IID

A6NND4_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	ALA	A	147	L	H	LYS	V	295
R	H	THR	A	148	L	H	LYS	V	295
R	H	LEU	A	155	L	H	ARG	V	235
R	H	ILE	A	309	L	H	MET	V	40
R	-	PRO	A	314	L	H	LEU	V	36
R	H	PHE	A	34	L	-	LEU	V	18
R	H	LEU	A	38	L	H	TRP	V	23
R	H	TYR	A	40	L	H	ILE	V	281
R	H	LEU	A	41	L	H	LEU	V	27
R	H	LEU	A	41	L	H	ILE	V	34
R	H	LEU	A	44	L	H	ILE	V	281
R	H	LEU	A	44	L	H	LEU	V	284
R	H	LEU	A	44	L	H	LEU	V	285
R	H	MET	A	45	L	H	LEU	V	29
R	H	MET	A	45	L	H	ALA	V	30
R	H	MET	A	45	L	H	VAL	V	33
R	H	MET	A	45	L	H	ILE	V	34
R	H	MET	A	45	L	H	ILE	V	37
R	H	ALA	A	48	L	H	LEU	V	284
R	H	ALA	A	48	L	H	ILE	V	288
R	H	ALA	A	48	L	H	ILE	V	37
R	H	LEU	A	49	L	H	VAL	V	33
R	H	LEU	A	49	L	H	ILE	V	37
R	H	LEU	A	51	L	H	ILE	V	288
R	H	LEU	A	51	L	H	LEU	V	292
R	H	VAL	A	52	L	H	ILE	V	37
R	H	VAL	A	52	L	H	MET	V	40
R	H	VAL	A	54	L	H	PHE	V	301
R	H	VAL	A	55	L	H	LEU	V	292
R	H	VAL	A	55	L	H	PHE	V	301
R	H	VAL	A	55	L	H	LEU	V	305
R	H	ALA	A	56	L	H	PHE	V	301
R	H	ALA	A	56	L	H	LEU	V	305
R	H	ALA	A	56	L	H	MET	V	40
R	-	GLU	A	57	L	H	LEU	V	305
R	H	PRO	A	58	L	H	LEU	V	305
R	H	PRO	A	58	L	H	VAL	V	309
R	-	HIS	A	61	L	H	PHE	V	301
R	-	HIS	A	61	L	H	THR	V	302
R	-	HIS	A	61	L	H	LEU	V	305
R	H	ILE	A	69	L	H	LEU	V	292
R	H	THR	A	73	L	H	ILE	V	288
R	H	ILE	A	76	L	H	LEU	V	285
R	H	ILE	A	76	L	H	ILE	V	288
R	H	LEU	A	77	L	H	PHE	V	246
R	H	THR	A	80	L	H	LEU	V	250
R	H	THR	A	80	L	H	LEU	V	285
R	H	PRO	A	84	L	H	PHE	V	277
R	H	LYS	A	85	L	H	PHE	V	257
R	H	LEU	A	91	L	-	ASP	V	271
R	H	LEU	A	91	L	H	VAL	V	273
R	H	LEU	A	92	L	-	PRO	V	262
R	H	LEU	A	92	L	-	SER	V	264
R	H	LEU	A	92	L	-	ALA	V	267
R	H	LEU	A	92	L	-	ASP	V	271
R	-	GLY	A	93	L	-	PRO	V	262
R	-	ASP	A	94	L	H	PHE	V	257
R	-	ASP	A	94	L	-	GLY	V	261
R	-	ASP	A	94	L	-	PRO	V	262

- 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

A6NND4_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	CE1	PHE	A	34	L	-	O	LEU	V	18
R	H	CZ	PHE	A	34	L	-	O	LEU	V	18
R	H	CG	LEU	A	38	L	H	CH2	TRP	V	23
R	H	CG	LEU	A	38	L	H	CZ3	TRP	V	23
R	H	CG	LEU	A	38	L	H	HH2	TRP	V	23
R	H	CG	LEU	A	38	L	H	HZ3	TRP	V	23
R	H	CD1	LEU	A	38	L	H	CH2	TRP	V	23
R	H	CD1	LEU	A	38	L	H	CZ3	TRP	V	23
R	H	CD1	LEU	A	38	L	H	HH2	TRP	V	23
R	H	CD1	LEU	A	38	L	H	HZ3	TRP	V	23
R	H	CD2	LEU	A	38	L	H	CH2	TRP	V	23
R	H	CD2	LEU	A	38	L	H	CZ2	TRP	V	23
R	H	CD2	LEU	A	38	L	H	CZ3	TRP	V	23
R	H	CD2	LEU	A	38	L	H	HH2	TRP	V	23
R	H	CD2	LEU	A	38	L	H	HZ3	TRP	V	23
R	H	OH	TYR	A	40	L	H	HD13	ILE	V	281
R	H	O	LEU	A	41	L	H	HD11	ILE	V	34
R	H	CD1	LEU	A	41	L	H	HD21	LEU	V	27
R	H	CD1	LEU	A	41	L	H	HD23	LEU	V	27
R	H	O	LEU	A	44	L	H	HD23	LEU	V	284
R	H	CD1	LEU	A	44	L	H	HG12	ILE	V	281
R	H	CD2	LEU	A	44	L	H	HD22	LEU	V	285
R	H	CA	MET	A	45	L	H	HG12	ILE	V	34
R	H	CA	MET	A	45	L	H	HG13	ILE	V	34
R	H	CB	MET	A	45	L	H	HG13	ILE	V	34
R	H	CB	MET	A	45	L	H	HD11	ILE	V	34
R	H	O	MET	A	45	L	H	HG11	VAL	V	33
R	H	O	MET	A	45	L	H	HG12	VAL	V	33
R	H	O	MET	A	45	L	H	CD1	ILE	V	37
R	H	O	MET	A	45	L	H	HD11	ILE	V	37
R	H	O	MET	A	45	L	H	HD12	ILE	V	37
R	H	O	MET	A	45	L	H	HD13	ILE	V	37
R	H	CG	MET	A	45	L	H	O	ALA	V	30
R	H	CG	MET	A	45	L	H	HA	ALA	V	30
R	H	CG	MET	A	45	L	H	CB	VAL	V	33
R	H	CG	MET	A	45	L	H	CG1	VAL	V	33
R	H	CG	MET	A	45	L	H	HB	VAL	V	33
R	H	CG	MET	A	45	L	H	HG11	VAL	V	33
R	H	CG	MET	A	45	L	H	HG12	VAL	V	33
R	H	CG	MET	A	45	L	H	HG13	ILE	V	34
R	H	SD	MET	A	45	L	H	O	LEU	V	29
R	H	SD	MET	A	45	L	H	CA	ALA	V	30
R	H	SD	MET	A	45	L	H	C	ALA	V	30
R	H	SD	MET	A	45	L	H	CB	ALA	V	30
R	H	SD	MET	A	45	L	H	O	ALA	V	30
R	H	SD	MET	A	45	L	H	HA	ALA	V	30
R	H	SD	MET	A	45	L	H	HB1	ALA	V	30
R	H	SD	MET	A	45	L	H	HB2	ALA	V	30
R	H	SD	MET	A	45	L	H	CB	VAL	V	33
R	H	SD	MET	A	45	L	H	CG1	VAL	V	33
R	H	SD	MET	A	45	L	H	CG2	VAL	V	33
R	H	SD	MET	A	45	L	H	HB	VAL	V	33
R	H	SD	MET	A	45	L	H	HG11	VAL	V	33
R	H	SD	MET	A	45	L	H	HG12	VAL	V	33
R	H	SD	MET	A	45	L	H	HG23	VAL	V	33
R	H	CE	MET	A	45	L	H	HA	ALA	V	30
R	H	CE	MET	A	45	L	H	HB2	ALA	V	30
R	H	CA	ALA	A	48	L	H	CD1	ILE	V	37
R	H	CA	ALA	A	48	L	H	HG22	ILE	V	37
R	H	CA	ALA	A	48	L	H	HD12	ILE	V	37
R	H	CA	ALA	A	48	L	H	HD12	LEU	V	284
R	H	CA	ALA	A	48	L	H	HD11	ILE	V	288
R	H	C	ALA	A	48	L	H	CD1	ILE	V	37
R	H	C	ALA	A	48	L	H	HG12	ILE	V	37
R	H	C	ALA	A	48	L	H	HG22	ILE	V	37
R	H	C	ALA	A	48	L	H	HD11	ILE	V	37
R	H	C	ALA	A	48	L	H	HD12	ILE	V	37
R	H	C	ALA	A	48	L	H	HD13	ILE	V	37
R	H	CB	ALA	A	48	L	H	CG2	ILE	V	37
R	H	CB	ALA	A	48	L	H	CD1	ILE	V	37
R	H	CB	ALA	A	48	L	H	HG22	ILE	V	37
R	H	CB	ALA	A	48	L	H	HD12	ILE	V	37
R	H	CB	ALA	A	48	L	H	HD13	ILE	V	37
R	H	CB	ALA	A	48	L	H	CD1	LEU	V	284
R	H	CB	ALA	A	48	L	H	HD12	LEU	V	284
R	H	CB	ALA	A	48	L	H	HD23	LEU	V	284
R	H	CB	ALA	A	48	L	H	HD11	ILE	V	288
R	H	O	ALA	A	48	L	H	CG2	ILE	V	37
R	H	O	ALA	A	48	L	H	CD1	ILE	V	37
R	H	O	ALA	A	48	L	H	HG12	ILE	V	37
R	H	O	ALA	A	48	L	H	HG22	ILE	V	37
R	H	O	ALA	A	48	L	H	HG23	ILE	V	37
R	H	O	ALA	A	48	L	H	HD11	ILE	V	37
R	H	O	ALA	A	48	L	H	HD12	ILE	V	37
R	H	N	LEU	A	49	L	H	CD1	ILE	V	37
R	H	N	LEU	A	49	L	H	HD11	ILE	V	37
R	H	N	LEU	A	49	L	H	HD12	ILE	V	37
R	H	N	LEU	A	49	L	H	HD13	ILE	V	37
R	H	CA	LEU	A	49	L	H	CD1	ILE	V	37
R	H	CA	LEU	A	49	L	H	HG12	ILE	V	37
R	H	CA	LEU	A	49	L	H	HD11	ILE	V	37
R	H	CA	LEU	A	49	L	H	HD12	ILE	V	37
R	H	CB	LEU	A	49	L	H	CD1	ILE	V	37
R	H	CB	LEU	A	49	L	H	HD11	ILE	V	37
R	H	CB	LEU	A	49	L	H	HD12	ILE	V	37
R	H	CG	LEU	A	49	L	H	HD11	ILE	V	37
R	H	CD1	LEU	A	49	L	H	HG13	VAL	V	33
R	H	CD1	LEU	A	49	L	H	HD11	ILE	V	37
R	H	CB	LEU	A	51	L	H	HG12	ILE	V	288
R	H	CB	LEU	A	51	L	H	CD1	LEU	V	292
R	H	CB	LEU	A	51	L	H	HD12	LEU	V	292
R	H	CB	LEU	A	51	L	H	HD13	LEU	V	292
R	H	CG	LEU	A	51	L	H	HG12	ILE	V	288
R	H	CG	LEU	A	51	L	H	HD13	ILE	V	288
R	H	CG	LEU	A	51	L	H	CD1	LEU	V	292
R	H	CG	LEU	A	51	L	H	HD11	LEU	V	292
R	H	CG	LEU	A	51	L	H	HD12	LEU	V	292
R	H	CG	LEU	A	51	L	H	HD13	LEU	V	292
R	H	CD1	LEU	A	51	L	H	CG1	ILE	V	288
R	H	CD1	LEU	A	51	L	H	CG2	ILE	V	288
R	H	CD1	LEU	A	51	L	H	CD1	ILE	V	288
R	H	CD1	LEU	A	51	L	H	HG12	ILE	V	288
R	H	CD1	LEU	A	51	L	H	HG21	ILE	V	288
R	H	CD1	LEU	A	51	L	H	HG22	ILE	V	288
R	H	CD1	LEU	A	51	L	H	HD11	ILE	V	288
R	H	CD1	LEU	A	51	L	H	HD12	ILE	V	288
R	H	CD1	LEU	A	51	L	H	HD13	ILE	V	288
R	H	CD1	LEU	A	51	L	H	CD1	LEU	V	292
R	H	CD1	LEU	A	51	L	H	HD11	LEU	V	292
R	H	CD1	LEU	A	51	L	H	HD12	LEU	V	292
R	H	CD1	LEU	A	51	L	H	HD13	LEU	V	292
R	H	CD2	LEU	A	51	L	H	CD1	LEU	V	292
R	H	CD2	LEU	A	51	L	H	HD11	LEU	V	292
R	H	CD2	LEU	A	51	L	H	HD12	LEU	V	292
R	H	CD2	LEU	A	51	L	H	HD13	LEU	V	292
R	H	CB	VAL	A	52	L	H	HA	ILE	V	37
R	H	CB	VAL	A	52	L	H	HG12	ILE	V	37
R	H	CB	VAL	A	52	L	H	HG23	ILE	V	37
R	H	CG1	VAL	A	52	L	H	HA	ILE	V	37
R	H	CG1	VAL	A	52	L	H	HG12	ILE	V	37
R	H	CG1	VAL	A	52	L	H	HG23	ILE	V	37
R	H	CG1	VAL	A	52	L	H	CE	MET	V	40
R	H	CG1	VAL	A	52	L	H	HB2	MET	V	40
R	H	CG1	VAL	A	52	L	H	HE1	MET	V	40
R	H	CG1	VAL	A	52	L	H	HE2	MET	V	40
R	H	CG2	VAL	A	52	L	H	CA	ILE	V	37
R	H	CG2	VAL	A	52	L	H	CB	ILE	V	37
R	H	CG2	VAL	A	52	L	H	O	ILE	V	37
R	H	CG2	VAL	A	52	L	H	CG1	ILE	V	37
R	H	CG2	VAL	A	52	L	H	CG2	ILE	V	37
R	H	CG2	VAL	A	52	L	H	HA	ILE	V	37
R	H	CG2	VAL	A	52	L	H	HG12	ILE	V	37
R	H	CG2	VAL	A	52	L	H	HG21	ILE	V	37
R	H	CG2	VAL	A	52	L	H	HG22	ILE	V	37
R	H	CG2	VAL	A	52	L	H	HG23	ILE	V	37
R	H	CG2	VAL	A	52	L	H	HD12	ILE	V	37
R	H	O	VAL	A	54	L	H	HE1	PHE	V	301
R	H	N	VAL	A	55	L	H	HE1	PHE	V	301
R	H	CA	VAL	A	55	L	H	CD1	PHE	V	301
R	H	CA	VAL	A	55	L	H	CE1	PHE	V	301
R	H	CA	VAL	A	55	L	H	CZ	PHE	V	301
R	H	CA	VAL	A	55	L	H	HE1	PHE	V	301
R	H	CA	VAL	A	55	L	H	HZ	PHE	V	301
R	H	C	VAL	A	55	L	H	CD1	PHE	V	301
R	H	C	VAL	A	55	L	H	CE1	PHE	V	301
R	H	C	VAL	A	55	L	H	CZ	PHE	V	301
R	H	C	VAL	A	55	L	H	HE1	PHE	V	301
R	H	C	VAL	A	55	L	H	HZ	PHE	V	301
R	H	C	VAL	A	55	L	H	CD1	LEU	V	305
R	H	C	VAL	A	55	L	H	HD11	LEU	V	305
R	H	CB	VAL	A	55	L	H	HD23	LEU	V	292
R	H	CB	VAL	A	55	L	H	CE1	PHE	V	301
R	H	CB	VAL	A	55	L	H	CZ	PHE	V	301
R	H	CB	VAL	A	55	L	H	HE1	PHE	V	301
R	H	CB	VAL	A	55	L	H	HZ	PHE	V	301
R	H	O	VAL	A	55	L	H	CG	PHE	V	301
R	H	O	VAL	A	55	L	H	CD1	PHE	V	301
R	H	O	VAL	A	55	L	H	CE1	PHE	V	301
R	H	O	VAL	A	55	L	H	CE2	PHE	V	301
R	H	O	VAL	A	55	L	H	CZ	PHE	V	301
R	H	O	VAL	A	55	L	H	HD1	PHE	V	301
R	H	O	VAL	A	55	L	H	HE1	PHE	V	301
R	H	O	VAL	A	55	L	H	HZ	PHE	V	301
R	H	O	VAL	A	55	L	H	CG	LEU	V	305
R	H	O	VAL	A	55	L	H	CD1	LEU	V	305
R	H	O	VAL	A	55	L	H	HG	LEU	V	305
R	H	O	VAL	A	55	L	H	HD11	LEU	V	305
R	H	O	VAL	A	55	L	H	HD12	LEU	V	305
R	H	O	VAL	A	55	L	H	HD13	LEU	V	305
R	H	O	VAL	A	55	L	H	HD23	LEU	V	305
R	H	CG1	VAL	A	55	L	H	HD23	LEU	V	292
R	H	CG1	VAL	A	55	L	H	CG	PHE	V	301
R	H	CG1	VAL	A	55	L	H	CD1	PHE	V	301
R	H	CG1	VAL	A	55	L	H	CD2	PHE	V	301
R	H	CG1	VAL	A	55	L	H	CE1	PHE	V	301
R	H	CG1	VAL	A	55	L	H	CE2	PHE	V	301
R	H	CG1	VAL	A	55	L	H	CZ	PHE	V	301
R	H	CG1	VAL	A	55	L	H	HD1	PHE	V	301
R	H	CG1	VAL	A	55	L	H	HE1	PHE	V	301
R	H	CG1	VAL	A	55	L	H	HZ	PHE	V	301
R	H	CG2	VAL	A	55	L	H	CD2	LEU	V	292
R	H	CG2	VAL	A	55	L	H	HD21	LEU	V	292
R	H	CG2	VAL	A	55	L	H	HD22	LEU	V	292
R	H	CG2	VAL	A	55	L	H	HD23	LEU	V	292
R	H	N	ALA	A	56	L	H	CE1	PHE	V	301
R	H	N	ALA	A	56	L	H	CZ	PHE	V	301
R	H	N	ALA	A	56	L	H	HE1	PHE	V	301
R	H	N	ALA	A	56	L	H	HZ	PHE	V	301
R	H	N	ALA	A	56	L	H	HD11	LEU	V	305
R	H	CA	ALA	A	56	L	H	CZ	PHE	V	301
R	H	CA	ALA	A	56	L	H	HE1	PHE	V	301
R	H	CA	ALA	A	56	L	H	HZ	PHE	V	301
R	H	CA	ALA	A	56	L	H	HD11	LEU	V	305
R	H	CA	ALA	A	56	L	H	HD23	LEU	V	305
R	H	C	ALA	A	56	L	H	HZ	PHE	V	301
R	H	C	ALA	A	56	L	H	CD1	LEU	V	305
R	H	C	ALA	A	56	L	H	CD2	LEU	V	305
R	H	C	ALA	A	56	L	H	HD11	LEU	V	305
R	H	C	ALA	A	56	L	H	HD13	LEU	V	305
R	H	C	ALA	A	56	L	H	HD22	LEU	V	305
R	H	C	ALA	A	56	L	H	HD23	LEU	V	305
R	H	CB	ALA	A	56	L	H	HE1	MET	V	40
R	H	CB	ALA	A	56	L	H	HE2	MET	V	40
R	H	CB	ALA	A	56	L	H	HZ	PHE	V	301
R	H	O	ALA	A	56	L	H	CD1	LEU	V	305
R	H	O	ALA	A	56	L	H	CD2	LEU	V	305
R	H	O	ALA	A	56	L	H	HD11	LEU	V	305
R	H	O	ALA	A	56	L	H	HD13	LEU	V	305
R	H	O	ALA	A	56	L	H	HD21	LEU	V	305
R	H	O	ALA	A	56	L	H	HD22	LEU	V	305
R	H	O	ALA	A	56	L	H	HD23	LEU	V	305
R	-	N	GLU	A	57	L	H	HD11	LEU	V	305
R	-	N	GLU	A	57	L	H	HD13	LEU	V	305
R	-	CA	GLU	A	57	L	H	HD13	LEU	V	305
R	-	C	GLU	A	57	L	H	CD1	LEU	V	305
R	-	C	GLU	A	57	L	H	HD13	LEU	V	305
R	-	O	GLU	A	57	L	H	HD13	LEU	V	305
R	H	N	PRO	A	58	L	H	CD1	LEU	V	305
R	H	N	PRO	A	58	L	H	HB3	LEU	V	305
R	H	N	PRO	A	58	L	H	HD13	LEU	V	305
R	H	N	PRO	A	58	L	H	HD22	LEU	V	305
R	H	CA	PRO	A	58	L	H	CD1	LEU	V	305
R	H	CA	PRO	A	58	L	H	HB3	LEU	V	305
R	H	CA	PRO	A	58	L	H	HD12	LEU	V	305
R	H	CA	PRO	A	58	L	H	HD13	LEU	V	305
R	H	CB	PRO	A	58	L	H	CB	LEU	V	305
R	H	CB	PRO	A	58	L	H	HB2	LEU	V	305
R	H	CB	PRO	A	58	L	H	HB3	LEU	V	305
R	H	CB	PRO	A	58	L	H	HD13	LEU	V	305
R	H	CB	PRO	A	58	L	H	HD22	LEU	V	305
R	H	CB	PRO	A	58	L	H	CG2	VAL	V	309
R	H	CB	PRO	A	58	L	H	HG21	VAL	V	309
R	H	CB	PRO	A	58	L	H	HG22	VAL	V	309
R	H	CG	PRO	A	58	L	H	CA	LEU	V	305
R	H	CG	PRO	A	58	L	H	C	LEU	V	305
R	H	CG	PRO	A	58	L	H	CB	LEU	V	305
R	H	CG	PRO	A	58	L	H	O	LEU	V	305
R	H	CG	PRO	A	58	L	H	CG	LEU	V	305
R	H	CG	PRO	A	58	L	H	CD1	LEU	V	305
R	H	CG	PRO	A	58	L	H	CD2	LEU	V	305
R	H	CG	PRO	A	58	L	H	HA	LEU	V	305
R	H	CG	PRO	A	58	L	H	HB2	LEU	V	305
R	H	CG	PRO	A	58	L	H	HB3	LEU	V	305
R	H	CG	PRO	A	58	L	H	HD12	LEU	V	305
R	H	CG	PRO	A	58	L	H	HD13	LEU	V	305
R	H	CG	PRO	A	58	L	H	HD21	LEU	V	305
R	H	CG	PRO	A	58	L	H	HD22	LEU	V	305
R	H	CG	PRO	A	58	L	H	CG2	VAL	V	309
R	H	CG	PRO	A	58	L	H	HG21	VAL	V	309
R	H	CG	PRO	A	58	L	H	HG22	VAL	V	309
R	H	CD	PRO	A	58	L	H	CB	LEU	V	305
R	H	CD	PRO	A	58	L	H	CG	LEU	V	305
R	H	CD	PRO	A	58	L	H	CD1	LEU	V	305
R	H	CD	PRO	A	58	L	H	CD2	LEU	V	305
R	H	CD	PRO	A	58	L	H	HB3	LEU	V	305
R	H	CD	PRO	A	58	L	H	HD13	LEU	V	305
R	H	CD	PRO	A	58	L	H	HD22	LEU	V	305
R	-	CB	HIS	A	61	L	H	HG22	THR	V	302
R	-	CG	HIS	A	61	L	H	CG2	THR	V	302
R	-	CG	HIS	A	61	L	H	OG1	THR	V	302
R	-	CG	HIS	A	61	L	H	HA	THR	V	302
R	-	CG	HIS	A	61	L	H	HG22	THR	V	302
R	-	CG	HIS	A	61	L	H	HD12	LEU	V	305
R	-	CD2	HIS	A	61	L	H	HD12	LEU	V	305
R	-	ND1	HIS	A	61	L	H	CA	THR	V	302
R	-	ND1	HIS	A	61	L	H	CB	THR	V	302
R	-	ND1	HIS	A	61	L	H	CG2	THR	V	302
R	-	ND1	HIS	A	61	L	H	OG1	THR	V	302
R	-	ND1	HIS	A	61	L	H	HA	THR	V	302
R	-	ND1	HIS	A	61	L	H	HG21	THR	V	302
R	-	ND1	HIS	A	61	L	H	HG22	THR	V	302
R	-	ND1	HIS	A	61	L	H	HG23	THR	V	302
R	-	ND1	HIS	A	61	L	H	CD1	LEU	V	305
R	-	ND1	HIS	A	61	L	H	HB2	LEU	V	305
R	-	ND1	HIS	A	61	L	H	HD12	LEU	V	305
R	-	ND1	HIS	A	61	L	H	HD13	LEU	V	305
R	-	CE1	HIS	A	61	L	H	CD1	PHE	V	301
R	-	CE1	HIS	A	61	L	H	HD1	PHE	V	301
R	-	CE1	HIS	A	61	L	H	HE1	PHE	V	301
R	-	CE1	HIS	A	61	L	H	N	THR	V	302
R	-	CE1	HIS	A	61	L	H	CA	THR	V	302
R	-	CE1	HIS	A	61	L	H	CB	THR	V	302
R	-	CE1	HIS	A	61	L	H	CG2	THR	V	302
R	-	CE1	HIS	A	61	L	H	OG1	THR	V	302
R	-	CE1	HIS	A	61	L	H	HA	THR	V	302
R	-	CE1	HIS	A	61	L	H	HG22	THR	V	302
R	-	CE1	HIS	A	61	L	H	CG	LEU	V	305
R	-	CE1	HIS	A	61	L	H	CD1	LEU	V	305
R	-	CE1	HIS	A	61	L	H	HB2	LEU	V	305
R	-	CE1	HIS	A	61	L	H	HD11	LEU	V	305
R	-	CE1	HIS	A	61	L	H	HD12	LEU	V	305
R	-	CE1	HIS	A	61	L	H	HD13	LEU	V	305
R	-	NE2	HIS	A	61	L	H	CD1	PHE	V	301
R	-	NE2	HIS	A	61	L	H	HD1	PHE	V	301
R	-	NE2	HIS	A	61	L	H	HE1	PHE	V	301
R	-	NE2	HIS	A	61	L	H	HA	THR	V	302
R	-	NE2	HIS	A	61	L	H	CD1	LEU	V	305
R	-	NE2	HIS	A	61	L	H	HD11	LEU	V	305
R	-	NE2	HIS	A	61	L	H	HD12	LEU	V	305
R	-	NE2	HIS	A	61	L	H	HD13	LEU	V	305
R	H	CG2	ILE	A	69	L	H	HB3	LEU	V	292
R	H	CG2	ILE	A	69	L	H	HD12	LEU	V	292
R	H	CG2	ILE	A	69	L	H	HD22	LEU	V	292
R	H	CD1	ILE	A	69	L	H	HD22	LEU	V	292
R	H	CG2	THR	A	73	L	H	CG2	ILE	V	288
R	H	CG2	THR	A	73	L	H	HG21	ILE	V	288
R	H	CG2	THR	A	73	L	H	HG22	ILE	V	288
R	H	CG2	THR	A	73	L	H	HG23	ILE	V	288
R	H	OG1	THR	A	73	L	H	CG2	ILE	V	288
R	H	OG1	THR	A	73	L	H	HG21	ILE	V	288
R	H	OG1	THR	A	73	L	H	HG22	ILE	V	288
R	H	OG1	THR	A	73	L	H	HG23	ILE	V	288
R	H	CG2	ILE	A	76	L	H	CD2	LEU	V	285
R	H	CG2	ILE	A	76	L	H	HD21	LEU	V	285
R	H	CG2	ILE	A	76	L	H	HD22	LEU	V	285
R	H	CG2	ILE	A	76	L	H	HD23	LEU	V	285
R	H	CD1	ILE	A	76	L	H	CD1	ILE	V	288
R	H	CD1	ILE	A	76	L	H	HD11	ILE	V	288
R	H	CD1	ILE	A	76	L	H	HD12	ILE	V	288
R	H	CD1	ILE	A	76	L	H	HD13	ILE	V	288
R	H	CD2	LEU	A	77	L	H	CE1	PHE	V	246
R	H	CD2	LEU	A	77	L	H	CZ	PHE	V	246
R	H	CD2	LEU	A	77	L	H	HE1	PHE	V	246
R	H	CD2	LEU	A	77	L	H	HZ	PHE	V	246
R	H	CG2	THR	A	80	L	H	HD23	LEU	V	250
R	H	OG1	THR	A	80	L	H	HD13	LEU	V	285
R	H	CB	PRO	A	84	L	H	HZ	PHE	V	277
R	H	CG	PRO	A	84	L	H	HZ	PHE	V	277
R	H	CD	LYS	A	85	L	H	HE1	PHE	V	257
R	H	CE	LYS	A	85	L	H	HE1	PHE	V	257
R	H	NZ	LYS	A	85	L	H	HE1	PHE	V	257
R	H	CG	LEU	A	91	L	-	CG	ASP	V	271
R	H	CG	LEU	A	91	L	-	OD1	ASP	V	271
R	H	CG	LEU	A	91	L	-	OD2	ASP	V	271
R	H	CD1	LEU	A	91	L	-	OD1	ASP	V	271
R	H	CD2	LEU	A	91	L	-	CG	ASP	V	271
R	H	CD2	LEU	A	91	L	-	OD1	ASP	V	271
R	H	CD2	LEU	A	91	L	-	OD2	ASP	V	271
R	H	CD2	LEU	A	91	L	-	HA	ASP	V	271
R	H	CD2	LEU	A	91	L	H	HG21	VAL	V	273
R	H	CD2	LEU	A	91	L	H	HG23	VAL	V	273
R	H	CA	LEU	A	92	L	-	HB2	ALA	V	267
R	H	CB	LEU	A	92	L	-	HB2	ALA	V	267
R	H	O	LEU	A	92	L	-	HG2	PRO	V	262
R	H	O	LEU	A	92	L	-	HB2	SER	V	264
R	H	O	LEU	A	92	L	-	HB3	SER	V	264
R	H	CG	LEU	A	92	L	-	HB2	ALA	V	267
R	H	CG	LEU	A	92	L	-	CG	ASP	V	271
R	H	CG	LEU	A	92	L	-	OD2	ASP	V	271
R	H	CD1	LEU	A	92	L	-	OD2	ASP	V	271
R	H	CD2	LEU	A	92	L	-	CA	ALA	V	267
R	H	CD2	LEU	A	92	L	-	CB	ALA	V	267
R	H	CD2	LEU	A	92	L	-	HA	ALA	V	267
R	H	CD2	LEU	A	92	L	-	HB1	ALA	V	267
R	H	CD2	LEU	A	92	L	-	HB2	ALA	V	267
R	H	CD2	LEU	A	92	L	-	CG	ASP	V	271
R	H	CD2	LEU	A	92	L	-	OD1	ASP	V	271
R	H	CD2	LEU	A	92	L	-	OD2	ASP	V	271
R	-	C	GLY	A	93	L	-	HG2	PRO	V	262
R	-	C	GLY	A	93	L	-	HG3	PRO	V	262
R	-	O	GLY	A	93	L	-	CG	PRO	V	262
R	-	O	GLY	A	93	L	-	HG2	PRO	V	262
R	-	O	GLY	A	93	L	-	HG3	PRO	V	262
R	-	N	ASP	A	94	L	-	HG2	PRO	V	262
R	-	N	ASP	A	94	L	-	HG3	PRO	V	262
R	-	CA	ASP	A	94	L	-	CG	PRO	V	262
R	-	CA	ASP	A	94	L	-	HG2	PRO	V	262
R	-	CA	ASP	A	94	L	-	HG3	PRO	V	262
R	-	CA	ASP	A	94	L	-	HD3	PRO	V	262
R	-	CB	ASP	A	94	L	-	HD3	PRO	V	262
R	-	CG	ASP	A	94	L	H	HD1	PHE	V	257
R	-	CG	ASP	A	94	L	-	HD3	PRO	V	262
R	-	OD1	ASP	A	94	L	-	HA2	GLY	V	261
R	-	OD1	ASP	A	94	L	-	CD	PRO	V	262
R	-	OD1	ASP	A	94	L	-	HD2	PRO	V	262
R	-	OD1	ASP	A	94	L	-	HD3	PRO	V	262
R	-	OD2	ASP	A	94	L	H	CD1	PHE	V	257
R	-	OD2	ASP	A	94	L	H	CE1	PHE	V	257
R	-	OD2	ASP	A	94	L	H	HD1	PHE	V	257
R	-	OD2	ASP	A	94	L	H	HE1	PHE	V	257
R	H	CA	ALA	A	147	L	H	HE2	LYS	V	295
R	H	CA	ALA	A	147	L	H	HZ1	LYS	V	295
R	H	C	ALA	A	147	L	H	HZ1	LYS	V	295
R	H	CB	ALA	A	147	L	H	CE	LYS	V	295
R	H	CB	ALA	A	147	L	H	NZ	LYS	V	295
R	H	CB	ALA	A	147	L	H	HE2	LYS	V	295
R	H	CB	ALA	A	147	L	H	HE3	LYS	V	295
R	H	CB	ALA	A	147	L	H	HZ1	LYS	V	295
R	H	CB	ALA	A	147	L	H	HZ2	LYS	V	295
R	H	CB	ALA	A	147	L	H	HZ3	LYS	V	295
R	H	O	ALA	A	147	L	H	HZ1	LYS	V	295
R	H	N	THR	A	148	L	H	HZ1	LYS	V	295
R	H	CG	LEU	A	155	L	H	CD	ARG	V	235
R	H	CG	LEU	A	155	L	H	HD2	ARG	V	235
R	H	CG	LEU	A	155	L	H	HD3	ARG	V	235
R	H	CD1	LEU	A	155	L	H	CD	ARG	V	235
R	H	CD1	LEU	A	155	L	H	NE	ARG	V	235
R	H	CD1	LEU	A	155	L	H	NH1	ARG	V	235
R	H	CD1	LEU	A	155	L	H	CZ	ARG	V	235
R	H	CD1	LEU	A	155	L	H	HD2	ARG	V	235
R	H	CD1	LEU	A	155	L	H	HD3	ARG	V	235
R	H	CD1	LEU	A	155	L	H	HH11	ARG	V	235
R	H	CD2	LEU	A	155	L	H	CG	ARG	V	235
R	H	CD2	LEU	A	155	L	H	CD	ARG	V	235
R	H	CD2	LEU	A	155	L	H	HG3	ARG	V	235
R	H	CD2	LEU	A	155	L	H	HD2	ARG	V	235
R	H	CD2	LEU	A	155	L	H	HD3	ARG	V	235
R	H	CG1	ILE	A	309	L	H	HE1	MET	V	40
R	H	CG2	ILE	A	309	L	H	HE1	MET	V	40
R	H	CD1	ILE	A	309	L	H	HE1	MET	V	40
R	-	CG	PRO	A	314	L	H	CD2	LEU	V	36
R	-	CG	PRO	A	314	L	H	HD22	LEU	V	36
R	-	CG	PRO	A	314	L	H	HD23	LEU	V	36

- 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