	235	L	-	HE1	MET	V	31
R	H	NZ	LYS	A	235	L	-	HE2	MET	V	31
R	H	NZ	LYS	A	235	L	-	HE3	MET	V	31
R	-	CA	SER	A	238	L	-	O	THR	V	33
R	-	CB	SER	A	238	L	-	C	THR	V	33
R	-	CB	SER	A	238	L	-	O	THR	V	33
R	-	CB	SER	A	238	L	-	HG1	THR	V	33
R	-	CB	SER	A	238	L	-	HA	PRO	V	34
R	-	OG	SER	A	238	L	-	O	THR	V	33
R	-	OG	SER	A	238	L	-	HG1	THR	V	33
R	-	O	VAL	A	239	L	-	CD1	LEU	V	35
R	-	O	VAL	A	239	L	-	HD11	LEU	V	35
R	-	O	VAL	A	239	L	-	HD12	LEU	V	35
R	-	CG2	THR	A	265	L	-	HD12	LEU	V	35
R	-	CG2	THR	A	265	L	-	HD23	LEU	V	35
R	-	C	VAL	A	266	L	-	HD21	LEU	V	35
R	-	C	VAL	A	266	L	-	HD23	LEU	V	35
R	-	O	VAL	A	266	L	-	CD2	LEU	V	35
R	-	O	VAL	A	266	L	-	HD21	LEU	V	35
R	-	O	VAL	A	266	L	-	HD22	LEU	V	35
R	-	O	VAL	A	266	L	-	HD23	LEU	V	35
R	-	N	THR	A	267	L	-	HD21	LEU	V	35
R	-	N	THR	A	267	L	-	HD23	LEU	V	35
R	-	CA	THR	A	267	L	-	CD2	LEU	V	35
R	-	CA	THR	A	267	L	-	HA	LEU	V	35
R	-	CA	THR	A	267	L	-	HG	LEU	V	35
R	-	CA	THR	A	267	L	-	HD21	LEU	V	35
R	-	CA	THR	A	267	L	-	HD23	LEU	V	35
R	-	C	THR	A	267	L	-	HA	LEU	V	35
R	-	C	THR	A	267	L	-	HD21	LEU	V	35
R	-	CG2	THR	A	267	L	-	HG	LEU	V	35
R	-	N	PHE	A	268	L	-	HA	LEU	V	35
R	-	N	PHE	A	268	L	-	HD21	LEU	V	35
R	-	N	PHE	A	268	L	-	O	TYR	V	36
R	-	N	PHE	A	268	L	-	H	TYR	V	36
R	-	CA	PHE	A	268	L	-	HA	LEU	V	35
R	-	CA	PHE	A	268	L	-	N	TYR	V	36
R	-	CA	PHE	A	268	L	-	C	TYR	V	36
R	-	CA	PHE	A	268	L	-	O	TYR	V	36
R	-	CA	PHE	A	268	L	-	H	TYR	V	36
R	-	CA	PHE	A	268	L	-	HA	PRO	V	37
R	-	C	PHE	A	268	L	-	O	PRO	V	34
R	-	C	PHE	A	268	L	-	HA	LEU	V	35
R	-	C	PHE	A	268	L	-	N	TYR	V	36
R	-	C	PHE	A	268	L	-	CA	TYR	V	36
R	-	C	PHE	A	268	L	-	C	TYR	V	36
R	-	C	PHE	A	268	L	-	CB	TYR	V	36
R	-	C	PHE	A	268	L	-	O	TYR	V	36
R	-	C	PHE	A	268	L	-	H	TYR	V	36
R	-	C	PHE	A	268	L	-	HB2	TYR	V	36
R	-	C	PHE	A	268	L	-	HB3	TYR	V	36
R	-	CB	PHE	A	268	L	-	N	TYR	V	36
R	-	CB	PHE	A	268	L	-	CA	TYR	V	36
R	-	CB	PHE	A	268	L	-	C	TYR	V	36
R	-	CB	PHE	A	268	L	-	O	TYR	V	36
R	-	CB	PHE	A	268	L	-	H	TYR	V	36
R	-	CB	PHE	A	268	L	-	N	PRO	V	37
R	-	CB	PHE	A	268	L	-	CA	PRO	V	37
R	-	CB	PHE	A	268	L	-	HA	PRO	V	37
R	-	CB	PHE	A	268	L	-	H	ALA	V	38
R	-	O	PHE	A	268	L	-	C	PRO	V	34
R	-	O	PHE	A	268	L	-	O	PRO	V	34
R	-	O	PHE	A	268	L	-	CA	LEU	V	35
R	-	O	PHE	A	268	L	-	C	LEU	V	35
R	-	O	PHE	A	268	L	-	HA	LEU	V	35
R	-	O	PHE	A	268	L	-	N	TYR	V	36
R	-	O	PHE	A	268	L	-	CA	TYR	V	36
R	-	O	PHE	A	268	L	-	C	TYR	V	36
R	-	O	PHE	A	268	L	-	CB	TYR	V	36
R	-	O	PHE	A	268	L	-	O	TYR	V	36
R	-	O	PHE	A	268	L	-	H	TYR	V	36
R	-	O	PHE	A	268	L	-	HA	TYR	V	36
R	-	O	PHE	A	268	L	-	HB2	TYR	V	36
R	-	O	PHE	A	268	L	-	HB3	TYR	V	36
R	-	O	PHE	A	268	L	-	N	PRO	V	37
R	-	CG	PHE	A	268	L	-	C	TYR	V	36
R	-	CG	PHE	A	268	L	-	O	TYR	V	36
R	-	CG	PHE	A	268	L	-	N	PRO	V	37
R	-	CG	PHE	A	268	L	-	CA	PRO	V	37
R	-	CG	PHE	A	268	L	-	HA	PRO	V	37
R	-	CG	PHE	A	268	L	-	N	ALA	V	38
R	-	CG	PHE	A	268	L	-	H	ALA	V	38
R	-	CD1	PHE	A	268	L	-	O	TYR	V	36
R	-	CD1	PHE	A	268	L	-	HA	PRO	V	37
R	-	CD1	PHE	A	268	L	-	N	ALA	V	38
R	-	CD1	PHE	A	268	L	-	H	ALA	V	38
R	-	CD2	PHE	A	268	L	-	CA	PRO	V	37
R	-	CD2	PHE	A	268	L	-	HA	PRO	V	37
R	-	CD2	PHE	A	268	L	-	HB3	PRO	V	37
R	-	CE1	PHE	A	268	L	-	HA	PRO	V	37
R	-	CE1	PHE	A	268	L	-	O	ALA	V	38
R	-	CE1	PHE	A	268	L	-	H	ALA	V	38
R	-	CE2	PHE	A	268	L	-	HA	PRO	V	37
R	-	N	GLN	A	269	L	-	O	TYR	V	36
R	-	N	GLN	A	269	L	-	H	TYR	V	36
R	-	N	GLN	A	269	L	-	HB3	TYR	V	36
R	-	CA	GLN	A	269	L	-	H	TYR	V	36
R	-	CA	GLN	A	269	L	-	HB3	TYR	V	36
R	-	C	GLN	A	269	L	-	O	PRO	V	34
R	-	C	GLN	A	269	L	-	HG2	PRO	V	34
R	-	C	GLN	A	269	L	-	H	TYR	V	36
R	-	C	GLN	A	269	L	-	HB2	TYR	V	36
R	-	C	GLN	A	269	L	-	HB3	TYR	V	36
R	-	CB	GLN	A	269	L	-	CB	TYR	V	36
R	-	CB	GLN	A	269	L	-	HB2	TYR	V	36
R	-	CB	GLN	A	269	L	-	HB3	TYR	V	36
R	-	O	GLN	A	269	L	-	O	PRO	V	34
R	-	O	GLN	A	269	L	-	HB2	PRO	V	34
R	-	O	GLN	A	269	L	-	HG2	PRO	V	34
R	-	O	GLN	A	269	L	-	CB	TYR	V	36
R	-	O	GLN	A	269	L	-	H	TYR	V	36
R	-	O	GLN	A	269	L	-	HB2	TYR	V	36
R	-	O	GLN	A	269	L	-	HB3	TYR	V	36
R	-	CD	GLN	A	269	L	-	HB2	ALA	V	38
R	-	OE1	GLN	A	269	L	-	CB	ALA	V	38
R	-	OE1	GLN	A	269	L	-	HB2	ALA	V	38
R	-	OE1	GLN	A	269	L	-	HB3	ALA	V	38
R	H	N	PRO	A	270	L	-	O	PRO	V	34
R	H	N	PRO	A	270	L	-	HG2	PRO	V	34
R	H	N	PRO	A	270	L	-	HD3	PRO	V	34
R	H	CA	PRO	A	270	L	-	O	PRO	V	34
R	H	CA	PRO	A	270	L	-	CG	PRO	V	34
R	H	CA	PRO	A	270	L	-	CD	PRO	V	34
R	H	CA	PRO	A	270	L	-	HG2	PRO	V	34
R	H	CA	PRO	A	270	L	-	HG3	PRO	V	34
R	H	CA	PRO	A	270	L	-	HD3	PRO	V	34
R	H	C	PRO	A	270	L	-	HG2	PRO	V	34
R	H	CB	PRO	A	270	L	-	HA	THR	V	33
R	H	CB	PRO	A	270	L	-	CD	PRO	V	34
R	H	CB	PRO	A	270	L	-	HG2	PRO	V	34
R	H	CB	PRO	A	270	L	-	HD3	PRO	V	34
R	H	O	PRO	A	270	L	-	HG2	PRO	V	34
R	H	O	PRO	A	270	L	-	HG3	PRO	V	34
R	H	CG	PRO	A	270	L	-	HD3	PRO	V	34
R	H	CB	ASP	A	273	L	-	CB	PRO	V	34
R	H	CB	ASP	A	273	L	-	CG	PRO	V	34
R	H	CB	ASP	A	273	L	-	HB2	PRO	V	34
R	H	CB	ASP	A	273	L	-	HB3	PRO	V	34
R	H	CB	ASP	A	273	L	-	HG2	PRO	V	34
R	H	CB	ASP	A	273	L	-	HG3	PRO	V	34
R	H	CG	ASP	A	273	L	-	CB	PRO	V	34
R	H	CG	ASP	A	273	L	-	CG	PRO	V	34
R	H	CG	ASP	A	273	L	-	HB2	PRO	V	34
R	H	CG	ASP	A	273	L	-	HB3	PRO	V	34
R	H	CG	ASP	A	273	L	-	HG2	PRO	V	34
R	H	CG	ASP	A	273	L	-	HG3	PRO	V	34
R	H	CG	ASP	A	273	L	-	CD2	TYR	V	36
R	H	CG	ASP	A	273	L	-	HB2	TYR	V	36
R	H	CG	ASP	A	273	L	-	HD2	TYR	V	36
R	H	OD1	ASP	A	273	L	-	HB2	PRO	V	34
R	H	OD1	ASP	A	273	L	-	CB	TYR	V	36
R	H	OD1	ASP	A	273	L	-	CG	TYR	V	36
R	H	OD1	ASP	A	273	L	-	CD2	TYR	V	36
R	H	OD1	ASP	A	273	L	-	CE2	TYR	V	36
R	H	OD1	ASP	A	273	L	-	HB2	TYR	V	36
R	H	OD1	ASP	A	273	L	-	HD2	TYR	V	36
R	H	OD1	ASP	A	273	L	-	HE2	TYR	V	36
R	H	OD2	ASP	A	273	L	-	CA	PRO	V	34
R	H	OD2	ASP	A	273	L	-	CB	PRO	V	34
R	H	OD2	ASP	A	273	L	-	O	PRO	V	34
R	H	OD2	ASP	A	273	L	-	CG	PRO	V	34
R	H	OD2	ASP	A	273	L	-	HB2	PRO	V	34
R	H	OD2	ASP	A	273	L	-	HB3	PRO	V	34
R	H	OD2	ASP	A	273	L	-	HG2	PRO	V	34
R	H	OD2	ASP	A	273	L	-	HG3	PRO	V	34
R	H	OD2	ASP	A	273	L	-	CB	TYR	V	36
R	H	OD2	ASP	A	273	L	-	CD2	TYR	V	36
R	H	OD2	ASP	A	273	L	-	HB2	TYR	V	36
R	H	OD2	ASP	A	273	L	-	HD2	TYR	V	36
R	H	CA	THR	A	274	L	-	HZ1	LYS	V	32
R	H	CB	THR	A	274	L	-	HE2	LYS	V	32
R	H	CB	THR	A	274	L	-	HE3	LYS	V	32
R	H	CB	THR	A	274	L	-	HZ1	LYS	V	32
R	H	CG2	THR	A	274	L	-	CE	LYS	V	32
R	H	CG2	THR	A	274	L	-	NZ	LYS	V	32
R	H	CG2	THR	A	274	L	-	HE2	LYS	V	32
R	H	CG2	THR	A	274	L	-	HE3	LYS	V	32
R	H	CG2	THR	A	274	L	-	HZ1	LYS	V	32
R	H	CG2	THR	A	274	L	-	HZ2	LYS	V	32
R	H	CG2	THR	A	274	L	-	HZ3	LYS	V	32
R	H	CD	ARG	A	276	L	-	HH	TYR	V	36
R	H	NE	ARG	A	276	L	-	OH	TYR	V	36
R	H	NE	ARG	A	276	L	-	HH	TYR	V	36
R	H	NH1	ARG	A	276	L	-	CE2	TYR	V	36
R	H	NH1	ARG	A	276	L	-	OH	TYR	V	36
R	H	NH1	ARG	A	276	L	-	CZ	TYR	V	36
R	H	NH1	ARG	A	276	L	-	HE2	TYR	V	36
R	H	NH1	ARG	A	276	L	-	HH	TYR	V	36
R	H	NH2	ARG	A	276	L	-	CE1	TYR	V	36
R	H	NH2	ARG	A	276	L	-	OH	TYR	V	36
R	H	NH2	ARG	A	276	L	-	CZ	TYR	V	36
R	H	NH2	ARG	A	276	L	-	HE1	TYR	V	36
R	H	NH2	ARG	A	276	L	-	HH	TYR	V	36
R	H	CZ	ARG	A	276	L	-	OH	TYR	V	36
R	H	CZ	ARG	A	276	L	-	CZ	TYR	V	36
R	H	CZ	ARG	A	276	L	-	HH	TYR	V	36
R	H	CD	GLU	A	277	L	-	HZ2	LYS	V	32
R	H	OE2	GLU	A	277	L	-	NZ	LYS	V	32
R	H	OE2	GLU	A	277	L	-	HZ1	LYS	V	32
R	H	OE2	GLU	A	277	L	-	HZ2	LYS	V	32
R	H	OE2	GLU	A	277	L	-	HZ3	LYS	V	32
R	H	CA	GLY	A	288	L	H	CE1	HIS	V	295
R	H	CA	GLY	A	288	L	H	HE1	HIS	V	295
R	H	CA	GLY	A	288	L	H	CE	MET	V	299
R	H	CA	GLY	A	288	L	H	HE1	MET	V	299
R	H	CA	GLY	A	288	L	H	HE2	MET	V	299
R	H	C	GLY	A	288	L	H	CE1	HIS	V	295
R	H	C	GLY	A	288	L	H	NE2	HIS	V	295
R	H	C	GLY	A	288	L	H	HE1	HIS	V	295
R	H	C	GLY	A	288	L	H	HE2	HIS	V	295
R	H	C	GLY	A	288	L	H	HE2	MET	V	299
R	H	O	GLY	A	288	L	H	CE1	HIS	V	295
R	H	O	GLY	A	288	L	H	NE2	HIS	V	295
R	H	O	GLY	A	288	L	H	HE1	HIS	V	295
R	H	O	GLY	A	288	L	H	HE2	HIS	V	295
R	H	O	GLY	A	288	L	H	HE2	MET	V	299
R	H	N	ILE	A	289	L	H	CE1	HIS	V	295
R	H	N	ILE	A	289	L	H	NE2	HIS	V	295
R	H	N	ILE	A	289	L	H	HE1	HIS	V	295
R	H	N	ILE	A	289	L	H	HE2	HIS	V	295
R	H	CA	ILE	A	289	L	H	CE1	HIS	V	295
R	H	CA	ILE	A	289	L	H	NE2	HIS	V	295
R	H	CA	ILE	A	289	L	H	HE1	HIS	V	295
R	H	CA	ILE	A	289	L	H	HE2	HIS	V	295
R	H	C	ILE	A	289	L	H	HE2	HIS	V	295
R	H	CB	ILE	A	289	L	H	HE1	HIS	V	295
R	H	O	ILE	A	289	L	H	HE2	HIS	V	295
R	H	CG1	ILE	A	289	L	H	HH2	TRP	V	291
R	H	CG1	ILE	A	289	L	H	ND1	HIS	V	295
R	H	CG1	ILE	A	289	L	H	CE1	HIS	V	295
R	H	CG1	ILE	A	289	L	H	HE1	HIS	V	295
R	H	CG2	ILE	A	289	L	H	HH2	TRP	V	291
R	H	CG2	ILE	A	289	L	H	HZ2	TRP	V	291
R	H	CD1	ILE	A	289	L	H	HH2	TRP	V	291
R	H	N	GLY	A	292	L	H	HE2	HIS	V	295
R	H	CA	GLY	A	292	L	H	NE2	HIS	V	295
R	H	CA	GLY	A	292	L	H	HE2	HIS	V	295
R	H	C	GLY	A	292	L	H	HE2	HIS	V	295
R	H	N	VAL	A	293	L	H	HE2	HIS	V	295
R	H	CG2	VAL	A	293	L	H	HZ2	TRP	V	291
R	H	CD1	LEU	A	296	L	H	HE1	TRP	V	291
R	H	CD1	ILE	A	318	L	H	HZ3	LYS	V	253
R	H	CH2	TRP	A	319	L	H	CE2	PHE	V	249
R	H	CH2	TRP	A	319	L	H	HE2	PHE	V	249
R	H	CZ2	TRP	A	319	L	H	HE2	PHE	V	249
R	H	CZ3	TRP	A	319	L	H	CE2	PHE	V	249
R	H	CZ3	TRP	A	319	L	H	HE2	PHE	V	249
R	H	CA	ILE	A	322	L	H	HE2	LYS	V	253
R	H	CB	ILE	A	322	L	H	HE2	LYS	V	253
R	H	CG1	ILE	A	322	L	H	HZ	PHE	V	249
R	H	CG1	ILE	A	322	L	H	CD	LYS	V	253
R	H	CG1	ILE	A	322	L	H	CE	LYS	V	253
R	H	CG1	ILE	A	322	L	H	NZ	LYS	V	253
R	H	CG1	ILE	A	322	L	H	HG3	LYS	V	253
R	H	CG1	ILE	A	322	L	H	HD2	LYS	V	253
R	H	CG1	ILE	A	322	L	H	HE2	LYS	V	253
R	H	CG1	ILE	A	322	L	H	HZ1	LYS	V	253
R	H	CG1	ILE	A	322	L	H	HZ3	LYS	V	253
R	H	CG2	ILE	A	322	L	H	HG3	LYS	V	253
R	H	CD1	ILE	A	322	L	H	CZ	PHE	V	249
R	H	CD1	ILE	A	322	L	H	HE2	PHE	V	249
R	H	CD1	ILE	A	322	L	H	HZ	PHE	V	249
R	H	CD1	ILE	A	322	L	H	HD2	LYS	V	253
R	H	CD1	ILE	A	322	L	H	HE2	LYS	V	253
R	H	CD1	ILE	A	322	L	H	HZ3	LYS	V	253
R	H	CB	TRP	A	325	L	H	HE21	GLN	V	257
R	H	O	TRP	A	325	L	H	HG3	GLN	V	257
R	H	CB	LEU	A	326	L	H	HB3	GLU	V	256
R	H	CG	LEU	A	326	L	H	HB3	GLU	V	256
R	H	CD1	LEU	A	326	L	H	CA	GLU	V	256
R	H	CD1	LEU	A	326	L	H	C	GLU	V	256
R	H	CD1	LEU	A	326	L	H	CB	GLU	V	256
R	H	CD1	LEU	A	326	L	H	O	GLU	V	256
R	H	CD1	LEU	A	326	L	H	CG	GLU	V	256
R	H	CD1	LEU	A	326	L	H	OE2	GLU	V	256
R	H	CD1	LEU	A	326	L	H	HB2	GLU	V	256
R	H	CD1	LEU	A	326	L	H	HB3	GLU	V	256
R	H	CD1	LEU	A	326	L	H	HG3	GLU	V	256
R	H	CD2	LEU	A	326	L	H	OE2	GLU	V	256
R	H	CD2	LEU	A	326	L	H	HB3	GLU	V	256
R	H	CB	SER	A	329	L	H	O	GLN	V	257
R	H	CB	SER	A	329	L	H	HA	GLN	V	257
R	H	OG	SER	A	329	L	H	CA	GLN	V	257
R	H	OG	SER	A	329	L	H	O	GLN	V	257
R	H	OG	SER	A	329	L	H	HA	GLN	V	257
R	H	OG	SER	A	329	L	H	HB3	GLN	V	257
R	H	OG	SER	A	329	L	H	HG3	GLN	V	257
R	H	CE1	PHE	A	332	L	-	HB	THR	V	258
R	H	CD1	PHE	A	333	L	-	HG2	LYS	V	259
R	H	CE1	PHE	A	333	L	H	O	GLN	V	257
R	H	CE1	PHE	A	333	L	-	HA	THR	V	258
R	H	CE1	PHE	A	333	L	-	N	LYS	V	259
R	H	CE1	PHE	A	333	L	-	CG	LYS	V	259
R	H	CE1	PHE	A	333	L	-	H	LYS	V	259
R	H	CE1	PHE	A	333	L	-	HG2	LYS	V	259
R	H	CE1	PHE	A	333	L	-	HG3	LYS	V	259
R	H	CE1	PHE	A	333	L	-	HZ2	LYS	V	259
R	H	CE2	PHE	A	333	L	H	O	GLU	V	256
R	H	CE2	PHE	A	333	L	H	C	GLN	V	257
R	H	CE2	PHE	A	333	L	H	O	GLN	V	257
R	H	CE2	PHE	A	333	L	-	HA	THR	V	258
R	H	CE2	PHE	A	333	L	-	NZ	LYS	V	259
R	H	CE2	PHE	A	333	L	-	HG2	LYS	V	259
R	H	CE2	PHE	A	333	L	-	HZ2	LYS	V	259
R	H	CZ	PHE	A	333	L	H	O	GLU	V	256
R	H	CZ	PHE	A	333	L	H	C	GLN	V	257
R	H	CZ	PHE	A	333	L	H	O	GLN	V	257
R	H	CZ	PHE	A	333	L	-	N	THR	V	258
R	H	CZ	PHE	A	333	L	-	CA	THR	V	258
R	H	CZ	PHE	A	333	L	-	HA	THR	V	258
R	H	CZ	PHE	A	333	L	-	N	LYS	V	259
R	H	CZ	PHE	A	333	L	-	CG	LYS	V	259
R	H	CZ	PHE	A	333	L	-	NZ	LYS	V	259
R	H	CZ	PHE	A	333	L	-	H	LYS	V	259
R	H	CZ	PHE	A	333	L	-	HG2	LYS	V	259
R	H	CZ	PHE	A	333	L	-	HZ2	LYS	V	259

- 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