K5O

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O2	S1	doub	1.42Å	0.00Å
O1	S1	doub	1.42Å	0.00Å
C19	S1	sing	1.81Å	0.00Å
S1	N7	sing	1.66Å	0.00Å
N7	C17	sing	1.47Å	0.00Å
N7	C16	sing	1.47Å	0.00Å
C17	C18	sing	1.53Å	0.00Å
C24	C23	sing	1.51Å	0.00Å
C1	N1	sing	1.46Å	0.00Å
C16	C15	sing	1.53Å	0.00Å
C18	N6	sing	1.47Å	0.00Å
C21	C22	sing	1.42Å	0.00Å	Aromatic
C21	C20	doub	1.36Å	0.00Å	Aromatic
C23	C22	doub	1.40Å	0.00Å	Aromatic
C23	C8	sing	1.37Å	0.00Å	Aromatic
N1	C2	sing	1.39Å	0.00Å
C7	C8	sing	1.51Å	0.00Å
C7	N4	sing	1.47Å	0.00Å
C22	C11	sing	1.41Å	0.00Å	Aromatic
C15	N6	sing	1.47Å	0.00Å
C26	N4	sing	1.47Å	0.00Å
C26	C27	sing	1.53Å	0.00Å
N8	C25	trip	1.14Å	0.00Å
C8	C9	doub	1.39Å	0.00Å	Aromatic
C25	C20	sing	1.43Å	0.00Å
C20	N5	sing	1.38Å	0.00Å	Aromatic
N6	C13	sing	1.47Å	0.00Å
N4	C6	sing	1.47Å	0.00Å
C2	N2	doub	1.33Å	0.00Å	Aromatic
C2	N9	sing	1.32Å	0.00Å	Aromatic
C11	N5	sing	1.38Å	0.00Å	Aromatic
C11	C10	doub	1.39Å	0.00Å	Aromatic
C27	C4	sing	1.53Å	0.00Å
N2	C3	sing	1.32Å	0.00Å	Aromatic
N5	C12	sing	1.46Å	0.00Å
C9	C10	sing	1.38Å	0.00Å	Aromatic
C6	C5	sing	1.53Å	0.00Å
C4	C5	sing	1.53Å	0.00Å
C4	N3	sing	1.47Å	0.00Å
C13	C12	sing	1.53Å	0.00Å
C13	C14	sing	1.53Å	0.00Å
N9	C33	doub	1.34Å	0.00Å	Aromatic
C3	N3	sing	1.38Å	0.00Å
C3	C28	doub	1.42Å	0.00Å	Aromatic
C33	C28	sing	1.40Å	0.00Å	Aromatic
C33	S2	sing	1.76Å	0.00Å	Aromatic
C28	C29	sing	1.45Å	0.00Å	Aromatic
S2	C30	sing	1.75Å	0.00Å	Aromatic
C29	C30	doub	1.32Å	0.00Å	Aromatic
C30	C31	sing	1.51Å	0.00Å
F1	C32	sing	1.40Å	0.00Å
F2	C32	sing	1.40Å	0.00Å
C31	C32	sing	1.53Å	0.00Å
C32	F3	sing	1.40Å	0.00Å
C1	H1	sing	1.09Å	0.00Å
C1	H2	sing	1.09Å	0.00Å
C1	H3	sing	1.09Å	0.00Å
N1	H4	sing	0.97Å	0.00Å
N3	H5	sing	0.97Å	0.00Å
C4	H6	sing	1.09Å	0.00Å
C5	H7	sing	1.09Å	0.00Å
C5	H8	sing	1.09Å	0.00Å
C6	H9	sing	1.09Å	0.00Å
C6	H10	sing	1.09Å	0.00Å
C7	H12	sing	1.09Å	0.00Å
C7	H13	sing	1.09Å	0.00Å
C9	H14	sing	1.08Å	0.00Å
C10	H15	sing	1.08Å	0.00Å
C12	H16	sing	1.09Å	0.00Å
C12	H17	sing	1.09Å	0.00Å
C13	H18	sing	1.09Å	0.00Å
C14	H19	sing	1.09Å	0.00Å
C14	H20	sing	1.09Å	0.00Å
C14	H21	sing	1.09Å	0.00Å
C15	H23	sing	1.09Å	0.00Å
C15	H24	sing	1.09Å	0.00Å
C16	H25	sing	1.09Å	0.00Å
C16	H26	sing	1.09Å	0.00Å
C17	H27	sing	1.09Å	0.00Å
C17	H28	sing	1.09Å	0.00Å
C18	H29	sing	1.09Å	0.00Å
C18	H30	sing	1.09Å	0.00Å
C19	H31	sing	1.09Å	0.00Å
C19	H32	sing	1.09Å	0.00Å
C19	H33	sing	1.09Å	0.00Å
C21	H34	sing	1.08Å	0.00Å
C24	H35	sing	1.09Å	0.00Å
C24	H36	sing	1.09Å	0.00Å
C24	H37	sing	1.09Å	0.00Å
C26	H38	sing	1.09Å	0.00Å
C26	H39	sing	1.09Å	0.00Å
C27	H40	sing	1.09Å	0.00Å
C27	H41	sing	1.09Å	0.00Å
C29	H42	sing	1.08Å	0.00Å
C31	H43	sing	1.09Å	0.00Å
C31	H44	sing	1.09Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O2	S1	O1	90.0°	121.1°
O2	S1	C19	90.0°	110.5°
O2	S1	N7	90.0°	104.3°
O1	S1	C19	90.0°	110.6°
O1	S1	N7	90.0°	104.3°
C19	S1	N7	90.0°	104.4°
S1	C19	H31	90.0°	109.5°
S1	C19	H32	90.0°	109.4°
S1	C19	H33	90.0°	109.5°
S1	N7	C17	90.0°	120.9°
S1	N7	C16	90.0°	120.9°
C17	N7	C16	90.0°	118.2°
N7	C17	C18	90.0°	108.5°
N7	C17	H27	90.0°	109.6°
N7	C17	H28	90.0°	109.6°
N7	C16	C15	90.0°	108.5°
N7	C16	H25	90.0°	109.7°
N7	C16	H26	90.0°	109.8°
C17	C18	N6	90.0°	109.3°
C18	C17	H27	90.0°	109.7°
C18	C17	H28	90.0°	109.7°
C17	C18	H29	90.0°	109.5°
C17	C18	H30	90.0°	109.4°
C24	C23	C22	90.0°	120.1°
C24	C23	C8	90.0°	120.1°
C23	C24	H35	90.0°	109.4°
C23	C24	H36	90.0°	109.5°
C23	C24	H37	90.0°	109.4°
C1	N1	C2	90.0°	120.0°
N1	C1	H1	90.0°	109.5°
N1	C1	H2	90.0°	109.5°
N1	C1	H3	90.0°	109.5°
C1	N1	H4	90.0°	120.0°
C16	C15	N6	90.0°	109.3°
C16	C15	H23	90.0°	109.5°
C16	C15	H24	90.0°	109.5°
C15	C16	H25	90.0°	109.6°
C15	C16	H26	90.0°	109.6°
C18	N6	C15	90.0°	111.3°
C18	N6	C13	90.0°	111.0°
N6	C18	H29	90.0°	109.6°
N6	C18	H30	90.0°	109.5°
C22	C21	C20	90.0°	107.7°
C21	C22	C23	90.0°	133.3°
C21	C22	C11	90.0°	106.9°
C22	C21	H34	90.0°	126.1°
C21	C20	C25	90.0°	125.4°
C21	C20	N5	90.0°	109.2°
C20	C21	H34	90.0°	126.2°
C22	C23	C8	90.0°	119.8°
C23	C22	C11	90.0°	119.7°
C23	C8	C7	90.0°	119.7°
C23	C8	C9	90.0°	120.6°
N1	C2	N2	90.0°	119.0°
N1	C2	N9	90.0°	119.0°
C2	N1	H4	90.0°	119.9°
C8	C7	N4	90.0°	109.4°
C7	C8	C9	90.0°	119.7°
C8	C7	H12	90.0°	109.5°
C8	C7	H13	90.0°	109.5°
C7	N4	C26	90.0°	111.0°
C7	N4	C6	90.0°	111.0°
N4	C7	H12	90.0°	109.5°
N4	C7	H13	90.0°	109.5°
C22	C11	N5	90.0°	107.4°
C22	C11	C10	90.0°	119.4°
C15	N6	C13	90.0°	111.0°
N6	C15	H23	90.0°	109.5°
N6	C15	H24	90.0°	109.5°
N4	C26	C27	90.0°	109.5°
C26	N4	C6	90.0°	111.2°
N4	C26	H38	90.0°	109.5°
N4	C26	H39	90.0°	109.5°
C26	C27	C4	90.0°	109.3°
C27	C26	H38	90.0°	109.4°
C27	C26	H39	90.0°	109.5°
C26	C27	H40	90.0°	109.4°
C26	C27	H41	90.0°	109.5°
N8	C25	C20	90.0°	179.9°
C8	C9	C10	90.0°	120.7°
C8	C9	H14	90.0°	119.6°
C25	C20	N5	90.0°	125.4°
C20	N5	C11	90.0°	108.8°
C20	N5	C12	90.0°	125.6°
N6	C13	C12	90.0°	109.5°
N6	C13	C14	90.0°	109.5°
N6	C13	H18	90.0°	109.5°
N4	C6	C5	90.0°	109.5°
N4	C6	H9	90.0°	109.5°
N4	C6	H10	90.0°	109.4°
N2	C2	N9	90.0°	122.0°
C2	N2	C3	90.0°	121.1°
C2	N9	C33	90.0°	121.0°
N5	C11	C10	90.0°	133.2°
C11	N5	C12	90.0°	125.6°
C11	C10	C9	90.0°	119.8°
C11	C10	H15	90.0°	120.1°
C27	C4	C5	90.0°	109.2°
C27	C4	N3	90.0°	109.5°
C27	C4	H6	90.0°	109.5°
C4	C27	H40	90.0°	109.5°
C4	C27	H41	90.0°	109.5°
N2	C3	N3	90.0°	120.4°
N2	C3	C28	90.0°	119.1°
N5	C12	C13	90.0°	109.5°
N5	C12	H16	90.0°	109.4°
N5	C12	H17	90.0°	109.5°
C10	C9	H14	90.0°	119.7°
C9	C10	H15	90.0°	120.1°
C6	C5	C4	90.0°	109.3°
C6	C5	H7	90.0°	109.5°
C6	C5	H8	90.0°	109.5°
C5	C6	H9	90.0°	109.5°
C5	C6	H10	90.0°	109.5°
C5	C4	N3	90.0°	109.5°
C5	C4	H6	90.0°	109.6°
C4	C5	H7	90.0°	109.5°
C4	C5	H8	90.0°	109.5°
C4	N3	C3	90.0°	120.0°
C4	N3	H5	90.0°	120.0°
N3	C4	H6	90.0°	109.5°
C12	C13	C14	90.0°	109.5°
C13	C12	H16	90.0°	109.4°
C13	C12	H17	90.0°	109.5°
C12	C13	H18	90.0°	109.4°
C14	C13	H18	90.0°	109.4°
C13	C14	H19	90.0°	109.5°
C13	C14	H20	90.0°	109.5°
C13	C14	H21	90.0°	109.5°
N9	C33	C28	90.0°	119.2°
N9	C33	S2	90.0°	131.2°
N3	C3	C28	90.0°	120.4°
C3	N3	H5	90.0°	120.0°
C3	C28	C33	90.0°	117.6°
C3	C28	C29	90.0°	130.4°
C28	C33	S2	90.0°	109.6°
C33	C28	C29	90.0°	112.0°
C33	S2	C30	90.0°	92.2°
C28	C29	C30	90.0°	114.8°
C28	C29	H42	90.0°	122.6°
S2	C30	C29	90.0°	111.4°
S2	C30	C31	90.0°	124.3°
C29	C30	C31	90.0°	124.3°
C30	C29	H42	90.0°	122.6°
C30	C31	C32	90.0°	109.5°
C30	C31	H43	90.0°	109.5°
C30	C31	H44	90.0°	109.5°
F1	C32	F2	90.0°	109.5°
F1	C32	C31	90.0°	109.5°
F1	C32	F3	90.0°	109.5°
F2	C32	C31	90.0°	109.4°
F2	C32	F3	90.0°	109.5°
C31	C32	F3	90.0°	109.5°
C32	C31	H43	90.0°	109.5°
C32	C31	H44	90.0°	109.5°
H1	C1	H2	90.0°	109.5°
H1	C1	H3	90.0°	109.5°
H2	C1	H3	90.0°	109.5°
H7	C5	H8	90.0°	109.5°
H9	C6	H10	90.0°	109.4°
H12	C7	H13	90.0°	109.5°
H16	C12	H17	90.0°	109.4°
H19	C14	H20	90.0°	109.5°
H19	C14	H21	90.0°	109.5°
H20	C14	H21	90.0°	109.4°
H23	C15	H24	90.0°	109.5°
H25	C16	H26	90.0°	109.6°
H27	C17	H28	90.0°	109.7°
H29	C18	H30	90.0°	109.5°
H31	C19	H32	90.0°	109.4°
H31	C19	H33	90.0°	109.5°
H32	C19	H33	90.0°	109.5°
H35	C24	H36	90.0°	109.5°
H35	C24	H37	90.0°	109.5°
H36	C24	H37	90.0°	109.5°
H38	C26	H39	90.0°	109.5°
H40	C27	H41	90.0°	109.5°
H43	C31	H44	90.0°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O2	S1	O1	C19	90.0°	131.6°
O2	S1	O1	N7	90.0°	116.8°
O2	S1	C19	N7	90.0°	111.6°
O2	S1	N7	C17	90.0°	26.0°
O2	S1	N7	C16	90.0°	153.9°
O2	S1	C19	H31	90.0°	171.6°
O2	S1	C19	H32	90.0°	68.4°
O2	S1	C19	H33	90.0°	51.6°
O1	S1	C19	N7	90.0°	111.6°
O1	S1	N7	C17	90.0°	153.9°
O1	S1	N7	C16	90.0°	26.0°
O1	S1	C19	H31	90.0°	51.5°
O1	S1	C19	H32	90.0°	68.4°
O1	S1	C19	H33	90.0°	171.6°
C19	S1	N7	C17	90.0°	90.0°
C19	S1	N7	C16	90.0°	90.1°
S1	C19	H31	H32	90.0°	119.9°
S1	C19	H31	H33	90.0°	120.1°
S1	C19	H32	H33	90.0°	120.0°
S1	N7	C17	C16	90.0°	179.9°
S1	N7	C17	C18	90.0°	128.9°
S1	N7	C16	C15	90.0°	128.9°
S1	N7	C16	H25	90.0°	9.2°
S1	N7	C16	H26	90.0°	111.3°
S1	N7	C17	H27	90.0°	9.1°
S1	N7	C17	H28	90.0°	111.4°
N7	S1	C19	H31	90.0°	60.1°
N7	S1	C19	H32	90.0°	180.0°
N7	S1	C19	H33	90.0°	60.0°
N7	C17	C18	H27	90.0°	119.7°
N7	C17	C18	H28	90.0°	119.7°
C17	N7	C16	C15	90.0°	51.2°
N7	C17	C18	N6	90.0°	53.8°
C17	N7	C16	H25	90.0°	170.9°
C17	N7	C16	H26	90.0°	68.6°
N7	C17	H27	H28	90.0°	120.4°
N7	C17	C18	H29	90.0°	173.8°
N7	C17	C18	H30	90.0°	66.1°
C16	N7	C17	C18	90.0°	51.2°
N7	C16	C15	H25	90.0°	119.7°
N7	C16	C15	H26	90.0°	119.9°
N7	C16	C15	N6	90.0°	53.8°
N7	C16	C15	H23	90.0°	66.1°
N7	C16	C15	H24	90.0°	173.8°
N7	C16	H25	H26	90.0°	120.7°
C16	N7	C17	H27	90.0°	171.0°
C16	N7	C17	H28	90.0°	68.5°
C17	C18	N6	H29	90.0°	120.0°
C17	C18	N6	H30	90.0°	119.9°
C17	C18	N6	C15	90.0°	63.1°
C17	C18	N6	C13	90.0°	172.7°
C18	C17	H27	H28	90.0°	120.5°
C17	C18	H29	H30	90.0°	120.0°
C24	C23	C22	C21	90.0°	0.0°
C24	C23	C22	C8	90.0°	179.8°
C24	C23	C8	C7	90.0°	0.1°
C24	C23	C22	C11	90.0°	179.7°
C24	C23	C8	C9	90.0°	179.7°
C23	C24	H35	H36	90.0°	120.0°
C23	C24	H35	H37	90.0°	119.9°
C23	C24	H36	H37	90.0°	120.0°
C1	N1	C2	H4	90.0°	180.0°
C1	N1	C2	N2	90.0°	180.0°
C1	N1	C2	N9	90.0°	0.3°
N1	C1	H1	H2	90.0°	120.0°
N1	C1	H1	H3	90.0°	120.0°
N1	C1	H2	H3	90.0°	120.0°
C16	C15	N6	C18	90.0°	63.1°
C16	C15	N6	H23	90.0°	120.0°
C16	C15	N6	H24	90.0°	120.0°
C16	C15	N6	C13	90.0°	172.7°
C16	C15	H23	H24	90.0°	120.1°
C15	C16	H25	H26	90.0°	120.3°
C18	N6	C15	C13	90.0°	124.2°
C18	N6	C13	C12	90.0°	65.7°
C18	N6	C13	C14	90.0°	54.4°
C18	N6	C13	H18	90.0°	174.3°
C18	N6	C15	H23	90.0°	56.9°
C18	N6	C15	H24	90.0°	176.9°
N6	C18	C17	H27	90.0°	173.5°
N6	C18	C17	H28	90.0°	65.9°
N6	C18	H29	H30	90.0°	120.1°
C22	C21	C20	H34	90.0°	180.0°
C21	C22	C23	C11	90.0°	179.7°
C21	C22	C23	C8	90.0°	179.8°
C22	C21	C20	C25	90.0°	180.0°
C22	C21	C20	N5	90.0°	0.0°
C21	C22	C11	N5	90.0°	0.0°
C21	C22	C11	C10	90.0°	180.0°
C20	C21	C22	C23	90.0°	179.7°
C20	C21	C22	C11	90.0°	0.0°
C21	C20	C25	N8	90.0°	0.7°
C21	C20	C25	N5	90.0°	179.9°
C21	C20	N5	C11	90.0°	0.0°
C21	C20	N5	C12	90.0°	180.0°
C22	C23	C8	C7	90.0°	179.8°
C22	C23	C8	C9	90.0°	0.5°
C23	C22	C11	N5	90.0°	179.8°
C23	C22	C11	C10	90.0°	0.2°
C23	C22	C21	H34	90.0°	0.3°
C22	C23	C24	H35	90.0°	95.4°
C22	C23	C24	H36	90.0°	144.7°
C22	C23	C24	H37	90.0°	24.6°
C23	C8	C7	C9	90.0°	179.7°
C23	C8	C7	N4	90.0°	76.9°
C8	C23	C22	C11	90.0°	0.5°
C23	C8	C9	C10	90.0°	0.2°
C23	C8	C7	H12	90.0°	163.1°
C23	C8	C7	H13	90.0°	43.1°
C23	C8	C9	H14	90.0°	179.8°
C8	C23	C24	H35	90.0°	84.8°
C8	C23	C24	H36	90.0°	35.2°
C8	C23	C24	H37	90.0°	155.2°
N1	C2	N2	N9	90.0°	179.7°
N1	C2	N2	C3	90.0°	180.0°
N1	C2	N9	C33	90.0°	179.7°
C2	N1	C1	H1	90.0°	60.0°
C2	N1	C1	H2	90.0°	60.0°
C2	N1	C1	H3	90.0°	180.0°
C8	C7	N4	H12	90.0°	120.0°
C8	C7	N4	H13	90.0°	120.0°
C8	C7	N4	C26	90.0°	71.6°
C8	C7	N4	C6	90.0°	164.2°
C7	C8	C9	C10	90.0°	180.0°
C8	C7	H12	H13	90.0°	120.0°
C7	C8	C9	H14	90.0°	0.0°
C7	N4	C26	C6	90.0°	124.1°
C7	N4	C26	C27	90.0°	174.2°
N4	C7	C8	C9	90.0°	103.4°
C7	N4	C6	C5	90.0°	174.2°
C7	N4	C6	H9	90.0°	65.8°
C7	N4	C6	H10	90.0°	54.1°
N4	C7	H12	H13	90.0°	120.0°
C7	N4	C26	H38	90.0°	65.8°
C7	N4	C26	H39	90.0°	54.2°
C22	C11	N5	C20	90.0°	0.0°
C22	C11	N5	C10	90.0°	180.0°
C22	C11	N5	C12	90.0°	179.9°
C22	C11	C10	C9	90.0°	0.1°
C22	C11	C10	H15	90.0°	180.0°
C11	C22	C21	H34	90.0°	180.0°
C15	N6	C13	C12	90.0°	170.0°
C15	N6	C13	C14	90.0°	70.0°
C15	N6	C13	H18	90.0°	50.0°
N6	C15	H23	H24	90.0°	120.0°
N6	C15	C16	H25	90.0°	173.5°
N6	C15	C16	H26	90.0°	66.1°
C15	N6	C18	H29	90.0°	176.9°
C15	N6	C18	H30	90.0°	56.8°
N4	C26	C27	H38	90.0°	120.0°
N4	C26	C27	H39	90.0°	120.0°
N4	C26	C27	C4	90.0°	59.1°
C26	N4	C6	C5	90.0°	61.8°
C26	N4	C6	H9	90.0°	58.3°
C26	N4	C6	H10	90.0°	178.2°
C26	N4	C7	H12	90.0°	48.4°
C26	N4	C7	H13	90.0°	168.4°
N4	C26	H38	H39	90.0°	120.0°
N4	C26	C27	H40	90.0°	60.8°
N4	C26	C27	H41	90.0°	179.1°
C27	C26	N4	C6	90.0°	61.7°
C26	C27	C4	H40	90.0°	119.9°
C26	C27	C4	H41	90.0°	120.0°
C26	C27	C4	C5	90.0°	57.6°
C26	C27	C4	N3	90.0°	177.6°
C26	C27	C4	H6	90.0°	62.3°
C27	C26	H38	H39	90.0°	120.0°
C26	C27	H40	H41	90.0°	120.1°
N8	C25	C20	N5	90.0°	179.4°
C8	C9	C10	C11	90.0°	0.1°
C8	C9	C10	H14	90.0°	180.0°
C9	C8	C7	H12	90.0°	16.6°
C9	C8	C7	H13	90.0°	136.7°
C8	C9	C10	H15	90.0°	179.9°
C25	C20	N5	C11	90.0°	179.9°
C25	C20	N5	C12	90.0°	0.1°
C25	C20	C21	H34	90.0°	0.0°
C20	N5	C11	C12	90.0°	179.9°
C20	N5	C11	C10	90.0°	180.0°
C20	N5	C12	C13	90.0°	89.9°
C20	N5	C12	H16	90.0°	30.1°
C20	N5	C12	H17	90.0°	150.0°
N5	C20	C21	H34	90.0°	180.0°
N6	C13	C12	N5	90.0°	65.0°
N6	C13	C12	C14	90.0°	120.0°
N6	C13	C12	H18	90.0°	120.0°
N6	C13	C14	H18	90.0°	120.0°
N6	C13	C12	H16	90.0°	55.0°
N6	C13	C12	H17	90.0°	174.9°
N6	C13	C14	H19	90.0°	180.0°
N6	C13	C14	H20	90.0°	60.0°
N6	C13	C14	H21	90.0°	60.0°
C13	N6	C15	H23	90.0°	67.3°
C13	N6	C15	H24	90.0°	52.7°
C13	N6	C18	H29	90.0°	52.8°
C13	N6	C18	H30	90.0°	67.4°
N4	C6	C5	H9	90.0°	120.1°
N4	C6	C5	H10	90.0°	120.0°
N4	C6	C5	C4	90.0°	59.2°
N4	C6	C5	H7	90.0°	179.1°
N4	C6	C5	H8	90.0°	60.8°
N4	C6	H9	H10	90.0°	119.9°
C6	N4	C7	H12	90.0°	75.8°
C6	N4	C7	H13	90.0°	44.3°
C6	N4	C26	H38	90.0°	58.2°
C6	N4	C26	H39	90.0°	178.3°
N2	C2	N9	C33	90.0°	0.6°
C2	N2	C3	N3	90.0°	179.9°
C2	N2	C3	C28	90.0°	0.0°
N2	C2	N1	H4	90.0°	0.0°
N9	C2	N2	C3	90.0°	0.3°
C2	N9	C33	C28	90.0°	0.6°
C2	N9	C33	S2	90.0°	179.8°
N9	C2	N1	H4	90.0°	179.7°
N5	C11	C10	C9	90.0°	180.0°
C11	N5	C12	C13	90.0°	90.0°
N5	C11	C10	H15	90.0°	0.1°
C11	N5	C12	H16	90.0°	150.0°
C11	N5	C12	H17	90.0°	30.1°
C10	C11	N5	C12	90.0°	0.0°
C11	C10	C9	H15	90.0°	179.9°
C11	C10	C9	H14	90.0°	179.9°
C27	C4	C5	C6	90.0°	57.6°
C27	C4	C5	N3	90.0°	119.9°
C27	C4	C5	H6	90.0°	119.9°
C27	C4	N3	H6	90.0°	120.1°
C27	C4	N3	C3	90.0°	85.2°
C27	C4	N3	H5	90.0°	94.7°
C27	C4	C5	H7	90.0°	177.6°
C27	C4	C5	H8	90.0°	62.4°
C4	C27	C26	H38	90.0°	60.8°
C4	C27	C26	H39	90.0°	179.2°
C4	C27	H40	H41	90.0°	120.1°
N2	C3	N3	C4	90.0°	0.0°
N2	C3	N3	C28	90.0°	180.0°
N2	C3	C28	C33	90.0°	0.0°
N2	C3	C28	C29	90.0°	180.0°
N2	C3	N3	H5	90.0°	180.0°
N5	C12	C13	H16	90.0°	120.0°
N5	C12	C13	H17	90.0°	120.1°
N5	C12	C13	C14	90.0°	175.0°
N5	C12	H16	H17	90.0°	120.0°
N5	C12	C13	H18	90.0°	55.1°
C6	C5	C4	H7	90.0°	120.0°
C6	C5	C4	H8	90.0°	120.0°
C6	C5	C4	N3	90.0°	177.6°
C6	C5	C4	H6	90.0°	62.3°
C6	C5	H7	H8	90.0°	120.1°
C5	C6	H9	H10	90.0°	120.0°
C5	C4	N3	H6	90.0°	120.2°
C5	C4	N3	C3	90.0°	155.0°
C5	C4	N3	H5	90.0°	25.0°
C4	C5	H7	H8	90.0°	120.1°
C4	C5	C6	H9	90.0°	60.9°
C4	C5	C6	H10	90.0°	179.2°
C5	C4	C27	H40	90.0°	62.3°
C5	C4	C27	H41	90.0°	177.6°
C4	N3	C3	H5	90.0°	179.9°
C4	N3	C3	C28	90.0°	180.0°
N3	C4	C5	H7	90.0°	62.5°
N3	C4	C5	H8	90.0°	57.6°
N3	C4	C27	H40	90.0°	57.7°
N3	C4	C27	H41	90.0°	62.4°
C12	C13	C14	H18	90.0°	119.9°
C13	C12	H16	H17	90.0°	120.0°
C12	C13	C14	H19	90.0°	59.9°
C12	C13	C14	H20	90.0°	180.0°
C12	C13	C14	H21	90.0°	60.0°
C14	C13	C12	H16	90.0°	65.0°
C14	C13	C12	H17	90.0°	54.9°
C13	C14	H19	H20	90.0°	120.1°
C13	C14	H19	H21	90.0°	120.0°
C13	C14	H20	H21	90.0°	120.0°
N9	C33	C28	C3	90.0°	0.3°
N9	C33	C28	S2	90.0°	179.7°
N9	C33	C28	C29	90.0°	179.7°
N9	C33	S2	C30	90.0°	179.6°
N3	C3	C28	C33	90.0°	180.0°
N3	C3	C28	C29	90.0°	0.0°
C3	N3	C4	H6	90.0°	34.9°
C3	C28	C33	C29	90.0°	180.0°
C3	C28	C33	S2	90.0°	180.0°
C3	C28	C29	C30	90.0°	179.9°
C28	C3	N3	H5	90.0°	0.1°
C3	C28	C29	H42	90.0°	0.0°
C28	C33	S2	C30	90.0°	0.0°
C33	C28	C29	C30	90.0°	0.0°
C33	C28	C29	H42	90.0°	180.0°
S2	C33	C28	C29	90.0°	0.0°
C33	S2	C30	C29	90.0°	0.0°
C33	S2	C30	C31	90.0°	180.0°
C28	C29	C30	S2	90.0°	0.0°
C28	C29	C30	H42	90.0°	180.0°
C28	C29	C30	C31	90.0°	180.0°
S2	C30	C29	C31	90.0°	180.0°
S2	C30	C31	C32	90.0°	89.9°
S2	C30	C29	H42	90.0°	180.0°
S2	C30	C31	H43	90.0°	30.1°
S2	C30	C31	H44	90.0°	150.0°
C29	C30	C31	C32	90.0°	90.1°
C29	C30	C31	H43	90.0°	149.9°
C29	C30	C31	H44	90.0°	30.0°
C30	C31	C32	F1	90.0°	180.0°
C30	C31	C32	F2	90.0°	60.0°
C30	C31	C32	H43	90.0°	120.0°
C30	C31	C32	H44	90.0°	120.1°
C30	C31	C32	F3	90.0°	60.0°
C31	C30	C29	H42	90.0°	0.0°
C30	C31	H43	H44	90.0°	120.0°
F1	C32	F2	C31	90.0°	120.0°
F1	C32	F2	F3	90.0°	120.0°
F1	C32	C31	F3	90.0°	120.0°
F1	C32	C31	H43	90.0°	60.0°
F1	C32	C31	H44	90.0°	59.9°
F2	C32	C31	F3	90.0°	120.0°
F2	C32	C31	H43	90.0°	180.0°
F2	C32	C31	H44	90.0°	60.0°
C32	C31	H43	H44	90.0°	120.0°
F3	C32	C31	H43	90.0°	60.0°
F3	C32	C31	H44	90.0°	180.0°
H1	C1	H2	H3	90.0°	120.0°
H1	C1	N1	H4	90.0°	120.0°
H2	C1	N1	H4	90.0°	120.0°
H3	C1	N1	H4	90.0°	0.0°
H5	N3	C4	H6	90.0°	145.2°
H6	C4	C5	H7	90.0°	57.7°
H6	C4	C5	H8	90.0°	177.7°
H6	C4	C27	H40	90.0°	177.8°
H6	C4	C27	H41	90.0°	57.7°
H7	C5	C6	H9	90.0°	59.1°
H7	C5	C6	H10	90.0°	60.9°
H8	C5	C6	H9	90.0°	179.2°
H8	C5	C6	H10	90.0°	59.2°
H14	C9	C10	H15	90.0°	0.1°
H16	C12	C13	H18	90.0°	175.0°
H17	C12	C13	H18	90.0°	65.0°
H18	C13	C14	H19	90.0°	60.0°
H18	C13	C14	H20	90.0°	60.0°
H18	C13	C14	H21	90.0°	180.0°
H19	C14	H20	H21	90.0°	119.9°
H23	C15	C16	H25	90.0°	53.6°
H23	C15	C16	H26	90.0°	174.0°
H24	C15	C16	H25	90.0°	66.5°
H24	C15	C16	H26	90.0°	53.9°
H27	C17	C18	H29	90.0°	66.5°
H27	C17	C18	H30	90.0°	53.6°
H28	C17	C18	H29	90.0°	54.1°
H28	C17	C18	H30	90.0°	174.2°
H31	C19	H32	H33	90.0°	120.0°
H35	C24	H36	H37	90.0°	120.1°
H38	C26	C27	H40	90.0°	179.3°
H38	C26	C27	H41	90.0°	59.2°
H39	C26	C27	H40	90.0°	59.3°
H39	C26	C27	H41	90.0°	60.8°

Release date:	2024-11-20
Definition date:	2023-06-02
Last modified:	2024-11-15
Release status:	REL
Processing site:	RCSB