IID

O76002_A6NKK0.1 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	PHE	A	102	L	H	LEU	V	235
R	H	PHE	A	102	L	H	PHE	V	239
R	H	SER	A	103	L	H	PHE	V	239
R	H	ILE	A	106	L	H	PHE	V	239
R	H	TYR	A	149	L	H	GLN	V	236
R	H	ILE	A	153	L	H	THR	V	232
R	H	ILE	A	153	L	H	LEU	V	235
R	H	ILE	A	153	L	H	GLN	V	236
R	H	LEU	A	157	L	H	LEU	V	235
R	H	GLU	A	160	L	H	LEU	V	227
R	H	PHE	A	164	L	H	LEU	V	227
R	H	ILE	A	25	L	-	GLN	V	262
R	H	ILE	A	25	L	H	GLN	V	271
R	H	PHE	A	28	L	H	ILE	V	254
R	H	PHE	A	28	L	H	CYS	V	258
R	H	LEU	A	29	L	H	GLN	V	271
R	H	HIS	A	308	L	H	THR	V	41
R	-	SER	A	312	L	H	LEU	V	37
R	-	SER	A	312	L	H	THR	V	41
R	H	LEU	A	32	L	H	PHE	V	278
R	H	VAL	A	33	L	H	PHE	V	278
R	H	TYR	A	35	L	H	MET	V	247
R	H	TYR	A	35	L	H	LEU	V	251
R	H	LEU	A	36	L	H	LEU	V	251
R	H	LEU	A	36	L	H	PHE	V	278
R	H	LEU	A	36	L	H	VAL	V	282
R	H	LEU	A	36	L	H	LEU	V	286
R	H	ILE	A	39	L	H	MET	V	247
R	H	ILE	A	39	L	H	LEU	V	286
R	H	ILE	A	39	L	-	ARG	V	294
R	H	MET	A	40	L	H	LEU	V	286
R	H	MET	A	40	L	H	PHE	V	35
R	H	LEU	A	43	L	H	MET	V	247
R	H	LEU	A	43	L	H	LEU	V	289
R	H	LEU	A	43	L	H	ILE	V	290
R	H	LEU	A	43	L	H	LEU	V	293
R	H	LEU	A	43	L	-	ARG	V	294
R	H	ILE	A	46	L	H	LEU	V	293
R	H	ILE	A	46	L	H	LYS	V	299
R	H	ALA	A	47	L	H	LEU	V	293
R	H	TRP	A	50	L	H	LEU	V	293
R	H	TRP	A	50	L	H	LYS	V	299
R	H	TRP	A	50	L	H	ALA	V	302
R	H	TRP	A	50	L	H	LYS	V	303
R	H	TRP	A	50	L	-	TRP	V	308
R	H	LYS	A	51	L	-	TRP	V	308
R	H	PHE	A	68	L	-	ARG	V	294
R	H	ALA	A	71	L	-	ARG	V	294
R	H	TRP	A	72	L	H	PHE	V	239
R	H	TRP	A	72	L	-	ARG	V	294
R	H	SER	A	75	L	H	MET	V	247
R	H	SER	A	75	L	-	ARG	V	294
R	H	PRO	A	79	L	H	SER	V	250
R	H	PRO	A	79	L	H	ILE	V	254
R	H	LEU	A	82	L	H	ILE	V	254
R	H	ASN	A	83	L	H	ILE	V	254
R	H	ASN	A	83	L	H	MET	V	257
R	-	LEU	A	86	L	H	ILE	V	254
R	-	LEU	A	86	L	H	CYS	V	258
R	H	SER	A	95	L	H	GLY	V	220
R	H	SER	A	95	L	H	ALA	V	223
R	H	GLU	A	96	L	H	LEU	V	216
R	H	LYS	A	98	L	H	LEU	V	227
R	H	ILE	A	99	L	H	ALA	V	223
R	H	ILE	A	99	L	H	PHE	V	239

- 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_A6NKK0.1 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	CB	ILE	A	25	L	H	HE22	GLN	V	271
R	H	CG1	ILE	A	25	L	-	HE22	GLN	V	262
R	H	CG1	ILE	A	25	L	H	HE22	GLN	V	271
R	H	CG2	ILE	A	25	L	H	CD	GLN	V	271
R	H	CG2	ILE	A	25	L	H	NE2	GLN	V	271
R	H	CG2	ILE	A	25	L	H	OE1	GLN	V	271
R	H	CG2	ILE	A	25	L	H	HE21	GLN	V	271
R	H	CG2	ILE	A	25	L	H	HE22	GLN	V	271
R	H	CD1	ILE	A	25	L	-	NE2	GLN	V	262
R	H	CD1	ILE	A	25	L	-	HE21	GLN	V	262
R	H	CD1	ILE	A	25	L	-	HE22	GLN	V	262
R	H	CD1	ILE	A	25	L	H	NE2	GLN	V	271
R	H	CD1	ILE	A	25	L	H	HE22	GLN	V	271
R	H	CE1	PHE	A	28	L	H	SG	CYS	V	258
R	H	CE2	PHE	A	28	L	H	CG2	ILE	V	254
R	H	CE2	PHE	A	28	L	H	HG21	ILE	V	254
R	H	CE2	PHE	A	28	L	H	HG22	ILE	V	254
R	H	CE2	PHE	A	28	L	H	HG23	ILE	V	254
R	H	CZ	PHE	A	28	L	H	CG2	ILE	V	254
R	H	CZ	PHE	A	28	L	H	HG21	ILE	V	254
R	H	CZ	PHE	A	28	L	H	HG22	ILE	V	254
R	H	CZ	PHE	A	28	L	H	HG23	ILE	V	254
R	H	CZ	PHE	A	28	L	H	SG	CYS	V	258
R	H	CZ	PHE	A	28	L	H	HG	CYS	V	258
R	H	CD1	LEU	A	29	L	H	HG3	GLN	V	271
R	H	O	LEU	A	32	L	H	HE1	PHE	V	278
R	H	CG	LEU	A	32	L	H	CE1	PHE	V	278
R	H	CG	LEU	A	32	L	H	CZ	PHE	V	278
R	H	CG	LEU	A	32	L	H	HE1	PHE	V	278
R	H	CG	LEU	A	32	L	H	HZ	PHE	V	278
R	H	CD1	LEU	A	32	L	H	CE1	PHE	V	278
R	H	CD1	LEU	A	32	L	H	HE1	PHE	V	278
R	H	CD2	LEU	A	32	L	H	CG	PHE	V	278
R	H	CD2	LEU	A	32	L	H	CD1	PHE	V	278
R	H	CD2	LEU	A	32	L	H	CD2	PHE	V	278
R	H	CD2	LEU	A	32	L	H	CE1	PHE	V	278
R	H	CD2	LEU	A	32	L	H	CE2	PHE	V	278
R	H	CD2	LEU	A	32	L	H	CZ	PHE	V	278
R	H	CD2	LEU	A	32	L	H	HE2	PHE	V	278
R	H	CD2	LEU	A	32	L	H	HZ	PHE	V	278
R	H	N	VAL	A	33	L	H	HZ	PHE	V	278
R	H	CA	VAL	A	33	L	H	HZ	PHE	V	278
R	H	CG2	VAL	A	33	L	H	HZ	PHE	V	278
R	H	CD1	TYR	A	35	L	H	HD23	LEU	V	251
R	H	CE1	TYR	A	35	L	H	CD2	LEU	V	251
R	H	CE1	TYR	A	35	L	H	HD21	LEU	V	251
R	H	CE1	TYR	A	35	L	H	HD23	LEU	V	251
R	H	OH	TYR	A	35	L	H	CG	MET	V	247
R	H	OH	TYR	A	35	L	H	SD	MET	V	247
R	H	OH	TYR	A	35	L	H	HG2	MET	V	247
R	H	OH	TYR	A	35	L	H	HG3	MET	V	247
R	H	CZ	TYR	A	35	L	H	HG2	MET	V	247
R	H	CZ	TYR	A	35	L	H	HD23	LEU	V	251
R	H	CB	LEU	A	36	L	H	HE1	PHE	V	278
R	H	CG	LEU	A	36	L	H	CE1	PHE	V	278
R	H	CG	LEU	A	36	L	H	HD1	PHE	V	278
R	H	CG	LEU	A	36	L	H	HE1	PHE	V	278
R	H	CG	LEU	A	36	L	H	HG12	VAL	V	282
R	H	CD1	LEU	A	36	L	H	CD1	PHE	V	278
R	H	CD1	LEU	A	36	L	H	CE1	PHE	V	278
R	H	CD1	LEU	A	36	L	H	CZ	PHE	V	278
R	H	CD1	LEU	A	36	L	H	HD1	PHE	V	278
R	H	CD1	LEU	A	36	L	H	HE1	PHE	V	278
R	H	CD1	LEU	A	36	L	H	HZ	PHE	V	278
R	H	CD1	LEU	A	36	L	H	CG1	VAL	V	282
R	H	CD1	LEU	A	36	L	H	HG12	VAL	V	282
R	H	CD1	LEU	A	36	L	H	HG23	VAL	V	282
R	H	CD2	LEU	A	36	L	H	CD2	LEU	V	251
R	H	CD2	LEU	A	36	L	H	HD22	LEU	V	251
R	H	CD2	LEU	A	36	L	H	HD23	LEU	V	251
R	H	CD2	LEU	A	36	L	H	HD1	PHE	V	278
R	H	CD2	LEU	A	36	L	H	HE1	PHE	V	278
R	H	CD2	LEU	A	36	L	H	CG1	VAL	V	282
R	H	CD2	LEU	A	36	L	H	HG11	VAL	V	282
R	H	CD2	LEU	A	36	L	H	HG12	VAL	V	282
R	H	CD2	LEU	A	36	L	H	HG13	VAL	V	282
R	H	CD2	LEU	A	36	L	H	CD1	LEU	V	286
R	H	CD2	LEU	A	36	L	H	HD11	LEU	V	286
R	H	CD2	LEU	A	36	L	H	HD12	LEU	V	286
R	H	CG2	ILE	A	39	L	H	HE3	MET	V	247
R	H	CG2	ILE	A	39	L	H	HD13	LEU	V	286
R	H	CG2	ILE	A	39	L	H	HD22	LEU	V	286
R	H	CD1	ILE	A	39	L	-	HH22	ARG	V	294
R	H	CG	MET	A	40	L	H	CD2	LEU	V	286
R	H	CG	MET	A	40	L	H	HD22	LEU	V	286
R	H	CG	MET	A	40	L	H	HD23	LEU	V	286
R	H	SD	MET	A	40	L	H	CE1	PHE	V	35
R	H	SD	MET	A	40	L	H	CZ	PHE	V	35
R	H	SD	MET	A	40	L	H	HE1	PHE	V	35
R	H	SD	MET	A	40	L	H	HZ	PHE	V	35
R	H	SD	MET	A	40	L	H	HD23	LEU	V	286
R	H	CE	MET	A	40	L	H	CE1	PHE	V	35
R	H	CE	MET	A	40	L	H	CZ	PHE	V	35
R	H	CE	MET	A	40	L	H	HE1	PHE	V	35
R	H	CE	MET	A	40	L	H	HZ	PHE	V	35
R	H	CA	LEU	A	43	L	H	HD11	LEU	V	293
R	H	CA	LEU	A	43	L	H	HD12	LEU	V	293
R	H	C	LEU	A	43	L	H	CD1	LEU	V	293
R	H	C	LEU	A	43	L	H	HD11	LEU	V	293
R	H	C	LEU	A	43	L	H	HD12	LEU	V	293
R	H	C	LEU	A	43	L	H	HD13	LEU	V	293
R	H	CB	LEU	A	43	L	H	HB3	LEU	V	289
R	H	CB	LEU	A	43	L	H	HD12	LEU	V	289
R	H	CB	LEU	A	43	L	H	CD1	LEU	V	293
R	H	CB	LEU	A	43	L	H	HD11	LEU	V	293
R	H	CB	LEU	A	43	L	H	HD12	LEU	V	293
R	H	O	LEU	A	43	L	H	CD1	LEU	V	293
R	H	O	LEU	A	43	L	H	HD11	LEU	V	293
R	H	O	LEU	A	43	L	H	HD12	LEU	V	293
R	H	O	LEU	A	43	L	H	HD13	LEU	V	293
R	H	CG	LEU	A	43	L	H	HD11	LEU	V	293
R	H	CD1	LEU	A	43	L	H	HE1	MET	V	247
R	H	CD1	LEU	A	43	L	H	HB2	LEU	V	289
R	H	CD1	LEU	A	43	L	H	HB3	LEU	V	289
R	H	CD1	LEU	A	43	L	H	HA	ILE	V	290
R	H	CD1	LEU	A	43	L	H	HG12	ILE	V	290
R	H	CD1	LEU	A	43	L	H	HG13	ILE	V	290
R	H	CD1	LEU	A	43	L	H	HD11	LEU	V	293
R	H	CD2	LEU	A	43	L	H	HB2	LEU	V	293
R	H	CD2	LEU	A	43	L	H	HD11	LEU	V	293
R	H	CD2	LEU	A	43	L	-	NE	ARG	V	294
R	H	CD2	LEU	A	43	L	-	HG3	ARG	V	294
R	H	CD2	LEU	A	43	L	-	HE	ARG	V	294
R	H	CD2	LEU	A	43	L	-	HH21	ARG	V	294
R	H	C	ILE	A	46	L	H	HD23	LEU	V	293
R	H	CG2	ILE	A	46	L	H	HB3	LEU	V	293
R	H	CG2	ILE	A	46	L	H	NZ	LYS	V	299
R	H	CG2	ILE	A	46	L	H	HZ1	LYS	V	299
R	H	CG2	ILE	A	46	L	H	HZ3	LYS	V	299
R	H	N	ALA	A	47	L	H	HD12	LEU	V	293
R	H	N	ALA	A	47	L	H	HD23	LEU	V	293
R	H	CA	ALA	A	47	L	H	CD2	LEU	V	293
R	H	CA	ALA	A	47	L	H	HD12	LEU	V	293
R	H	CA	ALA	A	47	L	H	HD22	LEU	V	293
R	H	CA	ALA	A	47	L	H	HD23	LEU	V	293
R	H	CB	ALA	A	47	L	H	CD1	LEU	V	293
R	H	CB	ALA	A	47	L	H	CD2	LEU	V	293
R	H	CB	ALA	A	47	L	H	HD12	LEU	V	293
R	H	CB	ALA	A	47	L	H	HD13	LEU	V	293
R	H	CB	ALA	A	47	L	H	HD22	LEU	V	293
R	H	CB	ALA	A	47	L	H	HD23	LEU	V	293
R	H	CB	TRP	A	50	L	H	HE2	LYS	V	299
R	H	O	TRP	A	50	L	-	HZ3	TRP	V	308
R	H	CG	TRP	A	50	L	H	HG2	LYS	V	299
R	H	CG	TRP	A	50	L	H	HD3	LYS	V	299
R	H	CG	TRP	A	50	L	H	HE2	LYS	V	299
R	H	CG	TRP	A	50	L	H	HZ3	LYS	V	299
R	H	CD1	TRP	A	50	L	H	CD	LYS	V	299
R	H	CD1	TRP	A	50	L	H	HB2	LYS	V	299
R	H	CD1	TRP	A	50	L	H	HG2	LYS	V	299
R	H	CD1	TRP	A	50	L	H	HD3	LYS	V	299
R	H	CD1	TRP	A	50	L	H	HE2	LYS	V	299
R	H	CD1	TRP	A	50	L	H	HE2	LYS	V	303
R	H	CD2	TRP	A	50	L	H	CG	LYS	V	299
R	H	CD2	TRP	A	50	L	H	CD	LYS	V	299
R	H	CD2	TRP	A	50	L	H	CE	LYS	V	299
R	H	CD2	TRP	A	50	L	H	HB2	LYS	V	299
R	H	CD2	TRP	A	50	L	H	HG2	LYS	V	299
R	H	CD2	TRP	A	50	L	H	HD3	LYS	V	299
R	H	CD2	TRP	A	50	L	H	HE2	LYS	V	299
R	H	CE2	TRP	A	50	L	H	CA	LYS	V	299
R	H	CE2	TRP	A	50	L	H	CB	LYS	V	299
R	H	CE2	TRP	A	50	L	H	CG	LYS	V	299
R	H	CE2	TRP	A	50	L	H	CD	LYS	V	299
R	H	CE2	TRP	A	50	L	H	HA	LYS	V	299
R	H	CE2	TRP	A	50	L	H	HB2	LYS	V	299
R	H	CE2	TRP	A	50	L	H	HG2	LYS	V	299
R	H	CE2	TRP	A	50	L	H	HD3	LYS	V	299
R	H	CE2	TRP	A	50	L	H	HE2	LYS	V	299
R	H	CE2	TRP	A	50	L	H	HE2	LYS	V	303
R	H	CE3	TRP	A	50	L	H	HD21	LEU	V	293
R	H	CE3	TRP	A	50	L	H	HG2	LYS	V	299
R	H	CE3	TRP	A	50	L	H	HE2	LYS	V	299
R	H	NE1	TRP	A	50	L	H	CB	LYS	V	299
R	H	NE1	TRP	A	50	L	H	CG	LYS	V	299
R	H	NE1	TRP	A	50	L	H	CD	LYS	V	299
R	H	NE1	TRP	A	50	L	H	HB2	LYS	V	299
R	H	NE1	TRP	A	50	L	H	HG2	LYS	V	299
R	H	NE1	TRP	A	50	L	H	HD3	LYS	V	299
R	H	NE1	TRP	A	50	L	H	HE2	LYS	V	299
R	H	NE1	TRP	A	50	L	H	CE	LYS	V	303
R	H	NE1	TRP	A	50	L	H	HE2	LYS	V	303
R	H	NE1	TRP	A	50	L	H	HE3	LYS	V	303
R	H	CH2	TRP	A	50	L	H	N	LYS	V	299
R	H	CH2	TRP	A	50	L	H	CA	LYS	V	299
R	H	CH2	TRP	A	50	L	H	C	LYS	V	299
R	H	CH2	TRP	A	50	L	H	CB	LYS	V	299
R	H	CH2	TRP	A	50	L	H	O	LYS	V	299
R	H	CH2	TRP	A	50	L	H	CG	LYS	V	299
R	H	CH2	TRP	A	50	L	H	HA	LYS	V	299
R	H	CH2	TRP	A	50	L	H	HB2	LYS	V	299
R	H	CH2	TRP	A	50	L	H	HG2	LYS	V	299
R	H	CH2	TRP	A	50	L	H	HG3	LYS	V	299
R	H	CH2	TRP	A	50	L	H	CB	ALA	V	302
R	H	CH2	TRP	A	50	L	H	HB1	ALA	V	302
R	H	CH2	TRP	A	50	L	H	HB2	ALA	V	302
R	H	CH2	TRP	A	50	L	H	HB3	ALA	V	302
R	H	CZ2	TRP	A	50	L	H	N	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	CA	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	C	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	CB	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	O	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	CG	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	CD	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	HA	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	HB2	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	HB3	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	HG2	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	HG3	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	HD3	LYS	V	299
R	H	CZ2	TRP	A	50	L	H	CB	ALA	V	302
R	H	CZ2	TRP	A	50	L	H	HB1	ALA	V	302
R	H	CZ2	TRP	A	50	L	H	HG3	LYS	V	303
R	H	CZ3	TRP	A	50	L	H	HD21	LEU	V	293
R	H	CZ3	TRP	A	50	L	H	CG	LYS	V	299
R	H	CZ3	TRP	A	50	L	H	HA	LYS	V	299
R	H	CZ3	TRP	A	50	L	H	HG2	LYS	V	299
R	H	CZ3	TRP	A	50	L	H	HE2	LYS	V	299
R	H	CZ3	TRP	A	50	L	H	HB1	ALA	V	302
R	H	CA	LYS	A	51	L	-	HH2	TRP	V	308
R	H	CA	LYS	A	51	L	-	HZ3	TRP	V	308
R	H	C	LYS	A	51	L	-	HH2	TRP	V	308
R	H	O	LYS	A	51	L	-	CH2	TRP	V	308
R	H	O	LYS	A	51	L	-	HH2	TRP	V	308
R	H	CD2	PHE	A	68	L	-	HG2	ARG	V	294
R	H	CE2	PHE	A	68	L	-	HG2	ARG	V	294
R	H	CA	ALA	A	71	L	-	NH2	ARG	V	294
R	H	CA	ALA	A	71	L	-	HH21	ARG	V	294
R	H	CA	ALA	A	71	L	-	HH22	ARG	V	294
R	H	C	ALA	A	71	L	-	NH2	ARG	V	294
R	H	C	ALA	A	71	L	-	HH21	ARG	V	294
R	H	C	ALA	A	71	L	-	HH22	ARG	V	294
R	H	CB	ALA	A	71	L	-	NH2	ARG	V	294
R	H	CB	ALA	A	71	L	-	HH21	ARG	V	294
R	H	CB	ALA	A	71	L	-	HH22	ARG	V	294
R	H	O	ALA	A	71	L	-	NH2	ARG	V	294
R	H	O	ALA	A	71	L	-	HH12	ARG	V	294
R	H	O	ALA	A	71	L	-	HH21	ARG	V	294
R	H	O	ALA	A	71	L	-	HH22	ARG	V	294
R	H	N	TRP	A	72	L	-	NH2	ARG	V	294
R	H	N	TRP	A	72	L	-	HH21	ARG	V	294
R	H	N	TRP	A	72	L	-	HH22	ARG	V	294
R	H	CA	TRP	A	72	L	-	HH22	ARG	V	294
R	H	CE2	TRP	A	72	L	H	HB3	PHE	V	239
R	H	CH2	TRP	A	72	L	H	HB3	PHE	V	239
R	H	CZ2	TRP	A	72	L	H	CB	PHE	V	239
R	H	CZ2	TRP	A	72	L	H	CG	PHE	V	239
R	H	CZ2	TRP	A	72	L	H	HB3	PHE	V	239
R	H	CB	SER	A	75	L	H	SD	MET	V	247
R	H	CB	SER	A	75	L	H	HG2	MET	V	247
R	H	CB	SER	A	75	L	-	HH12	ARG	V	294
R	H	CB	SER	A	75	L	-	HH22	ARG	V	294
R	H	OG	SER	A	75	L	H	CG	MET	V	247
R	H	OG	SER	A	75	L	H	SD	MET	V	247
R	H	OG	SER	A	75	L	H	CE	MET	V	247
R	H	OG	SER	A	75	L	H	HG2	MET	V	247
R	H	OG	SER	A	75	L	-	NH1	ARG	V	294
R	H	OG	SER	A	75	L	-	NH2	ARG	V	294
R	H	OG	SER	A	75	L	-	HH12	ARG	V	294
R	H	OG	SER	A	75	L	-	HH22	ARG	V	294
R	H	CA	PRO	A	79	L	H	HD11	ILE	V	254
R	H	C	PRO	A	79	L	H	HD11	ILE	V	254
R	H	CB	PRO	A	79	L	H	CB	SER	V	250
R	H	CB	PRO	A	79	L	H	OG	SER	V	250
R	H	CB	PRO	A	79	L	H	HB2	SER	V	250
R	H	CB	PRO	A	79	L	H	HD11	ILE	V	254
R	H	O	PRO	A	79	L	H	CD1	ILE	V	254
R	H	O	PRO	A	79	L	H	HD11	ILE	V	254
R	H	O	PRO	A	79	L	H	HD13	ILE	V	254
R	H	CG	PRO	A	79	L	H	HB2	SER	V	250
R	H	CB	LEU	A	82	L	H	HG23	ILE	V	254
R	H	CB	LEU	A	82	L	H	HD13	ILE	V	254
R	H	N	ASN	A	83	L	H	HD13	ILE	V	254
R	H	CB	ASN	A	83	L	H	HG12	ILE	V	254
R	H	CG	ASN	A	83	L	H	HE1	MET	V	257
R	H	OD1	ASN	A	83	L	H	HG12	ILE	V	254
R	H	OD1	ASN	A	83	L	H	CE	MET	V	257
R	H	OD1	ASN	A	83	L	H	HE1	MET	V	257
R	H	OD1	ASN	A	83	L	H	HE3	MET	V	257
R	-	CB	LEU	A	86	L	H	SG	CYS	V	258
R	-	CG	LEU	A	86	L	H	HG22	ILE	V	254
R	-	CG	LEU	A	86	L	H	SG	CYS	V	258
R	-	CG	LEU	A	86	L	H	HG	CYS	V	258
R	-	CD1	LEU	A	86	L	H	O	ILE	V	254
R	-	CD1	LEU	A	86	L	H	CG2	ILE	V	254
R	-	CD1	LEU	A	86	L	H	HG21	ILE	V	254
R	-	CD1	LEU	A	86	L	H	HG22	ILE	V	254
R	-	CD1	LEU	A	86	L	H	CB	CYS	V	258
R	-	CD1	LEU	A	86	L	H	SG	CYS	V	258
R	-	CD1	LEU	A	86	L	H	HG	CYS	V	258
R	-	CD2	LEU	A	86	L	H	SG	CYS	V	258
R	-	CD2	LEU	A	86	L	H	HG	CYS	V	258
R	H	C	SER	A	95	L	H	HB1	ALA	V	223
R	H	CB	SER	A	95	L	H	HB1	ALA	V	223
R	H	CB	SER	A	95	L	H	HB2	ALA	V	223
R	H	O	SER	A	95	L	H	HB1	ALA	V	223
R	H	OG	SER	A	95	L	H	HA2	GLY	V	220
R	H	OG	SER	A	95	L	H	HB2	ALA	V	223
R	H	CD	GLU	A	96	L	H	HD22	LEU	V	216
R	H	OE1	GLU	A	96	L	H	CD2	LEU	V	216
R	H	OE1	GLU	A	96	L	H	HD12	LEU	V	216
R	H	OE1	GLU	A	96	L	H	HD22	LEU	V	216
R	H	CB	LYS	A	98	L	H	HD13	LEU	V	227
R	H	CB	LYS	A	98	L	H	HD23	LEU	V	227
R	H	CD	LYS	A	98	L	H	HD12	LEU	V	227
R	H	CD	LYS	A	98	L	H	HD13	LEU	V	227
R	H	CD	LYS	A	98	L	H	HD23	LEU	V	227
R	H	CB	ILE	A	99	L	H	HB1	ALA	V	223
R	H	O	ILE	A	99	L	H	HE1	PHE	V	239
R	H	CG1	ILE	A	99	L	H	CA	ALA	V	223
R	H	CG1	ILE	A	99	L	H	CB	ALA	V	223
R	H	CG1	ILE	A	99	L	H	HA	ALA	V	223
R	H	CG1	ILE	A	99	L	H	HB1	ALA	V	223
R	H	CG1	ILE	A	99	L	H	HB3	ALA	V	223
R	H	CG2	ILE	A	99	L	H	HE1	PHE	V	239
R	H	CD1	ILE	A	99	L	H	N	ALA	V	223
R	H	CD1	ILE	A	99	L	H	CA	ALA	V	223
R	H	CD1	ILE	A	99	L	H	C	ALA	V	223
R	H	CD1	ILE	A	99	L	H	CB	ALA	V	223
R	H	CD1	ILE	A	99	L	H	HA	ALA	V	223
R	H	CD1	ILE	A	99	L	H	HB1	ALA	V	223
R	H	CD1	ILE	A	99	L	H	HB2	ALA	V	223
R	H	CD1	ILE	A	99	L	H	HB3	ALA	V	223
R	H	CB	PHE	A	102	L	H	HZ	PHE	V	239
R	H	CG	PHE	A	102	L	H	HZ	PHE	V	239
R	H	CD1	PHE	A	102	L	H	CE2	PHE	V	239
R	H	CD1	PHE	A	102	L	H	CZ	PHE	V	239
R	H	CD1	PHE	A	102	L	H	HE2	PHE	V	239
R	H	CD1	PHE	A	102	L	H	HZ	PHE	V	239
R	H	CE1	PHE	A	102	L	H	HD12	LEU	V	235
R	H	CE1	PHE	A	102	L	H	HD23	LEU	V	235
R	H	CE1	PHE	A	102	L	H	CE2	PHE	V	239
R	H	CE1	PHE	A	102	L	H	CZ	PHE	V	239
R	H	CE1	PHE	A	102	L	H	HE2	PHE	V	239
R	H	CE1	PHE	A	102	L	H	HZ	PHE	V	239
R	H	CZ	PHE	A	102	L	H	CD1	LEU	V	235
R	H	CZ	PHE	A	102	L	H	HD12	LEU	V	235
R	H	CZ	PHE	A	102	L	H	HD23	LEU	V	235
R	H	CZ	PHE	A	102	L	H	HE2	PHE	V	239
R	H	CB	SER	A	103	L	H	CE1	PHE	V	239
R	H	CB	SER	A	103	L	H	HE1	PHE	V	239
R	H	CD1	ILE	A	106	L	H	HE2	PHE	V	239
R	H	CB	TYR	A	149	L	H	NE2	GLN	V	236
R	H	CB	TYR	A	149	L	H	HE21	GLN	V	236
R	H	CB	TYR	A	149	L	H	HE22	GLN	V	236
R	H	CB	ILE	A	153	L	H	HG23	THR	V	232
R	H	CG1	ILE	A	153	L	H	HE21	GLN	V	236
R	H	CG2	ILE	A	153	L	H	CG2	THR	V	232
R	H	CG2	ILE	A	153	L	H	HA	THR	V	232
R	H	CG2	ILE	A	153	L	H	HB	THR	V	232
R	H	CG2	ILE	A	153	L	H	HG21	THR	V	232
R	H	CG2	ILE	A	153	L	H	HG23	THR	V	232
R	H	CG2	ILE	A	153	L	H	HD11	LEU	V	235
R	H	CD1	ILE	A	153	L	H	CB	THR	V	232
R	H	CD1	ILE	A	153	L	H	HB	THR	V	232
R	H	CD1	ILE	A	153	L	H	HG23	THR	V	232
R	H	CD1	ILE	A	153	L	H	CG	GLN	V	236
R	H	CD1	ILE	A	153	L	H	NE2	GLN	V	236
R	H	CD1	ILE	A	153	L	H	HG2	GLN	V	236
R	H	CD1	ILE	A	153	L	H	HG3	GLN	V	236
R	H	CD1	ILE	A	153	L	H	HE21	GLN	V	236
R	H	CD2	LEU	A	157	L	H	HD13	LEU	V	235
R	H	CG	GLU	A	160	L	H	HD22	LEU	V	227
R	H	CD	GLU	A	160	L	H	HD22	LEU	V	227
R	H	OE1	GLU	A	160	L	H	CD2	LEU	V	227
R	H	OE1	GLU	A	160	L	H	HD22	LEU	V	227
R	H	OE1	GLU	A	160	L	H	HD23	LEU	V	227
R	H	CE1	PHE	A	164	L	H	HD12	LEU	V	227
R	H	CE2	PHE	A	164	L	H	HD22	LEU	V	227
R	H	CZ	PHE	A	164	L	H	HB3	LEU	V	227
R	H	CZ	PHE	A	164	L	H	HD12	LEU	V	227
R	H	CZ	PHE	A	164	L	H	HD22	LEU	V	227
R	H	ND1	HIS	A	308	L	H	CB	THR	V	41
R	H	ND1	HIS	A	308	L	H	OG1	THR	V	41
R	H	ND1	HIS	A	308	L	H	HB	THR	V	41
R	H	ND1	HIS	A	308	L	H	HG21	THR	V	41
R	H	CE1	HIS	A	308	L	H	HB	THR	V	41
R	-	CA	SER	A	312	L	H	HD23	LEU	V	37
R	-	CB	SER	A	312	L	H	CD2	LEU	V	37
R	-	CB	SER	A	312	L	H	HD13	LEU	V	37
R	-	CB	SER	A	312	L	H	HD21	LEU	V	37
R	-	CB	SER	A	312	L	H	HD22	LEU	V	37
R	-	CB	SER	A	312	L	H	HD23	LEU	V	37
R	-	OG	SER	A	312	L	H	CB	LEU	V	37
R	-	OG	SER	A	312	L	H	CG	LEU	V	37
R	-	OG	SER	A	312	L	H	CD1	LEU	V	37
R	-	OG	SER	A	312	L	H	CD2	LEU	V	37
R	-	OG	SER	A	312	L	H	HB3	LEU	V	37
R	-	OG	SER	A	312	L	H	HD13	LEU	V	37
R	-	OG	SER	A	312	L	H	HD21	LEU	V	37
R	-	OG	SER	A	312	L	H	HD22	LEU	V	37
R	-	OG	SER	A	312	L	H	HD23	LEU	V	37
R	-	OG	SER	A	312	L	H	HG21	THR	V	41
R	-	OG	SER	A	312	L	H	HG23	THR	V	41

- 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