KGA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O31 | P3 | doub | 1.48Å | 1.53Å | |
| O21 | P2 | doub | 1.48Å | 1.52Å | |
| O12 | P1 | doub | 1.48Å | 1.53Å | |
| O22 | P2 | sing | 1.61Å | 1.50Å | |
| P3 | O33 | sing | 1.61Å | 1.52Å | |
| P3 | O32 | sing | 1.61Å | 1.53Å | |
| P3 | O3' | sing | 1.61Å | 1.60Å | |
| P2 | O6 | sing | 1.61Å | 1.62Å | |
| P2 | O7 | sing | 1.61Å | 1.63Å | |
| O6 | P1 | sing | 1.61Å | 1.64Å | |
| P1 | O5' | sing | 1.61Å | 1.61Å | |
| P1 | O11 | sing | 1.61Å | 1.55Å | |
| C5' | C4' | sing | 1.53Å | 1.52Å | |
| C5' | O5' | sing | 1.43Å | 1.44Å | |
| O3' | C3' | sing | 1.43Å | 1.41Å | |
| C3' | C4' | sing | 1.54Å | 1.54Å | |
| C3' | C2' | sing | 1.55Å | 1.53Å | |
| C4' | O4' | sing | 1.44Å | 1.44Å | |
| O7 | CPB | sing | 1.43Å | 1.43Å | |
| CPB | CPA | sing | 1.53Å | 1.52Å | |
| C2' | O2' | sing | 1.43Å | 1.46Å | |
| C2' | C1' | sing | 1.55Å | 1.54Å | |
| O4' | C1' | sing | 1.44Å | 1.45Å | |
| C1' | N9 | sing | 1.47Å | 1.48Å | |
| OP3 | CP7 | sing | 1.43Å | 1.43Å | |
| CPA | CP9 | sing | 1.53Å | 1.53Å | |
| CPA | CP7 | sing | 1.53Å | 1.53Å | |
| CPA | CP8 | sing | 1.53Å | 1.54Å | |
| CP7 | CP6 | sing | 1.51Å | 1.50Å | |
| N9 | C8 | sing | 1.36Å | 1.34Å | Aromatic |
| N9 | C4 | sing | 1.37Å | 1.33Å | Aromatic |
| C8 | N7 | doub | 1.30Å | 1.37Å | Aromatic |
| CP6 | OP2 | doub | 1.21Å | 1.19Å | |
| CP6 | NP2 | sing | 1.35Å | 1.31Å | |
| C4 | N3 | doub | 1.33Å | 1.36Å | Aromatic |
| C4 | C5 | sing | 1.41Å | 1.47Å | Aromatic |
| NP2 | CP5 | sing | 1.47Å | 1.45Å | |
| N7 | C5 | sing | 1.35Å | 1.34Å | Aromatic |
| N3 | C2 | sing | 1.32Å | 1.35Å | Aromatic |
| C5 | C6 | doub | 1.40Å | 1.47Å | Aromatic |
| CP5 | CP4 | sing | 1.53Å | 1.52Å | |
| C2 | N1 | doub | 1.32Å | 1.35Å | Aromatic |
| C6 | N1 | sing | 1.33Å | 1.34Å | Aromatic |
| C6 | N6 | sing | 1.38Å | 1.33Å | |
| CP4 | CP3 | sing | 1.51Å | 1.50Å | |
| CP3 | OP1 | doub | 1.21Å | 1.21Å | |
| CP3 | NP1 | sing | 1.35Å | 1.33Å | |
| NP1 | CP2 | sing | 1.47Å | 1.47Å | |
| CP2 | CP1 | sing | 1.53Å | 1.53Å | |
| CP1 | O | sing | 1.43Å | 1.44Å | |
| O | CS1 | sing | 1.36Å | 1.51Å | |
| OS1 | CS1 | doub | 1.33Å | 1.25Å | |
| CS1 | CS2 | sing | 1.34Å | 1.52Å | |
| OS4 | NS4 | sing | 1.22Å | 1.27Å | |
| CS2 | NS4 | doub | 1.47Å | 1.25Å | |
| CS2 | CS3 | sing | 1.51Å | 1.52Å | |
| NS4 | OS5 | sing | 1.22Å | 1.26Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| N6 | H2 | sing | 0.97Å | 1.00Å | |
| N6 | H3 | sing | 0.97Å | 1.00Å | |
| C8 | H4 | sing | 1.08Å | 1.08Å | |
| C1' | H5 | sing | 1.09Å | 1.10Å | |
| C2' | H6 | sing | 1.09Å | 1.10Å | |
| O2' | H7 | sing | 0.97Å | 0.95Å | |
| C3' | H8 | sing | 1.09Å | 1.10Å | |
| C4' | H9 | sing | 1.09Å | 1.10Å | |
| C5' | H10 | sing | 1.09Å | 1.10Å | |
| C5' | H11 | sing | 1.09Å | 1.10Å | |
| O33 | H12 | sing | 0.97Å | 0.95Å | |
| O32 | H13 | sing | 0.97Å | 0.95Å | |
| O11 | H14 | sing | 0.97Å | 0.95Å | |
| O22 | H15 | sing | 0.97Å | 0.95Å | |
| CPB | H16 | sing | 1.09Å | 1.10Å | |
| CPB | H17 | sing | 1.09Å | 1.10Å | |
| CP9 | H18 | sing | 1.09Å | 1.10Å | |
| CP9 | H19 | sing | 1.09Å | 1.10Å | |
| CP9 | H20 | sing | 1.09Å | 1.10Å | |
| CP8 | H21 | sing | 1.09Å | 1.10Å | |
| CP8 | H22 | sing | 1.09Å | 1.10Å | |
| CP8 | H23 | sing | 1.09Å | 1.10Å | |
| CP7 | H24 | sing | 1.09Å | 1.10Å | |
| OP3 | H25 | sing | 0.97Å | 0.95Å | |
| NP2 | H26 | sing | 0.97Å | 1.00Å | |
| CP5 | H27 | sing | 1.09Å | 1.10Å | |
| CP5 | H28 | sing | 1.09Å | 1.10Å | |
| CP4 | H29 | sing | 1.09Å | 1.10Å | |
| CP4 | H30 | sing | 1.09Å | 1.10Å | |
| NP1 | H31 | sing | 0.97Å | 1.00Å | |
| CP2 | H32 | sing | 1.09Å | 1.10Å | |
| CP2 | H33 | sing | 1.09Å | 1.10Å | |
| CP1 | H34 | sing | 1.09Å | 1.10Å | |
| CP1 | H35 | sing | 1.09Å | 1.10Å | |
| CS3 | H37 | sing | 1.09Å | 1.10Å | |
| CS3 | H38 | sing | 1.09Å | 1.10Å | |
| CS3 | H39 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O31 | P3 | O33 | 112.7° | 109.4° |
| O31 | P3 | O32 | 114.1° | 109.5° |
| O31 | P3 | O3' | 107.1° | 109.5° |
| O21 | P2 | O22 | 109.6° | 109.5° |
| O21 | P2 | O6 | 109.1° | 109.4° |
| O21 | P2 | O7 | 108.4° | 109.5° |
| O12 | P1 | O6 | 105.9° | 109.5° |
| O12 | P1 | O5' | 104.1° | 109.4° |
| O12 | P1 | O11 | 116.7° | 109.5° |
| O22 | P2 | O6 | 108.2° | 109.5° |
| O22 | P2 | O7 | 108.0° | 109.5° |
| P2 | O22 | H15 | 109.5° | 114.0° |
| O33 | P3 | O32 | 114.5° | 109.5° |
| O33 | P3 | O3' | 101.8° | 109.4° |
| P3 | O33 | H12 | 109.5° | 114.0° |
| O32 | P3 | O3' | 105.3° | 109.5° |
| P3 | O32 | H13 | 109.5° | 114.0° |
| P3 | O3' | C3' | 121.1° | 123.0° |
| O6 | P2 | O7 | 113.4° | 109.5° |
| P2 | O6 | P1 | 125.1° | 134.0° |
| P2 | O7 | CPB | 117.1° | 123.0° |
| O6 | P1 | O5' | 105.5° | 109.5° |
| O6 | P1 | O11 | 112.0° | 109.5° |
| O5' | P1 | O11 | 111.6° | 109.5° |
| P1 | O5' | C5' | 126.1° | 123.0° |
| P1 | O11 | H14 | 109.5° | 114.0° |
| C4' | C5' | O5' | 100.9° | 109.4° |
| C5' | C4' | C3' | 110.7° | 109.9° |
| C5' | C4' | O4' | 111.7° | 110.0° |
| C5' | C4' | H9 | 109.8° | 110.0° |
| C4' | C5' | H10 | 111.6° | 109.5° |
| C4' | C5' | H11 | 111.6° | 109.4° |
| O5' | C5' | H10 | 111.5° | 109.5° |
| O5' | C5' | H11 | 111.6° | 109.5° |
| O3' | C3' | C4' | 105.5° | 110.5° |
| O3' | C3' | C2' | 108.9° | 110.6° |
| O3' | C3' | H8 | 112.5° | 110.5° |
| C4' | C3' | C2' | 108.7° | 104.2° |
| C3' | C4' | O4' | 104.2° | 107.3° |
| C4' | C3' | H8 | 110.5° | 110.4° |
| C3' | C4' | H9 | 109.5° | 109.8° |
| C3' | C2' | O2' | 117.0° | 110.9° |
| C3' | C2' | C1' | 97.5° | 102.1° |
| C3' | C2' | H6 | 108.6° | 110.9° |
| C2' | C3' | H8 | 110.6° | 110.4° |
| C4' | O4' | C1' | 109.6° | 106.9° |
| O4' | C4' | H9 | 110.8° | 109.8° |
| O7 | CPB | CPA | 105.8° | 109.4° |
| O7 | CPB | H16 | 110.4° | 109.5° |
| O7 | CPB | H17 | 110.4° | 109.4° |
| CPB | CPA | CP9 | 108.4° | 109.5° |
| CPB | CPA | CP7 | 109.3° | 109.4° |
| CPB | CPA | CP8 | 109.5° | 109.5° |
| CPA | CPB | H16 | 110.4° | 109.5° |
| CPA | CPB | H17 | 110.4° | 109.5° |
| O2' | C2' | C1' | 114.7° | 110.9° |
| O2' | C2' | H6 | 109.6° | 110.8° |
| C2' | O2' | H7 | 109.5° | 114.0° |
| C2' | C1' | O4' | 109.4° | 103.6° |
| C2' | C1' | N9 | 111.6° | 110.6° |
| C2' | C1' | H5 | 107.7° | 110.7° |
| C1' | C2' | H6 | 108.6° | 110.9° |
| O4' | C1' | N9 | 110.9° | 110.6° |
| O4' | C1' | H5 | 108.8° | 110.7° |
| C1' | N9 | C8 | 127.3° | 126.3° |
| C1' | N9 | C4 | 124.0° | 126.3° |
| N9 | C1' | H5 | 108.4° | 110.5° |
| OP3 | CP7 | CPA | 109.6° | 109.5° |
| OP3 | CP7 | CP6 | 107.5° | 109.5° |
| OP3 | CP7 | H24 | 110.7° | 109.5° |
| CP7 | OP3 | H25 | 109.5° | 114.0° |
| CP9 | CPA | CP7 | 109.8° | 109.5° |
| CP9 | CPA | CP8 | 109.9° | 109.5° |
| CPA | CP9 | H18 | 109.5° | 109.4° |
| CPA | CP9 | H19 | 109.5° | 109.5° |
| CPA | CP9 | H20 | 109.5° | 109.5° |
| CP7 | CPA | CP8 | 110.0° | 109.5° |
| CPA | CP7 | CP6 | 110.1° | 109.5° |
| CPA | CP7 | H24 | 109.3° | 109.5° |
| CPA | CP8 | H21 | 109.5° | 109.5° |
| CPA | CP8 | H22 | 109.5° | 109.5° |
| CPA | CP8 | H23 | 109.4° | 109.5° |
| CP7 | CP6 | OP2 | 121.0° | 120.0° |
| CP7 | CP6 | NP2 | 118.5° | 120.0° |
| CP6 | CP7 | H24 | 109.7° | 109.4° |
| C8 | N9 | C4 | 108.7° | 107.4° |
| N9 | C8 | N7 | 111.1° | 110.0° |
| N9 | C8 | H4 | 124.4° | 125.0° |
| N9 | C4 | N3 | 134.2° | 134.9° |
| N9 | C4 | C5 | 106.4° | 106.0° |
| C8 | N7 | C5 | 107.0° | 109.4° |
| N7 | C8 | H4 | 124.5° | 125.0° |
| OP2 | CP6 | NP2 | 120.4° | 120.0° |
| CP6 | NP2 | CP5 | 120.2° | 120.0° |
| CP6 | NP2 | H26 | 119.9° | 120.0° |
| N3 | C4 | C5 | 119.5° | 119.1° |
| C4 | N3 | C2 | 119.8° | 120.6° |
| C4 | C5 | N7 | 106.8° | 107.2° |
| C4 | C5 | C6 | 116.9° | 118.1° |
| NP2 | CP5 | CP4 | 111.3° | 109.4° |
| CP5 | NP2 | H26 | 119.9° | 120.0° |
| NP2 | CP5 | H27 | 109.0° | 109.5° |
| NP2 | CP5 | H28 | 109.0° | 109.4° |
| N7 | C5 | C6 | 136.3° | 134.7° |
| N3 | C2 | N1 | 124.0° | 122.4° |
| N3 | C2 | H1 | 118.0° | 118.8° |
| C5 | C6 | N1 | 118.2° | 118.5° |
| C5 | C6 | N6 | 122.2° | 120.8° |
| CP5 | CP4 | CP3 | 106.6° | 109.4° |
| CP4 | CP5 | H27 | 109.0° | 109.5° |
| CP4 | CP5 | H28 | 109.0° | 109.5° |
| CP5 | CP4 | H29 | 110.2° | 109.5° |
| CP5 | CP4 | H30 | 110.2° | 109.5° |
| C2 | N1 | C6 | 121.6° | 121.2° |
| N1 | C2 | H1 | 118.0° | 118.8° |
| N1 | C6 | N6 | 119.7° | 120.8° |
| C6 | N6 | H2 | 109.5° | 120.0° |
| C6 | N6 | H3 | 109.5° | 120.0° |
| CP4 | CP3 | OP1 | 118.2° | 120.0° |
| CP4 | CP3 | NP1 | 118.8° | 120.0° |
| CP3 | CP4 | H29 | 110.2° | 109.5° |
| CP3 | CP4 | H30 | 110.2° | 109.5° |
| OP1 | CP3 | NP1 | 123.0° | 120.0° |
| CP3 | NP1 | CP2 | 122.7° | 120.0° |
| CP3 | NP1 | H31 | 118.6° | 120.1° |
| NP1 | CP2 | CP1 | 112.6° | 109.5° |
| CP2 | NP1 | H31 | 118.7° | 119.9° |
| NP1 | CP2 | H32 | 108.7° | 109.4° |
| NP1 | CP2 | H33 | 108.7° | 109.5° |
| CP2 | CP1 | O | 111.8° | 109.4° |
| CP1 | CP2 | H32 | 108.7° | 109.5° |
| CP1 | CP2 | H33 | 108.7° | 109.5° |
| CP2 | CP1 | H34 | 108.9° | 109.4° |
| CP2 | CP1 | H35 | 108.9° | 109.5° |
| CP1 | O | CS1 | 129.7° | 117.0° |
| O | CP1 | H34 | 108.9° | 109.5° |
| O | CP1 | H35 | 108.9° | 109.5° |
| O | CS1 | OS1 | 124.9° | 120.0° |
| O | CS1 | CS2 | 117.0° | 120.0° |
| OS1 | CS1 | CS2 | 118.1° | 120.0° |
| CS1 | CS2 | NS4 | 118.8° | 120.0° |
| CS1 | CS2 | CS3 | 125.8° | 120.0° |
| OS4 | NS4 | CS2 | 119.7° | 120.0° |
| OS4 | NS4 | OS5 | 124.9° | 120.0° |
| NS4 | CS2 | CS3 | 115.4° | 120.0° |
| CS2 | NS4 | OS5 | 115.4° | 120.0° |
| CS2 | CS3 | H37 | 109.5° | 109.5° |
| CS2 | CS3 | H38 | 109.5° | 109.5° |
| CS2 | CS3 | H39 | 109.5° | 109.5° |
| H2 | N6 | H3 | 109.5° | 120.0° |
| H10 | C5' | H11 | 109.5° | 109.5° |
| H16 | CPB | H17 | 109.5° | 109.5° |
| H18 | CP9 | H19 | 109.5° | 109.5° |
| H18 | CP9 | H20 | 109.4° | 109.4° |
| H19 | CP9 | H20 | 109.5° | 109.5° |
| H21 | CP8 | H22 | 109.5° | 109.4° |
| H21 | CP8 | H23 | 109.5° | 109.5° |
| H22 | CP8 | H23 | 109.5° | 109.5° |
| H27 | CP5 | H28 | 109.5° | 109.5° |
| H29 | CP4 | H30 | 109.5° | 109.5° |
| H32 | CP2 | H33 | 109.5° | 109.5° |
| H34 | CP1 | H35 | 109.5° | 109.5° |
| H37 | CS3 | H38 | 109.5° | 109.5° |
| H37 | CS3 | H39 | 109.5° | 109.5° |
| H38 | CS3 | H39 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O31 | P3 | O33 | O32 | 132.6° | 120.0° |
| O31 | P3 | O33 | O3' | 114.4° | 120.0° |
| O31 | P3 | O32 | O3' | 117.1° | 120.0° |
| O31 | P3 | O3' | C3' | 62.5° | 55.0° |
| O31 | P3 | O33 | H12 | 0.0° | 60.1° |
| O31 | P3 | O32 | H13 | 0.0° | 180.0° |
| O21 | P2 | O22 | O6 | 118.9° | 120.0° |
| O21 | P2 | O22 | O7 | 118.0° | 120.1° |
| O21 | P2 | O6 | O7 | 120.9° | 120.0° |
| O21 | P2 | O6 | P1 | 64.0° | 45.0° |
| O21 | P2 | O7 | CPB | 160.9° | 55.1° |
| O21 | P2 | O22 | H15 | 0.0° | 180.0° |
| O12 | P1 | O6 | P2 | 102.6° | 45.0° |
| O12 | P1 | O6 | O5' | 110.1° | 120.0° |
| O12 | P1 | O6 | O11 | 128.2° | 120.1° |
| O12 | P1 | O5' | O11 | 126.7° | 120.0° |
| O12 | P1 | O5' | C5' | 51.3° | 55.0° |
| O12 | P1 | O11 | H14 | 0.0° | 180.0° |
| O22 | P2 | O6 | O7 | 119.8° | 120.0° |
| O22 | P2 | O6 | P1 | 176.8° | 75.0° |
| O22 | P2 | O7 | CPB | 42.2° | 65.0° |
| O33 | P3 | O32 | O3' | 110.9° | 120.0° |
| O33 | P3 | O3' | C3' | 179.0° | 175.0° |
| O33 | P3 | O32 | H13 | 132.0° | 60.0° |
| O32 | P3 | O3' | C3' | 59.2° | 65.0° |
| O32 | P3 | O33 | H12 | 132.6° | 59.9° |
| P3 | O3' | C3' | C4' | 123.3° | 120.0° |
| P3 | O3' | C3' | C2' | 120.2° | 125.1° |
| P3 | O3' | C3' | H8 | 2.8° | 2.6° |
| O3' | P3 | O33 | H12 | 114.4° | 179.9° |
| O3' | P3 | O32 | H13 | 117.1° | 60.0° |
| P2 | O6 | P1 | O5' | 147.3° | 165.0° |
| P2 | O6 | P1 | O11 | 25.6° | 75.0° |
| O6 | P2 | O7 | CPB | 77.8° | 175.0° |
| O6 | P2 | O22 | H15 | 118.9° | 60.0° |
| O7 | P2 | O6 | P1 | 57.0° | 165.0° |
| P2 | O7 | CPB | CPA | 162.9° | 180.0° |
| O7 | P2 | O22 | H15 | 118.0° | 60.0° |
| P2 | O7 | CPB | H16 | 43.5° | 60.0° |
| P2 | O7 | CPB | H17 | 77.6° | 60.0° |
| O6 | P1 | O5' | O11 | 122.0° | 120.0° |
| O6 | P1 | O5' | C5' | 60.1° | 175.0° |
| O6 | P1 | O11 | H14 | 122.3° | 60.0° |
| P1 | O5' | C5' | C4' | 139.7° | 180.0° |
| P1 | O5' | C5' | H10 | 101.7° | 60.0° |
| P1 | O5' | C5' | H11 | 21.1° | 60.0° |
| O5' | P1 | O11 | H14 | 119.6° | 60.0° |
| O11 | P1 | O5' | C5' | 178.0° | 65.0° |
| C4' | C5' | O5' | H10 | 118.6° | 120.0° |
| C4' | C5' | O5' | H11 | 118.6° | 119.9° |
| C5' | C4' | C3' | O3' | 143.7° | 119.7° |
| C5' | C4' | C3' | O4' | 120.2° | 119.6° |
| C5' | C4' | C3' | H9 | 121.2° | 121.1° |
| C5' | C4' | C3' | C2' | 99.7° | 121.5° |
| C5' | C4' | O4' | H9 | 122.8° | 121.1° |
| C5' | C4' | O4' | C1' | 119.7° | 145.8° |
| C5' | C4' | C3' | H8 | 21.8° | 2.9° |
| C4' | C5' | H10 | H11 | 124.0° | 120.0° |
| O5' | C5' | C4' | C3' | 48.5° | 175.0° |
| O5' | C5' | C4' | O4' | 67.1° | 67.0° |
| O5' | C5' | C4' | H9 | 169.5° | 54.0° |
| O5' | C5' | H10 | H11 | 124.0° | 120.0° |
| O3' | C3' | C4' | C2' | 116.6° | 118.8° |
| O3' | C3' | C4' | H8 | 121.8° | 122.6° |
| O3' | C3' | C2' | H8 | 124.1° | 122.6° |
| O3' | C3' | C4' | O4' | 96.1° | 120.7° |
| O3' | C3' | C2' | O2' | 38.8° | 20.3° |
| O3' | C3' | C2' | C1' | 83.9° | 97.8° |
| O3' | C3' | C2' | H6 | 163.5° | 144.0° |
| O3' | C3' | C4' | H9 | 22.5° | 1.4° |
| C4' | C3' | C2' | H8 | 121.5° | 118.6° |
| C3' | C4' | O4' | H9 | 117.7° | 119.4° |
| C4' | C3' | C2' | O2' | 153.2° | 139.1° |
| C4' | C3' | C2' | C1' | 30.5° | 20.9° |
| C3' | C4' | O4' | C1' | 0.1° | 26.3° |
| C4' | C3' | C2' | H6 | 82.0° | 97.3° |
| C3' | C4' | C5' | H10 | 167.1° | 55.0° |
| C3' | C4' | C5' | H11 | 70.1° | 65.0° |
| C2' | C3' | C4' | O4' | 20.5° | 1.9° |
| C3' | C2' | O2' | C1' | 113.4° | 112.7° |
| C3' | C2' | O2' | H6 | 124.3° | 123.7° |
| C3' | C2' | C1' | H6 | 112.6° | 118.2° |
| C3' | C2' | C1' | O4' | 30.9° | 37.0° |
| C3' | C2' | C1' | N9 | 154.0° | 155.5° |
| C3' | C2' | C1' | H5 | 87.2° | 81.7° |
| C3' | C2' | O2' | H7 | 180.0° | 174.1° |
| C2' | C3' | C4' | H9 | 139.1° | 117.4° |
| C4' | O4' | C1' | C2' | 20.7° | 39.9° |
| C4' | O4' | C1' | N9 | 144.1° | 158.4° |
| C4' | O4' | C1' | H5 | 96.7° | 78.7° |
| O4' | C4' | C3' | H8 | 142.1° | 116.7° |
| O4' | C4' | C5' | H10 | 51.5° | 172.9° |
| O4' | C4' | C5' | H11 | 174.3° | 52.9° |
| O7 | CPB | CPA | H16 | 119.4° | 120.0° |
| O7 | CPB | CPA | H17 | 119.4° | 119.9° |
| O7 | CPB | CPA | CP9 | 74.8° | 60.0° |
| O7 | CPB | CPA | CP7 | 44.8° | 180.0° |
| O7 | CPB | CPA | CP8 | 165.4° | 60.0° |
| O7 | CPB | H16 | H17 | 121.7° | 120.0° |
| CPB | CPA | CP7 | OP3 | 46.3° | 65.7° |
| CPB | CPA | CP9 | CP7 | 119.3° | 120.0° |
| CPB | CPA | CP9 | CP8 | 119.6° | 120.0° |
| CPB | CPA | CP7 | CP8 | 120.3° | 120.0° |
| CPB | CPA | CP7 | CP6 | 164.3° | 54.3° |
| CPA | CPB | H16 | H17 | 121.7° | 120.1° |
| CPB | CPA | CP9 | H18 | 180.0° | 66.4° |
| CPB | CPA | CP9 | H19 | 60.0° | 173.6° |
| CPB | CPA | CP9 | H20 | 60.0° | 53.5° |
| CPB | CPA | CP8 | H21 | 180.0° | 63.4° |
| CPB | CPA | CP8 | H22 | 60.0° | 176.6° |
| CPB | CPA | CP8 | H23 | 60.0° | 56.7° |
| CPB | CPA | CP7 | H24 | 75.2° | 174.3° |
| O2' | C2' | C1' | H6 | 123.0° | 123.6° |
| O2' | C2' | C1' | O4' | 155.3° | 155.2° |
| O2' | C2' | C1' | N9 | 81.6° | 86.3° |
| O2' | C2' | C1' | H5 | 37.2° | 36.5° |
| O2' | C2' | C3' | H8 | 85.3° | 102.3° |
| C2' | C1' | O4' | N9 | 123.5° | 118.6° |
| C2' | C1' | O4' | H5 | 117.4° | 118.6° |
| C2' | C1' | N9 | H5 | 118.4° | 122.9° |
| C2' | C1' | N9 | C8 | 68.1° | 92.8° |
| C2' | C1' | N9 | C4 | 110.0° | 87.1° |
| C1' | C2' | O2' | H7 | 66.6° | 61.4° |
| C1' | C2' | C3' | H8 | 152.0° | 139.5° |
| O4' | C1' | N9 | H5 | 119.4° | 122.9° |
| O4' | C1' | N9 | C8 | 54.1° | 21.4° |
| O4' | C1' | N9 | C4 | 127.8° | 158.7° |
| O4' | C1' | C2' | H6 | 81.7° | 81.2° |
| C1' | O4' | C4' | H9 | 117.6° | 93.1° |
| C1' | N9 | C8 | C4 | 178.3° | 179.9° |
| C1' | N9 | C8 | N7 | 178.5° | 179.9° |
| C1' | N9 | C4 | N3 | 1.0° | 0.1° |
| C1' | N9 | C4 | C5 | 178.6° | 180.0° |
| C1' | N9 | C8 | H4 | 1.5° | 0.1° |
| N9 | C1' | C2' | H6 | 41.4° | 37.3° |
| OP3 | CP7 | CPA | CP9 | 165.0° | 174.2° |
| OP3 | CP7 | CPA | CP6 | 118.0° | 120.0° |
| OP3 | CP7 | CPA | H24 | 121.5° | 120.0° |
| OP3 | CP7 | CPA | CP8 | 74.0° | 54.3° |
| OP3 | CP7 | CP6 | H24 | 120.5° | 120.0° |
| OP3 | CP7 | CP6 | OP2 | 169.8° | 8.2° |
| OP3 | CP7 | CP6 | NP2 | 12.7° | 171.9° |
| CP9 | CPA | CP7 | CP8 | 121.0° | 120.0° |
| CP9 | CPA | CP7 | CP6 | 77.0° | 65.7° |
| CP9 | CPA | CPB | H16 | 165.8° | 180.0° |
| CP9 | CPA | CPB | H17 | 44.7° | 60.0° |
| CPA | CP9 | H18 | H19 | 120.0° | 120.0° |
| CPA | CP9 | H18 | H20 | 120.0° | 119.9° |
| CPA | CP9 | H19 | H20 | 120.0° | 120.0° |
| CP9 | CPA | CP8 | H21 | 61.0° | 176.5° |
| CP9 | CPA | CP8 | H22 | 178.9° | 56.6° |
| CP9 | CPA | CP8 | H23 | 58.9° | 63.4° |
| CP9 | CPA | CP7 | H24 | 43.5° | 54.2° |
| CPA | CP7 | CP6 | H24 | 120.2° | 120.0° |
| CPA | CP7 | CP6 | OP2 | 70.9° | 111.8° |
| CPA | CP7 | CP6 | NP2 | 106.6° | 68.1° |
| CP7 | CPA | CPB | H16 | 74.6° | 60.0° |
| CP7 | CPA | CPB | H17 | 164.2° | 60.0° |
| CP7 | CPA | CP9 | H18 | 60.7° | 173.6° |
| CP7 | CPA | CP9 | H19 | 179.3° | 53.6° |
| CP7 | CPA | CP9 | H20 | 59.3° | 66.5° |
| CP7 | CPA | CP8 | H21 | 59.9° | 56.6° |
| CP7 | CPA | CP8 | H22 | 60.1° | 63.4° |
| CP7 | CPA | CP8 | H23 | 179.9° | 176.6° |
| CPA | CP7 | OP3 | H25 | 180.0° | 60.0° |
| CP8 | CPA | CP7 | CP6 | 44.0° | 174.3° |
| CP8 | CPA | CPB | H16 | 45.9° | 60.0° |
| CP8 | CPA | CPB | H17 | 75.2° | 180.0° |
| CP8 | CPA | CP9 | H18 | 60.4° | 53.6° |
| CP8 | CPA | CP9 | H19 | 59.6° | 66.4° |
| CP8 | CPA | CP9 | H20 | 179.6° | 173.5° |
| CPA | CP8 | H21 | H22 | 120.0° | 120.0° |
| CPA | CP8 | H21 | H23 | 120.0° | 120.0° |
| CPA | CP8 | H22 | H23 | 120.0° | 120.0° |
| CP8 | CPA | CP7 | H24 | 164.5° | 65.7° |
| CP7 | CP6 | OP2 | NP2 | 177.5° | 179.9° |
| CP7 | CP6 | NP2 | CP5 | 177.4° | 175.6° |
| CP6 | CP7 | OP3 | H25 | 60.4° | 60.0° |
| CP7 | CP6 | NP2 | H26 | 2.6° | 4.5° |
| N9 | C8 | N7 | H4 | 180.0° | 180.0° |
| C8 | N9 | C4 | N3 | 179.4° | 180.0° |
| C8 | N9 | C4 | C5 | 0.2° | 0.1° |
| N9 | C8 | N7 | C5 | 0.2° | 0.0° |
| C8 | N9 | C1' | H5 | 173.5° | 144.3° |
| C4 | N9 | C8 | N7 | 0.2° | 0.0° |
| N9 | C4 | N3 | C5 | 179.5° | 179.9° |
| N9 | C4 | C5 | N7 | 0.1° | 0.1° |
| N9 | C4 | N3 | C2 | 179.3° | 180.0° |
| N9 | C4 | C5 | C6 | 178.6° | 180.0° |
| C4 | N9 | C8 | H4 | 179.8° | 180.0° |
| C4 | N9 | C1' | H5 | 8.4° | 35.8° |
| C8 | N7 | C5 | C4 | 0.1° | 0.0° |
| C8 | N7 | C5 | C6 | 178.3° | 180.0° |
| OP2 | CP6 | NP2 | CP5 | 0.1° | 4.3° |
| OP2 | CP6 | CP7 | H24 | 49.3° | 128.2° |
| OP2 | CP6 | NP2 | H26 | 179.9° | 175.6° |
| CP6 | NP2 | CP5 | H26 | 180.0° | 179.9° |
| CP6 | NP2 | CP5 | CP4 | 62.3° | 179.9° |
| NP2 | CP6 | CP7 | H24 | 133.2° | 51.9° |
| CP6 | NP2 | CP5 | H27 | 58.0° | 59.9° |
| CP6 | NP2 | CP5 | H28 | 177.5° | 60.1° |
| N3 | C4 | C5 | N7 | 179.6° | 180.0° |
| N3 | C4 | C5 | C6 | 1.8° | 0.1° |
| C4 | N3 | C2 | N1 | 1.5° | 0.1° |
| C4 | N3 | C2 | H1 | 178.5° | 180.0° |
| C4 | C5 | N7 | C6 | 178.3° | 179.9° |
| C5 | C4 | N3 | C2 | 0.2° | 0.1° |
| C4 | C5 | C6 | N1 | 2.6° | 0.1° |
| C4 | C5 | C6 | N6 | 178.0° | 180.0° |
| NP2 | CP5 | CP4 | H27 | 120.3° | 120.0° |
| NP2 | CP5 | CP4 | H28 | 120.3° | 119.9° |
| NP2 | CP5 | CP4 | CP3 | 177.0° | 180.0° |
| NP2 | CP5 | H27 | H28 | 119.2° | 120.0° |
| NP2 | CP5 | CP4 | H29 | 63.5° | 60.0° |
| NP2 | CP5 | CP4 | H30 | 57.4° | 60.0° |
| N7 | C5 | C6 | N1 | 179.3° | 180.0° |
| N7 | C5 | C6 | N6 | 0.1° | 0.0° |
| C5 | N7 | C8 | H4 | 179.8° | 180.0° |
| N3 | C2 | N1 | H1 | 180.0° | 179.9° |
| N3 | C2 | N1 | C6 | 0.6° | 0.1° |
| C5 | C6 | N1 | C2 | 1.5° | 0.1° |
| C5 | C6 | N1 | N6 | 179.4° | 180.0° |
| C5 | C6 | N6 | H2 | 179.3° | 0.0° |
| C5 | C6 | N6 | H3 | 60.6° | 179.9° |
| CP5 | CP4 | CP3 | H29 | 119.5° | 120.0° |
| CP5 | CP4 | CP3 | H30 | 119.5° | 120.0° |
| CP5 | CP4 | CP3 | OP1 | 84.4° | 0.0° |
| CP5 | CP4 | CP3 | NP1 | 97.8° | 180.0° |
| CP4 | CP5 | NP2 | H26 | 117.7° | 0.1° |
| CP4 | CP5 | H27 | H28 | 119.2° | 120.0° |
| CP5 | CP4 | H29 | H30 | 121.3° | 120.0° |
| C2 | N1 | C6 | N6 | 179.1° | 179.9° |
| C6 | N1 | C2 | H1 | 179.4° | 180.0° |
| N1 | C6 | N6 | H2 | 0.0° | 180.0° |
| N1 | C6 | N6 | H3 | 120.0° | 0.0° |
| C6 | N6 | H2 | H3 | 120.0° | 180.0° |
| CP4 | CP3 | OP1 | NP1 | 177.6° | 180.0° |
| CP4 | CP3 | NP1 | CP2 | 176.0° | 180.0° |
| CP3 | CP4 | CP5 | H27 | 56.7° | 60.0° |
| CP3 | CP4 | CP5 | H28 | 62.8° | 60.0° |
| CP3 | CP4 | H29 | H30 | 121.3° | 120.0° |
| CP4 | CP3 | NP1 | H31 | 4.1° | 0.0° |
| OP1 | CP3 | NP1 | CP2 | 1.7° | 0.0° |
| OP1 | CP3 | CP4 | H29 | 156.0° | 119.9° |
| OP1 | CP3 | CP4 | H30 | 35.1° | 120.1° |
| OP1 | CP3 | NP1 | H31 | 178.3° | 180.0° |
| CP3 | NP1 | CP2 | H31 | 180.0° | 180.0° |
| CP3 | NP1 | CP2 | CP1 | 104.2° | 180.0° |
| NP1 | CP3 | CP4 | H29 | 21.7° | 60.0° |
| NP1 | CP3 | CP4 | H30 | 142.6° | 60.0° |
| CP3 | NP1 | CP2 | H32 | 135.3° | 60.0° |
| CP3 | NP1 | CP2 | H33 | 16.2° | 60.0° |
| NP1 | CP2 | CP1 | H32 | 120.5° | 120.0° |
| NP1 | CP2 | CP1 | H33 | 120.4° | 120.1° |
| NP1 | CP2 | CP1 | O | 174.5° | 65.0° |
| NP1 | CP2 | H32 | H33 | 118.6° | 120.0° |
| NP1 | CP2 | CP1 | H34 | 65.1° | 175.0° |
| NP1 | CP2 | CP1 | H35 | 54.2° | 55.0° |
| CP2 | CP1 | O | H34 | 120.4° | 119.9° |
| CP2 | CP1 | O | H35 | 120.3° | 120.0° |
| CP2 | CP1 | O | CS1 | 69.5° | 180.0° |
| CP1 | CP2 | NP1 | H31 | 75.8° | 0.0° |
| CP1 | CP2 | H32 | H33 | 118.6° | 120.0° |
| CP2 | CP1 | H34 | H35 | 118.9° | 120.0° |
| CP1 | O | CS1 | OS1 | 18.3° | 0.1° |
| CP1 | O | CS1 | CS2 | 161.3° | 180.0° |
| O | CP1 | CP2 | H32 | 54.1° | 55.0° |
| O | CP1 | CP2 | H33 | 65.0° | 174.9° |
| O | CP1 | H34 | H35 | 119.0° | 120.0° |
| O | CS1 | OS1 | CS2 | 179.6° | 180.0° |
| O | CS1 | CS2 | NS4 | 25.4° | 0.0° |
| O | CS1 | CS2 | CS3 | 154.8° | 180.0° |
| CS1 | O | CP1 | H34 | 170.1° | 60.1° |
| CS1 | O | CP1 | H35 | 50.8° | 60.0° |
| OS1 | CS1 | CS2 | NS4 | 155.1° | 179.9° |
| OS1 | CS1 | CS2 | CS3 | 24.8° | 0.0° |
| CS1 | CS2 | NS4 | OS4 | 46.7° | 180.0° |
| CS1 | CS2 | NS4 | CS3 | 179.9° | 180.0° |
| CS1 | CS2 | NS4 | OS5 | 132.2° | 0.0° |
| CS1 | CS2 | CS3 | H37 | 180.0° | 90.0° |
| CS1 | CS2 | CS3 | H38 | 60.0° | 150.0° |
| CS1 | CS2 | CS3 | H39 | 60.0° | 30.0° |
| OS4 | NS4 | CS2 | OS5 | 178.9° | 180.0° |
| OS4 | NS4 | CS2 | CS3 | 133.4° | 0.1° |
| NS4 | CS2 | CS3 | H37 | 0.2° | 90.0° |
| NS4 | CS2 | CS3 | H38 | 119.8° | 30.0° |
| NS4 | CS2 | CS3 | H39 | 120.2° | 150.0° |
| CS3 | CS2 | NS4 | OS5 | 47.6° | 180.0° |
| CS2 | CS3 | H37 | H38 | 120.0° | 120.0° |
| CS2 | CS3 | H37 | H39 | 120.0° | 120.0° |
| CS2 | CS3 | H38 | H39 | 120.0° | 120.0° |
| H5 | C1' | C2' | H6 | 160.2° | 160.1° |
| H6 | C2' | O2' | H7 | 55.8° | 62.2° |
| H6 | C2' | C3' | H8 | 39.4° | 21.3° |
| H8 | C3' | C4' | H9 | 99.3° | 124.0° |
| H9 | C4' | C5' | H10 | 71.9° | 66.0° |
| H9 | C4' | C5' | H11 | 50.9° | 173.9° |
| H18 | CP9 | H19 | H20 | 120.0° | 120.0° |
| H21 | CP8 | H22 | H23 | 120.0° | 120.0° |
| H24 | CP7 | OP3 | H25 | 59.5° | 180.0° |
| H26 | NP2 | CP5 | H27 | 122.0° | 119.9° |
| H26 | NP2 | CP5 | H28 | 2.5° | 120.0° |
| H27 | CP5 | CP4 | H29 | 176.2° | 180.0° |
| H27 | CP5 | CP4 | H30 | 62.9° | 60.0° |
| H28 | CP5 | CP4 | H29 | 56.8° | 59.9° |
| H28 | CP5 | CP4 | H30 | 177.7° | 179.9° |
| H31 | NP1 | CP2 | H32 | 44.7° | 120.0° |
| H31 | NP1 | CP2 | H33 | 163.8° | 120.0° |
| H32 | CP2 | CP1 | H34 | 174.4° | 65.0° |
| H32 | CP2 | CP1 | H35 | 66.3° | 175.0° |
| H33 | CP2 | CP1 | H34 | 55.3° | 55.0° |
| H33 | CP2 | CP1 | H35 | 174.6° | 65.0° |
| H37 | CS3 | H38 | H39 | 120.0° | 120.0° |
