26B

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CA	N	sing	1.47Å	1.45Å
N	C8	sing	1.35Å	1.39Å
N	HN	sing	0.97Å	1.00Å
C	CA	sing	1.51Å	1.50Å
C2	CA	sing	1.53Å	1.51Å
CA	HA	sing	1.09Å	1.10Å
O	C	doub	1.21Å	1.26Å
OXT	C	sing	1.34Å	1.25Å
OXT	HOXT	sing	0.97Å	0.95Å
C2	C1	sing	1.53Å	1.51Å
C1	H1	sing	1.09Å	1.10Å
C1	H1A	sing	1.09Å	1.10Å
C1	H1B	sing	1.09Å	1.10Å
O3	C2	sing	1.43Å	1.43Å
C2	H2	sing	1.09Å	1.10Å
C4	O3	sing	1.43Å	1.43Å
C6	C4	sing	1.53Å	1.51Å
C7	C4	sing	1.53Å	1.51Å
C4	C5	sing	1.53Å	1.52Å
C5	H5	sing	1.09Å	1.10Å
C5	H5A	sing	1.09Å	1.10Å
C5	H5B	sing	1.09Å	1.10Å
C6	H6	sing	1.09Å	1.10Å
C6	H6A	sing	1.09Å	1.10Å
C6	H6B	sing	1.09Å	1.10Å
C7	H7	sing	1.09Å	1.10Å
C7	H7A	sing	1.09Å	1.10Å
C7	H7B	sing	1.09Å	1.10Å
C8	C10	sing	1.48Å	1.48Å
C8	O9	doub	1.22Å	1.22Å
C11	C10	doub	1.38Å	1.38Å	Aromatic
C10	C19	sing	1.41Å	1.38Å	Aromatic
C11	C12	sing	1.40Å	1.38Å	Aromatic
C11	H11	sing	1.08Å	1.08Å
C13	C12	doub	1.41Å	1.38Å	Aromatic
C12	C17	sing	1.42Å	1.38Å	Aromatic
C13	C14	sing	1.36Å	1.38Å	Aromatic
C13	H13	sing	1.08Å	1.08Å
C14	C15	doub	1.39Å	1.38Å	Aromatic
C14	H14	sing	1.08Å	1.08Å
C15	C16	sing	1.36Å	1.38Å	Aromatic
C15	H15	sing	1.08Å	1.08Å
C17	C16	doub	1.41Å	1.38Å	Aromatic
C16	H16	sing	1.08Å	1.08Å
C17	C18	sing	1.40Å	1.38Å	Aromatic
C19	C18	doub	1.37Å	1.38Å	Aromatic
C18	H18	sing	1.08Å	1.08Å
C19	N20	sing	1.39Å	1.40Å
N20	C21	sing	1.35Å	1.38Å
N20	HN20	sing	0.97Å	1.00Å
O22	C21	doub	1.22Å	1.22Å
C21	N23	sing	1.35Å	1.38Å
C24	N23	sing	1.40Å	1.40Å
N23	HN23	sing	0.97Å	1.00Å
C25	C24	doub	1.39Å	1.38Å	Aromatic
C24	C31	sing	1.39Å	1.38Å	Aromatic
C26	C25	sing	1.51Å	1.49Å
C27	C25	sing	1.38Å	1.38Å	Aromatic
C26	H26	sing	1.09Å	1.10Å
C26	H26A	sing	1.09Å	1.10Å
C26	H26B	sing	1.09Å	1.10Å
C27	C28	doub	1.38Å	1.38Å	Aromatic
C27	H27	sing	1.08Å	1.08Å
C29	C28	sing	1.51Å	1.49Å
C28	C30	sing	1.38Å	1.38Å	Aromatic
C29	H29	sing	1.09Å	1.10Å
C29	H29A	sing	1.09Å	1.10Å
C29	H29B	sing	1.09Å	1.10Å
C30	C31	doub	1.38Å	1.37Å	Aromatic
C30	H30	sing	1.08Å	1.08Å
C31	C32	sing	1.51Å	1.49Å
C32	H32	sing	1.09Å	1.10Å
C32	H32A	sing	1.09Å	1.10Å
C32	H32B	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CA	N	C8	120.1°	120.0°
CA	N	HN	120.0°	120.0°
N	CA	C	107.8°	109.5°
N	CA	C2	111.4°	109.4°
N	CA	HA	109.2°	109.5°
C8	N	HN	119.9°	120.0°
N	C8	C10	114.5°	120.0°
N	C8	O9	125.2°	120.0°
C	CA	C2	109.2°	109.5°
C	CA	HA	111.4°	109.5°
CA	C	O	121.2°	120.0°
CA	C	OXT	116.2°	120.0°
C2	CA	HA	107.8°	109.5°
CA	C2	C1	107.6°	109.5°
CA	C2	O3	108.8°	109.5°
CA	C2	H2	111.3°	109.4°
O	C	OXT	122.6°	120.0°
C	OXT	HOXT	109.5°	117.0°
C2	C1	H1	109.5°	109.5°
C2	C1	H1A	109.5°	109.4°
C2	C1	H1B	109.5°	109.5°
C1	C2	O3	110.1°	109.5°
C1	C2	H2	110.1°	109.4°
H1	C1	H1A	109.4°	109.5°
H1	C1	H1B	109.4°	109.5°
H1A	C1	H1B	109.5°	109.4°
O3	C2	H2	108.9°	109.5°
C2	O3	C4	114.2°	114.0°
O3	C4	C6	107.4°	109.5°
O3	C4	C7	110.8°	109.5°
O3	C4	C5	110.2°	109.5°
C6	C4	C7	108.5°	109.5°
C6	C4	C5	109.1°	109.5°
C4	C6	H6	109.5°	109.5°
C4	C6	H6A	109.5°	109.5°
C4	C6	H6B	109.5°	109.4°
C7	C4	C5	110.8°	109.5°
C4	C7	H7	109.5°	109.5°
C4	C7	H7A	109.4°	109.5°
C4	C7	H7B	109.4°	109.4°
C4	C5	H5	109.5°	109.5°
C4	C5	H5A	109.5°	109.5°
C4	C5	H5B	109.5°	109.5°
H5	C5	H5A	109.4°	109.4°
H5	C5	H5B	109.5°	109.4°
H5A	C5	H5B	109.5°	109.5°
H6	C6	H6A	109.5°	109.5°
H6	C6	H6B	109.4°	109.4°
H6A	C6	H6B	109.5°	109.5°
H7	C7	H7A	109.4°	109.5°
H7	C7	H7B	109.5°	109.5°
H7A	C7	H7B	109.5°	109.5°
C10	C8	O9	120.3°	120.0°
C8	C10	C11	119.3°	119.8°
C8	C10	C19	120.1°	119.7°
C11	C10	C19	120.6°	120.4°
C10	C11	C12	119.6°	119.6°
C10	C11	H11	120.2°	120.2°
C10	C19	C18	119.7°	120.6°
C10	C19	N20	118.9°	119.7°
C12	C11	H11	120.2°	120.2°
C11	C12	C13	119.6°	121.1°
C11	C12	C17	119.9°	119.6°
C13	C12	C17	120.5°	119.3°
C12	C13	C14	119.9°	119.7°
C12	C13	H13	120.1°	120.1°
C12	C17	C16	119.5°	119.2°
C12	C17	C18	120.6°	119.8°
C14	C13	H13	120.0°	120.2°
C13	C14	C15	119.7°	121.0°
C13	C14	H14	120.2°	119.5°
C15	C14	H14	120.2°	119.5°
C14	C15	C16	120.3°	121.0°
C14	C15	H15	119.8°	119.5°
C16	C15	H15	119.8°	119.5°
C15	C16	C17	120.1°	119.7°
C15	C16	H16	119.9°	120.2°
C17	C16	H16	120.0°	120.1°
C16	C17	C18	119.9°	121.0°
C17	C18	C19	119.7°	120.0°
C17	C18	H18	120.2°	120.0°
C19	C18	H18	120.2°	120.0°
C18	C19	N20	121.4°	119.7°
C19	N20	C21	124.8°	120.0°
C19	N20	HN20	117.6°	120.0°
C21	N20	HN20	117.6°	120.1°
N20	C21	O22	126.3°	120.0°
N20	C21	N23	110.9°	120.0°
O22	C21	N23	122.7°	120.0°
C21	N23	C24	120.6°	120.0°
C21	N23	HN23	119.7°	119.9°
C24	N23	HN23	119.7°	120.1°
N23	C24	C25	119.7°	120.1°
N23	C24	C31	119.6°	120.1°
C25	C24	C31	120.8°	119.9°
C24	C25	C26	121.1°	120.1°
C24	C25	C27	119.4°	119.9°
C24	C31	C30	119.5°	119.9°
C24	C31	C32	121.3°	120.1°
C26	C25	C27	119.5°	120.0°
C25	C26	H26	109.5°	109.4°
C25	C26	H26A	109.4°	109.5°
C25	C26	H26B	109.5°	109.4°
C25	C27	C28	119.9°	120.1°
C25	C27	H27	120.0°	120.0°
H26	C26	H26A	109.5°	109.6°
H26	C26	H26B	109.5°	109.5°
H26A	C26	H26B	109.5°	109.4°
C28	C27	H27	120.0°	119.9°
C27	C28	C29	120.0°	120.0°
C27	C28	C30	120.4°	120.1°
C29	C28	C30	119.6°	119.9°
C28	C29	H29	109.5°	109.5°
C28	C29	H29A	109.5°	109.4°
C28	C29	H29B	109.4°	109.4°
C28	C30	C31	120.0°	120.0°
C28	C30	H30	120.0°	120.0°
H29	C29	H29A	109.4°	109.5°
H29	C29	H29B	109.4°	109.5°
H29A	C29	H29B	109.5°	109.5°
C31	C30	H30	120.0°	120.0°
C30	C31	C32	119.3°	120.0°
C31	C32	H32	109.5°	109.5°
C31	C32	H32A	109.5°	109.5°
C31	C32	H32B	109.5°	109.5°
H32	C32	H32A	109.5°	109.4°
H32	C32	H32B	109.5°	109.5°
H32A	C32	H32B	109.4°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CA	N	C8	HN	180.0°	179.7°
N	CA	C	C2	121.3°	120.0°
N	CA	C	HA	119.8°	120.0°
N	CA	C2	HA	119.8°	120.0°
N	CA	C	O	7.1°	0.0°
N	CA	C	OXT	172.4°	180.0°
N	CA	C2	C1	64.1°	55.0°
N	CA	C2	O3	55.2°	65.0°
N	CA	C2	H2	175.2°	175.0°
CA	N	C8	C10	173.0°	179.7°
CA	N	C8	O9	6.2°	0.3°
C8	N	CA	C	119.9°	85.0°
C8	N	CA	C2	120.2°	155.0°
C8	N	CA	HA	1.3°	35.0°
N	C8	C10	O9	179.3°	180.0°
N	C8	C10	C11	37.0°	4.2°
N	C8	C10	C19	142.5°	176.0°
HN	N	CA	C	60.1°	94.7°
HN	N	CA	C2	59.8°	25.3°
HN	N	CA	HA	178.7°	145.3°
HN	N	C8	C10	6.9°	0.0°
HN	N	C8	O9	173.8°	180.0°
C	CA	C2	HA	121.1°	120.0°
CA	C	O	OXT	179.5°	180.0°
CA	C	OXT	HOXT	179.5°	180.0°
C	CA	C2	C1	176.8°	175.0°
C	CA	C2	O3	63.9°	55.0°
C	CA	C2	H2	56.1°	65.0°
C2	CA	C	O	114.2°	120.0°
C2	CA	C	OXT	66.3°	60.0°
CA	C2	C1	O3	118.5°	120.1°
CA	C2	C1	H2	121.5°	119.9°
CA	C2	C1	H1	29.6°	63.8°
CA	C2	C1	H1A	90.4°	56.2°
CA	C2	C1	H1B	149.6°	176.1°
CA	C2	O3	H2	121.5°	120.0°
CA	C2	O3	C4	142.2°	146.7°
HA	CA	C	O	126.9°	120.0°
HA	CA	C	OXT	52.6°	60.0°
HA	CA	C2	C1	55.7°	65.0°
HA	CA	C2	O3	175.0°	175.0°
HA	CA	C2	H2	65.0°	55.0°
O	C	OXT	HOXT	0.0°	0.0°
C2	C1	H1	H1A	120.0°	120.0°
C2	C1	H1	H1B	120.0°	120.0°
C2	C1	H1A	H1B	120.0°	120.0°
C1	C2	O3	H2	120.8°	120.0°
C1	C2	O3	C4	100.1°	93.3°
H1	C1	H1A	H1B	119.9°	120.0°
H1	C1	C2	O3	148.1°	176.1°
H1	C1	C2	H2	91.9°	56.1°
H1A	C1	C2	O3	28.1°	63.9°
H1A	C1	C2	H2	148.1°	176.1°
H1B	C1	C2	O3	92.0°	56.0°
H1B	C1	C2	H2	28.1°	64.0°
C2	O3	C4	C6	175.6°	175.3°
C2	O3	C4	C7	57.3°	64.8°
C2	O3	C4	C5	65.7°	55.3°
H2	C2	O3	C4	20.7°	26.7°
O3	C4	C6	C7	119.8°	120.0°
O3	C4	C6	C5	119.4°	120.0°
O3	C4	C7	C5	122.6°	120.0°
O3	C4	C5	H5	30.2°	60.4°
O3	C4	C5	H5A	89.7°	179.6°
O3	C4	C5	H5B	150.3°	59.6°
O3	C4	C6	H6	167.4°	60.0°
O3	C4	C6	H6A	72.6°	180.0°
O3	C4	C6	H6B	47.4°	60.0°
O3	C4	C7	H7	150.3°	60.0°
O3	C4	C7	H7A	30.4°	179.9°
O3	C4	C7	H7B	89.6°	60.0°
C6	C4	C7	C5	119.8°	120.0°
C6	C4	C5	H5	147.9°	59.6°
C6	C4	C5	H5A	28.0°	60.4°
C6	C4	C5	H5B	92.1°	179.6°
C4	C6	H6	H6A	120.0°	120.1°
C4	C6	H6	H6B	120.0°	119.9°
C4	C6	H6A	H6B	120.0°	120.0°
C6	C4	C7	H7	32.7°	180.0°
C6	C4	C7	H7A	87.3°	60.0°
C6	C4	C7	H7B	152.7°	60.0°
C7	C4	C5	H5	92.7°	179.6°
C7	C4	C5	H5A	147.4°	59.6°
C7	C4	C5	H5B	27.3°	60.4°
C7	C4	C6	H6	47.6°	60.0°
C7	C4	C6	H6A	167.6°	60.0°
C7	C4	C6	H6B	72.4°	180.0°
C4	C7	H7	H7A	120.0°	120.0°
C4	C7	H7	H7B	120.0°	120.0°
C4	C7	H7A	H7B	120.0°	120.0°
C4	C5	H5	H5A	120.0°	120.0°
C4	C5	H5	H5B	120.0°	120.0°
C4	C5	H5A	H5B	120.0°	120.0°
C5	C4	C6	H6	73.2°	180.0°
C5	C4	C6	H6A	46.8°	60.0°
C5	C4	C6	H6B	166.8°	60.0°
C5	C4	C7	H7	87.1°	60.0°
C5	C4	C7	H7A	152.9°	60.0°
C5	C4	C7	H7B	32.9°	180.0°
H5	C5	H5A	H5B	120.0°	119.9°
H6	C6	H6A	H6B	120.0°	119.9°
H7	C7	H7A	H7B	120.0°	120.0°
C8	C10	C11	C19	179.5°	179.8°
C8	C10	C11	C12	179.8°	180.0°
C8	C10	C11	H11	0.3°	0.0°
C8	C10	C19	C18	179.9°	179.8°
C8	C10	C19	N20	1.3°	0.0°
O9	C8	C10	C11	143.7°	175.8°
O9	C8	C10	C19	36.8°	3.9°
C10	C11	C12	H11	180.0°	180.0°
C10	C11	C12	C13	179.9°	180.0°
C10	C11	C12	C17	0.0°	0.0°
C11	C10	C19	C18	0.6°	0.5°
C11	C10	C19	N20	179.2°	179.8°
C19	C10	C11	C12	0.2°	0.2°
C19	C10	C11	H11	179.8°	179.8°
C10	C19	C18	C17	0.7°	0.5°
C10	C19	C18	N20	178.5°	179.8°
C10	C19	C18	H18	179.3°	179.8°
C10	C19	N20	C21	138.5°	139.8°
C10	C19	N20	HN20	41.5°	40.2°
C11	C12	C13	C17	179.9°	180.0°
C11	C12	C13	C14	179.8°	179.9°
C11	C12	C13	H13	0.2°	0.0°
C11	C12	C17	C16	179.9°	180.0°
C11	C12	C17	C18	0.1°	0.0°
H11	C11	C12	C13	0.1°	0.0°
H11	C11	C12	C17	180.0°	180.0°
C12	C13	C14	H13	180.0°	180.0°
C12	C13	C14	C15	0.1°	0.1°
C12	C13	C14	H14	179.9°	180.0°
C13	C12	C17	C16	0.0°	0.1°
C13	C12	C17	C18	180.0°	180.0°
C17	C12	C13	C14	0.1°	0.0°
C17	C12	C13	H13	179.9°	180.0°
C12	C17	C16	C15	0.0°	0.1°
C12	C17	C16	C18	180.0°	179.9°
C12	C17	C16	H16	179.9°	179.9°
C12	C17	C18	C19	0.4°	0.3°
C12	C17	C18	H18	179.6°	180.0°
C13	C14	C15	H14	180.0°	179.9°
C13	C14	C15	C16	0.0°	0.1°
C13	C14	C15	H15	179.9°	180.0°
H13	C13	C14	C15	179.9°	179.9°
H13	C13	C14	H14	0.1°	0.0°
C14	C15	C16	H15	180.0°	180.0°
C14	C15	C16	C17	0.0°	0.0°
C14	C15	C16	H16	179.9°	180.0°
H14	C14	C15	C16	180.0°	180.0°
H14	C14	C15	H15	0.0°	0.0°
C15	C16	C17	H16	180.0°	180.0°
C15	C16	C17	C18	179.9°	180.0°
H15	C15	C16	C17	180.0°	180.0°
H15	C15	C16	H16	0.1°	0.1°
C16	C17	C18	C19	179.6°	179.8°
C16	C17	C18	H18	0.4°	0.1°
H16	C16	C17	C18	0.1°	0.0°
C17	C18	C19	H18	180.0°	179.7°
C17	C18	C19	N20	179.2°	179.7°
C18	C19	N20	C21	43.0°	40.0°
C18	C19	N20	HN20	137.0°	140.0°
H18	C18	C19	N20	0.8°	0.0°
C19	N20	C21	HN20	180.0°	180.0°
C19	N20	C21	O22	4.2°	3.4°
C19	N20	C21	N23	175.9°	176.6°
N20	C21	O22	N23	179.9°	180.0°
N20	C21	N23	C24	45.3°	177.0°
N20	C21	N23	HN23	134.7°	3.0°
HN20	N20	C21	O22	175.9°	176.6°
HN20	N20	C21	N23	4.1°	3.4°
O22	C21	N23	C24	134.7°	3.1°
O22	C21	N23	HN23	45.3°	177.0°
C21	N23	C24	HN23	180.0°	180.0°
C21	N23	C24	C25	69.2°	121.0°
C21	N23	C24	C31	110.7°	59.3°
N23	C24	C25	C31	179.9°	179.7°
N23	C24	C25	C26	0.2°	0.0°
N23	C24	C25	C27	179.8°	180.0°
N23	C24	C31	C30	179.8°	179.8°
N23	C24	C31	C32	0.1°	0.0°
HN23	N23	C24	C25	110.8°	59.0°
HN23	N23	C24	C31	69.3°	120.7°
C24	C25	C26	C27	180.0°	180.0°
C24	C25	C26	H26	63.6°	94.5°
C24	C25	C26	H26A	56.4°	145.3°
C24	C25	C26	H26B	176.4°	25.4°
C24	C25	C27	C28	0.0°	0.0°
C24	C25	C27	H27	180.0°	180.0°
C25	C24	C31	C30	0.1°	0.5°
C25	C24	C31	C32	179.9°	179.7°
C31	C24	C25	C26	179.9°	179.7°
C31	C24	C25	C27	0.1°	0.3°
C24	C31	C30	C28	0.1°	0.5°
C24	C31	C30	C32	179.9°	179.8°
C24	C31	C30	H30	179.9°	179.8°
C24	C31	C32	H32	58.0°	96.9°
C24	C31	C32	H32A	62.0°	143.2°
C24	C31	C32	H32B	178.1°	23.1°
C25	C26	H26	H26A	120.0°	120.1°
C25	C26	H26	H26B	120.0°	119.9°
C25	C26	H26A	H26B	120.0°	119.9°
C26	C25	C27	C28	180.0°	180.0°
C26	C25	C27	H27	0.0°	0.1°
C27	C25	C26	H26	116.4°	85.5°
C27	C25	C26	H26A	123.6°	34.6°
C27	C25	C26	H26B	3.7°	154.5°
C25	C27	C28	H27	180.0°	179.9°
C25	C27	C28	C29	179.9°	180.0°
C25	C27	C28	C30	0.2°	0.0°
H26	C26	H26A	H26B	120.0°	120.0°
C27	C28	C29	C30	179.7°	180.0°
C27	C28	C29	H29	123.2°	90.0°
C27	C28	C29	H29A	3.2°	150.0°
C27	C28	C29	H29B	116.8°	30.0°
C27	C28	C30	C31	0.2°	0.2°
C27	C28	C30	H30	179.8°	180.0°
H27	C27	C28	C29	0.1°	0.0°
H27	C27	C28	C30	179.8°	179.9°
C28	C29	H29	H29A	120.0°	119.9°
C28	C29	H29	H29B	120.0°	120.0°
C28	C29	H29A	H29B	120.0°	120.0°
C29	C28	C30	C31	180.0°	179.8°
C29	C28	C30	H30	0.0°	0.0°
C30	C28	C29	H29	56.5°	89.9°
C30	C28	C29	H29A	176.5°	30.0°
C30	C28	C29	H29B	63.4°	150.1°
C28	C30	C31	H30	180.0°	179.8°
C28	C30	C31	C32	179.8°	179.8°
H29	C29	H29A	H29B	120.0°	120.1°
C30	C31	C32	H32	121.8°	82.9°
C30	C31	C32	H32A	118.1°	37.1°
C30	C31	C32	H32B	1.8°	157.1°
H30	C30	C31	C32	0.2°	0.0°
C31	C32	H32	H32A	120.0°	120.0°
C31	C32	H32	H32B	120.0°	120.0°
C31	C32	H32A	H32B	120.0°	120.0°
H32	C32	H32A	H32B	120.0°	120.0°

Definition date:	2008-06-10
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	3DDS