IID

O95069_Q96CX2.1 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	VAL	A	154	L	-	PRO	V	56
R	-	PRO	A	165	L	-	ASP	V	57
R	H	LYS	A	171	L	-	ASP	V	57
R	H	ILE	A	172	L	H	PRO	V	123
R	H	CYS	A	174	L	-	PRO	V	56
R	H	ILE	A	175	L	-	GLU	V	121
R	H	ILE	A	175	L	-	LEU	V	122
R	H	ILE	A	175	L	H	PRO	V	123
R	H	ILE	A	175	L	H	GLU	V	124
R	H	ILE	A	175	L	-	VAL	V	55
R	H	ILE	A	175	L	-	PRO	V	56
R	H	ILE	A	175	L	-	ASP	V	57
R	H	ILE	A	175	L	-	SER	V	58
R	H	ILE	A	176	L	H	PRO	V	123
R	H	ILE	A	176	L	H	GLU	V	124
R	H	ALA	A	178	L	-	VAL	V	55
R	H	ALA	A	178	L	-	PRO	V	56
R	H	ALA	A	178	L	-	LEU	V	99
R	H	LEU	A	179	L	H	GLU	V	124
R	H	LEU	A	179	L	H	LEU	V	125
R	H	LEU	A	179	L	-	VAL	V	55
R	H	LEU	A	179	L	H	TYR	V	95
R	H	LEU	A	179	L	-	LEU	V	99
R	H	LEU	A	180	L	H	ARG	V	128
R	H	LEU	A	180	L	-	LEU	V	99
R	H	ILE	A	182	L	-	SER	V	54
R	H	ILE	A	182	L	-	LEU	V	99
R	H	PRO	A	183	L	-	GLN	V	100
R	H	PRO	A	183	L	H	ASP	V	98
R	H	PRO	A	183	L	-	LEU	V	99
R	-	SER	A	252	L	-	SER	V	22
R	-	SER	A	252	L	-	SER	V	23
R	H	ASP	A	255	L	-	SER	V	23
R	H	ASP	A	255	L	-	SER	V	25
R	H	TYR	A	258	L	-	SER	V	25
R	H	TYR	A	258	L	-	ALA	V	27
R	-	PHE	A	269	L	-	PRO	V	30
R	-	ASP	A	271	L	-	ALA	V	27
R	-	TYR	A	272	L	-	SER	V	23
R	-	TYR	A	272	L	-	SER	V	25
R	-	PHE	A	37	L	H	GLU	V	286
R	-	THR	A	39	L	H	ASP	V	282
R	-	LYS	A	40	L	H	GLU	V	278
R	-	LYS	A	40	L	H	ASP	V	282
R	-	PRO	A	41	L	H	GLU	V	278
R	-	PRO	A	41	L	H	GLN	V	279
R	-	PRO	A	41	L	H	ASP	V	282
R	-	PRO	A	412	L	-	THR	V	306
R	-	PRO	A	412	L	-	ASP	V	307
R	-	HIS	A	413	L	-	THR	V	306
R	-	CYS	A	414	L	-	SER	V	305
R	-	CYS	A	414	L	-	THR	V	306
R	H	THR	A	42	L	H	GLU	V	278
R	-	ALA	A	420	L	-	MET	V	1
R	-	VAL	A	421	L	-	MET	V	1
R	-	ILE	A	422	L	-	ALA	V	2
R	-	ILE	A	422	L	-	LEU	V	3
R	-	ASN	A	424	L	-	ASP	V	5
R	-	ASN	A	424	L	-	SER	V	6
R	H	LEU	A	44	L	H	GLU	V	278
R	H	LEU	A	44	L	H	PHE	V	281
R	H	GLU	A	49	L	-	PHE	V	230
R	H	VAL	A	56	L	H	LYS	V	229
R	H	LYS	A	60	L	H	LYS	V	229
R	H	PHE	A	66	L	S	ILE	V	35
R	H	PHE	A	66	L	S	GLU	V	37
R	H	PHE	A	66	L	S	VAL	V	46
R	H	VAL	A	69	L	S	ILE	V	35
R	H	LEU	A	73	L	-	PRO	V	33
R	H	LEU	A	73	L	-	ASP	V	34
R	H	LEU	A	73	L	S	ILE	V	35
R	H	PHE	A	80	L	-	PRO	V	29
R	H	GLU	A	84	L	-	SER	V	26
R	H	GLU	A	84	L	-	ALA	V	27
R	H	GLU	A	84	L	-	PRO	V	29
R	H	HIS	A	87	L	-	SER	V	26

- 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

O95069_Q96CX2.1 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	-	C	PHE	A	37	L	H	OE1	GLU	V	286
R	-	CB	PHE	A	37	L	H	CD	GLU	V	286
R	-	CB	PHE	A	37	L	H	OE1	GLU	V	286
R	-	CB	PHE	A	37	L	H	HG2	GLU	V	286
R	-	O	PHE	A	37	L	H	OE1	GLU	V	286
R	-	CG	PHE	A	37	L	H	HG2	GLU	V	286
R	-	CD1	PHE	A	37	L	H	CG	GLU	V	286
R	-	CD1	PHE	A	37	L	H	HG2	GLU	V	286
R	-	CD1	PHE	A	37	L	H	HG3	GLU	V	286
R	-	CD2	PHE	A	37	L	H	HG2	GLU	V	286
R	-	CE1	PHE	A	37	L	H	HG2	GLU	V	286
R	-	O	THR	A	39	L	H	OD1	ASP	V	282
R	-	O	THR	A	39	L	H	OD2	ASP	V	282
R	-	C	LYS	A	40	L	H	HB3	GLU	V	278
R	-	C	LYS	A	40	L	H	OD1	ASP	V	282
R	-	C	LYS	A	40	L	H	OD2	ASP	V	282
R	-	O	LYS	A	40	L	H	HB3	GLU	V	278
R	-	O	LYS	A	40	L	H	CG	ASP	V	282
R	-	O	LYS	A	40	L	H	OD1	ASP	V	282
R	-	O	LYS	A	40	L	H	OD2	ASP	V	282
R	-	N	PRO	A	41	L	H	CB	GLU	V	278
R	-	N	PRO	A	41	L	H	HB2	GLU	V	278
R	-	N	PRO	A	41	L	H	HB3	GLU	V	278
R	-	N	PRO	A	41	L	H	HG2	GLU	V	278
R	-	N	PRO	A	41	L	H	OD2	ASP	V	282
R	-	CA	PRO	A	41	L	H	CA	GLU	V	278
R	-	CA	PRO	A	41	L	H	CB	GLU	V	278
R	-	CA	PRO	A	41	L	H	CG	GLU	V	278
R	-	CA	PRO	A	41	L	H	HB2	GLU	V	278
R	-	CA	PRO	A	41	L	H	HB3	GLU	V	278
R	-	CA	PRO	A	41	L	H	HG2	GLU	V	278
R	-	CA	PRO	A	41	L	H	HG3	GLU	V	278
R	-	C	PRO	A	41	L	H	CB	GLU	V	278
R	-	C	PRO	A	41	L	H	CG	GLU	V	278
R	-	C	PRO	A	41	L	H	HB2	GLU	V	278
R	-	C	PRO	A	41	L	H	HB3	GLU	V	278
R	-	C	PRO	A	41	L	H	HG2	GLU	V	278
R	-	C	PRO	A	41	L	H	HG3	GLU	V	278
R	-	CB	PRO	A	41	L	H	N	GLU	V	278
R	-	CB	PRO	A	41	L	H	CA	GLU	V	278
R	-	CB	PRO	A	41	L	H	C	GLU	V	278
R	-	CB	PRO	A	41	L	H	CB	GLU	V	278
R	-	CB	PRO	A	41	L	H	CG	GLU	V	278
R	-	CB	PRO	A	41	L	H	CD	GLU	V	278
R	-	CB	PRO	A	41	L	H	OE2	GLU	V	278
R	-	CB	PRO	A	41	L	H	H	GLU	V	278
R	-	CB	PRO	A	41	L	H	HA	GLU	V	278
R	-	CB	PRO	A	41	L	H	HB2	GLU	V	278
R	-	CB	PRO	A	41	L	H	HB3	GLU	V	278
R	-	CB	PRO	A	41	L	H	HG2	GLU	V	278
R	-	CB	PRO	A	41	L	H	HG3	GLU	V	278
R	-	CB	PRO	A	41	L	H	N	GLN	V	279
R	-	CB	PRO	A	41	L	H	H	GLN	V	279
R	-	O	PRO	A	41	L	H	CB	GLU	V	278
R	-	O	PRO	A	41	L	H	CG	GLU	V	278
R	-	O	PRO	A	41	L	H	CD	GLU	V	278
R	-	O	PRO	A	41	L	H	HB2	GLU	V	278
R	-	O	PRO	A	41	L	H	HB3	GLU	V	278
R	-	O	PRO	A	41	L	H	HG2	GLU	V	278
R	-	O	PRO	A	41	L	H	HG3	GLU	V	278
R	-	CG	PRO	A	41	L	H	CA	GLU	V	278
R	-	CG	PRO	A	41	L	H	C	GLU	V	278
R	-	CG	PRO	A	41	L	H	CB	GLU	V	278
R	-	CG	PRO	A	41	L	H	O	GLU	V	278
R	-	CG	PRO	A	41	L	H	CG	GLU	V	278
R	-	CG	PRO	A	41	L	H	HB2	GLU	V	278
R	-	CG	PRO	A	41	L	H	HB3	GLU	V	278
R	-	CG	PRO	A	41	L	H	N	GLN	V	279
R	-	CG	PRO	A	41	L	H	CA	GLN	V	279
R	-	CG	PRO	A	41	L	H	H	GLN	V	279
R	-	CG	PRO	A	41	L	H	HA	GLN	V	279
R	-	CG	PRO	A	41	L	H	HB2	GLN	V	279
R	-	CG	PRO	A	41	L	H	OD2	ASP	V	282
R	-	CD	PRO	A	41	L	H	CB	GLU	V	278
R	-	CD	PRO	A	41	L	H	HB2	GLU	V	278
R	-	CD	PRO	A	41	L	H	HB3	GLU	V	278
R	-	CD	PRO	A	41	L	H	OD2	ASP	V	282
R	H	N	THR	A	42	L	H	HB3	GLU	V	278
R	H	N	THR	A	42	L	H	HG2	GLU	V	278
R	H	CB	LEU	A	44	L	H	HG2	GLU	V	278
R	H	CB	LEU	A	44	L	H	HG3	GLU	V	278
R	H	CD2	LEU	A	44	L	H	HE2	PHE	V	281
R	H	CA	GLU	A	49	L	-	HE1	PHE	V	230
R	H	CB	GLU	A	49	L	-	CD1	PHE	V	230
R	H	CB	GLU	A	49	L	-	CE1	PHE	V	230
R	H	CB	GLU	A	49	L	-	HD1	PHE	V	230
R	H	CB	GLU	A	49	L	-	HE1	PHE	V	230
R	H	CG	GLU	A	49	L	-	CD1	PHE	V	230
R	H	CG	GLU	A	49	L	-	CE1	PHE	V	230
R	H	CG	GLU	A	49	L	-	CZ	PHE	V	230
R	H	CG	GLU	A	49	L	-	HD1	PHE	V	230
R	H	CG	GLU	A	49	L	-	HE1	PHE	V	230
R	H	CG	GLU	A	49	L	-	HZ	PHE	V	230
R	H	CD	GLU	A	49	L	-	CG	PHE	V	230
R	H	CD	GLU	A	49	L	-	CD1	PHE	V	230
R	H	CD	GLU	A	49	L	-	CD2	PHE	V	230
R	H	CD	GLU	A	49	L	-	CE1	PHE	V	230
R	H	CD	GLU	A	49	L	-	CE2	PHE	V	230
R	H	CD	GLU	A	49	L	-	CZ	PHE	V	230
R	H	CD	GLU	A	49	L	-	HD1	PHE	V	230
R	H	CD	GLU	A	49	L	-	HE1	PHE	V	230
R	H	CD	GLU	A	49	L	-	HZ	PHE	V	230
R	H	OE1	GLU	A	49	L	-	CB	PHE	V	230
R	H	OE1	GLU	A	49	L	-	CG	PHE	V	230
R	H	OE1	GLU	A	49	L	-	CD1	PHE	V	230
R	H	OE1	GLU	A	49	L	-	CD2	PHE	V	230
R	H	OE1	GLU	A	49	L	-	CE1	PHE	V	230
R	H	OE1	GLU	A	49	L	-	CE2	PHE	V	230
R	H	OE1	GLU	A	49	L	-	CZ	PHE	V	230
R	H	OE1	GLU	A	49	L	-	HB3	PHE	V	230
R	H	OE1	GLU	A	49	L	-	HD1	PHE	V	230
R	H	OE1	GLU	A	49	L	-	HD2	PHE	V	230
R	H	OE1	GLU	A	49	L	-	HE1	PHE	V	230
R	H	OE1	GLU	A	49	L	-	HE2	PHE	V	230
R	H	OE1	GLU	A	49	L	-	HZ	PHE	V	230
R	H	OE2	GLU	A	49	L	-	CD1	PHE	V	230
R	H	OE2	GLU	A	49	L	-	CE1	PHE	V	230
R	H	OE2	GLU	A	49	L	-	CZ	PHE	V	230
R	H	OE2	GLU	A	49	L	-	HD1	PHE	V	230
R	H	OE2	GLU	A	49	L	-	HE1	PHE	V	230
R	H	OE2	GLU	A	49	L	-	HZ	PHE	V	230
R	H	CB	VAL	A	56	L	H	NZ	LYS	V	229
R	H	CB	VAL	A	56	L	H	HD3	LYS	V	229
R	H	CB	VAL	A	56	L	H	HZ2	LYS	V	229
R	H	CG1	VAL	A	56	L	H	CE	LYS	V	229
R	H	CG1	VAL	A	56	L	H	NZ	LYS	V	229
R	H	CG1	VAL	A	56	L	H	HD3	LYS	V	229
R	H	CG1	VAL	A	56	L	H	HE3	LYS	V	229
R	H	CG1	VAL	A	56	L	H	HZ1	LYS	V	229
R	H	CG1	VAL	A	56	L	H	HZ2	LYS	V	229
R	H	CG1	VAL	A	56	L	H	HZ3	LYS	V	229
R	H	CG2	VAL	A	56	L	H	HD3	LYS	V	229
R	H	CG2	VAL	A	56	L	H	HE3	LYS	V	229
R	H	CG2	VAL	A	56	L	H	HZ2	LYS	V	229
R	H	CE	LYS	A	60	L	H	HZ1	LYS	V	229
R	H	NZ	LYS	A	60	L	H	NZ	LYS	V	229
R	H	NZ	LYS	A	60	L	H	HZ1	LYS	V	229
R	H	NZ	LYS	A	60	L	H	HZ2	LYS	V	229
R	H	NZ	LYS	A	60	L	H	HZ3	LYS	V	229
R	H	CD2	PHE	A	66	L	S	HG22	ILE	V	35
R	H	CD2	PHE	A	66	L	S	CG1	VAL	V	46
R	H	CD2	PHE	A	66	L	S	HG13	VAL	V	46
R	H	CD2	PHE	A	66	L	S	HG22	VAL	V	46
R	H	CE1	PHE	A	66	L	S	OE1	GLU	V	37
R	H	CE2	PHE	A	66	L	S	HG22	ILE	V	35
R	H	CE2	PHE	A	66	L	S	OE1	GLU	V	37
R	H	CE2	PHE	A	66	L	S	CG1	VAL	V	46
R	H	CE2	PHE	A	66	L	S	HG12	VAL	V	46
R	H	CE2	PHE	A	66	L	S	HG13	VAL	V	46
R	H	CE2	PHE	A	66	L	S	HG22	VAL	V	46
R	H	CZ	PHE	A	66	L	S	CD	GLU	V	37
R	H	CZ	PHE	A	66	L	S	OE1	GLU	V	37
R	H	CZ	PHE	A	66	L	S	HG13	VAL	V	46
R	H	CB	VAL	A	69	L	S	HG13	ILE	V	35
R	H	CG1	VAL	A	69	L	S	CG1	ILE	V	35
R	H	CG1	VAL	A	69	L	S	CD1	ILE	V	35
R	H	CG1	VAL	A	69	L	S	HG12	ILE	V	35
R	H	CG1	VAL	A	69	L	S	HG13	ILE	V	35
R	H	CG1	VAL	A	69	L	S	HD11	ILE	V	35
R	H	CD1	LEU	A	73	L	-	HB2	PRO	V	33
R	H	CD1	LEU	A	73	L	S	CB	ILE	V	35
R	H	CD1	LEU	A	73	L	S	CG1	ILE	V	35
R	H	CD1	LEU	A	73	L	S	H	ILE	V	35
R	H	CD1	LEU	A	73	L	S	HB	ILE	V	35
R	H	CD1	LEU	A	73	L	S	HG12	ILE	V	35
R	H	CD1	LEU	A	73	L	S	HG13	ILE	V	35
R	H	CD2	LEU	A	73	L	-	H	ASP	V	34
R	H	CD2	LEU	A	73	L	-	HB3	ASP	V	34
R	H	CD2	LEU	A	73	L	S	H	ILE	V	35
R	H	CB	PHE	A	80	L	-	HB3	PRO	V	29
R	H	CG	PHE	A	80	L	-	HB3	PRO	V	29
R	H	CB	GLU	A	84	L	-	HD2	PRO	V	29
R	H	CG	GLU	A	84	L	-	O	ALA	V	27
R	H	CG	GLU	A	84	L	-	HD2	PRO	V	29
R	H	CD	GLU	A	84	L	-	CB	SER	V	26
R	H	CD	GLU	A	84	L	-	HA	SER	V	26
R	H	CD	GLU	A	84	L	-	HB3	SER	V	26
R	H	CD	GLU	A	84	L	-	O	ALA	V	27
R	H	OE1	GLU	A	84	L	-	HA	SER	V	26
R	H	OE1	GLU	A	84	L	-	HB3	SER	V	26
R	H	OE2	GLU	A	84	L	-	CA	SER	V	26
R	H	OE2	GLU	A	84	L	-	C	SER	V	26
R	H	OE2	GLU	A	84	L	-	CB	SER	V	26
R	H	OE2	GLU	A	84	L	-	OG	SER	V	26
R	H	OE2	GLU	A	84	L	-	HA	SER	V	26
R	H	OE2	GLU	A	84	L	-	HB2	SER	V	26
R	H	OE2	GLU	A	84	L	-	HB3	SER	V	26
R	H	CG	HIS	A	87	L	-	HG	SER	V	26
R	H	CD2	HIS	A	87	L	-	OG	SER	V	26
R	H	CD2	HIS	A	87	L	-	HG	SER	V	26
R	H	NE2	HIS	A	87	L	-	HG	SER	V	26
R	H	CG1	VAL	A	154	L	-	HG3	PRO	V	56
R	-	CG	PRO	A	165	L	-	OD2	ASP	V	57
R	H	N	LYS	A	171	L	-	OD2	ASP	V	57
R	H	CA	LYS	A	171	L	-	CG	ASP	V	57
R	H	CA	LYS	A	171	L	-	OD2	ASP	V	57
R	H	CA	LYS	A	171	L	-	HB2	ASP	V	57
R	H	C	LYS	A	171	L	-	OD2	ASP	V	57
R	H	C	LYS	A	171	L	-	HB2	ASP	V	57
R	H	CB	LYS	A	171	L	-	CB	ASP	V	57
R	H	CB	LYS	A	171	L	-	CG	ASP	V	57
R	H	CB	LYS	A	171	L	-	OD2	ASP	V	57
R	H	CB	LYS	A	171	L	-	HB2	ASP	V	57
R	H	CB	LYS	A	171	L	-	HB3	ASP	V	57
R	H	O	LYS	A	171	L	-	OD2	ASP	V	57
R	H	O	LYS	A	171	L	-	HB2	ASP	V	57
R	H	CG	LYS	A	171	L	-	CB	ASP	V	57
R	H	CG	LYS	A	171	L	-	CG	ASP	V	57
R	H	CG	LYS	A	171	L	-	OD1	ASP	V	57
R	H	CG	LYS	A	171	L	-	OD2	ASP	V	57
R	H	CG	LYS	A	171	L	-	HB3	ASP	V	57
R	H	CD	LYS	A	171	L	-	CG	ASP	V	57
R	H	CD	LYS	A	171	L	-	OD1	ASP	V	57
R	H	CD	LYS	A	171	L	-	OD2	ASP	V	57
R	H	CD	LYS	A	171	L	-	HB3	ASP	V	57
R	H	CA	ILE	A	172	L	H	HG3	PRO	V	123
R	H	O	ILE	A	172	L	H	HG3	PRO	V	123
R	H	CG2	ILE	A	172	L	H	HG3	PRO	V	123
R	H	C	CYS	A	174	L	-	HB2	PRO	V	56
R	H	C	CYS	A	174	L	-	HD3	PRO	V	56
R	H	CB	CYS	A	174	L	-	HB2	PRO	V	56
R	H	O	CYS	A	174	L	-	HG3	PRO	V	56
R	H	O	CYS	A	174	L	-	HD3	PRO	V	56
R	H	SG	CYS	A	174	L	-	CB	PRO	V	56
R	H	SG	CYS	A	174	L	-	CG	PRO	V	56
R	H	SG	CYS	A	174	L	-	HB2	PRO	V	56
R	H	SG	CYS	A	174	L	-	HB3	PRO	V	56
R	H	SG	CYS	A	174	L	-	HG3	PRO	V	56
R	H	CA	ILE	A	175	L	-	HG11	VAL	V	55
R	H	CA	ILE	A	175	L	-	HG13	VAL	V	55
R	H	CA	ILE	A	175	L	-	HD3	PRO	V	56
R	H	C	ILE	A	175	L	-	HG13	VAL	V	55
R	H	CB	ILE	A	175	L	-	CG1	VAL	V	55
R	H	CB	ILE	A	175	L	-	HG11	VAL	V	55
R	H	CB	ILE	A	175	L	-	HG12	VAL	V	55
R	H	CB	ILE	A	175	L	-	HG13	VAL	V	55
R	H	CB	ILE	A	175	L	-	O	PRO	V	56
R	H	CB	ILE	A	175	L	H	CG	PRO	V	123
R	H	CB	ILE	A	175	L	H	HG2	PRO	V	123
R	H	CB	ILE	A	175	L	H	HG3	PRO	V	123
R	H	CB	ILE	A	175	L	H	HD3	PRO	V	123
R	H	O	ILE	A	175	L	-	HG13	VAL	V	55
R	H	CG1	ILE	A	175	L	-	CG1	VAL	V	55
R	H	CG1	ILE	A	175	L	-	HG11	VAL	V	55
R	H	CG1	ILE	A	175	L	-	HG12	VAL	V	55
R	H	CG1	ILE	A	175	L	-	HG13	VAL	V	55
R	H	CG1	ILE	A	175	L	-	C	PRO	V	56
R	H	CG1	ILE	A	175	L	-	O	PRO	V	56
R	H	CG1	ILE	A	175	L	-	HB2	ASP	V	57
R	H	CG1	ILE	A	175	L	-	H	SER	V	58
R	H	CG1	ILE	A	175	L	H	HD3	PRO	V	123
R	H	CG2	ILE	A	175	L	-	CG1	VAL	V	55
R	H	CG2	ILE	A	175	L	-	HG11	VAL	V	55
R	H	CG2	ILE	A	175	L	-	HG12	VAL	V	55
R	H	CG2	ILE	A	175	L	-	HG13	VAL	V	55
R	H	CG2	ILE	A	175	L	-	HA	LEU	V	122
R	H	CG2	ILE	A	175	L	H	CG	PRO	V	123
R	H	CG2	ILE	A	175	L	H	CD	PRO	V	123
R	H	CG2	ILE	A	175	L	H	HG2	PRO	V	123
R	H	CG2	ILE	A	175	L	H	HG3	PRO	V	123
R	H	CG2	ILE	A	175	L	H	HD2	PRO	V	123
R	H	CG2	ILE	A	175	L	H	HD3	PRO	V	123
R	H	CG2	ILE	A	175	L	H	H	GLU	V	124
R	H	CD1	ILE	A	175	L	-	HG11	VAL	V	55
R	H	CD1	ILE	A	175	L	-	O	PRO	V	56
R	H	CD1	ILE	A	175	L	-	HB2	ASP	V	57
R	H	CD1	ILE	A	175	L	-	O	GLU	V	121
R	H	CD1	ILE	A	175	L	H	CG	PRO	V	123
R	H	CD1	ILE	A	175	L	H	CD	PRO	V	123
R	H	CD1	ILE	A	175	L	H	HG3	PRO	V	123
R	H	CD1	ILE	A	175	L	H	HD2	PRO	V	123
R	H	CD1	ILE	A	175	L	H	HD3	PRO	V	123
R	H	CA	ILE	A	176	L	H	HB2	GLU	V	124
R	H	CB	ILE	A	176	L	H	HB2	GLU	V	124
R	H	CG1	ILE	A	176	L	H	HG2	PRO	V	123
R	H	CG1	ILE	A	176	L	H	HB2	GLU	V	124
R	H	C	ALA	A	178	L	-	CD1	LEU	V	99
R	H	C	ALA	A	178	L	-	HD11	LEU	V	99
R	H	C	ALA	A	178	L	-	HD12	LEU	V	99
R	H	C	ALA	A	178	L	-	HD13	LEU	V	99
R	H	CB	ALA	A	178	L	-	HA	VAL	V	55
R	H	CB	ALA	A	178	L	-	CD	PRO	V	56
R	H	CB	ALA	A	178	L	-	HG3	PRO	V	56
R	H	CB	ALA	A	178	L	-	HD2	PRO	V	56
R	H	CB	ALA	A	178	L	-	HD3	PRO	V	56
R	H	O	ALA	A	178	L	-	CD1	LEU	V	99
R	H	O	ALA	A	178	L	-	HD11	LEU	V	99
R	H	O	ALA	A	178	L	-	HD12	LEU	V	99
R	H	O	ALA	A	178	L	-	HD13	LEU	V	99
R	H	N	LEU	A	179	L	-	CD1	LEU	V	99
R	H	N	LEU	A	179	L	-	HD11	LEU	V	99
R	H	N	LEU	A	179	L	-	HD12	LEU	V	99
R	H	N	LEU	A	179	L	-	HD13	LEU	V	99
R	H	N	LEU	A	179	L	-	HD22	LEU	V	99
R	H	CA	LEU	A	179	L	-	CB	LEU	V	99
R	H	CA	LEU	A	179	L	-	CG	LEU	V	99
R	H	CA	LEU	A	179	L	-	CD1	LEU	V	99
R	H	CA	LEU	A	179	L	-	HB2	LEU	V	99
R	H	CA	LEU	A	179	L	-	HB3	LEU	V	99
R	H	CA	LEU	A	179	L	-	HD11	LEU	V	99
R	H	CA	LEU	A	179	L	-	HD12	LEU	V	99
R	H	CA	LEU	A	179	L	-	HD13	LEU	V	99
R	H	CA	LEU	A	179	L	-	HD22	LEU	V	99
R	H	C	LEU	A	179	L	-	CB	LEU	V	99
R	H	C	LEU	A	179	L	-	CD1	LEU	V	99
R	H	C	LEU	A	179	L	-	HB2	LEU	V	99
R	H	C	LEU	A	179	L	-	HB3	LEU	V	99
R	H	C	LEU	A	179	L	-	HD11	LEU	V	99
R	H	C	LEU	A	179	L	-	HD13	LEU	V	99
R	H	CB	LEU	A	179	L	H	OH	TYR	V	95
R	H	CB	LEU	A	179	L	H	HH	TYR	V	95
R	H	CB	LEU	A	179	L	-	HB3	LEU	V	99
R	H	CB	LEU	A	179	L	-	HD13	LEU	V	99
R	H	CB	LEU	A	179	L	-	HD22	LEU	V	99
R	H	CB	LEU	A	179	L	H	CG	GLU	V	124
R	H	CB	LEU	A	179	L	H	HB3	GLU	V	124
R	H	CB	LEU	A	179	L	H	HG2	GLU	V	124
R	H	O	LEU	A	179	L	-	CB	LEU	V	99
R	H	O	LEU	A	179	L	-	O	LEU	V	99
R	H	O	LEU	A	179	L	-	CG	LEU	V	99
R	H	O	LEU	A	179	L	-	CD1	LEU	V	99
R	H	O	LEU	A	179	L	-	HB2	LEU	V	99
R	H	O	LEU	A	179	L	-	HB3	LEU	V	99
R	H	O	LEU	A	179	L	-	HD11	LEU	V	99
R	H	O	LEU	A	179	L	-	HD13	LEU	V	99
R	H	CG	LEU	A	179	L	-	HG13	VAL	V	55
R	H	CG	LEU	A	179	L	-	HG22	VAL	V	55
R	H	CG	LEU	A	179	L	-	HG23	VAL	V	55
R	H	CG	LEU	A	179	L	H	OH	TYR	V	95
R	H	CG	LEU	A	179	L	H	CZ	TYR	V	95
R	H	CG	LEU	A	179	L	H	HE1	TYR	V	95
R	H	CG	LEU	A	179	L	H	HH	TYR	V	95
R	H	CG	LEU	A	179	L	-	CD2	LEU	V	99
R	H	CG	LEU	A	179	L	-	HB3	LEU	V	99
R	H	CG	LEU	A	179	L	-	HD13	LEU	V	99
R	H	CG	LEU	A	179	L	-	HD22	LEU	V	99
R	H	CG	LEU	A	179	L	H	HB3	GLU	V	124
R	H	CG	LEU	A	179	L	H	HG2	GLU	V	124
R	H	CD1	LEU	A	179	L	H	CE1	TYR	V	95
R	H	CD1	LEU	A	179	L	H	OH	TYR	V	95
R	H	CD1	LEU	A	179	L	H	CZ	TYR	V	95
R	H	CD1	LEU	A	179	L	H	HE1	TYR	V	95
R	H	CD1	LEU	A	179	L	H	HH	TYR	V	95
R	H	CD1	LEU	A	179	L	-	HD22	LEU	V	99
R	H	CD1	LEU	A	179	L	H	CA	GLU	V	124
R	H	CD1	LEU	A	179	L	H	CB	GLU	V	124
R	H	CD1	LEU	A	179	L	H	CG	GLU	V	124
R	H	CD1	LEU	A	179	L	H	H	GLU	V	124
R	H	CD1	LEU	A	179	L	H	HB2	GLU	V	124
R	H	CD1	LEU	A	179	L	H	HB3	GLU	V	124
R	H	CD1	LEU	A	179	L	H	HG2	GLU	V	124
R	H	CD1	LEU	A	179	L	H	HG3	GLU	V	124
R	H	CD1	LEU	A	179	L	H	H	LEU	V	125
R	H	CD2	LEU	A	179	L	-	CG2	VAL	V	55
R	H	CD2	LEU	A	179	L	-	HG22	VAL	V	55
R	H	CD2	LEU	A	179	L	-	HG23	VAL	V	55
R	H	CD2	LEU	A	179	L	H	CE1	TYR	V	95
R	H	CD2	LEU	A	179	L	H	CE2	TYR	V	95
R	H	CD2	LEU	A	179	L	H	OH	TYR	V	95
R	H	CD2	LEU	A	179	L	H	CZ	TYR	V	95
R	H	CD2	LEU	A	179	L	H	HE1	TYR	V	95
R	H	CD2	LEU	A	179	L	H	HE2	TYR	V	95
R	H	CD2	LEU	A	179	L	H	HH	TYR	V	95
R	H	CD2	LEU	A	179	L	-	CA	LEU	V	99
R	H	CD2	LEU	A	179	L	-	CB	LEU	V	99
R	H	CD2	LEU	A	179	L	-	CG	LEU	V	99
R	H	CD2	LEU	A	179	L	-	CD1	LEU	V	99
R	H	CD2	LEU	A	179	L	-	CD2	LEU	V	99
R	H	CD2	LEU	A	179	L	-	HA	LEU	V	99
R	H	CD2	LEU	A	179	L	-	HB3	LEU	V	99
R	H	CD2	LEU	A	179	L	-	HD13	LEU	V	99
R	H	CD2	LEU	A	179	L	-	HD21	LEU	V	99
R	H	CD2	LEU	A	179	L	-	HD22	LEU	V	99
R	H	CD2	LEU	A	179	L	-	HD23	LEU	V	99
R	H	N	LEU	A	180	L	-	HD13	LEU	V	99
R	H	CG	LEU	A	180	L	H	HH21	ARG	V	128
R	H	CD2	LEU	A	180	L	H	NH2	ARG	V	128
R	H	CD2	LEU	A	180	L	H	HH21	ARG	V	128
R	H	CD2	LEU	A	180	L	H	HH22	ARG	V	128
R	H	CA	ILE	A	182	L	-	HD11	LEU	V	99
R	H	CB	ILE	A	182	L	-	CD1	LEU	V	99
R	H	CB	ILE	A	182	L	-	HD11	LEU	V	99
R	H	CB	ILE	A	182	L	-	HD12	LEU	V	99
R	H	CG1	ILE	A	182	L	-	HD11	LEU	V	99
R	H	CG1	ILE	A	182	L	-	HD12	LEU	V	99
R	H	CG2	ILE	A	182	L	-	HD11	LEU	V	99
R	H	CD1	ILE	A	182	L	-	O	SER	V	54
R	H	CD1	ILE	A	182	L	-	CD1	LEU	V	99
R	H	CD1	ILE	A	182	L	-	HD11	LEU	V	99
R	H	CD1	ILE	A	182	L	-	HD12	LEU	V	99
R	H	N	PRO	A	183	L	-	HD11	LEU	V	99
R	H	CB	PRO	A	183	L	-	NE2	GLN	V	100
R	H	CB	PRO	A	183	L	-	HE21	GLN	V	100
R	H	CG	PRO	A	183	L	H	O	ASP	V	98
R	H	CG	PRO	A	183	L	-	HB2	LEU	V	99
R	H	CG	PRO	A	183	L	-	HD11	LEU	V	99
R	H	CG	PRO	A	183	L	-	NE2	GLN	V	100
R	H	CG	PRO	A	183	L	-	HE21	GLN	V	100
R	H	CG	PRO	A	183	L	-	HE22	GLN	V	100
R	H	CD	PRO	A	183	L	-	CD1	LEU	V	99
R	H	CD	PRO	A	183	L	-	HB2	LEU	V	99
R	H	CD	PRO	A	183	L	-	HD11	LEU	V	99
R	-	N	SER	A	252	L	-	OG	SER	V	23
R	-	N	SER	A	252	L	-	HG	SER	V	23
R	-	CA	SER	A	252	L	-	OG	SER	V	23
R	-	CA	SER	A	252	L	-	HG	SER	V	23
R	-	CB	SER	A	252	L	-	CB	SER	V	22
R	-	CB	SER	A	252	L	-	HA	SER	V	22
R	-	CB	SER	A	252	L	-	HB2	SER	V	22
R	-	CB	SER	A	252	L	-	N	SER	V	23
R	-	CB	SER	A	252	L	-	OG	SER	V	23
R	-	CB	SER	A	252	L	-	H	SER	V	23
R	-	CB	SER	A	252	L	-	HG	SER	V	23
R	-	OG	SER	A	252	L	-	CB	SER	V	22
R	-	OG	SER	A	252	L	-	HB2	SER	V	22
R	-	OG	SER	A	252	L	-	OG	SER	V	23
R	-	OG	SER	A	252	L	-	H	SER	V	23
R	-	OG	SER	A	252	L	-	HG	SER	V	23
R	H	CB	ASP	A	255	L	-	HG	SER	V	25
R	H	CG	ASP	A	255	L	-	CB	SER	V	23
R	H	CG	ASP	A	255	L	-	O	SER	V	23
R	H	CG	ASP	A	255	L	-	OG	SER	V	23
R	H	CG	ASP	A	255	L	-	HB2	SER	V	23
R	H	CG	ASP	A	255	L	-	HG	SER	V	23
R	H	OD1	ASP	A	255	L	-	C	SER	V	23
R	H	OD1	ASP	A	255	L	-	O	SER	V	23
R	H	OD1	ASP	A	255	L	-	OG	SER	V	23
R	H	OD1	ASP	A	255	L	-	HG	SER	V	23
R	H	OD1	ASP	A	255	L	-	H	SER	V	25
R	H	OD2	ASP	A	255	L	-	CB	SER	V	23
R	H	OD2	ASP	A	255	L	-	O	SER	V	23
R	H	OD2	ASP	A	255	L	-	OG	SER	V	23
R	H	OD2	ASP	A	255	L	-	HB2	SER	V	23
R	H	OD2	ASP	A	255	L	-	HB3	SER	V	23
R	H	OD2	ASP	A	255	L	-	HG	SER	V	23
R	H	CD1	TYR	A	258	L	-	HG	SER	V	25
R	H	CE1	TYR	A	258	L	-	HG	SER	V	25
R	H	CE1	TYR	A	258	L	-	HB2	ALA	V	27
R	H	CE2	TYR	A	258	L	-	HB2	ALA	V	27
R	H	OH	TYR	A	258	L	-	CB	ALA	V	27
R	H	OH	TYR	A	258	L	-	HB1	ALA	V	27
R	H	OH	TYR	A	258	L	-	HB2	ALA	V	27
R	H	OH	TYR	A	258	L	-	HB3	ALA	V	27
R	H	CZ	TYR	A	258	L	-	CB	ALA	V	27
R	H	CZ	TYR	A	258	L	-	HB2	ALA	V	27
R	-	CE1	PHE	A	269	L	-	HB3	PRO	V	30
R	-	OD2	ASP	A	271	L	-	HA	ALA	V	27
R	-	OD2	ASP	A	271	L	-	HB2	ALA	V	27
R	-	CD2	TYR	A	272	L	-	HB2	SER	V	25
R	-	CD2	TYR	A	272	L	-	HG	SER	V	25
R	-	CE2	TYR	A	272	L	-	CB	SER	V	25
R	-	CE2	TYR	A	272	L	-	OG	SER	V	25
R	-	CE2	TYR	A	272	L	-	HB2	SER	V	25
R	-	CE2	TYR	A	272	L	-	HB3	SER	V	25
R	-	CE2	TYR	A	272	L	-	HG	SER	V	25
R	-	OH	TYR	A	272	L	-	HB2	SER	V	23
R	-	OH	TYR	A	272	L	-	N	SER	V	25
R	-	OH	TYR	A	272	L	-	CA	SER	V	25
R	-	OH	TYR	A	272	L	-	CB	SER	V	25
R	-	OH	TYR	A	272	L	-	OG	SER	V	25
R	-	OH	TYR	A	272	L	-	H	SER	V	25
R	-	OH	TYR	A	272	L	-	HB2	SER	V	25
R	-	OH	TYR	A	272	L	-	HB3	SER	V	25
R	-	OH	TYR	A	272	L	-	HG	SER	V	25
R	-	CZ	TYR	A	272	L	-	CB	SER	V	25
R	-	CZ	TYR	A	272	L	-	OG	SER	V	25
R	-	CZ	TYR	A	272	L	-	HB2	SER	V	25
R	-	CZ	TYR	A	272	L	-	HG	SER	V	25
R	-	C	PRO	A	412	L	-	HG23	THR	V	306
R	-	CB	PRO	A	412	L	-	O	THR	V	306
R	-	CB	PRO	A	412	L	-	HB	THR	V	306
R	-	CB	PRO	A	412	L	-	CB	ASP	V	307
R	-	CB	PRO	A	412	L	-	CG	ASP	V	307
R	-	CB	PRO	A	412	L	-	OD1	ASP	V	307
R	-	CB	PRO	A	412	L	-	OD2	ASP	V	307
R	-	CB	PRO	A	412	L	-	HA	ASP	V	307
R	-	CB	PRO	A	412	L	-	HB2	ASP	V	307
R	-	O	PRO	A	412	L	-	HB	THR	V	306
R	-	O	PRO	A	412	L	-	HG21	THR	V	306
R	-	O	PRO	A	412	L	-	HG23	THR	V	306
R	-	CG	PRO	A	412	L	-	O	THR	V	306
R	-	CG	PRO	A	412	L	-	HB	THR	V	306
R	-	CG	PRO	A	412	L	-	CB	ASP	V	307
R	-	CG	PRO	A	412	L	-	CG	ASP	V	307
R	-	CG	PRO	A	412	L	-	OD2	ASP	V	307
R	-	CG	PRO	A	412	L	-	HB2	ASP	V	307
R	-	CD	PRO	A	412	L	-	OD2	ASP	V	307
R	-	N	HIS	A	413	L	-	O	THR	V	306
R	-	N	HIS	A	413	L	-	HG23	THR	V	306
R	-	CA	HIS	A	413	L	-	O	THR	V	306
R	-	CA	HIS	A	413	L	-	CG2	THR	V	306
R	-	CA	HIS	A	413	L	-	HG21	THR	V	306
R	-	CA	HIS	A	413	L	-	HG23	THR	V	306
R	-	C	HIS	A	413	L	-	O	THR	V	306
R	-	C	HIS	A	413	L	-	CG2	THR	V	306
R	-	C	HIS	A	413	L	-	HG23	THR	V	306
R	-	CB	HIS	A	413	L	-	HG23	THR	V	306
R	-	O	HIS	A	413	L	-	O	THR	V	306
R	-	O	HIS	A	413	L	-	HG23	THR	V	306
R	-	CG	HIS	A	413	L	-	CG2	THR	V	306
R	-	CG	HIS	A	413	L	-	HG21	THR	V	306
R	-	CG	HIS	A	413	L	-	HG23	THR	V	306
R	-	CD2	HIS	A	413	L	-	CG2	THR	V	306
R	-	CD2	HIS	A	413	L	-	HG21	THR	V	306
R	-	CD2	HIS	A	413	L	-	HG22	THR	V	306
R	-	CD2	HIS	A	413	L	-	HG23	THR	V	306
R	-	ND1	HIS	A	413	L	-	HG23	THR	V	306
R	-	CE1	HIS	A	413	L	-	HG21	THR	V	306
R	-	CE1	HIS	A	413	L	-	HG22	THR	V	306
R	-	NE2	HIS	A	413	L	-	CG2	THR	V	306
R	-	NE2	HIS	A	413	L	-	HG21	THR	V	306
R	-	NE2	HIS	A	413	L	-	HG22	THR	V	306
R	-	NE2	HIS	A	413	L	-	HG23	THR	V	306
R	-	N	CYS	A	414	L	-	O	THR	V	306
R	-	N	CYS	A	414	L	-	CG2	THR	V	306
R	-	N	CYS	A	414	L	-	HA	THR	V	306
R	-	N	CYS	A	414	L	-	HG22	THR	V	306
R	-	N	CYS	A	414	L	-	HG23	THR	V	306
R	-	CA	CYS	A	414	L	-	HA	THR	V	306
R	-	CA	CYS	A	414	L	-	HG23	THR	V	306
R	-	CB	CYS	A	414	L	-	O	SER	V	305
R	-	CB	CYS	A	414	L	-	CG2	THR	V	306
R	-	CB	CYS	A	414	L	-	HA	THR	V	306
R	-	CB	CYS	A	414	L	-	HG22	THR	V	306
R	-	CB	CYS	A	414	L	-	HG23	THR	V	306
R	-	SG	CYS	A	414	L	-	O	SER	V	305
R	-	SG	CYS	A	414	L	-	HA	THR	V	306
R	-	O	ALA	A	420	L	-	O	MET	V	1
R	-	O	ALA	A	420	L	-	HB2	MET	V	1
R	-	CG2	VAL	A	421	L	-	CB	MET	V	1
R	-	CG2	VAL	A	421	L	-	SD	MET	V	1
R	-	CG2	VAL	A	421	L	-	HB2	MET	V	1
R	-	CG2	VAL	A	421	L	-	HB3	MET	V	1
R	-	CG1	ILE	A	422	L	-	O	ALA	V	2
R	-	CG1	ILE	A	422	L	-	HB2	LEU	V	3
R	-	CG1	ILE	A	422	L	-	HD11	LEU	V	3
R	-	CD1	ILE	A	422	L	-	O	ALA	V	2
R	-	CD1	ILE	A	422	L	-	CD1	LEU	V	3
R	-	CD1	ILE	A	422	L	-	HB2	LEU	V	3
R	-	CD1	ILE	A	422	L	-	HD11	LEU	V	3
R	-	ND2	ASN	A	424	L	-	N	ASP	V	5
R	-	ND2	ASN	A	424	L	-	CA	ASP	V	5
R	-	ND2	ASN	A	424	L	-	C	ASP	V	5
R	-	ND2	ASN	A	424	L	-	O	ASP	V	5
R	-	ND2	ASN	A	424	L	-	H	ASP	V	5
R	-	ND2	ASN	A	424	L	-	N	SER	V	6
R	-	ND2	ASN	A	424	L	-	HB2	SER	V	6
R	-	ND2	ASN	A	424	L	-	HG	SER	V	6

- 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