IID

Q8ND94_A2RUH7.1 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	-	ALA	A	20	L	-	SER	V	77
R	-	ALA	A	20	L	-	SER	V	78
R	-	ALA	A	20	L	-	GLN	V	81
R	-	SER	A	21	L	-	SER	V	78
R	-	PRO	A	22	L	-	SER	V	78
R	-	PRO	A	22	L	-	PRO	V	79
R	-	ALA	A	23	L	-	PRO	V	79
R	-	ASP	A	24	L	-	PRO	V	79
R	-	ALA	A	25	L	-	PRO	V	79
R	-	GLU	A	26	L	H	LYS	V	61
R	-	GLU	A	26	L	H	ARG	V	65
R	-	PRO	A	28	L	-	LEU	V	112
R	-	PRO	A	28	L	-	ALA	V	133
R	-	PRO	A	28	L	-	PRO	V	59
R	-	PRO	A	28	L	H	GLU	V	62
R	-	GLN	A	29	L	-	THR	V	134
R	-	GLN	A	29	L	H	GLU	V	62
R	-	ALA	A	30	L	-	THR	V	134
R	-	ALA	A	30	L	-	VAL	V	58
R	-	ALA	A	30	L	-	PRO	V	59
R	-	ALA	A	30	L	H	GLU	V	62
R	-	SER	A	31	L	-	THR	V	134
R	-	SER	A	31	L	-	LEU	V	56
R	-	PRO	A	32	L	-	LEU	V	56
R	-	GLY	A	33	L	-	HIS	V	55
R	-	GLY	A	33	L	-	LEU	V	56
R	-	GLN	A	34	L	S	ARG	V	137
R	-	GLN	A	34	L	-	ARG	V	54
R	-	GLN	A	34	L	-	HIS	V	55
R	-	GLN	A	34	L	-	LEU	V	56
R	-	GLY	A	35	L	S	ARG	V	137
R	-	GLY	A	35	L	-	ARG	V	54
R	-	GLY	A	35	L	-	HIS	V	55
R	-	ALA	A	36	L	-	ASP	V	51
R	-	ALA	A	36	L	-	ARG	V	54
R	-	GLY	A	37	L	S	HIS	V	103
R	-	GLY	A	37	L	-	CYS	V	53
R	-	GLY	A	37	L	-	ARG	V	54
R	-	PRO	A	39	L	-	CYS	V	53
R	-	PRO	A	39	L	-	ARG	V	87
R	-	THR	A	40	L	-	PHE	V	180
R	-	THR	A	40	L	-	GLU	V	90
R	-	PRO	A	41	L	-	PHE	V	180
R	-	GLN	A	42	L	-	ALA	V	179
R	-	GLN	A	42	L	-	PHE	V	180
R	-	GLN	A	42	L	-	MET	V	88
R	-	GLN	A	42	L	-	GLY	V	89
R	-	LEU	A	43	L	-	ALA	V	179
R	-	LEU	A	44	L	-	ALA	V	179
R	-	PRO	A	45	L	-	ALA	V	179

- 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

Q8ND94_A2RUH7.1 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	-	CA	ALA	A	20	L	-	H	SER	V	78
R	-	CA	ALA	A	20	L	-	HB2	SER	V	78
R	-	C	ALA	A	20	L	-	H	SER	V	78
R	-	C	ALA	A	20	L	-	HB2	SER	V	78
R	-	CB	ALA	A	20	L	-	N	SER	V	78
R	-	CB	ALA	A	20	L	-	CB	SER	V	78
R	-	CB	ALA	A	20	L	-	H	SER	V	78
R	-	CB	ALA	A	20	L	-	HB2	SER	V	78
R	-	CB	ALA	A	20	L	-	HB3	SER	V	78
R	-	CB	ALA	A	20	L	-	CD	GLN	V	81
R	-	CB	ALA	A	20	L	-	OE1	GLN	V	81
R	-	O	ALA	A	20	L	-	HA	SER	V	77
R	-	O	ALA	A	20	L	-	N	SER	V	78
R	-	O	ALA	A	20	L	-	H	SER	V	78
R	-	O	ALA	A	20	L	-	HB2	SER	V	78
R	-	N	SER	A	21	L	-	HB2	SER	V	78
R	-	CA	SER	A	21	L	-	HB2	SER	V	78
R	-	C	SER	A	21	L	-	HB2	SER	V	78
R	-	O	SER	A	21	L	-	CA	SER	V	78
R	-	O	SER	A	21	L	-	CB	SER	V	78
R	-	O	SER	A	21	L	-	OG	SER	V	78
R	-	O	SER	A	21	L	-	HA	SER	V	78
R	-	O	SER	A	21	L	-	HB2	SER	V	78
R	-	O	SER	A	21	L	-	HG	SER	V	78
R	-	CA	PRO	A	22	L	-	HA	SER	V	78
R	-	CA	PRO	A	22	L	-	HD2	PRO	V	79
R	-	CA	PRO	A	22	L	-	HD3	PRO	V	79
R	-	C	PRO	A	22	L	-	HD3	PRO	V	79
R	-	N	ALA	A	23	L	-	CG	PRO	V	79
R	-	N	ALA	A	23	L	-	CD	PRO	V	79
R	-	N	ALA	A	23	L	-	HG2	PRO	V	79
R	-	N	ALA	A	23	L	-	HG3	PRO	V	79
R	-	N	ALA	A	23	L	-	HD2	PRO	V	79
R	-	N	ALA	A	23	L	-	HD3	PRO	V	79
R	-	CA	ALA	A	23	L	-	HG2	PRO	V	79
R	-	CA	ALA	A	23	L	-	HG3	PRO	V	79
R	-	CA	ALA	A	23	L	-	HD3	PRO	V	79
R	-	C	ALA	A	23	L	-	CG	PRO	V	79
R	-	C	ALA	A	23	L	-	HG2	PRO	V	79
R	-	C	ALA	A	23	L	-	HG3	PRO	V	79
R	-	C	ALA	A	23	L	-	HD3	PRO	V	79
R	-	O	ALA	A	23	L	-	CB	PRO	V	79
R	-	O	ALA	A	23	L	-	CG	PRO	V	79
R	-	O	ALA	A	23	L	-	CD	PRO	V	79
R	-	O	ALA	A	23	L	-	HB2	PRO	V	79
R	-	O	ALA	A	23	L	-	HG2	PRO	V	79
R	-	O	ALA	A	23	L	-	HG3	PRO	V	79
R	-	O	ALA	A	23	L	-	HD3	PRO	V	79
R	-	N	ASP	A	24	L	-	CG	PRO	V	79
R	-	N	ASP	A	24	L	-	HG2	PRO	V	79
R	-	N	ASP	A	24	L	-	HG3	PRO	V	79
R	-	CA	ASP	A	24	L	-	HG3	PRO	V	79
R	-	C	ASP	A	24	L	-	HG3	PRO	V	79
R	-	O	ASP	A	24	L	-	HB2	PRO	V	79
R	-	O	ASP	A	24	L	-	HG3	PRO	V	79
R	-	N	ALA	A	25	L	-	HG3	PRO	V	79
R	-	CB	ALA	A	25	L	-	HB2	PRO	V	79
R	-	CB	GLU	A	26	L	H	HZ2	LYS	V	61
R	-	CG	GLU	A	26	L	H	NZ	LYS	V	61
R	-	CG	GLU	A	26	L	H	HZ1	LYS	V	61
R	-	CG	GLU	A	26	L	H	HZ2	LYS	V	61
R	-	CD	GLU	A	26	L	H	HZ2	LYS	V	61
R	-	OE1	GLU	A	26	L	H	HZ2	LYS	V	61
R	-	OE1	GLU	A	26	L	H	HH12	ARG	V	65
R	-	OE1	GLU	A	26	L	H	HH22	ARG	V	65
R	-	O	PRO	A	28	L	-	CG	PRO	V	59
R	-	O	PRO	A	28	L	-	HG2	PRO	V	59
R	-	O	PRO	A	28	L	-	HG3	PRO	V	59
R	-	O	PRO	A	28	L	H	OE1	GLU	V	62
R	-	CG	PRO	A	28	L	-	HD11	LEU	V	112
R	-	CG	PRO	A	28	L	-	HB2	ALA	V	133
R	-	CD	PRO	A	28	L	-	HD11	LEU	V	112
R	-	CA	GLN	A	29	L	H	OE1	GLU	V	62
R	-	O	GLN	A	29	L	-	HG21	THR	V	134
R	-	N	ALA	A	30	L	H	OE1	GLU	V	62
R	-	N	ALA	A	30	L	H	OE2	GLU	V	62
R	-	CA	ALA	A	30	L	-	HD2	PRO	V	59
R	-	CA	ALA	A	30	L	-	HD3	PRO	V	59
R	-	CA	ALA	A	30	L	H	OE2	GLU	V	62
R	-	CA	ALA	A	30	L	-	HG21	THR	V	134
R	-	CB	ALA	A	30	L	-	HA	VAL	V	58
R	-	CB	ALA	A	30	L	-	HG12	VAL	V	58
R	-	CB	ALA	A	30	L	-	HG22	VAL	V	58
R	-	CB	ALA	A	30	L	-	HD3	PRO	V	59
R	-	CB	ALA	A	30	L	H	OE2	GLU	V	62
R	-	N	SER	A	31	L	-	HG21	THR	V	134
R	-	C	SER	A	31	L	-	HB3	LEU	V	56
R	-	C	SER	A	31	L	-	HD12	LEU	V	56
R	-	O	SER	A	31	L	-	CA	LEU	V	56
R	-	O	SER	A	31	L	-	C	LEU	V	56
R	-	O	SER	A	31	L	-	CB	LEU	V	56
R	-	O	SER	A	31	L	-	O	LEU	V	56
R	-	O	SER	A	31	L	-	HA	LEU	V	56
R	-	O	SER	A	31	L	-	HB2	LEU	V	56
R	-	O	SER	A	31	L	-	HB3	LEU	V	56
R	-	O	SER	A	31	L	-	HD12	LEU	V	56
R	-	O	SER	A	31	L	-	HD22	LEU	V	56
R	-	N	PRO	A	32	L	-	HB3	LEU	V	56
R	-	N	PRO	A	32	L	-	HD12	LEU	V	56
R	-	CA	PRO	A	32	L	-	HB3	LEU	V	56
R	-	C	PRO	A	32	L	-	CB	LEU	V	56
R	-	C	PRO	A	32	L	-	O	LEU	V	56
R	-	C	PRO	A	32	L	-	HB2	LEU	V	56
R	-	C	PRO	A	32	L	-	HB3	LEU	V	56
R	-	C	PRO	A	32	L	-	HD11	LEU	V	56
R	-	C	PRO	A	32	L	-	HD12	LEU	V	56
R	-	O	PRO	A	32	L	-	CB	LEU	V	56
R	-	O	PRO	A	32	L	-	CD1	LEU	V	56
R	-	O	PRO	A	32	L	-	HB2	LEU	V	56
R	-	O	PRO	A	32	L	-	HB3	LEU	V	56
R	-	O	PRO	A	32	L	-	HD11	LEU	V	56
R	-	O	PRO	A	32	L	-	HD12	LEU	V	56
R	-	N	GLY	A	33	L	-	CB	LEU	V	56
R	-	N	GLY	A	33	L	-	O	LEU	V	56
R	-	N	GLY	A	33	L	-	HB2	LEU	V	56
R	-	N	GLY	A	33	L	-	HB3	LEU	V	56
R	-	CA	GLY	A	33	L	-	HB2	LEU	V	56
R	-	C	GLY	A	33	L	-	O	HIS	V	55
R	-	C	GLY	A	33	L	-	HB2	LEU	V	56
R	-	C	GLY	A	33	L	-	HD11	LEU	V	56
R	-	O	GLY	A	33	L	-	HB2	LEU	V	56
R	-	O	GLY	A	33	L	-	HD11	LEU	V	56
R	-	N	GLN	A	34	L	-	HG2	ARG	V	54
R	-	N	GLN	A	34	L	-	C	HIS	V	55
R	-	N	GLN	A	34	L	-	O	HIS	V	55
R	-	N	GLN	A	34	L	-	CB	LEU	V	56
R	-	N	GLN	A	34	L	-	HB2	LEU	V	56
R	-	N	GLN	A	34	L	-	HD11	LEU	V	56
R	-	CA	GLN	A	34	L	-	O	HIS	V	55
R	-	CA	GLN	A	34	L	-	HB3	HIS	V	55
R	-	CA	GLN	A	34	L	-	HD2	HIS	V	55
R	-	CA	GLN	A	34	L	-	HB2	LEU	V	56
R	-	C	GLN	A	34	L	-	CG	ARG	V	54
R	-	C	GLN	A	34	L	-	HG2	ARG	V	54
R	-	C	GLN	A	34	L	-	HG3	ARG	V	54
R	-	C	GLN	A	34	L	-	N	HIS	V	55
R	-	C	GLN	A	34	L	-	O	HIS	V	55
R	-	C	GLN	A	34	L	-	H	HIS	V	55
R	-	C	GLN	A	34	L	-	HB3	HIS	V	55
R	-	C	GLN	A	34	L	S	HH21	ARG	V	137
R	-	C	GLN	A	34	L	S	HH22	ARG	V	137
R	-	CB	GLN	A	34	L	-	C	HIS	V	55
R	-	CB	GLN	A	34	L	-	CB	HIS	V	55
R	-	CB	GLN	A	34	L	-	O	HIS	V	55
R	-	CB	GLN	A	34	L	-	CG	HIS	V	55
R	-	CB	GLN	A	34	L	-	CD2	HIS	V	55
R	-	CB	GLN	A	34	L	-	HB3	HIS	V	55
R	-	CB	GLN	A	34	L	-	HD2	HIS	V	55
R	-	CB	GLN	A	34	L	-	HB2	LEU	V	56
R	-	CB	GLN	A	34	L	-	HD11	LEU	V	56
R	-	CB	GLN	A	34	L	S	NH2	ARG	V	137
R	-	CB	GLN	A	34	L	S	CZ	ARG	V	137
R	-	CB	GLN	A	34	L	S	HH21	ARG	V	137
R	-	CB	GLN	A	34	L	S	HH22	ARG	V	137
R	-	O	GLN	A	34	L	-	CA	ARG	V	54
R	-	O	GLN	A	34	L	-	C	ARG	V	54
R	-	O	GLN	A	34	L	-	CB	ARG	V	54
R	-	O	GLN	A	34	L	-	CG	ARG	V	54
R	-	O	GLN	A	34	L	-	CD	ARG	V	54
R	-	O	GLN	A	34	L	-	HA	ARG	V	54
R	-	O	GLN	A	34	L	-	HG2	ARG	V	54
R	-	O	GLN	A	34	L	-	HG3	ARG	V	54
R	-	O	GLN	A	34	L	-	HD3	ARG	V	54
R	-	O	GLN	A	34	L	-	N	HIS	V	55
R	-	O	GLN	A	34	L	-	CA	HIS	V	55
R	-	O	GLN	A	34	L	-	C	HIS	V	55
R	-	O	GLN	A	34	L	-	CB	HIS	V	55
R	-	O	GLN	A	34	L	-	O	HIS	V	55
R	-	O	GLN	A	34	L	-	H	HIS	V	55
R	-	O	GLN	A	34	L	-	HB3	HIS	V	55
R	-	CG	GLN	A	34	L	-	CD2	HIS	V	55
R	-	CG	GLN	A	34	L	-	HD2	HIS	V	55
R	-	CG	GLN	A	34	L	-	CD1	LEU	V	56
R	-	CG	GLN	A	34	L	-	HD11	LEU	V	56
R	-	CD	GLN	A	34	L	-	CD2	HIS	V	55
R	-	CD	GLN	A	34	L	-	NE2	HIS	V	55
R	-	CD	GLN	A	34	L	-	HD2	HIS	V	55
R	-	CD	GLN	A	34	L	-	HE2	HIS	V	55
R	-	CD	GLN	A	34	L	-	HD11	LEU	V	56
R	-	CD	GLN	A	34	L	-	HD13	LEU	V	56
R	-	CD	GLN	A	34	L	S	NH1	ARG	V	137
R	-	CD	GLN	A	34	L	S	HH11	ARG	V	137
R	-	NE2	GLN	A	34	L	-	HD2	HIS	V	55
R	-	NE2	GLN	A	34	L	-	HE2	HIS	V	55
R	-	NE2	GLN	A	34	L	-	HD11	LEU	V	56
R	-	NE2	GLN	A	34	L	-	HD13	LEU	V	56
R	-	OE1	GLN	A	34	L	-	CG	HIS	V	55
R	-	OE1	GLN	A	34	L	-	CD2	HIS	V	55
R	-	OE1	GLN	A	34	L	-	NE2	HIS	V	55
R	-	OE1	GLN	A	34	L	-	HB3	HIS	V	55
R	-	OE1	GLN	A	34	L	-	HD2	HIS	V	55
R	-	OE1	GLN	A	34	L	-	HE2	HIS	V	55
R	-	OE1	GLN	A	34	L	S	CD	ARG	V	137
R	-	OE1	GLN	A	34	L	S	NE	ARG	V	137
R	-	OE1	GLN	A	34	L	S	NH1	ARG	V	137
R	-	OE1	GLN	A	34	L	S	NH2	ARG	V	137
R	-	OE1	GLN	A	34	L	S	CZ	ARG	V	137
R	-	OE1	GLN	A	34	L	S	HD2	ARG	V	137
R	-	OE1	GLN	A	34	L	S	HH11	ARG	V	137
R	-	OE1	GLN	A	34	L	S	HH12	ARG	V	137
R	-	N	GLY	A	35	L	-	HG3	ARG	V	54
R	-	N	GLY	A	35	L	S	HH22	ARG	V	137
R	-	CA	GLY	A	35	L	-	CG	ARG	V	54
R	-	CA	GLY	A	35	L	-	HG3	ARG	V	54
R	-	CA	GLY	A	35	L	-	HD3	ARG	V	54
R	-	C	GLY	A	35	L	-	CA	ARG	V	54
R	-	C	GLY	A	35	L	-	CB	ARG	V	54
R	-	C	GLY	A	35	L	-	CG	ARG	V	54
R	-	C	GLY	A	35	L	-	HA	ARG	V	54
R	-	C	GLY	A	35	L	-	HB2	ARG	V	54
R	-	C	GLY	A	35	L	-	HG2	ARG	V	54
R	-	C	GLY	A	35	L	-	HG3	ARG	V	54
R	-	C	GLY	A	35	L	-	HE	ARG	V	54
R	-	C	GLY	A	35	L	-	H	HIS	V	55
R	-	O	GLY	A	35	L	-	CA	ARG	V	54
R	-	O	GLY	A	35	L	-	CG	ARG	V	54
R	-	O	GLY	A	35	L	-	HA	ARG	V	54
R	-	O	GLY	A	35	L	-	HG3	ARG	V	54
R	-	O	GLY	A	35	L	-	N	HIS	V	55
R	-	O	GLY	A	35	L	-	H	HIS	V	55
R	-	O	GLY	A	35	L	S	NH2	ARG	V	137
R	-	O	GLY	A	35	L	S	HH21	ARG	V	137
R	-	O	GLY	A	35	L	S	HH22	ARG	V	137
R	-	N	ALA	A	36	L	-	OD2	ASP	V	51
R	-	N	ALA	A	36	L	-	CA	ARG	V	54
R	-	N	ALA	A	36	L	-	CB	ARG	V	54
R	-	N	ALA	A	36	L	-	CG	ARG	V	54
R	-	N	ALA	A	36	L	-	CD	ARG	V	54
R	-	N	ALA	A	36	L	-	NE	ARG	V	54
R	-	N	ALA	A	36	L	-	HA	ARG	V	54
R	-	N	ALA	A	36	L	-	HB2	ARG	V	54
R	-	N	ALA	A	36	L	-	HG2	ARG	V	54
R	-	N	ALA	A	36	L	-	HG3	ARG	V	54
R	-	N	ALA	A	36	L	-	HE	ARG	V	54
R	-	CA	ALA	A	36	L	-	CG	ASP	V	51
R	-	CA	ALA	A	36	L	-	OD2	ASP	V	51
R	-	CA	ALA	A	36	L	-	N	ARG	V	54
R	-	CA	ALA	A	36	L	-	CA	ARG	V	54
R	-	CA	ALA	A	36	L	-	CB	ARG	V	54
R	-	CA	ALA	A	36	L	-	CG	ARG	V	54
R	-	CA	ALA	A	36	L	-	HA	ARG	V	54
R	-	CA	ALA	A	36	L	-	HB2	ARG	V	54
R	-	CA	ALA	A	36	L	-	HG3	ARG	V	54
R	-	CA	ALA	A	36	L	-	HE	ARG	V	54
R	-	C	ALA	A	36	L	-	OD2	ASP	V	51
R	-	C	ALA	A	36	L	-	HA	ARG	V	54
R	-	CB	ALA	A	36	L	-	CB	ASP	V	51
R	-	CB	ALA	A	36	L	-	CG	ASP	V	51
R	-	CB	ALA	A	36	L	-	OD1	ASP	V	51
R	-	CB	ALA	A	36	L	-	OD2	ASP	V	51
R	-	CB	ALA	A	36	L	-	HB2	ASP	V	51
R	-	CB	ALA	A	36	L	-	HB3	ASP	V	51
R	-	CB	ALA	A	36	L	-	CB	ARG	V	54
R	-	CB	ALA	A	36	L	-	NE	ARG	V	54
R	-	CB	ALA	A	36	L	-	HA	ARG	V	54
R	-	CB	ALA	A	36	L	-	HB2	ARG	V	54
R	-	CB	ALA	A	36	L	-	HG3	ARG	V	54
R	-	CB	ALA	A	36	L	-	HE	ARG	V	54
R	-	CB	ALA	A	36	L	-	HH21	ARG	V	54
R	-	N	GLY	A	37	L	-	O	CYS	V	53
R	-	N	GLY	A	37	L	-	HA	ARG	V	54
R	-	N	GLY	A	37	L	S	HE2	HIS	V	103
R	-	C	GLY	A	37	L	-	HB3	CYS	V	53
R	-	O	GLY	A	37	L	-	CB	CYS	V	53
R	-	O	GLY	A	37	L	-	HB2	CYS	V	53
R	-	O	GLY	A	37	L	-	HB3	CYS	V	53
R	-	O	GLY	A	37	L	S	CE1	HIS	V	103
R	-	O	GLY	A	37	L	S	HE1	HIS	V	103
R	-	CB	PRO	A	39	L	-	HH12	ARG	V	87
R	-	CG	PRO	A	39	L	-	HH12	ARG	V	87
R	-	CD	PRO	A	39	L	-	HG	CYS	V	53
R	-	C	THR	A	40	L	-	HE1	PHE	V	180
R	-	CB	THR	A	40	L	-	CB	GLU	V	90
R	-	CB	THR	A	40	L	-	HB3	GLU	V	90
R	-	CB	THR	A	40	L	-	HG3	GLU	V	90
R	-	O	THR	A	40	L	-	CE1	PHE	V	180
R	-	O	THR	A	40	L	-	HE1	PHE	V	180
R	-	O	THR	A	40	L	-	HZ	PHE	V	180
R	-	CG2	THR	A	40	L	-	HB3	GLU	V	90
R	-	CG2	THR	A	40	L	-	HG3	GLU	V	90
R	-	OG1	THR	A	40	L	-	N	GLU	V	90
R	-	OG1	THR	A	40	L	-	CA	GLU	V	90
R	-	OG1	THR	A	40	L	-	CB	GLU	V	90
R	-	OG1	THR	A	40	L	-	CG	GLU	V	90
R	-	OG1	THR	A	40	L	-	CD	GLU	V	90
R	-	OG1	THR	A	40	L	-	OE2	GLU	V	90
R	-	OG1	THR	A	40	L	-	H	GLU	V	90
R	-	OG1	THR	A	40	L	-	HA	GLU	V	90
R	-	OG1	THR	A	40	L	-	HB2	GLU	V	90
R	-	OG1	THR	A	40	L	-	HB3	GLU	V	90
R	-	OG1	THR	A	40	L	-	HG3	GLU	V	90
R	-	N	PRO	A	41	L	-	HE1	PHE	V	180
R	-	CA	PRO	A	41	L	-	CE1	PHE	V	180
R	-	CA	PRO	A	41	L	-	CZ	PHE	V	180
R	-	CA	PRO	A	41	L	-	HE1	PHE	V	180
R	-	CA	PRO	A	41	L	-	HZ	PHE	V	180
R	-	C	PRO	A	41	L	-	CE1	PHE	V	180
R	-	C	PRO	A	41	L	-	CZ	PHE	V	180
R	-	C	PRO	A	41	L	-	HE1	PHE	V	180
R	-	C	PRO	A	41	L	-	HZ	PHE	V	180
R	-	CB	PRO	A	41	L	-	HZ	PHE	V	180
R	-	O	PRO	A	41	L	-	HZ	PHE	V	180
R	-	N	GLN	A	42	L	-	CD1	PHE	V	180
R	-	N	GLN	A	42	L	-	CE1	PHE	V	180
R	-	N	GLN	A	42	L	-	CE2	PHE	V	180
R	-	N	GLN	A	42	L	-	CZ	PHE	V	180
R	-	N	GLN	A	42	L	-	HE1	PHE	V	180
R	-	N	GLN	A	42	L	-	HZ	PHE	V	180
R	-	CA	GLN	A	42	L	-	HB1	ALA	V	179
R	-	CA	GLN	A	42	L	-	CE1	PHE	V	180
R	-	CA	GLN	A	42	L	-	CE2	PHE	V	180
R	-	CA	GLN	A	42	L	-	CZ	PHE	V	180
R	-	CA	GLN	A	42	L	-	HE1	PHE	V	180
R	-	CA	GLN	A	42	L	-	HZ	PHE	V	180
R	-	C	GLN	A	42	L	-	HB1	ALA	V	179
R	-	C	GLN	A	42	L	-	CZ	PHE	V	180
R	-	C	GLN	A	42	L	-	HZ	PHE	V	180
R	-	CB	GLN	A	42	L	-	CB	ALA	V	179
R	-	CB	GLN	A	42	L	-	HA	ALA	V	179
R	-	CB	GLN	A	42	L	-	HB1	ALA	V	179
R	-	CB	GLN	A	42	L	-	CD1	PHE	V	180
R	-	CB	GLN	A	42	L	-	CD2	PHE	V	180
R	-	CB	GLN	A	42	L	-	CE1	PHE	V	180
R	-	CB	GLN	A	42	L	-	CE2	PHE	V	180
R	-	CB	GLN	A	42	L	-	CZ	PHE	V	180
R	-	CB	GLN	A	42	L	-	H	PHE	V	180
R	-	CB	GLN	A	42	L	-	HE1	PHE	V	180
R	-	CB	GLN	A	42	L	-	HZ	PHE	V	180
R	-	O	GLN	A	42	L	-	HB1	ALA	V	179
R	-	O	GLN	A	42	L	-	CE2	PHE	V	180
R	-	O	GLN	A	42	L	-	CZ	PHE	V	180
R	-	O	GLN	A	42	L	-	HE2	PHE	V	180
R	-	O	GLN	A	42	L	-	HZ	PHE	V	180
R	-	CG	GLN	A	42	L	-	CD1	PHE	V	180
R	-	CG	GLN	A	42	L	-	CE1	PHE	V	180
R	-	CG	GLN	A	42	L	-	CZ	PHE	V	180
R	-	CG	GLN	A	42	L	-	H	PHE	V	180
R	-	CG	GLN	A	42	L	-	HD1	PHE	V	180
R	-	CG	GLN	A	42	L	-	HE1	PHE	V	180
R	-	CD	GLN	A	42	L	-	HA	ALA	V	179
R	-	CD	GLN	A	42	L	-	N	PHE	V	180
R	-	CD	GLN	A	42	L	-	CA	PHE	V	180
R	-	CD	GLN	A	42	L	-	CD1	PHE	V	180
R	-	CD	GLN	A	42	L	-	H	PHE	V	180
R	-	CD	GLN	A	42	L	-	HA	PHE	V	180
R	-	CD	GLN	A	42	L	-	HD1	PHE	V	180
R	-	NE2	GLN	A	42	L	-	O	MET	V	88
R	-	NE2	GLN	A	42	L	-	HB3	MET	V	88
R	-	NE2	GLN	A	42	L	-	HG3	MET	V	88
R	-	NE2	GLN	A	42	L	-	O	GLY	V	89
R	-	NE2	GLN	A	42	L	-	N	PHE	V	180
R	-	NE2	GLN	A	42	L	-	H	PHE	V	180
R	-	NE2	GLN	A	42	L	-	HA	PHE	V	180
R	-	NE2	GLN	A	42	L	-	HD1	PHE	V	180
R	-	OE1	GLN	A	42	L	-	CA	ALA	V	179
R	-	OE1	GLN	A	42	L	-	C	ALA	V	179
R	-	OE1	GLN	A	42	L	-	HA	ALA	V	179
R	-	OE1	GLN	A	42	L	-	HB1	ALA	V	179
R	-	OE1	GLN	A	42	L	-	N	PHE	V	180
R	-	OE1	GLN	A	42	L	-	CA	PHE	V	180
R	-	OE1	GLN	A	42	L	-	H	PHE	V	180
R	-	OE1	GLN	A	42	L	-	HA	PHE	V	180
R	-	O	LEU	A	43	L	-	HB3	ALA	V	179
R	-	N	LEU	A	44	L	-	HB3	ALA	V	179
R	-	CA	LEU	A	44	L	-	HB3	ALA	V	179
R	-	CG	LEU	A	44	L	-	HB2	ALA	V	179
R	-	CD2	LEU	A	44	L	-	CB	ALA	V	179
R	-	CD2	LEU	A	44	L	-	HB1	ALA	V	179
R	-	CD2	LEU	A	44	L	-	HB2	ALA	V	179
R	-	CD2	LEU	A	44	L	-	HB3	ALA	V	179
R	-	CD	PRO	A	45	L	-	HB3	ALA	V	179

- 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