IID

P52951_P40426.1 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	-	LEU	A	11	L	-	TYR	V	50
R	-	LEU	A	11	L	-	ARG	V	51
R	-	ALA	A	12	L	-	MET	V	48
R	-	GLY	A	13	L	-	MET	V	48
R	-	GLY	A	13	L	-	TYR	V	50
R	-	VAL	A	14	L	-	PHE	V	47
R	-	VAL	A	14	L	-	MET	V	48
R	-	VAL	A	14	L	-	TYR	V	50
R	-	LEU	A	16	L	-	LYS	V	246
R	-	ALA	A	17	L	-	LYS	V	246
R	H	PHE	A	177	L	-	GLN	V	96
R	-	GLY	A	18	L	-	THR	V	244
R	-	GLY	A	18	L	-	GLY	V	245
R	-	GLY	A	18	L	-	LYS	V	246
R	-	GLY	A	18	L	-	ASN	V	247
R	H	HIS	A	180	L	-	LEU	V	94
R	H	HIS	A	180	L	-	ALA	V	95
R	H	HIS	A	180	L	-	GLN	V	96
R	H	LEU	A	184	L	-	GLN	V	96
R	H	LEU	A	184	L	-	GLY	V	97
R	H	LEU	A	184	L	-	MET	V	98
R	H	LEU	A	185	L	-	MET	V	98
R	H	GLN	A	188	L	-	GLY	V	97
R	H	GLN	A	188	L	-	MET	V	98
R	H	GLN	A	188	L	-	ALA	V	99
R	-	HIS	A	19	L	-	THR	V	244
R	-	HIS	A	19	L	-	GLY	V	245
R	-	HIS	A	19	L	-	LYS	V	246
R	-	HIS	A	19	L	-	ASN	V	247
R	-	ARG	A	192	L	-	LEU	V	100
R	-	ARG	A	192	L	-	MET	V	98
R	-	ARG	A	192	L	-	ALA	V	99
R	-	SER	A	20	L	-	ASN	V	247
R	-	VAL	A	21	L	-	ARG	V	250
R	-	GLN	A	22	L	-	ARG	V	250
R	-	GLY	A	23	L	-	ARG	V	250
R	-	MET	A	25	L	-	ALA	V	238
R	-	HIS	A	34	L	-	PRO	V	15
R	-	HIS	A	34	L	-	GLY	V	17
R	-	HIS	A	34	L	-	SER	V	18
R	-	HIS	A	34	L	-	SER	V	19
R	-	GLU	A	35	L	-	ARG	V	14
R	-	GLU	A	35	L	-	PRO	V	15
R	H	ARG	A	379	L	-	CYS	V	91
R	H	ILE	A	382	L	-	GLN	V	96
R	H	THR	A	385	L	-	MET	V	98
R	-	TYR	A	388	L	-	LEU	V	100
R	-	TYR	A	388	L	-	ALA	V	99
R	-	SER	A	389	L	-	THR	V	101
R	-	ASP	A	390	L	-	THR	V	101
R	-	ASP	A	390	L	-	SER	V	102
R	-	ASP	A	390	L	-	THR	V	103
R	-	ASP	A	390	L	-	MET	V	105
R	-	GLY	A	391	L	-	MET	V	105
R	-	LEU	A	392	L	-	LEU	V	104
R	-	GLY	A	393	L	-	MET	V	105
R	-	TYR	A	398	L	-	GLU	V	185
R	H	HIS	A	51	L	-	ASN	V	309
R	H	ALA	A	66	L	-	PRO	V	328
R	H	HIS	A	69	L	-	HIS	V	330
R	H	HIS	A	69	L	H	VAL	V	331
R	-	CYS	A	73	L	H	VAL	V	331
R	-	CYS	A	73	L	H	PHE	V	334
R	-	ARG	A	75	L	H	PHE	V	334

- 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

P52951_P40426.1 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	-	CD1	LEU	A	11	L	-	HB2	ARG	V	51
R	-	CD2	LEU	A	11	L	-	HA	TYR	V	50
R	-	CD2	LEU	A	11	L	-	H	ARG	V	51
R	-	CD2	LEU	A	11	L	-	HB2	ARG	V	51
R	-	C	ALA	A	12	L	-	SD	MET	V	48
R	-	C	ALA	A	12	L	-	HB2	MET	V	48
R	-	O	ALA	A	12	L	-	CB	MET	V	48
R	-	O	ALA	A	12	L	-	CG	MET	V	48
R	-	O	ALA	A	12	L	-	SD	MET	V	48
R	-	O	ALA	A	12	L	-	HB2	MET	V	48
R	-	O	ALA	A	12	L	-	HB3	MET	V	48
R	-	O	ALA	A	12	L	-	HG3	MET	V	48
R	-	N	GLY	A	13	L	-	HB2	MET	V	48
R	-	CA	GLY	A	13	L	-	CB	MET	V	48
R	-	CA	GLY	A	13	L	-	O	MET	V	48
R	-	CA	GLY	A	13	L	-	HB2	MET	V	48
R	-	CA	GLY	A	13	L	-	HB3	MET	V	48
R	-	C	GLY	A	13	L	-	HB2	MET	V	48
R	-	C	GLY	A	13	L	-	HH	TYR	V	50
R	-	O	GLY	A	13	L	-	CE1	TYR	V	50
R	-	O	GLY	A	13	L	-	CE2	TYR	V	50
R	-	O	GLY	A	13	L	-	OH	TYR	V	50
R	-	O	GLY	A	13	L	-	CZ	TYR	V	50
R	-	O	GLY	A	13	L	-	HE2	TYR	V	50
R	-	O	GLY	A	13	L	-	HH	TYR	V	50
R	-	N	VAL	A	14	L	-	HH	TYR	V	50
R	-	CA	VAL	A	14	L	-	HH	TYR	V	50
R	-	C	VAL	A	14	L	-	HE2	TYR	V	50
R	-	C	VAL	A	14	L	-	HH	TYR	V	50
R	-	CB	VAL	A	14	L	-	O	MET	V	48
R	-	CB	VAL	A	14	L	-	HE2	TYR	V	50
R	-	O	VAL	A	14	L	-	CE2	TYR	V	50
R	-	O	VAL	A	14	L	-	OH	TYR	V	50
R	-	O	VAL	A	14	L	-	CZ	TYR	V	50
R	-	O	VAL	A	14	L	-	HE2	TYR	V	50
R	-	O	VAL	A	14	L	-	HH	TYR	V	50
R	-	CG2	VAL	A	14	L	-	HA	PHE	V	47
R	-	CG2	VAL	A	14	L	-	N	MET	V	48
R	-	CG2	VAL	A	14	L	-	C	MET	V	48
R	-	CG2	VAL	A	14	L	-	O	MET	V	48
R	-	CG2	VAL	A	14	L	-	H	MET	V	48
R	-	CG2	VAL	A	14	L	-	HB2	MET	V	48
R	-	C	LEU	A	16	L	-	HE3	LYS	V	246
R	-	C	LEU	A	16	L	-	HZ1	LYS	V	246
R	-	O	LEU	A	16	L	-	CE	LYS	V	246
R	-	O	LEU	A	16	L	-	NZ	LYS	V	246
R	-	O	LEU	A	16	L	-	HE2	LYS	V	246
R	-	O	LEU	A	16	L	-	HE3	LYS	V	246
R	-	O	LEU	A	16	L	-	HZ1	LYS	V	246
R	-	N	ALA	A	17	L	-	HE2	LYS	V	246
R	-	N	ALA	A	17	L	-	HE3	LYS	V	246
R	-	N	ALA	A	17	L	-	HZ1	LYS	V	246
R	-	CA	ALA	A	17	L	-	HE2	LYS	V	246
R	-	CA	ALA	A	17	L	-	HE3	LYS	V	246
R	-	C	ALA	A	17	L	-	CE	LYS	V	246
R	-	C	ALA	A	17	L	-	HG2	LYS	V	246
R	-	C	ALA	A	17	L	-	HG3	LYS	V	246
R	-	C	ALA	A	17	L	-	HE2	LYS	V	246
R	-	C	ALA	A	17	L	-	HE3	LYS	V	246
R	-	O	ALA	A	17	L	-	CE	LYS	V	246
R	-	O	ALA	A	17	L	-	HG2	LYS	V	246
R	-	O	ALA	A	17	L	-	HE2	LYS	V	246
R	-	O	ALA	A	17	L	-	HE3	LYS	V	246
R	-	N	GLY	A	18	L	-	HG22	THR	V	244
R	-	N	GLY	A	18	L	-	HG2	LYS	V	246
R	-	N	GLY	A	18	L	-	HG3	LYS	V	246
R	-	N	GLY	A	18	L	-	HE3	LYS	V	246
R	-	CA	GLY	A	18	L	-	HG22	THR	V	244
R	-	CA	GLY	A	18	L	-	H	LYS	V	246
R	-	CA	GLY	A	18	L	-	HG2	LYS	V	246
R	-	C	GLY	A	18	L	-	HG22	THR	V	244
R	-	C	GLY	A	18	L	-	HG23	THR	V	244
R	-	C	GLY	A	18	L	-	H	GLY	V	245
R	-	C	GLY	A	18	L	-	N	LYS	V	246
R	-	C	GLY	A	18	L	-	CA	LYS	V	246
R	-	C	GLY	A	18	L	-	H	LYS	V	246
R	-	C	GLY	A	18	L	-	HA	LYS	V	246
R	-	C	GLY	A	18	L	-	HG2	LYS	V	246
R	-	C	GLY	A	18	L	-	HG3	LYS	V	246
R	-	O	GLY	A	18	L	-	N	GLY	V	245
R	-	O	GLY	A	18	L	-	C	GLY	V	245
R	-	O	GLY	A	18	L	-	H	GLY	V	245
R	-	O	GLY	A	18	L	-	N	LYS	V	246
R	-	O	GLY	A	18	L	-	CA	LYS	V	246
R	-	O	GLY	A	18	L	-	C	LYS	V	246
R	-	O	GLY	A	18	L	-	CB	LYS	V	246
R	-	O	GLY	A	18	L	-	CG	LYS	V	246
R	-	O	GLY	A	18	L	-	H	LYS	V	246
R	-	O	GLY	A	18	L	-	HA	LYS	V	246
R	-	O	GLY	A	18	L	-	HG2	LYS	V	246
R	-	O	GLY	A	18	L	-	HG3	LYS	V	246
R	-	O	GLY	A	18	L	-	H	ASN	V	247
R	-	N	HIS	A	19	L	-	CG2	THR	V	244
R	-	N	HIS	A	19	L	-	HA	THR	V	244
R	-	N	HIS	A	19	L	-	HG22	THR	V	244
R	-	N	HIS	A	19	L	-	HG23	THR	V	244
R	-	N	HIS	A	19	L	-	N	GLY	V	245
R	-	N	HIS	A	19	L	-	H	GLY	V	245
R	-	N	HIS	A	19	L	-	N	LYS	V	246
R	-	N	HIS	A	19	L	-	H	LYS	V	246
R	-	CA	HIS	A	19	L	-	HA	THR	V	244
R	-	CA	HIS	A	19	L	-	HG23	THR	V	244
R	-	CA	HIS	A	19	L	-	H	GLY	V	245
R	-	C	HIS	A	19	L	-	H	GLY	V	245
R	-	C	HIS	A	19	L	-	H	LYS	V	246
R	-	C	HIS	A	19	L	-	H	ASN	V	247
R	-	CB	HIS	A	19	L	-	HG23	THR	V	244
R	-	O	HIS	A	19	L	-	N	LYS	V	246
R	-	O	HIS	A	19	L	-	H	LYS	V	246
R	-	O	HIS	A	19	L	-	HA	LYS	V	246
R	-	O	HIS	A	19	L	-	N	ASN	V	247
R	-	O	HIS	A	19	L	-	H	ASN	V	247
R	-	CG	HIS	A	19	L	-	HG23	THR	V	244
R	-	ND1	HIS	A	19	L	-	CG2	THR	V	244
R	-	ND1	HIS	A	19	L	-	HG21	THR	V	244
R	-	ND1	HIS	A	19	L	-	HG23	THR	V	244
R	-	CE1	HIS	A	19	L	-	HG23	THR	V	244
R	-	N	SER	A	20	L	-	H	ASN	V	247
R	-	O	VAL	A	21	L	-	HH21	ARG	V	250
R	-	C	GLN	A	22	L	-	NH2	ARG	V	250
R	-	C	GLN	A	22	L	-	HH21	ARG	V	250
R	-	C	GLN	A	22	L	-	HH22	ARG	V	250
R	-	O	GLN	A	22	L	-	NH2	ARG	V	250
R	-	O	GLN	A	22	L	-	HH21	ARG	V	250
R	-	O	GLN	A	22	L	-	HH22	ARG	V	250
R	-	N	GLY	A	23	L	-	HH22	ARG	V	250
R	-	SD	MET	A	25	L	-	HB3	ALA	V	238
R	-	CE	MET	A	25	L	-	HB3	ALA	V	238
R	-	N	HIS	A	34	L	-	O	GLY	V	17
R	-	N	HIS	A	34	L	-	H	GLY	V	17
R	-	CB	HIS	A	34	L	-	C	GLY	V	17
R	-	CB	HIS	A	34	L	-	O	GLY	V	17
R	-	CB	HIS	A	34	L	-	HA2	GLY	V	17
R	-	CB	HIS	A	34	L	-	HA	SER	V	19
R	-	O	HIS	A	34	L	-	O	PRO	V	15
R	-	O	HIS	A	34	L	-	HB2	PRO	V	15
R	-	O	HIS	A	34	L	-	HD3	PRO	V	15
R	-	CG	HIS	A	34	L	-	HA	SER	V	19
R	-	CD2	HIS	A	34	L	-	O	SER	V	18
R	-	CD2	HIS	A	34	L	-	HA	SER	V	19
R	-	CG	GLU	A	35	L	-	HG2	ARG	V	14
R	-	CG	GLU	A	35	L	-	HE	ARG	V	14
R	-	CG	GLU	A	35	L	-	HD3	PRO	V	15
R	-	CD	GLU	A	35	L	-	CG	ARG	V	14
R	-	CD	GLU	A	35	L	-	NE	ARG	V	14
R	-	CD	GLU	A	35	L	-	HA	ARG	V	14
R	-	CD	GLU	A	35	L	-	HG2	ARG	V	14
R	-	CD	GLU	A	35	L	-	HG3	ARG	V	14
R	-	CD	GLU	A	35	L	-	HE	ARG	V	14
R	-	CD	GLU	A	35	L	-	HD3	PRO	V	15
R	-	OE1	GLU	A	35	L	-	CG	ARG	V	14
R	-	OE1	GLU	A	35	L	-	HA	ARG	V	14
R	-	OE1	GLU	A	35	L	-	HG2	ARG	V	14
R	-	OE1	GLU	A	35	L	-	HG3	ARG	V	14
R	-	OE1	GLU	A	35	L	-	HE	ARG	V	14
R	-	OE2	GLU	A	35	L	-	CG	ARG	V	14
R	-	OE2	GLU	A	35	L	-	CD	ARG	V	14
R	-	OE2	GLU	A	35	L	-	NE	ARG	V	14
R	-	OE2	GLU	A	35	L	-	NH2	ARG	V	14
R	-	OE2	GLU	A	35	L	-	CZ	ARG	V	14
R	-	OE2	GLU	A	35	L	-	HG2	ARG	V	14
R	-	OE2	GLU	A	35	L	-	HG3	ARG	V	14
R	-	OE2	GLU	A	35	L	-	HD3	ARG	V	14
R	-	OE2	GLU	A	35	L	-	HE	ARG	V	14
R	-	OE2	GLU	A	35	L	-	HH21	ARG	V	14
R	H	ND1	HIS	A	51	L	-	HD21	ASN	V	309
R	H	CE1	HIS	A	51	L	-	ND2	ASN	V	309
R	H	CE1	HIS	A	51	L	-	HD21	ASN	V	309
R	H	CE1	HIS	A	51	L	-	HD22	ASN	V	309
R	H	NE2	HIS	A	51	L	-	HD21	ASN	V	309
R	H	CA	ALA	A	66	L	-	HG3	PRO	V	328
R	H	CB	ALA	A	66	L	-	CG	PRO	V	328
R	H	CB	ALA	A	66	L	-	HG2	PRO	V	328
R	H	CB	ALA	A	66	L	-	HG3	PRO	V	328
R	H	O	ALA	A	66	L	-	HB2	PRO	V	328
R	H	CG	HIS	A	69	L	H	HG13	VAL	V	331
R	H	CD2	HIS	A	69	L	H	HG13	VAL	V	331
R	H	ND1	HIS	A	69	L	H	HG13	VAL	V	331
R	H	CE1	HIS	A	69	L	H	CG1	VAL	V	331
R	H	CE1	HIS	A	69	L	H	CG2	VAL	V	331
R	H	CE1	HIS	A	69	L	H	H	VAL	V	331
R	H	CE1	HIS	A	69	L	H	HG11	VAL	V	331
R	H	CE1	HIS	A	69	L	H	HG12	VAL	V	331
R	H	CE1	HIS	A	69	L	H	HG13	VAL	V	331
R	H	CE1	HIS	A	69	L	H	HG22	VAL	V	331
R	H	CE1	HIS	A	69	L	H	HG23	VAL	V	331
R	H	NE2	HIS	A	69	L	-	HA	HIS	V	330
R	H	NE2	HIS	A	69	L	H	N	VAL	V	331
R	H	NE2	HIS	A	69	L	H	CG1	VAL	V	331
R	H	NE2	HIS	A	69	L	H	CG2	VAL	V	331
R	H	NE2	HIS	A	69	L	H	H	VAL	V	331
R	H	NE2	HIS	A	69	L	H	HG11	VAL	V	331
R	H	NE2	HIS	A	69	L	H	HG12	VAL	V	331
R	H	NE2	HIS	A	69	L	H	HG13	VAL	V	331
R	H	NE2	HIS	A	69	L	H	HG22	VAL	V	331
R	-	CA	CYS	A	73	L	H	HG11	VAL	V	331
R	-	CB	CYS	A	73	L	H	CG1	VAL	V	331
R	-	CB	CYS	A	73	L	H	HG11	VAL	V	331
R	-	CB	CYS	A	73	L	H	HG13	VAL	V	331
R	-	O	CYS	A	73	L	H	CE2	PHE	V	334
R	-	O	CYS	A	73	L	H	HE2	PHE	V	334
R	-	SG	CYS	A	73	L	H	CB	VAL	V	331
R	-	SG	CYS	A	73	L	H	CG1	VAL	V	331
R	-	SG	CYS	A	73	L	H	HA	VAL	V	331
R	-	SG	CYS	A	73	L	H	HG11	VAL	V	331
R	-	SG	CYS	A	73	L	H	HG12	VAL	V	331
R	-	SG	CYS	A	73	L	H	HG13	VAL	V	331
R	-	CB	ARG	A	75	L	H	HZ	PHE	V	334
R	-	CD	ARG	A	75	L	H	HE1	PHE	V	334
R	H	CE2	PHE	A	177	L	-	HE22	GLN	V	96
R	H	CD2	HIS	A	180	L	-	HA	ALA	V	95
R	H	CD2	HIS	A	180	L	-	H	GLN	V	96
R	H	ND1	HIS	A	180	L	-	HD12	LEU	V	94
R	H	ND1	HIS	A	180	L	-	HA	ALA	V	95
R	H	ND1	HIS	A	180	L	-	HB3	ALA	V	95
R	H	CE1	HIS	A	180	L	-	HG	LEU	V	94
R	H	CE1	HIS	A	180	L	-	HD12	LEU	V	94
R	H	CE1	HIS	A	180	L	-	N	ALA	V	95
R	H	CE1	HIS	A	180	L	-	CA	ALA	V	95
R	H	CE1	HIS	A	180	L	-	CB	ALA	V	95
R	H	CE1	HIS	A	180	L	-	H	ALA	V	95
R	H	CE1	HIS	A	180	L	-	HA	ALA	V	95
R	H	CE1	HIS	A	180	L	-	HB1	ALA	V	95
R	H	CE1	HIS	A	180	L	-	HB3	ALA	V	95
R	H	CE1	HIS	A	180	L	-	N	GLN	V	96
R	H	CE1	HIS	A	180	L	-	H	GLN	V	96
R	H	NE2	HIS	A	180	L	-	CA	ALA	V	95
R	H	NE2	HIS	A	180	L	-	C	ALA	V	95
R	H	NE2	HIS	A	180	L	-	CB	ALA	V	95
R	H	NE2	HIS	A	180	L	-	H	ALA	V	95
R	H	NE2	HIS	A	180	L	-	HA	ALA	V	95
R	H	NE2	HIS	A	180	L	-	HB1	ALA	V	95
R	H	NE2	HIS	A	180	L	-	HB3	ALA	V	95
R	H	NE2	HIS	A	180	L	-	N	GLN	V	96
R	H	NE2	HIS	A	180	L	-	H	GLN	V	96
R	H	NE2	HIS	A	180	L	-	HB2	GLN	V	96
R	H	CB	LEU	A	184	L	-	O	GLN	V	96
R	H	CG	LEU	A	184	L	-	C	GLN	V	96
R	H	CG	LEU	A	184	L	-	O	GLN	V	96
R	H	CG	LEU	A	184	L	-	HB2	GLN	V	96
R	H	CG	LEU	A	184	L	-	HA2	GLY	V	97
R	H	CG	LEU	A	184	L	-	H	MET	V	98
R	H	CG	LEU	A	184	L	-	HG3	MET	V	98
R	H	CD1	LEU	A	184	L	-	C	GLN	V	96
R	H	CD1	LEU	A	184	L	-	O	GLN	V	96
R	H	CD1	LEU	A	184	L	-	N	GLY	V	97
R	H	CD1	LEU	A	184	L	-	CA	GLY	V	97
R	H	CD1	LEU	A	184	L	-	HA2	GLY	V	97
R	H	CD1	LEU	A	184	L	-	HA3	GLY	V	97
R	H	CD1	LEU	A	184	L	-	H	MET	V	98
R	H	CD2	LEU	A	184	L	-	CA	GLN	V	96
R	H	CD2	LEU	A	184	L	-	C	GLN	V	96
R	H	CD2	LEU	A	184	L	-	CB	GLN	V	96
R	H	CD2	LEU	A	184	L	-	O	GLN	V	96
R	H	CD2	LEU	A	184	L	-	OE1	GLN	V	96
R	H	CD2	LEU	A	184	L	-	H	GLN	V	96
R	H	CD2	LEU	A	184	L	-	HB2	GLN	V	96
R	H	CD2	LEU	A	184	L	-	HB3	GLN	V	96
R	H	CD2	LEU	A	184	L	-	HA2	GLY	V	97
R	H	CD2	LEU	A	184	L	-	HG3	MET	V	98
R	H	CD2	LEU	A	184	L	-	HE3	MET	V	98
R	H	CD2	LEU	A	185	L	-	HG2	MET	V	98
R	H	CB	GLN	A	188	L	-	HB2	MET	V	98
R	H	CG	GLN	A	188	L	-	N	MET	V	98
R	H	CG	GLN	A	188	L	-	CB	MET	V	98
R	H	CG	GLN	A	188	L	-	H	MET	V	98
R	H	CG	GLN	A	188	L	-	HB2	MET	V	98
R	H	CD	GLN	A	188	L	-	HA2	GLY	V	97
R	H	CD	GLN	A	188	L	-	N	MET	V	98
R	H	CD	GLN	A	188	L	-	C	MET	V	98
R	H	CD	GLN	A	188	L	-	O	MET	V	98
R	H	CD	GLN	A	188	L	-	H	MET	V	98
R	H	CD	GLN	A	188	L	-	HB2	MET	V	98
R	H	NE2	GLN	A	188	L	-	CA	GLY	V	97
R	H	NE2	GLN	A	188	L	-	C	GLY	V	97
R	H	NE2	GLN	A	188	L	-	HA2	GLY	V	97
R	H	NE2	GLN	A	188	L	-	HA3	GLY	V	97
R	H	NE2	GLN	A	188	L	-	N	MET	V	98
R	H	NE2	GLN	A	188	L	-	O	MET	V	98
R	H	NE2	GLN	A	188	L	-	H	MET	V	98
R	H	OE1	GLN	A	188	L	-	N	MET	V	98
R	H	OE1	GLN	A	188	L	-	CA	MET	V	98
R	H	OE1	GLN	A	188	L	-	C	MET	V	98
R	H	OE1	GLN	A	188	L	-	CB	MET	V	98
R	H	OE1	GLN	A	188	L	-	O	MET	V	98
R	H	OE1	GLN	A	188	L	-	H	MET	V	98
R	H	OE1	GLN	A	188	L	-	HB2	MET	V	98
R	H	OE1	GLN	A	188	L	-	O	ALA	V	99
R	-	CD	ARG	A	192	L	-	O	ALA	V	99
R	-	CD	ARG	A	192	L	-	HD11	LEU	V	100
R	-	NE	ARG	A	192	L	-	HB2	MET	V	98
R	-	NE	ARG	A	192	L	-	HB3	MET	V	98
R	-	NE	ARG	A	192	L	-	O	ALA	V	99
R	-	NE	ARG	A	192	L	-	HB3	ALA	V	99
R	-	NH1	ARG	A	192	L	-	C	MET	V	98
R	-	NH1	ARG	A	192	L	-	CB	MET	V	98
R	-	NH1	ARG	A	192	L	-	O	MET	V	98
R	-	NH1	ARG	A	192	L	-	HB2	MET	V	98
R	-	NH1	ARG	A	192	L	-	HB3	MET	V	98
R	-	NH1	ARG	A	192	L	-	N	ALA	V	99
R	-	NH1	ARG	A	192	L	-	CA	ALA	V	99
R	-	NH1	ARG	A	192	L	-	C	ALA	V	99
R	-	NH1	ARG	A	192	L	-	CB	ALA	V	99
R	-	NH1	ARG	A	192	L	-	O	ALA	V	99
R	-	NH1	ARG	A	192	L	-	HA	ALA	V	99
R	-	NH1	ARG	A	192	L	-	HB1	ALA	V	99
R	-	NH1	ARG	A	192	L	-	HB2	ALA	V	99
R	-	NH1	ARG	A	192	L	-	HB3	ALA	V	99
R	-	NH1	ARG	A	192	L	-	N	LEU	V	100
R	-	NH1	ARG	A	192	L	-	CG	LEU	V	100
R	-	NH1	ARG	A	192	L	-	H	LEU	V	100
R	-	NH1	ARG	A	192	L	-	HB2	LEU	V	100
R	-	NH1	ARG	A	192	L	-	HG	LEU	V	100
R	-	NH1	ARG	A	192	L	-	HD11	LEU	V	100
R	-	NH2	ARG	A	192	L	-	CA	MET	V	98
R	-	NH2	ARG	A	192	L	-	C	MET	V	98
R	-	NH2	ARG	A	192	L	-	CB	MET	V	98
R	-	NH2	ARG	A	192	L	-	O	MET	V	98
R	-	NH2	ARG	A	192	L	-	CG	MET	V	98
R	-	NH2	ARG	A	192	L	-	HB2	MET	V	98
R	-	NH2	ARG	A	192	L	-	HB3	MET	V	98
R	-	NH2	ARG	A	192	L	-	HG2	MET	V	98
R	-	NH2	ARG	A	192	L	-	CB	ALA	V	99
R	-	NH2	ARG	A	192	L	-	O	ALA	V	99
R	-	NH2	ARG	A	192	L	-	HB1	ALA	V	99
R	-	NH2	ARG	A	192	L	-	HB3	ALA	V	99
R	-	NH2	ARG	A	192	L	-	HG	LEU	V	100
R	-	CZ	ARG	A	192	L	-	C	MET	V	98
R	-	CZ	ARG	A	192	L	-	CB	MET	V	98
R	-	CZ	ARG	A	192	L	-	O	MET	V	98
R	-	CZ	ARG	A	192	L	-	HB2	MET	V	98
R	-	CZ	ARG	A	192	L	-	HB3	MET	V	98
R	-	CZ	ARG	A	192	L	-	CA	ALA	V	99
R	-	CZ	ARG	A	192	L	-	C	ALA	V	99
R	-	CZ	ARG	A	192	L	-	CB	ALA	V	99
R	-	CZ	ARG	A	192	L	-	O	ALA	V	99
R	-	CZ	ARG	A	192	L	-	HB3	ALA	V	99
R	-	CZ	ARG	A	192	L	-	HG	LEU	V	100
R	H	NH1	ARG	A	379	L	-	HG	CYS	V	91
R	H	CA	ILE	A	382	L	-	HE21	GLN	V	96
R	H	CA	ILE	A	382	L	-	HE22	GLN	V	96
R	H	CB	ILE	A	382	L	-	NE2	GLN	V	96
R	H	CB	ILE	A	382	L	-	HE21	GLN	V	96
R	H	CB	ILE	A	382	L	-	HE22	GLN	V	96
R	H	CG1	ILE	A	382	L	-	NE2	GLN	V	96
R	H	CG1	ILE	A	382	L	-	HE21	GLN	V	96
R	H	CG1	ILE	A	382	L	-	HE22	GLN	V	96
R	H	CG2	ILE	A	382	L	-	CD	GLN	V	96
R	H	CG2	ILE	A	382	L	-	NE2	GLN	V	96
R	H	CG2	ILE	A	382	L	-	HG3	GLN	V	96
R	H	CG2	ILE	A	382	L	-	HE21	GLN	V	96
R	H	CG2	ILE	A	382	L	-	HE22	GLN	V	96
R	H	CD1	ILE	A	382	L	-	NE2	GLN	V	96
R	H	CD1	ILE	A	382	L	-	HE21	GLN	V	96
R	H	CD1	ILE	A	382	L	-	HE22	GLN	V	96
R	H	C	THR	A	385	L	-	HE1	MET	V	98
R	H	CB	THR	A	385	L	-	HE1	MET	V	98
R	H	O	THR	A	385	L	-	HE1	MET	V	98
R	H	OG1	THR	A	385	L	-	HE1	MET	V	98
R	-	C	TYR	A	388	L	-	HD21	LEU	V	100
R	-	O	TYR	A	388	L	-	HB2	ALA	V	99
R	-	O	TYR	A	388	L	-	CD2	LEU	V	100
R	-	O	TYR	A	388	L	-	HA	LEU	V	100
R	-	O	TYR	A	388	L	-	HD21	LEU	V	100
R	-	O	TYR	A	388	L	-	HD22	LEU	V	100
R	-	O	TYR	A	388	L	-	HD23	LEU	V	100
R	-	CA	SER	A	389	L	-	H	THR	V	101
R	-	CB	SER	A	389	L	-	H	THR	V	101
R	-	OG	SER	A	389	L	-	H	THR	V	101
R	-	OG	SER	A	389	L	-	HA	THR	V	101
R	-	N	ASP	A	390	L	-	HA	THR	V	101
R	-	N	ASP	A	390	L	-	HG23	THR	V	101
R	-	CA	ASP	A	390	L	-	HG23	THR	V	101
R	-	CA	ASP	A	390	L	-	H	THR	V	103
R	-	CA	ASP	A	390	L	-	HB	THR	V	103
R	-	C	ASP	A	390	L	-	HE1	MET	V	105
R	-	CB	ASP	A	390	L	-	HA	SER	V	102
R	-	CB	ASP	A	390	L	-	N	THR	V	103
R	-	CB	ASP	A	390	L	-	CA	THR	V	103
R	-	CB	ASP	A	390	L	-	CB	THR	V	103
R	-	CB	ASP	A	390	L	-	O	THR	V	103
R	-	CB	ASP	A	390	L	-	OG1	THR	V	103
R	-	CB	ASP	A	390	L	-	H	THR	V	103
R	-	CB	ASP	A	390	L	-	HB	THR	V	103
R	-	CB	ASP	A	390	L	-	HG1	THR	V	103
R	-	O	ASP	A	390	L	-	HE1	MET	V	105
R	-	CG	ASP	A	390	L	-	HA	THR	V	101
R	-	CG	ASP	A	390	L	-	CA	SER	V	102
R	-	CG	ASP	A	390	L	-	C	SER	V	102
R	-	CG	ASP	A	390	L	-	HA	SER	V	102
R	-	CG	ASP	A	390	L	-	N	THR	V	103
R	-	CG	ASP	A	390	L	-	CA	THR	V	103
R	-	CG	ASP	A	390	L	-	C	THR	V	103
R	-	CG	ASP	A	390	L	-	CB	THR	V	103
R	-	CG	ASP	A	390	L	-	O	THR	V	103
R	-	CG	ASP	A	390	L	-	OG1	THR	V	103
R	-	CG	ASP	A	390	L	-	H	THR	V	103
R	-	CG	ASP	A	390	L	-	HA	THR	V	103
R	-	CG	ASP	A	390	L	-	HB	THR	V	103
R	-	CG	ASP	A	390	L	-	HG1	THR	V	103
R	-	OD1	ASP	A	390	L	-	CA	THR	V	101
R	-	OD1	ASP	A	390	L	-	HA	THR	V	101
R	-	OD1	ASP	A	390	L	-	HB	THR	V	101
R	-	OD1	ASP	A	390	L	-	HG23	THR	V	101
R	-	OD1	ASP	A	390	L	-	N	SER	V	102
R	-	OD1	ASP	A	390	L	-	CA	SER	V	102
R	-	OD1	ASP	A	390	L	-	C	SER	V	102
R	-	OD1	ASP	A	390	L	-	CB	SER	V	102
R	-	OD1	ASP	A	390	L	-	O	SER	V	102
R	-	OD1	ASP	A	390	L	-	OG	SER	V	102
R	-	OD1	ASP	A	390	L	-	HA	SER	V	102
R	-	OD1	ASP	A	390	L	-	HB3	SER	V	102
R	-	OD1	ASP	A	390	L	-	N	THR	V	103
R	-	OD1	ASP	A	390	L	-	CA	THR	V	103
R	-	OD1	ASP	A	390	L	-	C	THR	V	103
R	-	OD1	ASP	A	390	L	-	CB	THR	V	103
R	-	OD1	ASP	A	390	L	-	O	THR	V	103
R	-	OD1	ASP	A	390	L	-	H	THR	V	103
R	-	OD1	ASP	A	390	L	-	HB	THR	V	103
R	-	OD1	ASP	A	390	L	-	HG1	THR	V	103
R	-	OD2	ASP	A	390	L	-	HA	THR	V	101
R	-	OD2	ASP	A	390	L	-	N	SER	V	102
R	-	OD2	ASP	A	390	L	-	CA	SER	V	102
R	-	OD2	ASP	A	390	L	-	C	SER	V	102
R	-	OD2	ASP	A	390	L	-	O	SER	V	102
R	-	OD2	ASP	A	390	L	-	HA	SER	V	102
R	-	OD2	ASP	A	390	L	-	N	THR	V	103
R	-	OD2	ASP	A	390	L	-	CA	THR	V	103
R	-	OD2	ASP	A	390	L	-	CB	THR	V	103
R	-	OD2	ASP	A	390	L	-	OG1	THR	V	103
R	-	OD2	ASP	A	390	L	-	H	THR	V	103
R	-	OD2	ASP	A	390	L	-	HA	THR	V	103
R	-	OD2	ASP	A	390	L	-	HB	THR	V	103
R	-	OD2	ASP	A	390	L	-	HG1	THR	V	103
R	-	CA	GLY	A	391	L	-	HE1	MET	V	105
R	-	C	LEU	A	392	L	-	HD21	LEU	V	104
R	-	O	LEU	A	392	L	-	CD2	LEU	V	104
R	-	O	LEU	A	392	L	-	HD21	LEU	V	104
R	-	O	LEU	A	392	L	-	HD22	LEU	V	104
R	-	O	LEU	A	392	L	-	HD23	LEU	V	104
R	-	O	GLY	A	393	L	-	HE2	MET	V	105
R	-	CE2	TYR	A	398	L	-	OE1	GLU	V	185
R	-	OH	TYR	A	398	L	-	OE1	GLU	V	185
R	-	CZ	TYR	A	398	L	-	OE1	GLU	V	185

- 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