V22

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C14	C15	sing	0.00Å	1.51Å
C14	C13	sing	0.00Å	1.52Å
C15	C16	sing	0.00Å	1.50Å
C10	N11	sing	0.00Å	1.50Å
C10	C9	sing	0.00Å	1.49Å
C12	C13	sing	0.00Å	1.51Å
C12	N11	sing	0.00Å	1.50Å
C13	C18	sing	0.00Å	1.53Å
C19	C9	sing	0.00Å	1.43Å	Aromatic
C19	C20	doub	0.00Å	1.34Å	Aromatic
C30	C29	doub	0.00Å	1.41Å	Aromatic
C30	C31	sing	0.00Å	1.33Å	Aromatic
C9	C8	doub	0.00Å	1.33Å	Aromatic
C16	C17	sing	0.00Å	1.51Å
C20	C21	sing	0.00Å	1.40Å	Aromatic
C29	C28	sing	0.00Å	1.33Å	Aromatic
C31	C32	doub	0.00Å	1.46Å	Aromatic
C18	C17	sing	0.00Å	1.52Å
C8	N7	sing	0.00Å	1.37Å	Aromatic
C21	N7	sing	0.00Å	1.36Å	Aromatic
C21	N22	doub	0.00Å	1.31Å	Aromatic
C28	N27	doub	0.00Å	1.38Å	Aromatic
N7	C6	sing	0.00Å	1.36Å	Aromatic
C32	N27	sing	0.00Å	1.38Å	Aromatic
C32	N33	sing	0.00Å	1.29Å
N22	C5	sing	0.00Å	1.36Å	Aromatic
N27	C25	sing	0.00Å	1.39Å
N33	C23	sing	0.00Å	1.36Å
C6	C5	doub	0.00Å	1.37Å	Aromatic
C5	C4	sing	0.00Å	1.46Å
N3	C4	sing	0.00Å	1.44Å
N3	C2	sing	0.00Å	1.37Å
C25	O26	doub	0.00Å	1.22Å
C25	C24	sing	0.00Å	1.47Å
C23	C24	doub	0.00Å	1.33Å
C23	C2	sing	0.00Å	1.48Å
C2	O1	doub	0.00Å	1.23Å
C6	H1	sing	0.00Å	1.08Å
C20	H2	sing	0.00Å	1.08Å
C19	H3	sing	0.00Å	1.08Å
C30	H4	sing	0.00Å	1.08Å
C31	H5	sing	0.00Å	1.08Å
C29	H6	sing	0.00Å	1.08Å
C24	H7	sing	0.00Å	1.08Å
C8	H8	sing	0.00Å	1.08Å
C28	H9	sing	0.00Å	1.08Å
C16	H10	sing	0.00Å	1.10Å
C16	H11	sing	0.00Å	1.10Å
C15	H12	sing	0.00Å	1.10Å
C15	H13	sing	0.00Å	1.10Å
C17	H14	sing	0.00Å	1.10Å
C17	H15	sing	0.00Å	1.10Å
C14	H16	sing	0.00Å	1.10Å
C14	H17	sing	0.00Å	1.10Å
C18	H18	sing	0.00Å	1.10Å
C18	H19	sing	0.00Å	1.10Å
C13	H20	sing	0.00Å	1.10Å
C4	H21	sing	0.00Å	1.10Å
C4	H22	sing	0.00Å	1.10Å
C10	H23	sing	0.00Å	1.10Å
C10	H24	sing	0.00Å	1.10Å
C12	H25	sing	0.00Å	1.10Å
C12	H26	sing	0.00Å	1.10Å
N33	H27	sing	0.00Å	1.00Å
N3	H28	sing	0.00Å	1.00Å
N11	H29	sing	0.00Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C15	C14	C13	113.1°	90.0°
C14	C15	C16	108.9°	90.0°
C14	C15	H12	109.6°	90.0°
C14	C15	H13	109.6°	90.0°
C15	C14	H16	108.6°	90.0°
C15	C14	H17	108.5°	90.0°
C14	C13	C12	109.0°	90.0°
C14	C13	C18	111.5°	90.0°
C13	C14	H16	108.5°	90.0°
C13	C14	H17	108.6°	90.0°
C14	C13	H20	108.8°	90.0°
C15	C16	C17	109.8°	90.0°
C15	C16	H10	109.4°	90.0°
C15	C16	H11	109.4°	90.0°
C16	C15	H12	109.6°	90.0°
C16	C15	H13	109.6°	90.0°
N11	C10	C9	114.5°	90.0°
C10	N11	C12	110.7°	90.0°
N11	C10	H23	108.2°	90.0°
N11	C10	H24	108.2°	90.0°
C10	N11	H29	109.2°	90.0°
C10	C9	C19	118.7°	90.0°
C10	C9	C8	123.6°	90.0°
C9	C10	H23	108.2°	90.0°
C9	C10	H24	108.2°	90.0°
C13	C12	N11	110.5°	90.0°
C12	C13	C18	109.9°	90.0°
C12	C13	H20	108.9°	90.0°
C13	C12	H25	109.2°	90.0°
C13	C12	H26	109.2°	90.0°
N11	C12	H25	109.2°	90.0°
N11	C12	H26	109.2°	90.0°
C12	N11	H29	109.2°	90.0°
C13	C18	C17	115.0°	90.0°
C13	C18	H18	108.1°	90.0°
C13	C18	H19	108.1°	90.0°
C18	C13	H20	108.7°	90.0°
C9	C19	C20	121.8°	90.0°
C19	C9	C8	117.8°	90.0°
C9	C19	H3	119.0°	90.0°
C19	C20	C21	120.0°	90.0°
C19	C20	H2	120.0°	90.0°
C20	C19	H3	119.1°	90.0°
C29	C30	C31	119.9°	90.0°
C30	C29	C28	119.3°	90.0°
C29	C30	H4	120.0°	90.0°
C30	C29	H6	120.3°	90.0°
C30	C31	C32	121.2°	90.0°
C31	C30	H4	120.1°	90.0°
C30	C31	H5	119.4°	90.0°
C9	C8	N7	120.3°	90.0°
C9	C8	H8	119.8°	90.0°
C16	C17	C18	111.4°	90.0°
C17	C16	H10	109.4°	90.0°
C17	C16	H11	109.4°	90.0°
C16	C17	H14	109.0°	90.0°
C16	C17	H15	109.0°	90.0°
C20	C21	N7	116.8°	90.0°
C20	C21	N22	131.5°	90.0°
C21	C20	H2	120.0°	90.0°
C29	C28	N27	122.9°	90.0°
C28	C29	H6	120.4°	90.0°
C29	C28	H9	118.5°	90.0°
C31	C32	N27	116.5°	90.0°
C31	C32	N33	118.7°	90.0°
C32	C31	H5	119.4°	90.0°
C18	C17	H14	109.0°	90.0°
C18	C17	H15	109.0°	90.0°
C17	C18	H18	108.1°	90.0°
C17	C18	H19	108.1°	90.0°
C8	N7	C21	123.3°	90.0°
C8	N7	C6	129.7°	90.0°
N7	C8	H8	119.8°	90.0°
N7	C21	N22	111.7°	90.0°
C21	N7	C6	107.0°	90.0°
C21	N22	C5	105.3°	90.0°
C28	N27	C32	120.2°	90.0°
C28	N27	C25	118.6°	90.0°
N27	C28	H9	118.6°	90.0°
N7	C6	C5	105.3°	90.0°
N7	C6	H1	127.3°	90.0°
N27	C32	N33	124.8°	90.0°
C32	N27	C25	121.3°	90.0°
C32	N33	C23	115.7°	90.0°
C32	N33	H27	122.1°	90.0°
N22	C5	C6	110.7°	90.0°
N22	C5	C4	120.5°	90.0°
N27	C25	O26	125.8°	90.0°
N27	C25	C24	113.8°	90.0°
N33	C23	C24	125.5°	90.0°
N33	C23	C2	120.6°	90.0°
C23	N33	H27	122.2°	90.0°
C6	C5	C4	128.8°	90.0°
C5	C6	H1	127.3°	90.0°
C5	C4	N3	107.9°	90.0°
C5	C4	H21	109.9°	90.0°
C5	C4	H22	109.9°	90.0°
C4	N3	C2	119.4°	90.0°
N3	C4	H21	109.8°	90.0°
N3	C4	H22	109.9°	90.0°
C4	N3	H28	120.3°	90.0°
N3	C2	C23	111.1°	90.0°
N3	C2	O1	125.8°	90.0°
C2	N3	H28	120.3°	90.0°
O26	C25	C24	120.4°	90.0°
C25	C24	C23	118.9°	90.0°
C25	C24	H7	120.5°	90.0°
C24	C23	C2	113.9°	90.0°
C23	C24	H7	120.6°	90.0°
C23	C2	O1	123.1°	90.0°
H10	C16	H11	109.5°	90.0°
H12	C15	H13	109.5°	90.0°
H14	C17	H15	109.5°	90.0°
H16	C14	H17	109.5°	90.0°
H18	C18	H19	109.5°	90.0°
H21	C4	H22	109.5°	90.0°
H23	C10	H24	109.4°	90.0°
H25	C12	H26	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C15	C14	C13	H16	120.6°	90.0°
C15	C14	C13	H17	120.5°	90.0°
C14	C15	C16	H12	119.9°	90.0°
C14	C15	C16	H13	119.9°	90.0°
C15	C14	C13	C12	73.1°	90.0°
C15	C14	C13	C18	48.4°	90.0°
C14	C15	C16	C17	63.2°	90.0°
C14	C15	C16	H10	56.8°	90.0°
C14	C15	C16	H11	176.7°	90.0°
C14	C15	H12	H13	120.3°	90.0°
C15	C14	H16	H17	118.3°	90.0°
C15	C14	C13	H20	168.3°	90.0°
C13	C14	C15	C16	59.2°	90.0°
C14	C13	C12	C18	122.5°	90.0°
C14	C13	C12	H20	118.5°	90.0°
C14	C13	C12	N11	158.0°	90.0°
C14	C13	C18	H20	119.9°	90.0°
C14	C13	C18	C17	43.0°	90.0°
C13	C14	C15	H12	179.1°	90.0°
C13	C14	C15	H13	60.7°	90.0°
C13	C14	H16	H17	118.3°	90.0°
C14	C13	C18	H18	163.8°	90.0°
C14	C13	C18	H19	77.8°	90.0°
C14	C13	C12	H25	81.8°	90.0°
C14	C13	C12	H26	37.9°	90.0°
C15	C16	C17	H10	120.0°	90.0°
C15	C16	C17	H11	120.1°	90.0°
C15	C16	C17	C18	58.1°	90.0°
C15	C16	H10	H11	119.9°	90.0°
C16	C15	H12	H13	120.3°	90.0°
C15	C16	C17	H14	178.4°	90.0°
C15	C16	C17	H15	62.2°	90.0°
C16	C15	C14	H16	179.7°	90.0°
C16	C15	C14	H17	61.4°	90.0°
N11	C10	C9	H23	120.8°	90.0°
N11	C10	C9	H24	120.8°	90.0°
C10	N11	C12	C13	150.2°	90.0°
C10	N11	C12	H29	120.2°	90.0°
N11	C10	C9	C19	98.4°	90.0°
N11	C10	C9	C8	82.1°	90.0°
N11	C10	H23	H24	117.7°	90.0°
C10	N11	C12	H25	89.7°	90.0°
C10	N11	C12	H26	30.0°	90.0°
C9	C10	N11	C12	158.8°	90.0°
C10	C9	C19	C8	179.5°	90.0°
C10	C9	C19	C20	179.9°	90.0°
C10	C9	C8	N7	180.0°	90.0°
C10	C9	C19	H3	0.1°	90.0°
C10	C9	C8	H8	0.0°	90.0°
C9	C10	H23	H24	117.7°	90.0°
C9	C10	N11	H29	38.6°	90.0°
C13	C12	N11	H25	120.2°	90.0°
C13	C12	N11	H26	120.1°	90.0°
C12	C13	C18	H20	119.1°	90.0°
C12	C13	C18	C17	77.9°	90.0°
C12	C13	C14	H16	47.5°	90.0°
C12	C13	C14	H17	166.4°	90.0°
C12	C13	C18	H18	42.9°	90.0°
C12	C13	C18	H19	161.3°	90.0°
C13	C12	H25	H26	119.5°	90.0°
C13	C12	N11	H29	89.7°	90.0°
N11	C12	C13	C18	79.5°	90.0°
N11	C12	C13	H20	39.5°	90.0°
C12	N11	C10	H23	38.1°	90.0°
C12	N11	C10	H24	80.4°	90.0°
N11	C12	H25	H26	119.5°	90.0°
C13	C18	C17	C16	48.5°	90.0°
C13	C18	C17	H18	120.8°	90.0°
C13	C18	C17	H19	120.8°	90.0°
C13	C18	C17	H14	168.7°	90.0°
C13	C18	C17	H15	71.9°	90.0°
C18	C13	C14	H16	169.0°	90.0°
C18	C13	C14	H17	72.1°	90.0°
C13	C18	H18	H19	117.5°	90.0°
C18	C13	C12	H25	40.7°	90.0°
C18	C13	C12	H26	160.4°	90.0°
C9	C19	C20	H3	180.0°	90.0°
C9	C19	C20	C21	0.3°	90.0°
C19	C9	C8	N7	0.5°	90.0°
C9	C19	C20	H2	179.7°	90.0°
C19	C9	C8	H8	179.5°	90.0°
C19	C9	C10	H23	140.8°	90.0°
C19	C9	C10	H24	22.4°	90.0°
C20	C19	C9	C8	0.6°	90.0°
C19	C20	C21	H2	180.0°	90.0°
C19	C20	C21	N7	0.0°	90.0°
C19	C20	C21	N22	180.0°	90.0°
C29	C30	C31	H4	180.0°	90.0°
C30	C29	C28	H6	180.0°	90.0°
C29	C30	C31	C32	0.4°	90.0°
C30	C29	C28	N27	0.4°	90.0°
C29	C30	C31	H5	179.6°	90.0°
C30	C29	C28	H9	179.6°	90.0°
C31	C30	C29	C28	0.6°	90.0°
C30	C31	C32	H5	180.0°	90.0°
C30	C31	C32	N27	0.0°	90.0°
C30	C31	C32	N33	179.7°	90.0°
C31	C30	C29	H6	179.4°	90.0°
C9	C8	N7	H8	180.0°	90.0°
C9	C8	N7	C21	0.2°	90.0°
C9	C8	N7	C6	179.5°	90.0°
C8	C9	C19	H3	179.4°	90.0°
C8	C9	C10	H23	38.7°	90.0°
C8	C9	C10	H24	157.1°	90.0°
C16	C17	C18	H14	120.3°	90.0°
C16	C17	C18	H15	120.3°	90.0°
C17	C16	H10	H11	119.8°	90.0°
C17	C16	C15	H12	176.9°	90.0°
C17	C16	C15	H13	56.7°	90.0°
C16	C17	H14	H15	119.1°	90.0°
C16	C17	C18	H18	169.2°	90.0°
C16	C17	C18	H19	72.3°	90.0°
C20	C21	N7	C8	0.1°	90.0°
C20	C21	N7	N22	180.0°	90.0°
C20	C21	N7	C6	179.8°	90.0°
C20	C21	N22	C5	179.7°	90.0°
C21	C20	C19	H3	179.7°	90.0°
C29	C28	N27	H9	180.0°	90.0°
C29	C28	N27	C32	0.1°	90.0°
C29	C28	N27	C25	179.3°	90.0°
C28	C29	C30	H4	179.4°	90.0°
C31	C32	N27	C28	0.3°	90.0°
C31	C32	N27	N33	179.6°	90.0°
C31	C32	N27	C25	179.5°	90.0°
C31	C32	N33	C23	179.7°	90.0°
C32	C31	C30	H4	179.6°	90.0°
C31	C32	N33	H27	0.2°	90.0°
C18	C17	C16	H10	61.9°	90.0°
C18	C17	C16	H11	178.2°	90.0°
C18	C17	H14	H15	119.1°	90.0°
C17	C18	H18	H19	117.5°	90.0°
C17	C18	C13	H20	163.0°	90.0°
C8	N7	C21	C6	179.7°	90.0°
C8	N7	C21	N22	179.9°	90.0°
C8	N7	C6	C5	179.7°	90.0°
C8	N7	C6	H1	0.3°	90.0°
N7	C21	N22	C5	0.3°	90.0°
C21	N7	C6	C5	0.0°	90.0°
C21	N7	C6	H1	180.0°	90.0°
N7	C21	C20	H2	179.9°	90.0°
C21	N7	C8	H8	179.8°	90.0°
N22	C21	N7	C6	0.2°	90.0°
C21	N22	C5	C6	0.3°	90.0°
C21	N22	C5	C4	180.0°	90.0°
N22	C21	C20	H2	0.0°	90.0°
C28	N27	C32	C25	179.2°	90.0°
C28	N27	C32	N33	179.9°	90.0°
C28	N27	C25	O26	0.3°	90.0°
C28	N27	C25	C24	179.9°	90.0°
N27	C28	C29	H6	179.6°	90.0°
N7	C6	C5	N22	0.2°	90.0°
N7	C6	C5	H1	180.0°	90.0°
N7	C6	C5	C4	179.9°	90.0°
C6	N7	C8	H8	0.5°	90.0°
N27	C32	N33	C23	0.7°	90.0°
C32	N27	C25	O26	179.6°	90.0°
C32	N27	C25	C24	0.7°	90.0°
N27	C32	C31	H5	180.0°	90.0°
C32	N27	C28	H9	179.9°	90.0°
N27	C32	N33	H27	179.3°	90.0°
N33	C32	N27	C25	0.9°	90.0°
C32	N33	C23	H27	180.0°	90.0°
C32	N33	C23	C24	0.4°	90.0°
C32	N33	C23	C2	179.9°	90.0°
N33	C32	C31	H5	0.4°	90.0°
N22	C5	C6	C4	179.7°	90.0°
N22	C5	C4	N3	90.8°	90.0°
N22	C5	C6	H1	179.8°	90.0°
N22	C5	C4	H21	28.9°	90.0°
N22	C5	C4	H22	149.4°	90.0°
N27	C25	O26	C24	179.7°	90.0°
N27	C25	C24	C23	0.4°	90.0°
N27	C25	C24	H7	179.6°	90.0°
C25	N27	C28	H9	0.7°	90.0°
N33	C23	C2	N3	26.3°	90.0°
N33	C23	C24	C25	0.3°	90.0°
N33	C23	C24	C2	179.5°	90.0°
N33	C23	C2	O1	153.0°	90.0°
N33	C23	C24	H7	179.7°	90.0°
C6	C5	C4	N3	88.9°	90.0°
C6	C5	C4	H21	151.4°	90.0°
C6	C5	C4	H22	30.9°	90.0°
C5	C4	N3	H21	119.8°	90.0°
C5	C4	N3	H22	119.8°	90.0°
C5	C4	N3	C2	170.5°	90.0°
C4	C5	C6	H1	0.1°	90.0°
C5	C4	H21	H22	120.7°	90.0°
C5	C4	N3	H28	9.5°	90.0°
C4	N3	C2	H28	180.0°	90.0°
C4	N3	C2	C23	164.9°	90.0°
C4	N3	C2	O1	14.4°	90.0°
N3	C4	H21	H22	120.7°	90.0°
N3	C2	C23	C24	154.1°	90.0°
N3	C2	C23	O1	179.3°	90.0°
C2	N3	C4	H21	69.8°	90.0°
C2	N3	C4	H22	50.7°	90.0°
O26	C25	C24	C23	179.8°	90.0°
O26	C25	C24	H7	0.2°	90.0°
C25	C24	C23	H7	180.0°	90.0°
C25	C24	C23	C2	179.8°	90.0°
C24	C23	C2	O1	26.6°	90.0°
C24	C23	N33	H27	179.6°	90.0°
C2	C23	C24	H7	0.2°	90.0°
C2	C23	N33	H27	0.1°	90.0°
C23	C2	N3	H28	15.2°	90.0°
O1	C2	N3	H28	165.5°	90.0°
H2	C20	C19	H3	0.3°	90.0°
H4	C30	C31	H5	0.4°	90.0°
H4	C30	C29	H6	0.6°	90.0°
H6	C29	C28	H9	0.4°	90.0°
H10	C16	C15	H12	63.1°	90.0°
H10	C16	C15	H13	176.7°	90.0°
H10	C16	C17	H14	58.3°	90.0°
H10	C16	C17	H15	177.8°	90.0°
H11	C16	C15	H12	56.8°	90.0°
H11	C16	C15	H13	63.4°	90.0°
H11	C16	C17	H14	61.6°	90.0°
H11	C16	C17	H15	57.9°	90.0°
H12	C15	C14	H16	60.4°	90.0°
H12	C15	C14	H17	58.5°	90.0°
H13	C15	C14	H16	59.8°	90.0°
H13	C15	C14	H17	178.7°	90.0°
H14	C17	C18	H18	70.5°	90.0°
H14	C17	C18	H19	47.9°	90.0°
H15	C17	C18	H18	48.9°	90.0°
H15	C17	C18	H19	167.4°	90.0°
H16	C14	C13	H20	71.1°	90.0°
H17	C14	C13	H20	47.8°	90.0°
H18	C18	C13	H20	76.2°	90.0°
H19	C18	C13	H20	42.2°	90.0°
H20	C13	C12	H25	159.7°	90.0°
H20	C13	C12	H26	80.6°	90.0°
H21	C4	N3	H28	110.3°	90.0°
H22	C4	N3	H28	129.3°	90.0°
H23	C10	N11	H29	82.1°	90.0°
H24	C10	N11	H29	159.4°	90.0°
H25	C12	N11	H29	30.5°	90.0°
H26	C12	N11	H29	150.2°	90.0°

Release date:	2021-04-14
Definition date:	2021-04-07
Last modified:	2021-04-09
Release status:	REL
Processing site:	PDBE
Derived from:	7O2I