PTT

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.54Å	1.55Å
C1	O4P	sing	1.44Å	1.43Å
C1	H1	sing	0.98Å	1.10Å
C2	C3	sing	1.52Å	1.55Å
C2	O2	sing	1.45Å	1.39Å
C2	H2	sing	0.99Å	1.10Å
C3	S3	sing	1.69Å	1.73Å
C3	C4	doub	1.35Å	1.35Å
S3	W1	sing	2.16Å	2.47Å
C4	S4	sing	1.68Å	1.73Å
C4	C5	sing	1.53Å	1.55Å
S4	W1	sing	2.13Å	2.46Å
W1	S23	sing	2.18Å	2.50Å
W1	S24	sing	2.13Å	2.45Å
W1	OX1	sing	1.73Å	2.12Å
C5	N6	sing	1.46Å	1.46Å
C5	C14	sing	1.56Å	1.56Å
C5	H5	sing	0.99Å	1.10Å
N6	C7	sing	1.38Å	1.35Å
N6	HN6	sing	0.87Å	1.00Å
C7	C8	sing	1.44Å	1.42Å
C7	C12	doub	1.41Å	1.43Å
C8	O8	doub	1.23Å	1.37Å
C8	N9	sing	1.39Å	1.35Å
N9	C10	sing	1.37Å	1.37Å
C10	N10	sing	1.33Å	1.35Å
C10	N11	doub	1.34Å	1.35Å
N10	H101	sing	0.88Å	1.00Å
N10	H102	sing	0.88Å	1.00Å
N11	C12	sing	1.36Å	1.36Å
C12	N13	sing	1.36Å	1.34Å
N13	C14	sing	1.46Å	1.45Å
N13	H13	sing	0.88Å	1.00Å
C14	O2	sing	1.44Å	1.40Å
C14	H14	sing	0.99Å	1.10Å
C21	C22	sing	1.53Å	1.54Å
C21	O8P	sing	1.44Å	1.45Å
C21	H21	sing	0.98Å	1.10Å
C22	C23	sing	1.52Å	1.55Å
C22	O22	sing	1.44Å	1.40Å
C22	H22	sing	0.99Å	1.10Å
C23	S23	sing	1.69Å	1.74Å
C23	C24	doub	1.35Å	1.40Å
C24	S24	sing	1.67Å	1.76Å
C24	C25	sing	1.53Å	1.52Å
C25	N26	sing	1.46Å	1.47Å
C25	C34	sing	1.56Å	1.57Å
C25	H25	sing	0.99Å	1.10Å
N26	C27	sing	1.39Å	1.39Å
N26	H26	sing	0.87Å	1.00Å
C27	C28	sing	1.44Å	1.42Å
C27	C32	doub	1.41Å	1.46Å
C28	O28	doub	1.23Å	1.37Å
C28	N29	sing	1.39Å	1.35Å
N29	C30	sing	1.37Å	1.37Å
N29	H29	sing	0.88Å	1.00Å
C30	N30	sing	1.33Å	1.36Å
C30	N31	doub	1.34Å	1.34Å
N30	H301	sing	0.88Å	1.00Å
N30	H302	sing	0.88Å	1.00Å
N31	C32	sing	1.36Å	1.36Å
C32	N33	sing	1.36Å	1.34Å
N33	C34	sing	1.46Å	1.45Å
N33	H33	sing	0.88Å	1.00Å
C34	O22	sing	1.44Å	1.41Å
C34	H34	sing	0.99Å	1.10Å
P1	O1P	sing	1.54Å	1.56Å
P1	O2P	doub	1.49Å	1.57Å
P1	O3P	sing	1.54Å	1.50Å
P1	O4P	sing	1.58Å	1.61Å
P2	O5P	sing	1.54Å	1.55Å
P2	O6P	doub	1.49Å	1.55Å
P2	O7P	sing	1.54Å	1.46Å
P2	O8P	sing	1.57Å	1.55Å
O3P	HOP3	sing	0.89Å	0.95Å
O7P	HOP7	sing	0.89Å	0.95Å
OX1	HX1	sing	0.87Å	0.95Å
HC1	C21	sing	0.98Å	1.10Å
HC2	C1	sing	0.98Å	1.10Å
O1P	H3	sing	0.89Å	0.95Å
O5P	H4	sing	0.89Å	0.95Å
N9	H6	sing	0.88Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	O4P	108.8°	113.1°
C2	C1	H1	109.6°	109.0°
C1	C2	C3	107.4°	114.3°
C1	C2	O2	98.0°	109.4°
C1	C2	H2	113.3°	106.6°
C2	C1	HC2	109.6°	108.6°
O4P	C1	H1	109.6°	109.2°
C1	O4P	P1	121.1°	121.8°
O4P	C1	HC2	109.6°	109.4°
H1	C1	HC2	109.5°	107.5°
C3	C2	O2	107.6°	112.4°
C3	C2	H2	113.3°	105.6°
C2	C3	S3	117.8°	123.8°
C2	C3	C4	120.9°	122.0°
O2	C2	H2	116.0°	108.1°
C2	O2	C14	115.8°	122.9°
S3	C3	C4	120.5°	114.3°
C3	S3	W1	108.1°	97.8°
C3	C4	S4	122.9°	116.3°
C3	C4	C5	123.5°	122.7°
S3	W1	S4	80.3°	81.2°
S3	W1	S23	106.4°	94.0°
S3	W1	S24	79.0°	96.1°
S3	W1	OX1	156.6°	170.2°
S4	C4	C5	113.5°	121.0°
C4	S4	W1	107.4°	95.2°
C4	C5	N6	108.8°	109.3°
C4	C5	C14	108.5°	111.4°
C4	C5	H5	112.9°	109.2°
S4	W1	S23	85.7°	102.9°
S4	W1	S24	150.6°	172.4°
S4	W1	OX1	86.9°	91.5°
S23	W1	S24	80.4°	84.3°
S23	W1	OX1	91.9°	94.0°
W1	S23	C23	104.7°	107.4°
S24	W1	OX1	119.2°	90.3°
W1	S24	C24	104.7°	107.0°
W1	OX1	HX1	109.5°	115.0°
N6	C5	C14	98.6°	110.9°
N6	C5	H5	114.3°	108.3°
C5	N6	C7	113.2°	121.2°
C5	N6	HN6	108.5°	119.8°
C14	C5	H5	112.8°	107.6°
C5	C14	N13	111.5°	111.7°
C5	C14	O2	112.5°	110.9°
C5	C14	H14	102.4°	108.6°
C7	N6	HN6	108.5°	119.1°
N6	C7	C8	124.3°	121.6°
N6	C7	C12	119.0°	119.0°
C8	C7	C12	116.5°	119.3°
C7	C8	O8	119.8°	125.3°
C7	C8	N9	118.6°	114.9°
C7	C12	N11	121.3°	122.3°
C7	C12	N13	117.6°	120.9°
O8	C8	N9	121.2°	119.8°
C8	N9	C10	123.8°	122.5°
C8	N9	H6	118.1°	118.4°
N9	C10	N10	123.0°	117.8°
N9	C10	N11	118.7°	123.0°
C10	N9	H6	118.1°	119.2°
N10	C10	N11	118.2°	119.1°
C10	N10	H101	120.0°	120.1°
C10	N10	H102	120.0°	120.6°
C10	N11	C12	121.0°	117.9°
H101	N10	H102	120.0°	119.3°
N11	C12	N13	120.9°	116.7°
C12	N13	C14	120.1°	122.8°
C12	N13	H13	106.8°	118.2°
C14	N13	H13	106.7°	119.0°
N13	C14	O2	120.9°	109.6°
N13	C14	H14	103.2°	107.5°
O2	C14	H14	103.8°	108.4°
C22	C21	O8P	105.7°	110.5°
C22	C21	H21	110.4°	109.1°
C21	C22	C23	100.5°	115.0°
C21	C22	O22	112.1°	105.4°
C21	C22	H22	110.2°	107.9°
C22	C21	HC1	110.4°	109.2°
O8P	C21	H21	110.4°	110.0°
C21	O8P	P2	121.1°	124.0°
O8P	C21	HC1	110.4°	109.9°
H21	C21	HC1	109.5°	108.0°
C23	C22	O22	111.2°	112.6°
C23	C22	H22	110.0°	106.9°
C22	C23	S23	117.4°	123.2°
C22	C23	C24	122.7°	121.3°
O22	C22	H22	112.3°	108.9°
C22	O22	C34	118.4°	121.2°
S23	C23	C24	119.8°	115.4°
C23	C24	S24	122.1°	119.4°
C23	C24	C25	121.6°	122.9°
S24	C24	C25	116.2°	117.6°
C24	C25	N26	108.8°	111.2°
C24	C25	C34	104.0°	111.7°
C24	C25	H25	111.6°	107.7°
N26	C25	C34	108.7°	111.6°
N26	C25	H25	112.4°	107.9°
C25	N26	C27	111.9°	122.1°
C25	N26	H26	108.9°	119.8°
C34	C25	H25	110.9°	106.6°
C25	C34	N33	109.7°	112.1°
C25	C34	O22	113.7°	110.2°
C25	C34	H34	108.2°	108.9°
C27	N26	H26	108.8°	118.2°
N26	C27	C28	123.2°	121.5°
N26	C27	C32	122.6°	119.3°
C28	C27	C32	114.0°	119.3°
C27	C28	O28	119.6°	125.3°
C27	C28	N29	119.1°	114.9°
C27	C32	N31	123.8°	122.3°
C27	C32	N33	117.8°	120.9°
O28	C28	N29	121.1°	119.7°
C28	N29	C30	124.1°	122.5°
C28	N29	H29	117.9°	118.4°
C30	N29	H29	118.0°	119.1°
N29	C30	N30	117.9°	117.9°
N29	C30	N31	120.1°	123.0°
N30	C30	N31	121.7°	119.2°
C30	N30	H301	120.0°	120.2°
C30	N30	H302	120.0°	120.6°
C30	N31	C32	118.2°	118.0°
H301	N30	H302	120.0°	119.3°
N31	C32	N33	117.9°	116.7°
C32	N33	C34	121.0°	122.6°
C32	N33	H33	106.5°	118.3°
C34	N33	H33	106.5°	119.0°
N33	C34	O22	105.0°	108.9°
N33	C34	H34	109.7°	107.9°
O22	C34	H34	110.4°	108.9°
O1P	P1	O2P	109.1°	112.4°
O1P	P1	O3P	111.2°	105.7°
O1P	P1	O4P	105.2°	107.8°
P1	O1P	H3	109.5°	109.7°
O2P	P1	O3P	115.3°	111.7°
O2P	P1	O4P	109.2°	112.9°
O3P	P1	O4P	106.2°	105.9°
P1	O3P	HOP3	109.5°	109.4°
O5P	P2	O6P	116.5°	112.4°
O5P	P2	O7P	106.4°	105.7°
O5P	P2	O8P	109.9°	107.6°
P2	O5P	H4	109.5°	109.7°
O6P	P2	O7P	110.5°	112.1°
O6P	P2	O8P	105.1°	112.6°
O7P	P2	O8P	108.1°	106.0°
P2	O7P	HOP7	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	O4P	H1	119.9°	121.5°
C2	C1	O4P	HC2	119.9°	121.1°
C2	C1	H1	HC2	120.3°	117.5°
C1	C2	C3	O2	104.6°	125.5°
C1	C2	C3	H2	125.8°	116.9°
C1	C2	O2	H2	120.8°	115.8°
C1	C2	C3	S3	43.4°	44.6°
C1	C2	C3	C4	126.2°	136.9°
C1	C2	O2	C14	168.9°	106.1°
C2	C1	O4P	P1	142.2°	163.4°
O4P	C1	H1	HC2	120.3°	118.6°
O4P	C1	C2	C3	178.2°	141.1°
O4P	C1	C2	O2	70.5°	14.1°
O4P	C1	C2	H2	52.3°	102.6°
C1	O4P	P1	O1P	46.7°	68.9°
C1	O4P	P1	O2P	163.7°	55.9°
C1	O4P	P1	O3P	71.3°	178.3°
H1	C1	C2	C3	58.3°	19.6°
H1	C1	C2	O2	169.6°	107.5°
H1	C1	C2	H2	67.6°	135.9°
H1	C1	O4P	P1	98.0°	42.0°
C3	C2	O2	H2	128.0°	116.1°
C2	C3	S3	C4	169.6°	178.6°
C2	C3	S3	W1	178.9°	149.8°
C2	C3	C4	S4	179.0°	169.3°
C2	C3	C4	C5	3.8°	14.4°
C3	C2	O2	C14	57.8°	22.0°
C3	C2	C1	HC2	62.0°	97.2°
O2	C2	C3	S3	148.0°	170.1°
O2	C2	C3	C4	21.6°	11.4°
C2	O2	C14	C5	67.0°	48.1°
C2	O2	C14	N13	157.8°	75.7°
C2	O2	C14	H14	42.9°	167.2°
O2	C2	C1	HC2	49.4°	135.7°
H2	C2	C3	S3	82.4°	72.3°
H2	C2	C3	C4	108.0°	106.2°
H2	C2	O2	C14	70.3°	138.1°
H2	C2	C1	HC2	172.2°	19.1°
S3	C3	C4	S4	11.6°	9.4°
S3	C3	C4	C5	173.1°	167.0°
C3	S3	W1	S4	3.4°	46.5°
C3	S3	W1	S23	85.9°	148.9°
C3	S3	W1	S24	162.4°	126.4°
C3	S3	W1	OX1	54.1°	3.9°
C4	C3	S3	W1	9.2°	31.6°
C3	C4	S4	C5	175.7°	176.4°
C3	C4	S4	W1	7.4°	45.8°
C3	C4	C5	N6	104.5°	135.4°
C3	C4	C5	C14	1.8°	12.5°
C3	C4	C5	H5	127.5°	106.3°
S3	W1	S4	C4	1.0°	49.3°
S3	W1	S4	S23	107.4°	92.1°
S3	W1	S4	S24	45.6°	69.9°
S3	W1	S4	OX1	160.4°	173.4°
S3	W1	S23	S24	75.4°	95.7°
S3	W1	S23	OX1	165.3°	174.4°
S3	W1	S24	OX1	164.3°	172.5°
S3	W1	S23	C23	51.8°	115.8°
S3	W1	S24	C24	86.2°	115.5°
S3	W1	OX1	HX1	180.0°	165.6°
C4	S4	W1	S23	106.4°	141.4°
C4	S4	W1	S24	44.6°	20.6°
C4	S4	W1	OX1	161.5°	124.1°
S4	C4	C5	N6	79.9°	40.8°
S4	C4	C5	C14	173.9°	163.6°
S4	C4	C5	H5	48.1°	77.6°
C5	C4	S4	W1	176.9°	130.6°
C4	C5	N6	C14	112.9°	123.2°
C4	C5	N6	H5	127.3°	118.9°
C4	C5	C14	H5	125.9°	119.7°
C4	C5	N6	C7	178.9°	84.4°
C4	C5	N6	HN6	60.6°	95.6°
C4	C5	C14	N13	173.0°	82.1°
C4	C5	C14	O2	33.6°	40.5°
C4	C5	C14	H14	77.2°	159.5°
S4	W1	S23	S24	154.0°	177.6°
S4	W1	S23	OX1	86.7°	92.5°
S4	W1	S24	OX1	149.8°	103.6°
S4	W1	S23	C23	130.3°	162.3°
S4	W1	S24	C24	40.4°	175.5°
S4	W1	OX1	HX1	123.6°	123.6°
S23	W1	S24	OX1	86.8°	94.0°
W1	S23	C23	C22	160.2°	169.6°
W1	S23	C23	C24	21.3°	13.2°
S23	W1	S24	C24	22.7°	22.1°
S23	W1	OX1	HX1	38.0°	20.6°
S24	W1	S23	C23	23.6°	20.1°
W1	S24	C24	C23	19.7°	22.0°
W1	S24	C24	C25	162.5°	157.1°
S24	W1	OX1	HX1	42.1°	63.8°
OX1	W1	S23	C23	142.9°	69.8°
OX1	W1	S24	C24	109.5°	71.9°
N6	C5	C14	H5	121.0°	118.3°
C5	N6	C7	HN6	120.5°	180.0°
C5	N6	C7	C8	142.2°	162.9°
C5	N6	C7	C12	42.6°	19.1°
N6	C5	C14	N13	59.8°	39.9°
N6	C5	C14	O2	79.6°	162.5°
N6	C5	C14	H14	169.6°	78.6°
C14	C5	N6	C7	68.2°	38.8°
C14	C5	N6	HN6	52.3°	141.2°
C5	C14	N13	C12	27.7°	25.8°
C5	C14	N13	O2	135.6°	123.4°
C5	C14	N13	H14	109.2°	119.0°
C5	C14	N13	H13	149.2°	154.2°
C5	C14	O2	H14	109.9°	119.1°
H5	C5	N6	C7	51.6°	156.7°
H5	C5	N6	HN6	172.2°	23.3°
H5	C5	C14	N13	61.1°	158.2°
H5	C5	C14	O2	159.4°	79.2°
H5	C5	C14	H14	48.6°	39.8°
N6	C7	C8	C12	175.3°	178.0°
N6	C7	C8	O8	3.1°	2.5°
N6	C7	C8	N9	175.6°	180.0°
N6	C7	C12	N11	173.4°	179.4°
N6	C7	C12	N13	1.3°	0.3°
HN6	N6	C7	C8	97.3°	17.2°
HN6	N6	C7	C12	77.9°	160.9°
C7	C8	O8	N9	172.3°	177.4°
C7	C8	N9	C10	2.2°	1.7°
C8	C7	C12	N11	2.1°	1.3°
C8	C7	C12	N13	176.9°	178.3°
C7	C8	N9	H6	177.8°	179.0°
C12	C7	C8	O8	172.2°	179.5°
C12	C7	C8	N9	0.3°	2.0°
C7	C12	N11	C10	2.8°	0.1°
C7	C12	N11	N13	174.6°	179.6°
C7	C12	N13	C14	4.6°	5.4°
C7	C12	N13	H13	116.9°	174.6°
O8	C8	N9	C10	170.2°	179.4°
O8	C8	N9	H6	9.8°	1.3°
C8	N9	C10	H6	180.0°	179.4°
C8	N9	C10	N10	176.0°	179.3°
C8	N9	C10	N11	1.7°	0.6°
N9	C10	N10	N11	174.4°	180.0°
N9	C10	N10	H101	174.4°	180.0°
N9	C10	N10	H102	5.6°	0.3°
N9	C10	N11	C12	0.9°	0.2°
C10	N10	H101	H102	179.9°	179.7°
N10	C10	N11	C12	173.7°	179.8°
N10	C10	N9	H6	4.0°	0.0°
N11	C10	N10	H101	0.0°	0.0°
N11	C10	N10	H102	180.0°	179.8°
C10	N11	C12	N13	177.3°	179.5°
N11	C10	N9	H6	178.3°	180.0°
N11	C12	N13	C14	179.3°	174.2°
N11	C12	N13	H13	57.8°	5.8°
C12	N13	C14	H13	121.5°	180.0°
C12	N13	C14	O2	107.9°	149.2°
C12	N13	C14	H14	136.9°	93.2°
N13	C14	O2	H14	114.9°	117.1°
H13	N13	C14	O2	13.6°	30.8°
H13	N13	C14	H14	101.6°	86.8°
C22	C21	O8P	H21	119.4°	120.6°
C22	C21	O8P	HC1	119.4°	120.6°
C22	C21	H21	HC1	121.8°	118.7°
C21	C22	C23	O22	118.8°	120.7°
C21	C22	C23	H22	116.1°	119.7°
C21	C22	O22	H22	124.7°	115.5°
C21	C22	C23	S23	66.6°	49.0°
C21	C22	C23	C24	115.0°	134.0°
C21	C22	O22	C34	139.6°	163.2°
C22	C21	O8P	P2	166.7°	170.6°
O8P	C21	H21	HC1	121.8°	120.0°
O8P	C21	C22	C23	175.8°	173.2°
O8P	C21	C22	O22	66.0°	48.6°
O8P	C21	C22	H22	59.8°	67.6°
C21	O8P	P2	O5P	57.4°	69.4°
C21	O8P	P2	O6P	176.4°	55.1°
C21	O8P	P2	O7P	58.4°	177.9°
H21	C21	C22	C23	56.4°	52.1°
H21	C21	C22	O22	174.6°	72.5°
H21	C21	C22	H22	59.6°	171.3°
H21	C21	O8P	P2	73.9°	68.8°
C23	C22	O22	H22	123.7°	118.4°
C22	C23	S23	C24	178.4°	177.1°
C22	C23	C24	S24	179.8°	171.7°
C22	C23	C24	C25	2.1°	9.3°
C23	C22	O22	C34	28.0°	37.1°
C23	C22	C21	HC1	64.8°	65.8°
O22	C22	C23	S23	174.5°	169.7°
O22	C22	C23	C24	3.9°	13.3°
C22	O22	C34	C25	61.8°	52.3°
C22	O22	C34	N33	178.2°	175.5°
C22	O22	C34	H34	60.0°	67.1°
O22	C22	C21	HC1	53.4°	169.6°
H22	C22	C23	S23	49.5°	70.7°
H22	C22	C23	C24	128.9°	106.3°
H22	C22	O22	C34	95.7°	81.3°
H22	C22	C21	HC1	179.3°	53.4°
S23	C23	C24	S24	1.5°	5.5°
S23	C23	C24	C25	176.3°	173.5°
C23	C24	S24	C25	177.8°	179.1°
C23	C24	C25	N26	90.4°	101.7°
C23	C24	C25	C34	25.4°	23.7°
C23	C24	C25	H25	145.0°	140.4°
S24	C24	C25	N26	91.8°	77.4°
S24	C24	C25	C34	152.5°	157.2°
S24	C24	C25	H25	32.8°	40.6°
C24	C25	N26	C34	112.7°	125.5°
C24	C25	N26	H25	124.1°	117.8°
C24	C25	C34	H25	120.1°	117.3°
C24	C25	N26	C27	164.5°	157.7°
C24	C25	N26	H26	44.2°	22.3°
C24	C25	C34	N33	173.1°	163.1°
C24	C25	C34	O22	55.8°	41.7°
C24	C25	C34	H34	67.2°	77.7°
N26	C25	C34	H25	124.1°	117.5°
C25	N26	C27	H26	120.4°	179.9°
C25	N26	C27	C28	158.1°	167.9°
C25	N26	C27	C32	17.0°	12.6°
N26	C25	C34	N33	57.4°	37.9°
N26	C25	C34	O22	59.9°	83.4°
N26	C25	C34	H34	177.1°	157.2°
C34	C25	N26	C27	51.9°	32.2°
C34	C25	N26	H26	68.4°	147.7°
C25	C34	N33	C32	26.5°	28.6°
C25	C34	N33	O22	122.6°	122.1°
C25	C34	N33	H34	118.8°	119.9°
C25	C34	N33	H33	148.1°	151.2°
C25	C34	O22	H34	121.8°	119.4°
H25	C25	N26	C27	71.3°	84.5°
H25	C25	N26	H26	168.3°	95.6°
H25	C25	C34	N33	66.8°	79.6°
H25	C25	C34	O22	175.9°	159.1°
H25	C25	C34	H34	52.9°	39.7°
N26	C27	C28	C32	175.5°	179.5°
N26	C27	C28	O28	3.8°	1.4°
N26	C27	C28	N29	178.4°	179.7°
N26	C27	C32	N31	171.6°	179.5°
N26	C27	C32	N33	16.2°	1.1°
H26	N26	C27	C28	81.5°	12.2°
H26	N26	C27	C32	103.3°	167.3°
C27	C28	O28	N29	174.4°	178.3°
C27	C28	N29	C30	8.3°	1.0°
C27	C28	N29	H29	171.7°	179.4°
C28	C27	C32	N31	3.9°	0.0°
C28	C27	C32	N33	168.3°	178.4°
C32	C27	C28	O28	171.7°	179.2°
C32	C27	C28	N29	2.9°	0.8°
C27	C32	N31	C30	5.6°	0.7°
C27	C32	N31	N33	172.2°	178.4°
C27	C32	N33	C34	9.3°	8.7°
C27	C32	N33	H33	112.3°	171.1°
O28	C28	N29	C30	166.2°	179.5°
O28	C28	N29	H29	13.8°	0.9°
C28	N29	C30	H29	180.0°	179.6°
C28	N29	C30	N30	179.1°	179.6°
C28	N29	C30	N31	6.7°	0.4°
N29	C30	N30	N31	174.1°	180.0°
N29	C30	N30	H301	174.1°	180.0°
N29	C30	N30	H302	5.9°	0.1°
N29	C30	N31	C32	0.4°	0.5°
H29	N29	C30	N30	0.9°	0.0°
H29	N29	C30	N31	173.2°	180.0°
C30	N30	H301	H302	180.0°	179.9°
N30	C30	N31	C32	173.6°	179.6°
N31	C30	N30	H301	0.0°	0.1°
N31	C30	N30	H302	180.0°	180.0°
C30	N31	C32	N33	166.6°	179.1°
N31	C32	N33	C34	178.1°	169.8°
N31	C32	N33	H33	60.3°	10.4°
C32	N33	C34	H33	121.6°	179.8°
C32	N33	C34	O22	96.1°	93.5°
C32	N33	C34	H34	145.3°	148.5°
N33	C34	O22	H34	118.2°	117.4°
H33	N33	C34	O22	25.5°	86.7°
H33	N33	C34	H34	93.1°	31.3°
O1P	P1	O2P	O3P	126.1°	118.6°
O1P	P1	O2P	O4P	114.5°	122.2°
O1P	P1	O3P	O4P	113.9°	114.2°
O1P	P1	O3P	HOP3	125.0°	179.2°
O2P	P1	O3P	O4P	121.1°	123.3°
O2P	P1	O3P	HOP3	0.0°	56.6°
O2P	P1	O1P	H3	0.0°	51.9°
O3P	P1	O1P	H3	128.4°	173.9°
O4P	P1	O3P	HOP3	121.1°	66.6°
P1	O4P	C1	HC2	22.3°	75.4°
O4P	P1	O1P	H3	117.1°	73.2°
O5P	P2	O6P	O7P	121.6°	118.9°
O5P	P2	O6P	O8P	122.0°	121.8°
O5P	P2	O7P	O8P	118.1°	114.1°
O5P	P2	O7P	HOP7	127.4°	179.9°
O6P	P2	O7P	O8P	114.6°	123.1°
O6P	P2	O7P	HOP7	0.0°	57.1°
O6P	P2	O5P	H4	0.0°	53.4°
O7P	P2	O5P	H4	123.7°	176.0°
O8P	P2	O7P	HOP7	114.5°	66.1°
P2	O8P	C21	HC1	47.3°	50.0°
O8P	P2	O5P	H4	119.5°	71.1°

Definition date:	1999-07-08
Last modified:	2026-07-31
Release status:	REL
Processing site:	RCSB
Derived from:	1B25