IID

P25021_P50406.46 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	101	L	H	ALA	V	26
R	H	LEU	A	101	L	H	LEU	V	30
R	H	LEU	A	141	L	H	VAL	V	89
R	H	LEU	A	144	L	-	PHE	V	86
R	H	LEU	A	144	L	H	GLY	V	87
R	H	LEU	A	144	L	H	VAL	V	89
R	H	LEU	A	148	L	-	PHE	V	86
R	H	LEU	A	148	L	H	PHE	V	90
R	H	TRP	A	151	L	-	PHE	V	86
R	-	THR	A	412	L	-	ARG	V	161
R	-	THR	A	412	L	-	THR	V	164
R	-	ARG	A	413	L	H	ASP	V	263
R	-	ALA	A	414	L	-	ARG	V	161
R	-	ALA	A	414	L	-	SER	V	165
R	-	ALA	A	414	L	-	HIS	V	169
R	-	ALA	A	414	L	H	ASP	V	262
R	-	ALA	A	414	L	H	ASP	V	263
R	-	ALA	A	415	L	-	HIS	V	169
R	-	ALA	A	415	L	-	LYS	V	173
R	-	ALA	A	415	L	-	LYS	V	175
R	-	ALA	A	415	L	H	ASP	V	262
R	-	ALA	A	416	L	-	GLY	V	167
R	-	ALA	A	416	L	-	HIS	V	169
R	-	ALA	A	416	L	-	THR	V	171
R	-	ALA	A	416	L	-	LYS	V	173
R	-	ALA	A	417	L	-	GLU	V	163
R	-	ALA	A	417	L	-	LYS	V	173
R	-	ALA	A	417	L	-	GLN	V	177
R	-	VAL	A	418	L	-	HIS	V	169
R	-	VAL	A	418	L	-	THR	V	171
R	-	VAL	A	418	L	-	SER	V	172
R	-	VAL	A	418	L	-	LYS	V	173
R	-	ASN	A	419	L	-	GLU	V	163
R	-	ASN	A	419	L	H	LYS	V	88
R	-	PHE	A	420	L	-	SER	V	172
R	-	PHE	A	420	L	H	GLY	V	87
R	-	PHE	A	420	L	H	LYS	V	88
R	-	PHE	A	421	L	H	LYS	V	88
R	-	PHE	A	421	L	H	VAL	V	89
R	H	ASN	A	44	L	-	LYS	V	83
R	H	SER	A	45	L	-	LYS	V	83
R	H	ILE	A	48	L	-	LYS	V	83
R	H	CYS	A	52	L	-	THR	V	170
R	H	THR	A	53	L	-	THR	V	170
R	H	THR	A	70	L	-	SER	V	85
R	H	LEU	A	73	L	H	SER	V	81
R	H	LEU	A	73	L	-	LYS	V	83
R	H	MET	A	74	L	H	ILE	V	77
R	H	LEU	A	77	L	H	LYS	V	18
R	H	LEU	A	77	L	H	LEU	V	80
R	H	LEU	A	77	L	H	SER	V	81
R	H	VAL	A	78	L	H	THR	V	22
R	H	VAL	A	78	L	H	LEU	V	80
R	H	PRO	A	81	L	H	ILE	V	19
R	H	MET	A	84	L	H	ILE	V	19
R	H	LEU	A	85	L	H	ILE	V	19
R	-	LEU	A	94	L	H	VAL	V	23
R	-	ALA	A	95	L	H	VAL	V	27
R	H	GLY	A	97	L	H	LEU	V	30
R	H	LEU	A	98	L	H	VAL	V	23
R	H	LEU	A	98	L	H	ALA	V	26
R	H	LEU	A	98	L	H	VAL	V	27

- 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

P25021_P50406.46 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	ASN	A	44	L	-	HZ1	LYS	V	83
R	H	N	SER	A	45	L	-	HZ2	LYS	V	83
R	H	CA	SER	A	45	L	-	NZ	LYS	V	83
R	H	CA	SER	A	45	L	-	HZ1	LYS	V	83
R	H	CA	SER	A	45	L	-	HZ2	LYS	V	83
R	H	C	SER	A	45	L	-	HZ2	LYS	V	83
R	H	CB	SER	A	45	L	-	HZ2	LYS	V	83
R	H	O	SER	A	45	L	-	HZ2	LYS	V	83
R	H	OG	SER	A	45	L	-	HZ2	LYS	V	83
R	H	CA	ILE	A	48	L	-	HZ3	LYS	V	83
R	H	CB	ILE	A	48	L	-	NZ	LYS	V	83
R	H	CB	ILE	A	48	L	-	HZ1	LYS	V	83
R	H	CB	ILE	A	48	L	-	HZ2	LYS	V	83
R	H	CB	ILE	A	48	L	-	HZ3	LYS	V	83
R	H	CG1	ILE	A	48	L	-	NZ	LYS	V	83
R	H	CG1	ILE	A	48	L	-	HZ1	LYS	V	83
R	H	CG1	ILE	A	48	L	-	HZ2	LYS	V	83
R	H	CG1	ILE	A	48	L	-	HZ3	LYS	V	83
R	H	CG2	ILE	A	48	L	-	CD	LYS	V	83
R	H	CG2	ILE	A	48	L	-	CE	LYS	V	83
R	H	CG2	ILE	A	48	L	-	NZ	LYS	V	83
R	H	CG2	ILE	A	48	L	-	HD3	LYS	V	83
R	H	CG2	ILE	A	48	L	-	HE3	LYS	V	83
R	H	CG2	ILE	A	48	L	-	HZ1	LYS	V	83
R	H	CG2	ILE	A	48	L	-	HZ2	LYS	V	83
R	H	CG2	ILE	A	48	L	-	HZ3	LYS	V	83
R	H	CD1	ILE	A	48	L	-	CE	LYS	V	83
R	H	CD1	ILE	A	48	L	-	NZ	LYS	V	83
R	H	CD1	ILE	A	48	L	-	HE2	LYS	V	83
R	H	CD1	ILE	A	48	L	-	HE3	LYS	V	83
R	H	CD1	ILE	A	48	L	-	HZ1	LYS	V	83
R	H	CD1	ILE	A	48	L	-	HZ2	LYS	V	83
R	H	CD1	ILE	A	48	L	-	HZ3	LYS	V	83
R	H	CB	CYS	A	52	L	-	O	THR	V	170
R	H	CA	THR	A	53	L	-	HG22	THR	V	170
R	H	CB	THR	A	53	L	-	CG2	THR	V	170
R	H	CB	THR	A	53	L	-	HB	THR	V	170
R	H	CB	THR	A	53	L	-	HG21	THR	V	170
R	H	CB	THR	A	53	L	-	HG22	THR	V	170
R	H	CG2	THR	A	53	L	-	CA	THR	V	170
R	H	CG2	THR	A	53	L	-	CB	THR	V	170
R	H	CG2	THR	A	53	L	-	CG2	THR	V	170
R	H	CG2	THR	A	53	L	-	OG1	THR	V	170
R	H	CG2	THR	A	53	L	-	HA	THR	V	170
R	H	CG2	THR	A	53	L	-	HB	THR	V	170
R	H	CG2	THR	A	53	L	-	HG21	THR	V	170
R	H	CG2	THR	A	53	L	-	HG22	THR	V	170
R	H	CG2	THR	A	53	L	-	HG23	THR	V	170
R	H	OG1	THR	A	53	L	-	HG22	THR	V	170
R	H	CB	THR	A	70	L	-	HB3	SER	V	85
R	H	CB	THR	A	70	L	-	HG	SER	V	85
R	H	CG2	THR	A	70	L	-	CB	SER	V	85
R	H	CG2	THR	A	70	L	-	OG	SER	V	85
R	H	CG2	THR	A	70	L	-	HB2	SER	V	85
R	H	CG2	THR	A	70	L	-	HB3	SER	V	85
R	H	CG2	THR	A	70	L	-	HG	SER	V	85
R	H	OG1	THR	A	70	L	-	CB	SER	V	85
R	H	OG1	THR	A	70	L	-	OG	SER	V	85
R	H	OG1	THR	A	70	L	-	HB2	SER	V	85
R	H	OG1	THR	A	70	L	-	HB3	SER	V	85
R	H	OG1	THR	A	70	L	-	HG	SER	V	85
R	H	CG	LEU	A	73	L	-	HE2	LYS	V	83
R	H	CD2	LEU	A	73	L	H	HB2	SER	V	81
R	H	CD2	LEU	A	73	L	-	CE	LYS	V	83
R	H	CD2	LEU	A	73	L	-	NZ	LYS	V	83
R	H	CD2	LEU	A	73	L	-	HE2	LYS	V	83
R	H	CD2	LEU	A	73	L	-	HE3	LYS	V	83
R	H	CD2	LEU	A	73	L	-	HZ1	LYS	V	83
R	H	CD2	LEU	A	73	L	-	HZ2	LYS	V	83
R	H	SD	MET	A	74	L	H	HG12	ILE	V	77
R	H	SD	MET	A	74	L	H	HG22	ILE	V	77
R	H	SD	MET	A	74	L	H	HG23	ILE	V	77
R	H	SD	MET	A	74	L	H	HD13	ILE	V	77
R	H	CE	MET	A	74	L	H	CG1	ILE	V	77
R	H	CE	MET	A	74	L	H	CD1	ILE	V	77
R	H	CE	MET	A	74	L	H	HG12	ILE	V	77
R	H	CE	MET	A	74	L	H	HD11	ILE	V	77
R	H	CE	MET	A	74	L	H	HD13	ILE	V	77
R	H	CA	LEU	A	77	L	H	CE	LYS	V	18
R	H	CA	LEU	A	77	L	H	NZ	LYS	V	18
R	H	CA	LEU	A	77	L	H	HE2	LYS	V	18
R	H	CA	LEU	A	77	L	H	HZ1	LYS	V	18
R	H	CA	LEU	A	77	L	H	HZ2	LYS	V	18
R	H	C	LEU	A	77	L	H	HE2	LYS	V	18
R	H	CB	LEU	A	77	L	H	CE	LYS	V	18
R	H	CB	LEU	A	77	L	H	NZ	LYS	V	18
R	H	CB	LEU	A	77	L	H	HE2	LYS	V	18
R	H	CB	LEU	A	77	L	H	HE3	LYS	V	18
R	H	CB	LEU	A	77	L	H	HZ1	LYS	V	18
R	H	CB	LEU	A	77	L	H	HZ2	LYS	V	18
R	H	CB	LEU	A	77	L	H	HZ3	LYS	V	18
R	H	O	LEU	A	77	L	H	HG3	LYS	V	18
R	H	O	LEU	A	77	L	H	HE2	LYS	V	18
R	H	CG	LEU	A	77	L	H	CE	LYS	V	18
R	H	CG	LEU	A	77	L	H	NZ	LYS	V	18
R	H	CG	LEU	A	77	L	H	HE2	LYS	V	18
R	H	CG	LEU	A	77	L	H	HE3	LYS	V	18
R	H	CG	LEU	A	77	L	H	HZ1	LYS	V	18
R	H	CG	LEU	A	77	L	H	HZ2	LYS	V	18
R	H	CG	LEU	A	77	L	H	HZ3	LYS	V	18
R	H	CD1	LEU	A	77	L	H	CE	LYS	V	18
R	H	CD1	LEU	A	77	L	H	NZ	LYS	V	18
R	H	CD1	LEU	A	77	L	H	HE2	LYS	V	18
R	H	CD1	LEU	A	77	L	H	HE3	LYS	V	18
R	H	CD1	LEU	A	77	L	H	HZ1	LYS	V	18
R	H	CD1	LEU	A	77	L	H	HZ2	LYS	V	18
R	H	CD1	LEU	A	77	L	H	HZ3	LYS	V	18
R	H	CD1	LEU	A	77	L	H	O	LEU	V	80
R	H	CD1	LEU	A	77	L	H	HA	SER	V	81
R	H	CD2	LEU	A	77	L	H	CD	LYS	V	18
R	H	CD2	LEU	A	77	L	H	CE	LYS	V	18
R	H	CD2	LEU	A	77	L	H	NZ	LYS	V	18
R	H	CD2	LEU	A	77	L	H	HD2	LYS	V	18
R	H	CD2	LEU	A	77	L	H	HD3	LYS	V	18
R	H	CD2	LEU	A	77	L	H	HE2	LYS	V	18
R	H	CD2	LEU	A	77	L	H	HE3	LYS	V	18
R	H	CD2	LEU	A	77	L	H	HZ1	LYS	V	18
R	H	CD2	LEU	A	77	L	H	HZ2	LYS	V	18
R	H	CD2	LEU	A	77	L	H	HZ3	LYS	V	18
R	H	CA	VAL	A	78	L	H	HG21	THR	V	22
R	H	O	VAL	A	78	L	H	HG21	THR	V	22
R	H	CG1	VAL	A	78	L	H	HG21	THR	V	22
R	H	CG2	VAL	A	78	L	H	HD12	LEU	V	80
R	H	CA	PRO	A	81	L	H	HG12	ILE	V	19
R	H	CA	PRO	A	81	L	H	HD11	ILE	V	19
R	H	C	PRO	A	81	L	H	HG12	ILE	V	19
R	H	C	PRO	A	81	L	H	HD11	ILE	V	19
R	H	CB	PRO	A	81	L	H	CG1	ILE	V	19
R	H	CB	PRO	A	81	L	H	CD1	ILE	V	19
R	H	CB	PRO	A	81	L	H	HG12	ILE	V	19
R	H	CB	PRO	A	81	L	H	HG13	ILE	V	19
R	H	CB	PRO	A	81	L	H	HD11	ILE	V	19
R	H	CB	PRO	A	81	L	H	HD13	ILE	V	19
R	H	O	PRO	A	81	L	H	HD11	ILE	V	19
R	H	O	PRO	A	81	L	H	HD13	ILE	V	19
R	H	CG	PRO	A	81	L	H	HG12	ILE	V	19
R	H	CG	PRO	A	81	L	H	HD11	ILE	V	19
R	H	CE	MET	A	84	L	H	HD11	ILE	V	19
R	H	CG	LEU	A	85	L	H	HG23	ILE	V	19
R	H	CG	LEU	A	85	L	H	HD13	ILE	V	19
R	H	CD1	LEU	A	85	L	H	CG2	ILE	V	19
R	H	CD1	LEU	A	85	L	H	HG22	ILE	V	19
R	H	CD1	LEU	A	85	L	H	HG23	ILE	V	19
R	H	CD1	LEU	A	85	L	H	HD13	ILE	V	19
R	H	CD2	LEU	A	85	L	H	HD13	ILE	V	19
R	-	CB	LEU	A	94	L	H	HG22	VAL	V	23
R	-	CB	LEU	A	94	L	H	HG23	VAL	V	23
R	-	CG	LEU	A	94	L	H	CG2	VAL	V	23
R	-	CG	LEU	A	94	L	H	HG22	VAL	V	23
R	-	CG	LEU	A	94	L	H	HG23	VAL	V	23
R	-	CD1	LEU	A	94	L	H	CG2	VAL	V	23
R	-	CD1	LEU	A	94	L	H	HG21	VAL	V	23
R	-	CD1	LEU	A	94	L	H	HG22	VAL	V	23
R	-	CD1	LEU	A	94	L	H	HG23	VAL	V	23
R	-	CD2	LEU	A	94	L	H	CG2	VAL	V	23
R	-	CD2	LEU	A	94	L	H	HG12	VAL	V	23
R	-	CD2	LEU	A	94	L	H	HG21	VAL	V	23
R	-	CD2	LEU	A	94	L	H	HG22	VAL	V	23
R	-	CD2	LEU	A	94	L	H	HG23	VAL	V	23
R	-	CB	ALA	A	95	L	H	HG22	VAL	V	27
R	-	CB	ALA	A	95	L	H	HG23	VAL	V	27
R	H	CA	GLY	A	97	L	H	CD2	LEU	V	30
R	H	CA	GLY	A	97	L	H	HD21	LEU	V	30
R	H	CA	GLY	A	97	L	H	HD22	LEU	V	30
R	H	CA	GLY	A	97	L	H	HD23	LEU	V	30
R	H	C	GLY	A	97	L	H	CD2	LEU	V	30
R	H	C	GLY	A	97	L	H	HD22	LEU	V	30
R	H	C	GLY	A	97	L	H	HD23	LEU	V	30
R	H	O	GLY	A	97	L	H	CD2	LEU	V	30
R	H	O	GLY	A	97	L	H	HD22	LEU	V	30
R	H	O	GLY	A	97	L	H	HD23	LEU	V	30
R	H	CG	LEU	A	98	L	H	HA	VAL	V	23
R	H	CG	LEU	A	98	L	H	HG13	VAL	V	23
R	H	CG	LEU	A	98	L	H	HB3	ALA	V	26
R	H	CG	LEU	A	98	L	H	CG2	VAL	V	27
R	H	CG	LEU	A	98	L	H	HG21	VAL	V	27
R	H	CG	LEU	A	98	L	H	HG23	VAL	V	27
R	H	CD1	LEU	A	98	L	H	CA	VAL	V	23
R	H	CD1	LEU	A	98	L	H	CB	VAL	V	23
R	H	CD1	LEU	A	98	L	H	O	VAL	V	23
R	H	CD1	LEU	A	98	L	H	CG1	VAL	V	23
R	H	CD1	LEU	A	98	L	H	CG2	VAL	V	23
R	H	CD1	LEU	A	98	L	H	HA	VAL	V	23
R	H	CD1	LEU	A	98	L	H	HG11	VAL	V	23
R	H	CD1	LEU	A	98	L	H	HG12	VAL	V	23
R	H	CD1	LEU	A	98	L	H	HG13	VAL	V	23
R	H	CD1	LEU	A	98	L	H	HG23	VAL	V	23
R	H	CD1	LEU	A	98	L	H	HB3	ALA	V	26
R	H	CD1	LEU	A	98	L	H	CG2	VAL	V	27
R	H	CD1	LEU	A	98	L	H	HG21	VAL	V	27
R	H	CD1	LEU	A	98	L	H	HG22	VAL	V	27
R	H	CD1	LEU	A	98	L	H	HG23	VAL	V	27
R	H	CD2	LEU	A	98	L	H	O	VAL	V	23
R	H	CD2	LEU	A	98	L	H	HA	VAL	V	23
R	H	CD2	LEU	A	98	L	H	HG13	VAL	V	23
R	H	CD2	LEU	A	98	L	H	CA	ALA	V	26
R	H	CD2	LEU	A	98	L	H	C	ALA	V	26
R	H	CD2	LEU	A	98	L	H	CB	ALA	V	26
R	H	CD2	LEU	A	98	L	H	HB1	ALA	V	26
R	H	CD2	LEU	A	98	L	H	HB2	ALA	V	26
R	H	CD2	LEU	A	98	L	H	HB3	ALA	V	26
R	H	CD2	LEU	A	98	L	H	N	VAL	V	27
R	H	CD2	LEU	A	98	L	H	CG2	VAL	V	27
R	H	CD2	LEU	A	98	L	H	H	VAL	V	27
R	H	CD2	LEU	A	98	L	H	HA	VAL	V	27
R	H	CD2	LEU	A	98	L	H	HG21	VAL	V	27
R	H	CD2	LEU	A	98	L	H	HG23	VAL	V	27
R	H	CG	LEU	A	101	L	H	HB1	ALA	V	26
R	H	CD2	LEU	A	101	L	H	CA	ALA	V	26
R	H	CD2	LEU	A	101	L	H	C	ALA	V	26
R	H	CD2	LEU	A	101	L	H	CB	ALA	V	26
R	H	CD2	LEU	A	101	L	H	O	ALA	V	26
R	H	CD2	LEU	A	101	L	H	HA	ALA	V	26
R	H	CD2	LEU	A	101	L	H	HB1	ALA	V	26
R	H	CD2	LEU	A	101	L	H	HB2	ALA	V	26
R	H	CD2	LEU	A	101	L	H	HB3	ALA	V	26
R	H	CD2	LEU	A	101	L	H	HB3	LEU	V	30
R	H	CD1	LEU	A	141	L	H	HG22	VAL	V	89
R	H	CD1	LEU	A	144	L	-	O	PHE	V	86
R	H	CD1	LEU	A	144	L	H	HA3	GLY	V	87
R	H	CD2	LEU	A	144	L	H	HA3	GLY	V	87
R	H	CD2	LEU	A	144	L	H	HB	VAL	V	89
R	H	CD1	LEU	A	148	L	H	HB2	PHE	V	90
R	H	CD2	LEU	A	148	L	-	HD1	PHE	V	86
R	H	CD2	TRP	A	151	L	-	HE1	PHE	V	86
R	-	O	THR	A	412	L	-	OG1	THR	V	164
R	-	OG1	THR	A	412	L	-	HH21	ARG	V	161
R	-	CA	ARG	A	413	L	H	OD2	ASP	V	263
R	-	C	ARG	A	413	L	H	CG	ASP	V	263
R	-	C	ARG	A	413	L	H	OD2	ASP	V	263
R	-	CB	ARG	A	413	L	H	OD2	ASP	V	263
R	-	O	ARG	A	413	L	H	CB	ASP	V	263
R	-	O	ARG	A	413	L	H	CG	ASP	V	263
R	-	O	ARG	A	413	L	H	OD1	ASP	V	263
R	-	O	ARG	A	413	L	H	OD2	ASP	V	263
R	-	O	ARG	A	413	L	H	H	ASP	V	263
R	-	O	ARG	A	413	L	H	HB2	ASP	V	263
R	-	CG	ARG	A	413	L	H	OD2	ASP	V	263
R	-	N	ALA	A	414	L	-	CB	SER	V	165
R	-	N	ALA	A	414	L	-	OG	SER	V	165
R	-	N	ALA	A	414	L	-	HB2	SER	V	165
R	-	N	ALA	A	414	L	-	HG	SER	V	165
R	-	N	ALA	A	414	L	H	OD2	ASP	V	263
R	-	CA	ALA	A	414	L	-	HB2	SER	V	165
R	-	CA	ALA	A	414	L	-	HG	SER	V	165
R	-	CA	ALA	A	414	L	H	HB2	ASP	V	262
R	-	CA	ALA	A	414	L	H	OD2	ASP	V	263
R	-	C	ALA	A	414	L	-	CB	SER	V	165
R	-	C	ALA	A	414	L	-	OG	SER	V	165
R	-	C	ALA	A	414	L	-	HB2	SER	V	165
R	-	C	ALA	A	414	L	-	HB3	SER	V	165
R	-	C	ALA	A	414	L	-	HG	SER	V	165
R	-	C	ALA	A	414	L	H	HB2	ASP	V	262
R	-	CB	ALA	A	414	L	-	HD3	ARG	V	161
R	-	CB	ALA	A	414	L	-	HB2	SER	V	165
R	-	CB	ALA	A	414	L	H	CB	ASP	V	262
R	-	CB	ALA	A	414	L	H	OD2	ASP	V	262
R	-	CB	ALA	A	414	L	H	H	ASP	V	262
R	-	CB	ALA	A	414	L	H	HB2	ASP	V	262
R	-	O	ALA	A	414	L	-	CB	SER	V	165
R	-	O	ALA	A	414	L	-	OG	SER	V	165
R	-	O	ALA	A	414	L	-	HB2	SER	V	165
R	-	O	ALA	A	414	L	-	HB3	SER	V	165
R	-	O	ALA	A	414	L	-	HG	SER	V	165
R	-	O	ALA	A	414	L	-	HE2	HIS	V	169
R	-	N	ALA	A	415	L	H	CB	ASP	V	262
R	-	N	ALA	A	415	L	H	HB2	ASP	V	262
R	-	N	ALA	A	415	L	H	HB3	ASP	V	262
R	-	CA	ALA	A	415	L	-	NE2	HIS	V	169
R	-	CA	ALA	A	415	L	-	HE2	HIS	V	169
R	-	C	ALA	A	415	L	-	CD2	HIS	V	169
R	-	C	ALA	A	415	L	-	NE2	HIS	V	169
R	-	C	ALA	A	415	L	-	HD2	HIS	V	169
R	-	C	ALA	A	415	L	-	HE2	HIS	V	169
R	-	CB	ALA	A	415	L	-	HD2	LYS	V	173
R	-	CB	ALA	A	415	L	-	HZ2	LYS	V	173
R	-	CB	ALA	A	415	L	-	HE2	LYS	V	175
R	-	CB	ALA	A	415	L	H	HB3	ASP	V	262
R	-	N	ALA	A	416	L	-	CG	HIS	V	169
R	-	N	ALA	A	416	L	-	CD2	HIS	V	169
R	-	N	ALA	A	416	L	-	NE2	HIS	V	169
R	-	N	ALA	A	416	L	-	HB2	HIS	V	169
R	-	N	ALA	A	416	L	-	HD2	HIS	V	169
R	-	N	ALA	A	416	L	-	HE2	HIS	V	169
R	-	CA	ALA	A	416	L	-	CB	HIS	V	169
R	-	CA	ALA	A	416	L	-	CG	HIS	V	169
R	-	CA	ALA	A	416	L	-	CD2	HIS	V	169
R	-	CA	ALA	A	416	L	-	NE2	HIS	V	169
R	-	CA	ALA	A	416	L	-	HB2	HIS	V	169
R	-	CA	ALA	A	416	L	-	HB3	HIS	V	169
R	-	CA	ALA	A	416	L	-	HD2	HIS	V	169
R	-	C	ALA	A	416	L	-	CB	HIS	V	169
R	-	C	ALA	A	416	L	-	CD2	HIS	V	169
R	-	C	ALA	A	416	L	-	HB2	HIS	V	169
R	-	C	ALA	A	416	L	-	HB3	HIS	V	169
R	-	C	ALA	A	416	L	-	HD2	HIS	V	169
R	-	C	ALA	A	416	L	-	HB2	LYS	V	173
R	-	C	ALA	A	416	L	-	HD2	LYS	V	173
R	-	CB	ALA	A	416	L	-	O	GLY	V	167
R	-	CB	ALA	A	416	L	-	N	HIS	V	169
R	-	CB	ALA	A	416	L	-	CA	HIS	V	169
R	-	CB	ALA	A	416	L	-	CB	HIS	V	169
R	-	CB	ALA	A	416	L	-	CG	HIS	V	169
R	-	CB	ALA	A	416	L	-	CD2	HIS	V	169
R	-	CB	ALA	A	416	L	-	ND1	HIS	V	169
R	-	CB	ALA	A	416	L	-	NE2	HIS	V	169
R	-	CB	ALA	A	416	L	-	H	HIS	V	169
R	-	CB	ALA	A	416	L	-	HB2	HIS	V	169
R	-	CB	ALA	A	416	L	-	HB3	HIS	V	169
R	-	CB	ALA	A	416	L	-	HD2	HIS	V	169
R	-	O	ALA	A	416	L	-	CB	HIS	V	169
R	-	O	ALA	A	416	L	-	CG	HIS	V	169
R	-	O	ALA	A	416	L	-	HB2	HIS	V	169
R	-	O	ALA	A	416	L	-	HB3	HIS	V	169
R	-	O	ALA	A	416	L	-	HD2	HIS	V	169
R	-	O	ALA	A	416	L	-	O	THR	V	171
R	-	O	ALA	A	416	L	-	H	LYS	V	173
R	-	O	ALA	A	416	L	-	HB2	LYS	V	173
R	-	O	ALA	A	416	L	-	HG3	LYS	V	173
R	-	O	ALA	A	416	L	-	HD2	LYS	V	173
R	-	N	ALA	A	417	L	-	HB2	LYS	V	173
R	-	CA	ALA	A	417	L	-	H	LYS	V	173
R	-	CA	ALA	A	417	L	-	HB2	LYS	V	173
R	-	C	ALA	A	417	L	-	H	LYS	V	173
R	-	CB	ALA	A	417	L	-	O	LYS	V	173
R	-	CB	ALA	A	417	L	-	HB2	LYS	V	173
R	-	CB	ALA	A	417	L	-	HE21	GLN	V	177
R	-	O	ALA	A	417	L	-	OE1	GLU	V	163
R	-	N	VAL	A	418	L	-	HA	SER	V	172
R	-	N	VAL	A	418	L	-	N	LYS	V	173
R	-	N	VAL	A	418	L	-	H	LYS	V	173
R	-	CA	VAL	A	418	L	-	HA	SER	V	172
R	-	C	VAL	A	418	L	-	HA	SER	V	172
R	-	CB	VAL	A	418	L	-	C	THR	V	171
R	-	CB	VAL	A	418	L	-	O	THR	V	171
R	-	CB	VAL	A	418	L	-	N	SER	V	172
R	-	CB	VAL	A	418	L	-	CA	SER	V	172
R	-	CB	VAL	A	418	L	-	CB	SER	V	172
R	-	CB	VAL	A	418	L	-	HA	SER	V	172
R	-	CB	VAL	A	418	L	-	HB2	SER	V	172
R	-	O	VAL	A	418	L	-	OG	SER	V	172
R	-	O	VAL	A	418	L	-	HA	SER	V	172
R	-	O	VAL	A	418	L	-	HB2	SER	V	172
R	-	CG1	VAL	A	418	L	-	HA	SER	V	172
R	-	CG1	VAL	A	418	L	-	HB2	SER	V	172
R	-	CG2	VAL	A	418	L	-	C	HIS	V	169
R	-	CG2	VAL	A	418	L	-	O	HIS	V	169
R	-	CG2	VAL	A	418	L	-	HB3	HIS	V	169
R	-	CG2	VAL	A	418	L	-	N	THR	V	171
R	-	CG2	VAL	A	418	L	-	C	THR	V	171
R	-	CG2	VAL	A	418	L	-	O	THR	V	171
R	-	CG2	VAL	A	418	L	-	N	SER	V	172
R	-	CG2	VAL	A	418	L	-	CA	SER	V	172
R	-	CG2	VAL	A	418	L	-	H	SER	V	172
R	-	CG2	VAL	A	418	L	-	HA	SER	V	172
R	-	CA	ASN	A	419	L	H	CD	LYS	V	88
R	-	CA	ASN	A	419	L	H	HB2	LYS	V	88
R	-	CA	ASN	A	419	L	H	HD2	LYS	V	88
R	-	CA	ASN	A	419	L	H	HZ3	LYS	V	88
R	-	C	ASN	A	419	L	H	HB2	LYS	V	88
R	-	C	ASN	A	419	L	H	HD2	LYS	V	88
R	-	CB	ASN	A	419	L	H	CD	LYS	V	88
R	-	CB	ASN	A	419	L	H	NZ	LYS	V	88
R	-	CB	ASN	A	419	L	H	HD2	LYS	V	88
R	-	CB	ASN	A	419	L	H	HZ2	LYS	V	88
R	-	CB	ASN	A	419	L	H	HZ3	LYS	V	88
R	-	CG	ASN	A	419	L	H	CD	LYS	V	88
R	-	CG	ASN	A	419	L	H	CE	LYS	V	88
R	-	CG	ASN	A	419	L	H	NZ	LYS	V	88
R	-	CG	ASN	A	419	L	H	HD2	LYS	V	88
R	-	CG	ASN	A	419	L	H	HD3	LYS	V	88
R	-	CG	ASN	A	419	L	H	HE2	LYS	V	88
R	-	CG	ASN	A	419	L	H	HE3	LYS	V	88
R	-	CG	ASN	A	419	L	H	HZ1	LYS	V	88
R	-	CG	ASN	A	419	L	H	HZ2	LYS	V	88
R	-	CG	ASN	A	419	L	H	HZ3	LYS	V	88
R	-	ND2	ASN	A	419	L	H	CE	LYS	V	88
R	-	ND2	ASN	A	419	L	H	NZ	LYS	V	88
R	-	ND2	ASN	A	419	L	H	HD2	LYS	V	88
R	-	ND2	ASN	A	419	L	H	HE2	LYS	V	88
R	-	ND2	ASN	A	419	L	H	HZ1	LYS	V	88
R	-	ND2	ASN	A	419	L	H	HZ2	LYS	V	88
R	-	ND2	ASN	A	419	L	H	HZ3	LYS	V	88
R	-	ND2	ASN	A	419	L	-	OE1	GLU	V	163
R	-	OD1	ASN	A	419	L	H	CG	LYS	V	88
R	-	OD1	ASN	A	419	L	H	CD	LYS	V	88
R	-	OD1	ASN	A	419	L	H	CE	LYS	V	88
R	-	OD1	ASN	A	419	L	H	NZ	LYS	V	88
R	-	OD1	ASN	A	419	L	H	HG3	LYS	V	88
R	-	OD1	ASN	A	419	L	H	HD2	LYS	V	88
R	-	OD1	ASN	A	419	L	H	HD3	LYS	V	88
R	-	OD1	ASN	A	419	L	H	HE2	LYS	V	88
R	-	OD1	ASN	A	419	L	H	HE3	LYS	V	88
R	-	OD1	ASN	A	419	L	H	HZ1	LYS	V	88
R	-	OD1	ASN	A	419	L	H	HZ2	LYS	V	88
R	-	OD1	ASN	A	419	L	H	HZ3	LYS	V	88
R	-	N	PHE	A	420	L	H	HB2	LYS	V	88
R	-	N	PHE	A	420	L	H	HD2	LYS	V	88
R	-	CA	PHE	A	420	L	H	HB2	LYS	V	88
R	-	CB	PHE	A	420	L	H	HA2	GLY	V	87
R	-	CB	PHE	A	420	L	H	N	LYS	V	88
R	-	CB	PHE	A	420	L	H	H	LYS	V	88
R	-	CB	PHE	A	420	L	H	HB2	LYS	V	88
R	-	CG	PHE	A	420	L	H	HA2	GLY	V	87
R	-	CG	PHE	A	420	L	H	H	LYS	V	88
R	-	CD1	PHE	A	420	L	H	HA2	GLY	V	87
R	-	CD2	PHE	A	420	L	H	HA2	GLY	V	87
R	-	CD2	PHE	A	420	L	-	HB2	SER	V	172
R	-	CE2	PHE	A	420	L	H	HA2	GLY	V	87
R	-	CE2	PHE	A	420	L	-	HB2	SER	V	172
R	-	N	PHE	A	421	L	H	HD2	LYS	V	88
R	-	N	PHE	A	421	L	H	HD3	LYS	V	88
R	-	CB	PHE	A	421	L	H	HD3	LYS	V	88
R	-	CG	PHE	A	421	L	H	CB	LYS	V	88
R	-	CG	PHE	A	421	L	H	CD	LYS	V	88
R	-	CG	PHE	A	421	L	H	HB3	LYS	V	88
R	-	CG	PHE	A	421	L	H	HD3	LYS	V	88
R	-	CD1	PHE	A	421	L	H	HB3	LYS	V	88
R	-	CD1	PHE	A	421	L	H	HG21	VAL	V	89
R	-	CD2	PHE	A	421	L	H	CA	LYS	V	88
R	-	CD2	PHE	A	421	L	H	CB	LYS	V	88
R	-	CD2	PHE	A	421	L	H	CG	LYS	V	88
R	-	CD2	PHE	A	421	L	H	CD	LYS	V	88
R	-	CD2	PHE	A	421	L	H	CE	LYS	V	88
R	-	CD2	PHE	A	421	L	H	H	LYS	V	88
R	-	CD2	PHE	A	421	L	H	HB2	LYS	V	88
R	-	CD2	PHE	A	421	L	H	HB3	LYS	V	88
R	-	CD2	PHE	A	421	L	H	HG2	LYS	V	88
R	-	CD2	PHE	A	421	L	H	HG3	LYS	V	88
R	-	CD2	PHE	A	421	L	H	HD2	LYS	V	88
R	-	CD2	PHE	A	421	L	H	HD3	LYS	V	88
R	-	CD2	PHE	A	421	L	H	H	VAL	V	89
R	-	CD2	PHE	A	421	L	H	HG21	VAL	V	89
R	-	CE1	PHE	A	421	L	H	HB3	LYS	V	88
R	-	CE1	PHE	A	421	L	H	CG2	VAL	V	89
R	-	CE1	PHE	A	421	L	H	H	VAL	V	89
R	-	CE1	PHE	A	421	L	H	HG21	VAL	V	89
R	-	CE1	PHE	A	421	L	H	HG22	VAL	V	89
R	-	CE1	PHE	A	421	L	H	HG23	VAL	V	89
R	-	CE2	PHE	A	421	L	H	N	LYS	V	88
R	-	CE2	PHE	A	421	L	H	CA	LYS	V	88
R	-	CE2	PHE	A	421	L	H	C	LYS	V	88
R	-	CE2	PHE	A	421	L	H	CB	LYS	V	88
R	-	CE2	PHE	A	421	L	H	CG	LYS	V	88
R	-	CE2	PHE	A	421	L	H	CD	LYS	V	88
R	-	CE2	PHE	A	421	L	H	H	LYS	V	88
R	-	CE2	PHE	A	421	L	H	HB2	LYS	V	88
R	-	CE2	PHE	A	421	L	H	HB3	LYS	V	88
R	-	CE2	PHE	A	421	L	H	HG2	LYS	V	88
R	-	CE2	PHE	A	421	L	H	HG3	LYS	V	88
R	-	CE2	PHE	A	421	L	H	HD2	LYS	V	88
R	-	CE2	PHE	A	421	L	H	HD3	LYS	V	88
R	-	CE2	PHE	A	421	L	H	N	VAL	V	89
R	-	CE2	PHE	A	421	L	H	CA	VAL	V	89
R	-	CE2	PHE	A	421	L	H	CG2	VAL	V	89
R	-	CE2	PHE	A	421	L	H	H	VAL	V	89
R	-	CE2	PHE	A	421	L	H	HA	VAL	V	89
R	-	CE2	PHE	A	421	L	H	HG21	VAL	V	89
R	-	CE2	PHE	A	421	L	H	HG23	VAL	V	89
R	-	CZ	PHE	A	421	L	H	N	LYS	V	88
R	-	CZ	PHE	A	421	L	H	CA	LYS	V	88
R	-	CZ	PHE	A	421	L	H	C	LYS	V	88
R	-	CZ	PHE	A	421	L	H	CB	LYS	V	88
R	-	CZ	PHE	A	421	L	H	H	LYS	V	88
R	-	CZ	PHE	A	421	L	H	HB3	LYS	V	88
R	-	CZ	PHE	A	421	L	H	N	VAL	V	89
R	-	CZ	PHE	A	421	L	H	CA	VAL	V	89
R	-	CZ	PHE	A	421	L	H	CB	VAL	V	89
R	-	CZ	PHE	A	421	L	H	CG2	VAL	V	89
R	-	CZ	PHE	A	421	L	H	H	VAL	V	89
R	-	CZ	PHE	A	421	L	H	HA	VAL	V	89
R	-	CZ	PHE	A	421	L	H	HB	VAL	V	89
R	-	CZ	PHE	A	421	L	H	HG21	VAL	V	89
R	-	CZ	PHE	A	421	L	H	HG22	VAL	V	89
R	-	CZ	PHE	A	421	L	H	HG23	VAL	V	89

- 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