T0P

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
OBE	PBD	doub	0.00Å	1.49Å
PBD	OBF	sing	0.00Å	1.49Å
PBD	OAT	sing	0.00Å	1.64Å
OAT	CAS	sing	0.00Å	1.43Å
CAS	CAN	sing	0.00Å	1.53Å
NAL	CAD	sing	0.00Å	1.33Å
CAD	NAE	sing	0.00Å	1.39Å
CAD	NAC	doub	0.00Å	1.33Å
OAM	CAN	sing	0.00Å	1.47Å
OAM	CAK	sing	0.00Å	1.44Å
CAN	CAO	sing	0.00Å	1.53Å
NAE	CAF	sing	0.00Å	1.39Å
NAC	CAB	sing	0.00Å	1.34Å
O	C	doub	0.00Å	1.24Å
FAQ	CAP	sing	0.00Å	1.37Å
CAF	OAJ	doub	0.00Å	1.23Å
CAF	CAA	sing	0.00Å	1.34Å
CAB	CAA	doub	0.00Å	1.34Å	Aromatic
CAB	NAI	sing	0.00Å	1.33Å	Aromatic
CAK	NAI	sing	0.00Å	1.51Å
CAK	CAP	sing	0.00Å	1.51Å
CAA	N	sing	0.00Å	1.34Å	Aromatic
CAO	CAP	sing	0.00Å	1.51Å
CAO	OAR	sing	0.00Å	1.41Å
NAI	CAH	doub	0.00Å	1.34Å	Aromatic
CBC	CBB	doub	0.00Å	1.39Å	Aromatic
CBC	CAW	sing	0.00Å	1.39Å	Aromatic
C	CAW	sing	0.00Å	1.39Å
C	CA	sing	0.00Å	1.53Å
N	CAH	sing	0.00Å	1.33Å	Aromatic
N	CA	sing	0.00Å	1.49Å
CBB	CBA	sing	0.00Å	1.39Å	Aromatic
CAW	CAY	doub	0.00Å	1.39Å	Aromatic
CBA	CAZ	doub	0.00Å	1.39Å	Aromatic
CAY	CAZ	sing	0.00Å	1.40Å	Aromatic
PBD	O1	sing	0.00Å	1.57Å
CA	H1	sing	0.00Å	1.10Å
CA	H2	sing	0.00Å	1.10Å
CAH	H3	sing	0.00Å	1.08Å
CAK	H4	sing	0.00Å	1.10Å
CAN	H5	sing	0.00Å	1.10Å
CAO	H6	sing	0.00Å	1.10Å
CAP	H7	sing	0.00Å	1.10Å
CAS	H8	sing	0.00Å	1.10Å
CAS	H9	sing	0.00Å	1.10Å
CAY	H10	sing	0.00Å	1.08Å
CAZ	H11	sing	0.00Å	1.08Å
CBA	H12	sing	0.00Å	1.08Å
CBB	H13	sing	0.00Å	1.08Å
CBC	H14	sing	0.00Å	1.08Å
NAE	H15	sing	0.00Å	1.00Å
NAL	H16	sing	0.00Å	1.00Å
NAL	H17	sing	0.00Å	1.00Å
OAR	H18	sing	0.00Å	0.95Å
OBF	H19	sing	0.00Å	0.95Å
O1	H20	sing	0.00Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
OBE	PBD	OBF	119.4°	90.0°
OBE	PBD	OAT	107.6°	90.0°
OBE	PBD	O1	94.5°	90.0°
OBF	PBD	OAT	108.4°	90.0°
OBF	PBD	O1	110.9°	90.0°
PBD	OBF	H19	109.5°	90.0°
PBD	OAT	CAS	122.8°	90.0°
OAT	PBD	O1	115.8°	90.0°
OAT	CAS	CAN	108.2°	90.0°
OAT	CAS	H8	109.8°	90.0°
OAT	CAS	H9	109.8°	90.0°
CAS	CAN	OAM	112.3°	90.0°
CAS	CAN	CAO	110.8°	90.0°
CAS	CAN	H5	109.5°	90.0°
CAN	CAS	H8	109.8°	90.0°
CAN	CAS	H9	109.8°	90.0°
NAL	CAD	NAE	120.4°	90.0°
NAL	CAD	NAC	120.0°	90.0°
CAD	NAL	H16	120.0°	90.0°
CAD	NAL	H17	120.0°	90.0°
NAE	CAD	NAC	119.6°	90.0°
CAD	NAE	CAF	118.7°	90.0°
CAD	NAE	H15	120.7°	90.0°
CAD	NAC	CAB	120.7°	90.0°
CAN	OAM	CAK	102.2°	90.0°
OAM	CAN	CAO	104.2°	90.0°
OAM	CAN	H5	110.4°	90.0°
OAM	CAK	NAI	113.6°	90.0°
OAM	CAK	CAP	97.4°	90.0°
OAM	CAK	H4	110.2°	90.0°
CAN	CAO	CAP	101.6°	90.0°
CAN	CAO	OAR	106.8°	90.0°
CAO	CAN	H5	109.5°	90.0°
CAN	CAO	H6	112.3°	90.0°
NAE	CAF	OAJ	117.7°	90.0°
NAE	CAF	CAA	119.6°	90.0°
CAF	NAE	H15	120.6°	90.0°
NAC	CAB	CAA	121.3°	90.0°
NAC	CAB	NAI	130.0°	90.0°
O	C	CAW	121.8°	90.0°
O	C	CA	123.4°	90.0°
FAQ	CAP	CAK	107.0°	90.0°
FAQ	CAP	CAO	110.8°	90.0°
FAQ	CAP	H7	115.3°	90.0°
OAJ	CAF	CAA	122.7°	90.0°
CAF	CAA	CAB	120.1°	90.0°
CAF	CAA	N	132.8°	90.0°
CAA	CAB	NAI	108.7°	90.0°
CAB	CAA	N	107.1°	90.0°
CAB	NAI	CAK	127.6°	90.0°
CAB	NAI	CAH	107.6°	90.0°
NAI	CAK	CAP	116.5°	90.0°
CAK	NAI	CAH	124.8°	90.0°
NAI	CAK	H4	109.3°	90.0°
CAK	CAP	CAO	96.7°	90.0°
CAP	CAK	H4	109.3°	90.0°
CAK	CAP	H7	112.8°	90.0°
CAA	N	CAH	108.2°	90.0°
CAA	N	CA	129.4°	90.0°
CAP	CAO	OAR	108.0°	90.0°
CAP	CAO	H6	112.7°	90.0°
CAO	CAP	H7	112.7°	90.0°
OAR	CAO	H6	114.4°	90.0°
CAO	OAR	H18	109.5°	90.0°
NAI	CAH	N	108.4°	90.0°
NAI	CAH	H3	125.8°	90.0°
CBB	CBC	CAW	120.0°	90.0°
CBC	CBB	CBA	120.7°	90.0°
CBC	CBB	H13	119.6°	90.0°
CBB	CBC	H14	120.0°	90.0°
CBC	CAW	C	119.9°	90.0°
CBC	CAW	CAY	119.9°	90.0°
CAW	CBC	H14	120.0°	90.0°
CAW	C	CA	114.8°	90.0°
C	CAW	CAY	120.2°	90.0°
C	CA	N	112.7°	90.0°
C	CA	H1	108.7°	90.0°
C	CA	H2	108.6°	90.0°
CAH	N	CA	122.4°	90.0°
N	CAH	H3	125.8°	90.0°
N	CA	H1	108.6°	90.0°
N	CA	H2	108.7°	90.0°
CBB	CBA	CAZ	118.8°	90.0°
CBB	CBA	H12	120.6°	90.0°
CBA	CBB	H13	119.7°	90.0°
CAW	CAY	CAZ	119.7°	90.0°
CAW	CAY	H10	120.1°	90.0°
CBA	CAZ	CAY	120.9°	90.0°
CBA	CAZ	H11	119.6°	90.0°
CAZ	CBA	H12	120.6°	90.0°
CAZ	CAY	H10	120.2°	90.0°
CAY	CAZ	H11	119.5°	90.0°
PBD	O1	H20	109.5°	90.0°
H1	CA	H2	109.5°	90.0°
H8	CAS	H9	109.5°	90.0°
H16	NAL	H17	120.0°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
OBE	PBD	OBF	OAT	123.6°	90.0°
OBE	PBD	OBF	O1	108.1°	90.0°
OBE	PBD	OAT	O1	104.2°	90.0°
OBE	PBD	OAT	CAS	162.6°	90.0°
OBE	PBD	OBF	H19	0.0°	90.0°
OBE	PBD	O1	H20	0.0°	90.0°
OBF	PBD	OAT	O1	125.4°	90.0°
OBF	PBD	OAT	CAS	67.0°	90.0°
OBF	PBD	O1	H20	123.8°	90.0°
PBD	OAT	CAS	CAN	162.5°	90.0°
PBD	OAT	CAS	H8	42.7°	90.0°
PBD	OAT	CAS	H9	77.7°	90.0°
OAT	PBD	OBF	H19	123.6°	90.0°
OAT	PBD	O1	H20	112.0°	90.0°
OAT	CAS	CAN	H8	119.8°	90.0°
OAT	CAS	CAN	H9	119.8°	90.0°
OAT	CAS	CAN	OAM	55.0°	90.0°
OAT	CAS	CAN	CAO	61.0°	90.0°
CAS	OAT	PBD	O1	58.5°	90.0°
OAT	CAS	CAN	H5	178.1°	90.0°
OAT	CAS	H8	H9	120.6°	90.0°
CAS	CAN	OAM	CAO	120.0°	90.0°
CAS	CAN	OAM	H5	122.5°	90.0°
CAS	CAN	OAM	CAK	147.3°	90.0°
CAS	CAN	CAO	H5	121.0°	90.0°
CAS	CAN	CAO	CAP	110.9°	90.0°
CAS	CAN	CAO	OAR	136.1°	90.0°
CAS	CAN	CAO	H6	9.8°	90.0°
CAN	CAS	H8	H9	120.6°	90.0°
NAL	CAD	NAE	NAC	179.9°	90.0°
NAL	CAD	NAE	CAF	179.9°	90.0°
NAL	CAD	NAC	CAB	179.9°	90.0°
NAL	CAD	NAE	H15	0.1°	90.0°
CAD	NAL	H16	H17	180.0°	90.0°
CAD	NAE	CAF	H15	180.0°	90.0°
NAE	CAD	NAC	CAB	0.0°	90.0°
CAD	NAE	CAF	OAJ	179.7°	90.0°
CAD	NAE	CAF	CAA	0.3°	90.0°
NAE	CAD	NAL	H16	179.9°	90.0°
NAE	CAD	NAL	H17	0.1°	90.0°
NAC	CAD	NAE	CAF	0.2°	90.0°
CAD	NAC	CAB	CAA	0.0°	90.0°
CAD	NAC	CAB	NAI	179.5°	90.0°
NAC	CAD	NAE	H15	179.8°	90.0°
NAC	CAD	NAL	H16	0.0°	90.0°
NAC	CAD	NAL	H17	180.0°	90.0°
OAM	CAN	CAO	H5	118.1°	90.0°
CAN	OAM	CAK	NAI	177.6°	90.0°
CAN	OAM	CAK	CAP	54.4°	90.0°
OAM	CAN	CAO	CAP	10.1°	90.0°
OAM	CAN	CAO	OAR	103.0°	90.0°
CAN	OAM	CAK	H4	59.4°	90.0°
OAM	CAN	CAO	H6	130.8°	90.0°
OAM	CAN	CAS	H8	174.9°	90.0°
OAM	CAN	CAS	H9	64.8°	90.0°
CAK	OAM	CAN	CAO	27.3°	90.0°
OAM	CAK	CAP	FAQ	54.8°	90.0°
OAM	CAK	NAI	CAB	60.9°	90.0°
OAM	CAK	NAI	CAP	112.0°	90.0°
OAM	CAK	NAI	H4	123.5°	90.0°
OAM	CAK	CAP	H4	114.5°	90.0°
OAM	CAK	CAP	CAO	59.5°	90.0°
OAM	CAK	NAI	CAH	117.7°	90.0°
CAK	OAM	CAN	H5	90.1°	90.0°
OAM	CAK	CAP	H7	177.5°	90.0°
CAN	CAO	CAP	FAQ	69.5°	90.0°
CAN	CAO	CAP	CAK	41.5°	90.0°
CAN	CAO	CAP	OAR	112.2°	90.0°
CAN	CAO	CAP	H6	120.4°	90.0°
CAN	CAO	OAR	H6	125.0°	90.0°
CAN	CAO	CAP	H7	159.6°	90.0°
CAO	CAN	CAS	H8	58.8°	90.0°
CAO	CAN	CAS	H9	179.2°	90.0°
CAN	CAO	OAR	H18	180.0°	90.0°
NAE	CAF	OAJ	CAA	180.0°	90.0°
NAE	CAF	CAA	CAB	0.2°	90.0°
NAE	CAF	CAA	N	179.5°	90.0°
NAC	CAB	CAA	CAF	0.1°	90.0°
NAC	CAB	CAA	NAI	179.6°	90.0°
NAC	CAB	NAI	CAK	1.3°	90.0°
NAC	CAB	CAA	N	179.7°	90.0°
NAC	CAB	NAI	CAH	180.0°	90.0°
O	C	CAW	CBC	15.3°	90.0°
O	C	CAW	CA	179.9°	90.0°
O	C	CA	N	2.2°	90.0°
O	C	CAW	CAY	164.5°	90.0°
O	C	CA	H1	122.6°	90.0°
O	C	CA	H2	118.3°	90.0°
FAQ	CAP	CAK	NAI	66.3°	90.0°
FAQ	CAP	CAK	CAO	114.2°	90.0°
FAQ	CAP	CAK	H7	127.7°	90.0°
FAQ	CAP	CAO	H7	130.8°	90.0°
FAQ	CAP	CAO	OAR	178.3°	90.0°
FAQ	CAP	CAK	H4	169.3°	90.0°
FAQ	CAP	CAO	H6	50.9°	90.0°
OAJ	CAF	CAA	CAB	179.7°	90.0°
OAJ	CAF	CAA	N	0.5°	90.0°
OAJ	CAF	NAE	H15	0.3°	90.0°
CAF	CAA	CAB	N	179.8°	90.0°
CAF	CAA	CAB	NAI	179.5°	90.0°
CAF	CAA	N	CAH	179.6°	90.0°
CAF	CAA	N	CA	1.0°	90.0°
CAA	CAF	NAE	H15	179.7°	90.0°
CAA	CAB	NAI	CAK	179.2°	90.0°
CAA	CAB	NAI	CAH	0.5°	90.0°
CAB	CAA	N	CAH	0.7°	90.0°
CAB	CAA	N	CA	179.2°	90.0°
CAB	NAI	CAK	CAH	178.5°	90.0°
CAB	NAI	CAK	CAP	51.2°	90.0°
NAI	CAB	CAA	N	0.7°	90.0°
CAB	NAI	CAH	N	0.1°	90.0°
CAB	NAI	CAH	H3	180.0°	90.0°
CAB	NAI	CAK	H4	175.6°	90.0°
NAI	CAK	CAP	H4	124.5°	90.0°
NAI	CAK	CAP	CAO	179.5°	90.0°
CAK	NAI	CAH	N	178.9°	90.0°
CAK	NAI	CAH	H3	1.2°	90.0°
NAI	CAK	CAP	H7	61.5°	90.0°
CAK	CAP	CAO	H7	118.1°	90.0°
CAK	CAP	CAO	OAR	70.6°	90.0°
CAP	CAK	NAI	CAH	130.3°	90.0°
CAK	CAP	CAO	H6	162.0°	90.0°
CAA	N	CAH	NAI	0.4°	90.0°
CAA	N	CA	C	60.3°	90.0°
CAA	N	CAH	CA	178.7°	90.0°
CAA	N	CA	H1	179.2°	90.0°
CAA	N	CA	H2	60.2°	90.0°
CAA	N	CAH	H3	179.6°	90.0°
CAP	CAO	OAR	H6	126.4°	90.0°
CAO	CAP	CAK	H4	55.0°	90.0°
CAP	CAO	CAN	H5	128.2°	90.0°
CAP	CAO	OAR	H18	71.4°	90.0°
OAR	CAO	CAN	H5	15.1°	90.0°
OAR	CAO	CAP	H7	47.5°	90.0°
NAI	CAH	N	H3	180.0°	90.0°
NAI	CAH	N	CA	179.0°	90.0°
CAH	NAI	CAK	H4	5.9°	90.0°
CBB	CBC	CAW	H14	180.0°	90.0°
CBB	CBC	CAW	C	179.9°	90.0°
CBC	CBB	CBA	H13	180.0°	90.0°
CBB	CBC	CAW	CAY	0.1°	90.0°
CBC	CBB	CBA	CAZ	0.1°	90.0°
CBC	CBB	CBA	H12	180.0°	90.0°
CBC	CAW	C	CAY	179.8°	90.0°
CBC	CAW	C	CA	164.8°	90.0°
CAW	CBC	CBB	CBA	0.2°	90.0°
CBC	CAW	CAY	CAZ	0.2°	90.0°
CBC	CAW	CAY	H10	179.8°	90.0°
CAW	CBC	CBB	H13	179.8°	90.0°
CAW	C	CA	N	177.7°	90.0°
C	CAW	CAY	CAZ	179.6°	90.0°
CAW	C	CA	H1	57.3°	90.0°
CAW	C	CA	H2	61.8°	90.0°
C	CAW	CAY	H10	0.4°	90.0°
C	CAW	CBC	H14	0.1°	90.0°
C	CA	N	CAH	121.4°	90.0°
C	CA	N	H1	120.5°	90.0°
C	CA	N	H2	120.5°	90.0°
CA	C	CAW	CAY	15.4°	90.0°
C	CA	H1	H2	118.5°	90.0°
CAH	N	CA	H1	0.9°	90.0°
CAH	N	CA	H2	118.2°	90.0°
N	CA	H1	H2	118.5°	90.0°
CA	N	CAH	H3	1.0°	90.0°
CBB	CBA	CAZ	H12	180.0°	90.0°
CBB	CBA	CAZ	CAY	0.2°	90.0°
CBB	CBA	CAZ	H11	179.8°	90.0°
CBA	CBB	CBC	H14	179.8°	90.0°
CAW	CAY	CAZ	CBA	0.4°	90.0°
CAW	CAY	CAZ	H10	180.0°	90.0°
CAW	CAY	CAZ	H11	179.6°	90.0°
CAY	CAW	CBC	H14	179.9°	90.0°
CBA	CAZ	CAY	H11	180.0°	90.0°
CBA	CAZ	CAY	H10	179.6°	90.0°
CAZ	CBA	CBB	H13	179.9°	90.0°
CAY	CAZ	CBA	H12	179.7°	90.0°
O1	PBD	OBF	H19	108.1°	90.0°
H4	CAK	CAP	H7	63.0°	90.0°
H5	CAN	CAO	H6	111.2°	90.0°
H5	CAN	CAS	H8	62.1°	90.0°
H5	CAN	CAS	H9	58.3°	90.0°
H6	CAO	CAP	H7	79.9°	90.0°
H6	CAO	OAR	H18	55.0°	90.0°
H10	CAY	CAZ	H11	0.4°	90.0°
H11	CAZ	CBA	H12	0.3°	90.0°
H12	CBA	CBB	H13	0.0°	90.0°
H13	CBB	CBC	H14	0.2°	90.0°

Release date:	2022-02-09
Definition date:	2020-03-16
Last modified:	2022-02-04
Release status:	REL
Processing site:	RCSB
Derived from:	7LCD