SF2

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CAA	OAR	sing	1.43Å	1.46Å
CAA	HAA1	sing	1.09Å	1.10Å
CAA	HAA2	sing	1.09Å	1.10Å
CAA	HAA3	sing	1.09Å	1.10Å
OAR	CAW	sing	1.36Å	1.37Å
CAW	CAJ	sing	1.39Å	1.40Å	Aromatic
CAW	CAO	doub	1.39Å	1.41Å	Aromatic
CAO	CAV	sing	1.38Å	1.40Å	Aromatic
CAO	HAO	sing	1.08Å	1.08Å
CAJ	CAH	doub	1.38Å	1.39Å	Aromatic
CAJ	HAJ	sing	1.08Å	1.08Å
CAH	CAI	sing	1.38Å	1.39Å	Aromatic
CAH	HAH	sing	1.08Å	1.08Å
CAI	CAV	doub	1.38Å	1.40Å	Aromatic
CAI	HAI	sing	1.08Å	1.08Å
CAV	CAQ	sing	1.51Å	1.56Å
CAQ	NBC	sing	1.46Å	1.48Å
CAQ	HAQ1	sing	1.09Å	1.10Å
CAQ	HAQ2	sing	1.09Å	1.10Å
NBC	CBB	sing	1.38Å	1.34Å	Aromatic
NBC	CAZ	sing	1.39Å	1.34Å	Aromatic
CAZ	CAY	doub	1.38Å	1.39Å	Aromatic
CAZ	CAT	sing	1.41Å	1.54Å
CAT	OAC	doub	1.22Å	1.25Å
CAT	OAB	sing	1.35Å	1.25Å
OAB	HOAB	sing	0.97Å	0.95Å
CBB	CAN	sing	1.39Å	1.40Å	Aromatic
CBB	CBA	doub	1.41Å	1.39Å	Aromatic
CAN	CAM	doub	1.38Å	1.39Å	Aromatic
CAN	HAN	sing	1.08Å	1.08Å
CAM	CAU	sing	1.39Å	1.39Å	Aromatic
CAM	HAM	sing	1.08Å	1.08Å
CAU	CLAD	sing	1.74Å	1.73Å
CAU	CAP	doub	1.37Å	1.39Å	Aromatic
CAP	CBA	sing	1.40Å	1.39Å	Aromatic
CAP	HAP	sing	1.08Å	1.08Å
CBA	CAY	sing	1.47Å	1.38Å	Aromatic
CAY	SAS	sing	1.76Å	1.77Å
SAS	CAX	sing	1.76Å	1.74Å
CAX	CAL	doub	1.39Å	1.39Å	Aromatic
CAX	CAK	sing	1.39Å	1.39Å	Aromatic
CAK	CAF	doub	1.38Å	1.40Å	Aromatic
CAK	HAK	sing	1.08Å	1.08Å
CAF	CAE	sing	1.38Å	1.39Å	Aromatic
CAF	HAF	sing	1.08Å	1.08Å
CAE	CAG	doub	1.38Å	1.39Å	Aromatic
CAE	HAE	sing	1.08Å	1.08Å
CAG	CAL	sing	1.38Å	1.39Å	Aromatic
CAG	HAG	sing	1.08Å	1.08Å
CAL	HAL	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
OAR	CAA	HAA1	109.5°	109.5°
OAR	CAA	HAA2	109.4°	109.5°
OAR	CAA	HAA3	109.5°	109.5°
CAA	OAR	CAW	113.2°	117.0°
HAA1	CAA	HAA2	109.4°	109.4°
HAA1	CAA	HAA3	109.4°	109.4°
HAA2	CAA	HAA3	109.5°	109.5°
OAR	CAW	CAJ	119.3°	120.1°
OAR	CAW	CAO	120.4°	120.0°
CAJ	CAW	CAO	120.4°	119.9°
CAW	CAJ	CAH	119.7°	119.9°
CAW	CAJ	HAJ	120.2°	120.0°
CAW	CAO	CAV	120.6°	119.9°
CAW	CAO	HAO	119.7°	120.1°
CAV	CAO	HAO	119.7°	120.0°
CAO	CAV	CAI	117.8°	120.1°
CAO	CAV	CAQ	122.2°	120.0°
CAH	CAJ	HAJ	120.2°	120.1°
CAJ	CAH	CAI	119.5°	120.1°
CAJ	CAH	HAH	120.2°	119.9°
CAI	CAH	HAH	120.3°	120.0°
CAH	CAI	CAV	122.1°	120.1°
CAH	CAI	HAI	118.9°	119.9°
CAV	CAI	HAI	119.0°	119.9°
CAI	CAV	CAQ	120.0°	120.0°
CAV	CAQ	NBC	107.1°	109.5°
CAV	CAQ	HAQ1	110.2°	109.4°
CAV	CAQ	HAQ2	110.8°	109.4°
NBC	CAQ	HAQ1	110.3°	109.5°
NBC	CAQ	HAQ2	110.8°	109.5°
CAQ	NBC	CBB	123.1°	125.1°
CAQ	NBC	CAZ	126.7°	125.0°
HAQ1	CAQ	HAQ2	107.7°	109.5°
CBB	NBC	CAZ	110.1°	109.9°
NBC	CBB	CAN	133.1°	132.7°
NBC	CBB	CBA	107.7°	108.0°
NBC	CAZ	CAY	107.9°	108.9°
NBC	CAZ	CAT	127.4°	125.6°
CAY	CAZ	CAT	124.6°	125.6°
CAZ	CAY	CBA	107.0°	106.6°
CAZ	CAY	SAS	128.0°	126.7°
CAZ	CAT	OAC	118.1°	120.0°
CAZ	CAT	OAB	118.3°	120.0°
OAC	CAT	OAB	123.5°	120.0°
CAT	OAB	HOAB	109.5°	114.0°
CAN	CBB	CBA	119.3°	119.2°
CBB	CAN	CAM	119.9°	119.9°
CBB	CAN	HAN	120.1°	120.1°
CBB	CBA	CAP	120.6°	120.0°
CBB	CBA	CAY	107.2°	106.6°
CAM	CAN	HAN	120.0°	120.1°
CAN	CAM	CAU	120.3°	120.7°
CAN	CAM	HAM	119.9°	119.7°
CAU	CAM	HAM	119.9°	119.7°
CAM	CAU	CLAD	120.4°	119.7°
CAM	CAU	CAP	119.9°	120.5°
CLAD	CAU	CAP	119.7°	119.7°
CAU	CAP	CBA	120.0°	119.8°
CAU	CAP	HAP	120.0°	120.1°
CBA	CAP	HAP	120.0°	120.1°
CAP	CBA	CAY	132.2°	133.4°
CBA	CAY	SAS	124.6°	126.7°
CAY	SAS	CAX	117.8°	100.0°
SAS	CAX	CAL	116.1°	120.1°
SAS	CAX	CAK	123.8°	120.0°
CAL	CAX	CAK	120.0°	119.9°
CAX	CAL	CAG	120.7°	119.9°
CAX	CAL	HAL	119.6°	120.0°
CAX	CAK	CAF	119.2°	119.9°
CAX	CAK	HAK	120.4°	120.0°
CAF	CAK	HAK	120.4°	120.0°
CAK	CAF	CAE	120.8°	120.1°
CAK	CAF	HAF	119.6°	120.0°
CAE	CAF	HAF	119.6°	120.0°
CAF	CAE	CAG	119.8°	120.1°
CAF	CAE	HAE	120.1°	120.0°
CAG	CAE	HAE	120.1°	119.9°
CAE	CAG	CAL	119.5°	120.1°
CAE	CAG	HAG	120.3°	119.9°
CAL	CAG	HAG	120.2°	120.0°
CAG	CAL	HAL	119.7°	120.1°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
OAR	CAA	HAA1	HAA2	120.0°	120.0°
OAR	CAA	HAA1	HAA3	120.0°	120.1°
OAR	CAA	HAA2	HAA3	120.0°	120.1°
CAA	OAR	CAW	CAJ	90.7°	0.0°
CAA	OAR	CAW	CAO	90.4°	179.7°
HAA1	CAA	HAA2	HAA3	120.0°	119.9°
HAA1	CAA	OAR	CAW	110.1°	180.0°
HAA2	CAA	OAR	CAW	129.9°	60.0°
HAA3	CAA	OAR	CAW	9.9°	60.0°
OAR	CAW	CAJ	CAO	178.8°	179.7°
OAR	CAW	CAO	CAV	179.7°	180.0°
OAR	CAW	CAO	HAO	0.3°	0.0°
OAR	CAW	CAJ	CAH	179.7°	180.0°
OAR	CAW	CAJ	HAJ	0.3°	0.0°
CAJ	CAW	CAO	CAV	0.9°	0.3°
CAJ	CAW	CAO	HAO	179.1°	179.8°
CAW	CAJ	CAH	HAJ	180.0°	180.0°
CAW	CAJ	CAH	CAI	0.5°	0.0°
CAW	CAJ	CAH	HAH	179.5°	180.0°
CAW	CAO	CAV	HAO	180.0°	179.9°
CAO	CAW	CAJ	CAH	0.9°	0.3°
CAO	CAW	CAJ	HAJ	179.2°	179.7°
CAW	CAO	CAV	CAI	0.5°	0.0°
CAW	CAO	CAV	CAQ	179.5°	180.0°
CAO	CAV	CAI	CAH	0.1°	0.3°
CAO	CAV	CAI	CAQ	180.0°	180.0°
CAO	CAV	CAI	HAI	179.9°	179.9°
CAO	CAV	CAQ	NBC	169.9°	90.0°
CAO	CAV	CAQ	HAQ1	70.1°	150.0°
CAO	CAV	CAQ	HAQ2	49.0°	30.1°
HAO	CAO	CAV	CAI	179.5°	179.9°
HAO	CAO	CAV	CAQ	0.5°	0.1°
CAJ	CAH	CAI	HAH	180.0°	179.9°
CAJ	CAH	CAI	CAV	0.1°	0.3°
CAJ	CAH	CAI	HAI	179.9°	179.9°
HAJ	CAJ	CAH	CAI	179.6°	180.0°
HAJ	CAJ	CAH	HAH	0.4°	0.1°
CAH	CAI	CAV	HAI	180.0°	179.7°
CAH	CAI	CAV	CAQ	179.9°	179.7°
HAH	CAH	CAI	CAV	179.9°	179.7°
HAH	CAH	CAI	HAI	0.1°	0.0°
CAI	CAV	CAQ	NBC	10.1°	90.0°
CAI	CAV	CAQ	HAQ1	109.9°	30.0°
CAI	CAV	CAQ	HAQ2	131.0°	150.0°
HAI	CAI	CAV	CAQ	0.1°	0.0°
CAV	CAQ	NBC	HAQ1	120.0°	119.9°
CAV	CAQ	NBC	HAQ2	120.9°	120.0°
CAV	CAQ	HAQ1	HAQ2	121.0°	119.9°
CAV	CAQ	NBC	CBB	81.2°	90.0°
CAV	CAQ	NBC	CAZ	95.5°	89.7°
NBC	CAQ	HAQ1	HAQ2	121.0°	120.1°
CAQ	NBC	CBB	CAZ	177.2°	179.7°
CAQ	NBC	CAZ	CAY	179.5°	180.0°
CAQ	NBC	CAZ	CAT	4.2°	0.1°
CAQ	NBC	CBB	CAN	2.1°	0.0°
CAQ	NBC	CBB	CBA	177.9°	180.0°
HAQ1	CAQ	NBC	CBB	38.8°	30.0°
HAQ1	CAQ	NBC	CAZ	144.5°	150.3°
HAQ2	CAQ	NBC	CBB	157.9°	150.0°
HAQ2	CAQ	NBC	CAZ	25.4°	30.3°
CBB	NBC	CAZ	CAY	2.5°	0.2°
CBB	NBC	CAZ	CAT	178.8°	179.6°
NBC	CBB	CAN	CBA	180.0°	180.0°
NBC	CBB	CAN	CAM	179.7°	180.0°
NBC	CBB	CAN	HAN	0.3°	0.0°
NBC	CBB	CBA	CAP	179.5°	180.0°
NBC	CBB	CBA	CAY	1.3°	0.2°
NBC	CAZ	CAY	CAT	176.4°	179.9°
NBC	CAZ	CAT	OAC	172.7°	180.0°
NBC	CAZ	CAT	OAB	9.6°	0.1°
CAZ	NBC	CBB	CAN	179.3°	179.7°
CAZ	NBC	CBB	CBA	0.7°	0.2°
NBC	CAZ	CAY	CBA	3.2°	0.1°
NBC	CAZ	CAY	SAS	177.1°	180.0°
CAY	CAZ	CAT	OAC	11.6°	0.2°
CAY	CAZ	CAT	OAB	166.1°	179.9°
CAZ	CAY	CBA	CBB	2.8°	0.0°
CAZ	CAY	CBA	CAP	179.3°	179.8°
CAZ	CAY	CBA	SAS	174.1°	179.9°
CAZ	CAY	SAS	CAX	94.4°	90.1°
CAZ	CAT	OAC	OAB	177.5°	179.9°
CAZ	CAT	OAB	HOAB	177.6°	180.0°
CAT	CAZ	CAY	CBA	179.6°	179.8°
CAT	CAZ	CAY	SAS	6.6°	0.2°
OAC	CAT	OAB	HOAB	0.0°	0.1°
CBB	CAN	CAM	HAN	180.0°	180.0°
CBB	CAN	CAM	CAU	0.1°	0.0°
CBB	CAN	CAM	HAM	179.9°	180.0°
CAN	CBB	CBA	CAP	0.5°	0.0°
CAN	CBB	CBA	CAY	178.7°	179.8°
CBA	CBB	CAN	CAM	0.3°	0.0°
CBA	CBB	CAN	HAN	179.7°	180.0°
CBB	CBA	CAP	CAU	0.5°	0.0°
CBB	CBA	CAP	CAY	177.7°	179.8°
CBB	CBA	CAP	HAP	179.5°	180.0°
CBB	CBA	CAY	SAS	176.8°	179.9°
CAN	CAM	CAU	HAM	180.0°	180.0°
CAN	CAM	CAU	CLAD	179.9°	180.0°
CAN	CAM	CAU	CAP	0.1°	0.0°
HAN	CAN	CAM	CAU	179.9°	180.0°
HAN	CAN	CAM	HAM	0.1°	0.0°
CAM	CAU	CLAD	CAP	179.8°	180.0°
CAM	CAU	CAP	CBA	0.3°	0.1°
CAM	CAU	CAP	HAP	179.6°	180.0°
HAM	CAM	CAU	CLAD	0.1°	0.0°
HAM	CAM	CAU	CAP	179.9°	180.0°
CLAD	CAU	CAP	CBA	179.9°	180.0°
CLAD	CAU	CAP	HAP	0.2°	0.0°
CAU	CAP	CBA	HAP	180.0°	180.0°
CAU	CAP	CBA	CAY	178.2°	179.7°
CAP	CBA	CAY	SAS	5.3°	0.1°
HAP	CAP	CBA	CAY	1.8°	0.2°
CBA	CAY	SAS	CAX	92.8°	89.8°
CAY	SAS	CAX	CAL	128.3°	180.0°
CAY	SAS	CAX	CAK	55.6°	0.2°
SAS	CAX	CAL	CAK	176.2°	179.8°
SAS	CAX	CAK	CAF	178.2°	180.0°
SAS	CAX	CAK	HAK	1.9°	0.0°
SAS	CAX	CAL	CAG	178.6°	179.7°
SAS	CAX	CAL	HAL	1.4°	0.1°
CAL	CAX	CAK	CAF	2.2°	0.2°
CAL	CAX	CAK	HAK	177.8°	179.8°
CAX	CAL	CAG	CAE	1.2°	0.6°
CAX	CAL	CAG	HAL	180.0°	179.7°
CAX	CAL	CAG	HAG	178.7°	179.7°
CAX	CAK	CAF	HAK	180.0°	180.0°
CAX	CAK	CAF	CAE	1.1°	0.0°
CAX	CAK	CAF	HAF	179.0°	179.9°
CAK	CAX	CAL	CAG	2.3°	0.6°
CAK	CAX	CAL	HAL	177.7°	179.7°
CAK	CAF	CAE	HAF	180.0°	180.0°
CAK	CAF	CAE	CAG	0.0°	0.0°
CAK	CAF	CAE	HAE	180.0°	180.0°
HAK	CAK	CAF	CAE	179.0°	179.9°
HAK	CAK	CAF	HAF	1.0°	0.1°
CAF	CAE	CAG	HAE	180.0°	180.0°
CAF	CAE	CAG	CAL	0.1°	0.3°
CAF	CAE	CAG	HAG	179.9°	180.0°
HAF	CAF	CAE	CAG	180.0°	180.0°
HAF	CAF	CAE	HAE	0.0°	0.0°
CAE	CAG	CAL	HAG	180.0°	179.7°
CAE	CAG	CAL	HAL	178.8°	179.6°
HAE	CAE	CAG	CAL	179.9°	179.7°
HAE	CAE	CAG	HAG	0.1°	0.0°
HAG	CAG	CAL	HAL	1.3°	0.1°

Definition date:	2007-06-25
Last modified:	2020-06-17
Release status:	REL
Processing site:	RCSB