KGJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O31 | P3 | doub | 1.48Å | 1.51Å | |
| C2 | N3 | doub | 1.32Å | 1.33Å | Aromatic |
| C2 | N1 | sing | 1.32Å | 1.38Å | Aromatic |
| P3 | O33 | sing | 1.61Å | 1.53Å | |
| P3 | O3' | sing | 1.61Å | 1.64Å | |
| P3 | O32 | sing | 1.61Å | 1.53Å | |
| O2' | C2' | sing | 1.43Å | 1.46Å | |
| OS5 | NS4 | sing | 1.42Å | 1.21Å | |
| N3 | C4 | sing | 1.33Å | 1.35Å | Aromatic |
| OS4 | NS4 | sing | 1.42Å | 1.22Å | |
| O3' | C3' | sing | 1.43Å | 1.42Å | |
| N1 | C6 | doub | 1.33Å | 1.35Å | Aromatic |
| NS4 | CS2 | doub | 1.46Å | 1.28Å | |
| C2' | C3' | sing | 1.55Å | 1.52Å | |
| C2' | C1' | sing | 1.54Å | 1.53Å | |
| C4 | N9 | sing | 1.37Å | 1.31Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.47Å | Aromatic |
| CS2 | CS3 | sing | 1.51Å | 1.51Å | |
| CS2 | CS1 | sing | 1.49Å | 1.48Å | |
| C6 | C5 | sing | 1.41Å | 1.43Å | Aromatic |
| C6 | N6 | sing | 1.38Å | 1.34Å | |
| C3' | C4' | sing | 1.55Å | 1.54Å | |
| N | CS1 | sing | 1.35Å | 1.47Å | |
| N | CP1 | sing | 1.47Å | 1.47Å | |
| C1' | N9 | sing | 1.46Å | 1.50Å | |
| C1' | O4' | sing | 1.44Å | 1.48Å | |
| CS1 | OS1 | doub | 1.21Å | 1.22Å | |
| CP1 | CP2 | sing | 1.53Å | 1.48Å | |
| N9 | C8 | sing | 1.36Å | 1.38Å | Aromatic |
| C5 | N7 | sing | 1.35Å | 1.36Å | Aromatic |
| O4' | C4' | sing | 1.44Å | 1.46Å | |
| C4' | C5' | sing | 1.53Å | 1.53Å | |
| C8 | N7 | doub | 1.30Å | 1.35Å | Aromatic |
| CP2 | NP1 | sing | 1.47Å | 1.42Å | |
| OP1 | CP3 | doub | 1.21Å | 1.20Å | |
| CP5 | NP2 | sing | 1.46Å | 1.44Å | |
| CP5 | CP4 | sing | 1.53Å | 1.51Å | |
| NP1 | CP3 | sing | 1.35Å | 1.32Å | |
| CP3 | CP4 | sing | 1.51Å | 1.51Å | |
| O12 | P1 | doub | 1.48Å | 1.51Å | |
| O11 | P1 | sing | 1.61Å | 1.52Å | |
| NP2 | CP6 | sing | 1.35Å | 1.33Å | |
| O5' | C5' | sing | 1.43Å | 1.43Å | |
| O5' | P1 | sing | 1.61Å | 1.59Å | |
| P1 | O6 | sing | 1.61Å | 1.63Å | |
| OP3 | CP7 | sing | 1.43Å | 1.41Å | |
| CP6 | OP2 | doub | 1.21Å | 1.24Å | |
| CP6 | CP7 | sing | 1.51Å | 1.48Å | |
| CP7 | CPA | sing | 1.53Å | 1.55Å | |
| O6 | P2 | sing | 1.61Å | 1.62Å | |
| O21 | P2 | doub | 1.48Å | 1.49Å | |
| CPA | CP8 | sing | 1.53Å | 1.52Å | |
| CPA | CPB | sing | 1.53Å | 1.50Å | |
| CPA | CP9 | sing | 1.53Å | 1.52Å | |
| P2 | O7 | sing | 1.61Å | 1.62Å | |
| P2 | O22 | sing | 1.61Å | 1.50Å | |
| O7 | CPB | sing | 1.43Å | 1.40Å | |
| 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 | |
| O32 | H12 | sing | 0.97Å | 0.95Å | |
| O33 | 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 | |
| N | H36 | sing | 0.97Å | 1.00Å | |
| CS3 | H38 | sing | 1.09Å | 1.10Å | |
| CS3 | H39 | sing | 1.09Å | 1.10Å | |
| CS3 | H40 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O31 | P3 | O33 | 119.7° | 109.5° |
| O31 | P3 | O3' | 98.8° | 109.4° |
| O31 | P3 | O32 | 110.5° | 109.5° |
| N3 | C2 | N1 | 122.1° | 122.4° |
| C2 | N3 | C4 | 117.7° | 120.6° |
| N3 | C2 | H1 | 119.0° | 118.8° |
| C2 | N1 | C6 | 123.6° | 121.2° |
| N1 | C2 | H1 | 119.0° | 118.7° |
| O33 | P3 | O3' | 104.3° | 109.5° |
| O33 | P3 | O32 | 116.0° | 109.5° |
| P3 | O33 | H13 | 109.5° | 114.0° |
| O3' | P3 | O32 | 104.4° | 109.4° |
| P3 | O3' | C3' | 121.5° | 123.0° |
| P3 | O32 | H12 | 109.5° | 114.1° |
| O2' | C2' | C3' | 117.6° | 110.5° |
| O2' | C2' | C1' | 115.7° | 110.5° |
| O2' | C2' | H6 | 109.0° | 110.6° |
| C2' | O2' | H7 | 109.5° | 114.0° |
| OS5 | NS4 | OS4 | 118.7° | 120.0° |
| OS5 | NS4 | CS2 | 119.7° | 120.0° |
| N3 | C4 | N9 | 133.2° | 134.9° |
| N3 | C4 | C5 | 123.1° | 119.1° |
| OS4 | NS4 | CS2 | 121.2° | 120.0° |
| O3' | C3' | C2' | 108.0° | 110.5° |
| O3' | C3' | C4' | 112.0° | 110.5° |
| O3' | C3' | H8 | 111.4° | 110.6° |
| N1 | C6 | C5 | 117.7° | 118.4° |
| N1 | C6 | N6 | 124.1° | 120.8° |
| NS4 | CS2 | CS3 | 120.9° | 120.0° |
| NS4 | CS2 | CS1 | 121.7° | 120.0° |
| C3' | C2' | C1' | 97.4° | 104.1° |
| C2' | C3' | C4' | 105.6° | 104.0° |
| C3' | C2' | H6 | 108.2° | 110.4° |
| C2' | C3' | H8 | 109.9° | 110.5° |
| C2' | C1' | N9 | 110.2° | 110.4° |
| C2' | C1' | O4' | 112.6° | 104.8° |
| C2' | C1' | H5 | 107.6° | 110.5° |
| C1' | C2' | H6 | 108.2° | 110.5° |
| N9 | C4 | C5 | 103.6° | 106.0° |
| C4 | N9 | C1' | 120.0° | 126.2° |
| C4 | N9 | C8 | 111.4° | 107.4° |
| C4 | C5 | C6 | 115.6° | 118.1° |
| C4 | C5 | N7 | 109.1° | 107.2° |
| CS3 | CS2 | CS1 | 117.2° | 120.0° |
| CS2 | CS3 | H38 | 109.5° | 109.4° |
| CS2 | CS3 | H39 | 109.5° | 109.5° |
| CS2 | CS3 | H40 | 109.5° | 109.5° |
| CS2 | CS1 | N | 116.9° | 120.0° |
| CS2 | CS1 | OS1 | 120.0° | 120.0° |
| C5 | C6 | N6 | 118.1° | 120.8° |
| C6 | C5 | N7 | 135.3° | 134.7° |
| C6 | N6 | H2 | 109.5° | 120.0° |
| C6 | N6 | H3 | 109.4° | 120.0° |
| C3' | C4' | O4' | 108.1° | 104.8° |
| C3' | C4' | C5' | 109.7° | 110.4° |
| C4' | C3' | H8 | 109.7° | 110.5° |
| C3' | C4' | H9 | 109.1° | 110.3° |
| CS1 | N | CP1 | 121.3° | 119.9° |
| N | CS1 | OS1 | 122.9° | 120.1° |
| CS1 | N | H36 | 119.3° | 120.1° |
| N | CP1 | CP2 | 104.4° | 109.4° |
| N | CP1 | H34 | 110.7° | 109.5° |
| N | CP1 | H35 | 110.7° | 109.5° |
| CP1 | N | H36 | 119.3° | 120.0° |
| N9 | C1' | O4' | 110.2° | 110.3° |
| C1' | N9 | C8 | 128.6° | 126.3° |
| N9 | C1' | H5 | 107.9° | 110.4° |
| C1' | O4' | C4' | 103.3° | 105.3° |
| O4' | C1' | H5 | 108.2° | 110.3° |
| CP1 | CP2 | NP1 | 113.9° | 109.5° |
| CP1 | CP2 | H32 | 108.4° | 109.5° |
| CP1 | CP2 | H33 | 108.4° | 109.5° |
| CP2 | CP1 | H34 | 110.7° | 109.5° |
| CP2 | CP1 | H35 | 110.7° | 109.5° |
| N9 | C8 | N7 | 109.7° | 110.0° |
| N9 | C8 | H4 | 125.1° | 125.0° |
| C5 | N7 | C8 | 106.1° | 109.4° |
| O4' | C4' | C5' | 110.4° | 110.4° |
| O4' | C4' | H9 | 110.2° | 110.5° |
| C4' | C5' | O5' | 105.9° | 109.5° |
| C5' | C4' | H9 | 109.3° | 110.4° |
| C4' | C5' | H10 | 110.3° | 109.5° |
| C4' | C5' | H11 | 110.3° | 109.5° |
| N7 | C8 | H4 | 125.1° | 125.0° |
| CP2 | NP1 | CP3 | 123.8° | 120.1° |
| CP2 | NP1 | H31 | 118.1° | 120.0° |
| NP1 | CP2 | H32 | 108.4° | 109.4° |
| NP1 | CP2 | H33 | 108.3° | 109.5° |
| OP1 | CP3 | NP1 | 122.4° | 120.0° |
| OP1 | CP3 | CP4 | 118.4° | 120.0° |
| NP2 | CP5 | CP4 | 111.0° | 109.5° |
| CP5 | NP2 | CP6 | 119.9° | 120.0° |
| CP5 | NP2 | H26 | 120.1° | 120.0° |
| NP2 | CP5 | H27 | 109.1° | 109.5° |
| NP2 | CP5 | H28 | 109.1° | 109.5° |
| CP5 | CP4 | CP3 | 108.8° | 109.5° |
| CP4 | CP5 | H27 | 109.1° | 109.5° |
| CP4 | CP5 | H28 | 109.1° | 109.5° |
| CP5 | CP4 | H29 | 109.7° | 109.5° |
| CP5 | CP4 | H30 | 109.7° | 109.5° |
| NP1 | CP3 | CP4 | 119.2° | 120.0° |
| CP3 | NP1 | H31 | 118.1° | 120.0° |
| CP3 | CP4 | H29 | 109.6° | 109.5° |
| CP3 | CP4 | H30 | 109.6° | 109.5° |
| O12 | P1 | O11 | 117.2° | 109.5° |
| O12 | P1 | O5' | 97.7° | 109.5° |
| O12 | P1 | O6 | 109.1° | 109.5° |
| O11 | P1 | O5' | 115.9° | 109.5° |
| O11 | P1 | O6 | 103.5° | 109.5° |
| P1 | O11 | H14 | 109.5° | 114.0° |
| NP2 | CP6 | OP2 | 123.2° | 120.0° |
| NP2 | CP6 | CP7 | 115.2° | 120.0° |
| CP6 | NP2 | H26 | 120.0° | 120.0° |
| C5' | O5' | P1 | 129.9° | 123.0° |
| O5' | C5' | H10 | 110.3° | 109.5° |
| O5' | C5' | H11 | 110.4° | 109.5° |
| O5' | P1 | O6 | 113.6° | 109.5° |
| P1 | O6 | P2 | 131.3° | 134.0° |
| OP3 | CP7 | CP6 | 106.7° | 109.5° |
| OP3 | CP7 | CPA | 110.3° | 109.4° |
| OP3 | CP7 | H24 | 110.6° | 109.5° |
| CP7 | OP3 | H25 | 109.5° | 114.0° |
| OP2 | CP6 | CP7 | 121.3° | 120.0° |
| CP6 | CP7 | CPA | 111.0° | 109.4° |
| CP6 | CP7 | H24 | 109.6° | 109.5° |
| CP7 | CPA | CP8 | 111.0° | 109.5° |
| CP7 | CPA | CPB | 110.8° | 109.5° |
| CP7 | CPA | CP9 | 111.7° | 109.5° |
| CPA | CP7 | H24 | 108.8° | 109.4° |
| O6 | P2 | O21 | 110.8° | 109.4° |
| O6 | P2 | O7 | 120.0° | 109.5° |
| O6 | P2 | O22 | 99.3° | 109.5° |
| O21 | P2 | O7 | 106.2° | 109.5° |
| O21 | P2 | O22 | 112.7° | 109.5° |
| CP8 | CPA | CPB | 105.2° | 109.5° |
| CP8 | CPA | CP9 | 109.2° | 109.4° |
| CPA | CP8 | H21 | 109.5° | 109.5° |
| CPA | CP8 | H22 | 109.5° | 109.5° |
| CPA | CP8 | H23 | 109.5° | 109.5° |
| CPB | CPA | CP9 | 108.7° | 109.5° |
| CPA | CPB | O7 | 106.3° | 109.5° |
| CPA | CPB | H16 | 110.3° | 109.5° |
| CPA | CPB | H17 | 110.2° | 109.4° |
| CPA | CP9 | H18 | 109.5° | 109.5° |
| CPA | CP9 | H19 | 109.5° | 109.5° |
| CPA | CP9 | H20 | 109.5° | 109.5° |
| O7 | P2 | O22 | 107.9° | 109.5° |
| P2 | O7 | CPB | 118.9° | 123.0° |
| P2 | O22 | H15 | 109.5° | 114.0° |
| O7 | CPB | H16 | 110.3° | 109.5° |
| O7 | CPB | H17 | 110.3° | 109.5° |
| H2 | N6 | H3 | 109.4° | 120.0° |
| H10 | C5' | H11 | 109.5° | 109.5° |
| H16 | CPB | H17 | 109.5° | 109.4° |
| H18 | CP9 | H19 | 109.5° | 109.4° |
| H18 | CP9 | H20 | 109.5° | 109.5° |
| H19 | CP9 | H20 | 109.5° | 109.4° |
| H21 | CP8 | H22 | 109.5° | 109.4° |
| H21 | CP8 | H23 | 109.5° | 109.5° |
| H22 | CP8 | H23 | 109.4° | 109.5° |
| H27 | CP5 | H28 | 109.5° | 109.5° |
| H29 | CP4 | H30 | 109.4° | 109.5° |
| H32 | CP2 | H33 | 109.5° | 109.4° |
| H34 | CP1 | H35 | 109.5° | 109.5° |
| H38 | CS3 | H39 | 109.5° | 109.5° |
| H38 | CS3 | H40 | 109.4° | 109.4° |
| H39 | CS3 | H40 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O31 | P3 | O33 | O3' | 109.1° | 120.0° |
| O31 | P3 | O33 | O32 | 136.7° | 120.1° |
| O31 | P3 | O3' | O32 | 113.9° | 120.0° |
| O31 | P3 | O3' | C3' | 178.7° | 55.0° |
| O31 | P3 | O32 | H12 | 0.0° | 180.0° |
| O31 | P3 | O33 | H13 | 0.0° | 60.0° |
| N3 | C2 | N1 | H1 | 180.0° | 179.9° |
| N3 | C2 | N1 | C6 | 4.2° | 0.1° |
| C2 | N3 | C4 | N9 | 178.3° | 180.0° |
| C2 | N3 | C4 | C5 | 1.5° | 0.1° |
| N1 | C2 | N3 | C4 | 3.3° | 0.1° |
| C2 | N1 | C6 | C5 | 3.0° | 0.0° |
| C2 | N1 | C6 | N6 | 176.3° | 179.9° |
| O33 | P3 | O3' | O32 | 122.2° | 120.0° |
| O33 | P3 | O3' | C3' | 54.8° | 175.0° |
| O33 | P3 | O32 | H12 | 140.5° | 60.0° |
| P3 | O3' | C3' | C2' | 144.0° | 121.5° |
| P3 | O3' | C3' | C4' | 100.1° | 123.9° |
| P3 | O3' | C3' | H8 | 23.2° | 1.2° |
| O3' | P3 | O32 | H12 | 105.3° | 60.0° |
| O3' | P3 | O33 | H13 | 109.1° | 180.0° |
| O32 | P3 | O3' | C3' | 67.4° | 65.0° |
| O32 | P3 | O33 | H13 | 136.7° | 60.1° |
| O2' | C2' | C3' | O3' | 38.2° | 0.1° |
| O2' | C2' | C3' | C1' | 124.1° | 118.7° |
| O2' | C2' | C3' | H6 | 124.0° | 122.7° |
| O2' | C2' | C1' | H6 | 122.5° | 122.8° |
| O2' | C2' | C3' | C4' | 158.2° | 118.7° |
| O2' | C2' | C1' | N9 | 77.9° | 98.6° |
| O2' | C2' | C1' | O4' | 158.6° | 142.6° |
| O2' | C2' | C1' | H5 | 39.4° | 23.8° |
| O2' | C2' | C3' | H8 | 83.6° | 122.7° |
| OS5 | NS4 | OS4 | CS2 | 173.0° | 179.9° |
| OS5 | NS4 | CS2 | CS3 | 5.8° | 174.4° |
| OS5 | NS4 | CS2 | CS1 | 179.8° | 5.7° |
| N3 | C4 | N9 | C5 | 179.8° | 179.9° |
| N3 | C4 | C5 | C6 | 0.5° | 0.0° |
| N3 | C4 | N9 | C1' | 1.5° | 0.1° |
| N3 | C4 | N9 | C8 | 179.0° | 180.0° |
| N3 | C4 | C5 | N7 | 178.4° | 180.0° |
| C4 | N3 | C2 | H1 | 176.8° | 180.0° |
| OS4 | NS4 | CS2 | CS3 | 167.1° | 5.5° |
| OS4 | NS4 | CS2 | CS1 | 6.9° | 174.4° |
| O3' | C3' | C2' | C4' | 120.0° | 118.6° |
| O3' | C3' | C2' | H8 | 121.8° | 122.8° |
| O3' | C3' | C2' | C1' | 85.9° | 118.6° |
| O3' | C3' | C4' | H8 | 124.2° | 122.7° |
| O3' | C3' | C4' | O4' | 90.5° | 142.6° |
| O3' | C3' | C4' | C5' | 149.1° | 98.6° |
| O3' | C3' | C2' | H6 | 162.1° | 122.7° |
| O3' | C3' | C4' | H9 | 29.4° | 23.7° |
| N1 | C6 | C5 | C4 | 1.2° | 0.0° |
| N1 | C6 | C5 | N6 | 179.4° | 180.0° |
| N1 | C6 | C5 | N7 | 177.3° | 180.0° |
| C6 | N1 | C2 | H1 | 175.8° | 180.0° |
| N1 | C6 | N6 | H2 | 0.0° | 0.0° |
| N1 | C6 | N6 | H3 | 120.0° | 180.0° |
| NS4 | CS2 | CS3 | CS1 | 174.2° | 180.0° |
| NS4 | CS2 | CS1 | N | 9.5° | 174.9° |
| NS4 | CS2 | CS1 | OS1 | 174.4° | 5.2° |
| NS4 | CS2 | CS3 | H38 | 180.0° | 90.0° |
| NS4 | CS2 | CS3 | H39 | 60.0° | 30.0° |
| NS4 | CS2 | CS3 | H40 | 60.0° | 150.1° |
| C3' | C2' | C1' | H6 | 112.0° | 118.6° |
| C2' | C3' | C4' | H8 | 118.4° | 118.6° |
| C3' | C2' | C1' | N9 | 156.6° | 142.8° |
| C3' | C2' | C1' | O4' | 33.1° | 24.0° |
| C2' | C3' | C4' | O4' | 26.9° | 24.0° |
| C2' | C3' | C4' | C5' | 93.5° | 142.8° |
| C3' | C2' | C1' | H5 | 86.0° | 94.9° |
| C3' | C2' | O2' | H7 | 180.0° | 180.0° |
| C2' | C3' | C4' | H9 | 146.8° | 95.0° |
| C2' | C1' | N9 | C4 | 118.8° | 88.1° |
| C1' | C2' | C3' | C4' | 34.1° | 0.0° |
| C2' | C1' | N9 | O4' | 124.8° | 115.4° |
| C2' | C1' | N9 | H5 | 117.2° | 122.4° |
| C2' | C1' | O4' | H5 | 118.8° | 118.9° |
| C2' | C1' | N9 | C8 | 61.7° | 91.8° |
| C2' | C1' | O4' | C4' | 17.9° | 40.5° |
| C1' | C2' | O2' | H7 | 65.6° | 65.3° |
| C1' | C2' | C3' | H8 | 152.3° | 118.6° |
| N9 | C4 | C5 | C6 | 179.3° | 180.0° |
| C4 | N9 | C1' | C8 | 179.5° | 179.9° |
| C4 | N9 | C1' | O4' | 116.4° | 156.5° |
| N9 | C4 | C5 | N7 | 1.8° | 0.0° |
| C4 | N9 | C8 | N7 | 0.2° | 0.0° |
| C4 | N9 | C8 | H4 | 179.8° | 179.9° |
| C4 | N9 | C1' | H5 | 1.6° | 34.3° |
| C4 | C5 | C6 | N7 | 178.5° | 180.0° |
| C4 | C5 | C6 | N6 | 178.2° | 180.0° |
| C5 | C4 | N9 | C1' | 178.4° | 180.0° |
| C5 | C4 | N9 | C8 | 1.2° | 0.0° |
| C4 | C5 | N7 | C8 | 1.7° | 0.0° |
| CS3 | CS2 | CS1 | N | 164.7° | 5.2° |
| CS3 | CS2 | CS1 | OS1 | 11.4° | 174.8° |
| CS2 | CS3 | H38 | H39 | 120.0° | 120.0° |
| CS2 | CS3 | H38 | H40 | 120.0° | 120.0° |
| CS2 | CS3 | H39 | H40 | 120.0° | 120.0° |
| CS2 | CS1 | N | OS1 | 176.0° | 180.0° |
| CS2 | CS1 | N | CP1 | 172.1° | 174.7° |
| CS2 | CS1 | N | H36 | 7.9° | 5.3° |
| CS1 | CS2 | CS3 | H38 | 5.7° | 90.0° |
| CS1 | CS2 | CS3 | H39 | 125.7° | 150.0° |
| CS1 | CS2 | CS3 | H40 | 114.2° | 30.0° |
| C6 | C5 | N7 | C8 | 179.7° | 180.0° |
| C5 | C6 | N6 | H2 | 179.3° | 180.0° |
| C5 | C6 | N6 | H3 | 59.4° | 0.1° |
| N6 | C6 | C5 | N7 | 3.3° | 0.0° |
| C6 | N6 | H2 | H3 | 120.0° | 179.9° |
| C3' | C4' | O4' | C1' | 5.8° | 40.5° |
| C3' | C4' | O4' | C5' | 120.0° | 118.8° |
| C3' | C4' | O4' | H9 | 119.2° | 118.8° |
| C3' | C4' | C5' | H9 | 119.6° | 122.2° |
| C3' | C4' | C5' | O5' | 38.5° | 175.0° |
| C4' | C3' | C2' | H6 | 77.8° | 118.6° |
| C3' | C4' | C5' | H10 | 158.0° | 55.0° |
| C3' | C4' | C5' | H11 | 80.9° | 65.0° |
| CS1 | N | CP1 | H36 | 180.0° | 180.0° |
| CS1 | N | CP1 | CP2 | 96.7° | 180.0° |
| CS1 | N | CP1 | H34 | 22.5° | 60.0° |
| CS1 | N | CP1 | H35 | 144.1° | 60.0° |
| CP1 | N | CS1 | OS1 | 4.0° | 5.3° |
| N | CP1 | CP2 | H34 | 119.2° | 120.0° |
| N | CP1 | CP2 | H35 | 119.2° | 120.0° |
| N | CP1 | CP2 | NP1 | 173.7° | 180.0° |
| N | CP1 | CP2 | H32 | 53.0° | 60.0° |
| N | CP1 | CP2 | H33 | 65.7° | 60.0° |
| N | CP1 | H34 | H35 | 122.3° | 120.0° |
| N9 | C1' | O4' | H5 | 117.7° | 122.2° |
| N9 | C1' | O4' | C4' | 141.4° | 159.4° |
| C1' | N9 | C8 | N7 | 179.3° | 180.0° |
| C1' | N9 | C8 | H4 | 0.7° | 0.0° |
| N9 | C1' | C2' | H6 | 44.6° | 24.2° |
| O4' | C1' | N9 | C8 | 63.1° | 23.6° |
| C1' | O4' | C4' | C5' | 114.3° | 159.3° |
| O4' | C1' | C2' | H6 | 78.9° | 94.6° |
| C1' | O4' | C4' | H9 | 124.9° | 78.3° |
| OS1 | CS1 | N | H36 | 176.1° | 174.7° |
| CP1 | CP2 | NP1 | H32 | 120.7° | 120.0° |
| CP1 | CP2 | NP1 | H33 | 120.7° | 120.1° |
| CP1 | CP2 | NP1 | CP3 | 119.2° | 180.0° |
| CP1 | CP2 | NP1 | H31 | 60.8° | 0.0° |
| CP1 | CP2 | H32 | H33 | 118.0° | 120.0° |
| CP2 | CP1 | H34 | H35 | 122.3° | 120.0° |
| CP2 | CP1 | N | H36 | 83.4° | 0.0° |
| N9 | C8 | N7 | C5 | 1.0° | 0.0° |
| N9 | C8 | N7 | H4 | 180.0° | 180.0° |
| C8 | N9 | C1' | H5 | 178.9° | 145.8° |
| C5 | N7 | C8 | H4 | 179.0° | 180.0° |
| O4' | C4' | C5' | H9 | 121.3° | 122.5° |
| O4' | C4' | C5' | O5' | 80.5° | 69.7° |
| C4' | O4' | C1' | H5 | 100.9° | 78.4° |
| O4' | C4' | C3' | H8 | 145.3° | 94.6° |
| O4' | C4' | C5' | H10 | 38.9° | 170.4° |
| O4' | C4' | C5' | H11 | 160.0° | 50.4° |
| C4' | C5' | O5' | H10 | 119.4° | 120.0° |
| C4' | C5' | O5' | H11 | 119.4° | 120.0° |
| C4' | C5' | O5' | P1 | 133.7° | 180.0° |
| C5' | C4' | C3' | H8 | 24.9° | 24.2° |
| C4' | C5' | H10 | H11 | 121.6° | 120.0° |
| CP2 | NP1 | CP3 | OP1 | 5.2° | 0.1° |
| CP2 | NP1 | CP3 | H31 | 180.0° | 180.0° |
| CP2 | NP1 | CP3 | CP4 | 175.8° | 180.0° |
| NP1 | CP2 | H32 | H33 | 118.0° | 119.9° |
| NP1 | CP2 | CP1 | H34 | 67.1° | 60.0° |
| NP1 | CP2 | CP1 | H35 | 54.5° | 60.0° |
| OP1 | CP3 | CP4 | CP5 | 69.8° | 0.0° |
| OP1 | CP3 | NP1 | CP4 | 178.9° | 180.0° |
| OP1 | CP3 | CP4 | H29 | 170.2° | 120.0° |
| OP1 | CP3 | CP4 | H30 | 50.1° | 120.0° |
| OP1 | CP3 | NP1 | H31 | 174.7° | 180.0° |
| NP2 | CP5 | CP4 | H27 | 120.2° | 120.0° |
| NP2 | CP5 | CP4 | H28 | 120.2° | 120.0° |
| NP2 | CP5 | CP4 | CP3 | 177.3° | 180.0° |
| CP5 | NP2 | CP6 | H26 | 180.0° | 180.0° |
| CP5 | NP2 | CP6 | OP2 | 2.5° | 4.7° |
| CP5 | NP2 | CP6 | CP7 | 176.2° | 175.3° |
| NP2 | CP5 | H27 | H28 | 119.3° | 120.0° |
| NP2 | CP5 | CP4 | H29 | 57.4° | 60.0° |
| NP2 | CP5 | CP4 | H30 | 62.8° | 60.0° |
| CP5 | CP4 | CP3 | NP1 | 109.1° | 180.0° |
| CP5 | CP4 | CP3 | H29 | 119.9° | 120.0° |
| CP5 | CP4 | CP3 | H30 | 119.9° | 120.0° |
| CP4 | CP5 | NP2 | CP6 | 70.6° | 180.0° |
| CP4 | CP5 | NP2 | H26 | 109.4° | 0.0° |
| CP4 | CP5 | H27 | H28 | 119.3° | 120.0° |
| CP5 | CP4 | H29 | H30 | 120.3° | 120.0° |
| NP1 | CP3 | CP4 | H29 | 10.8° | 60.0° |
| NP1 | CP3 | CP4 | H30 | 130.9° | 60.0° |
| CP3 | NP1 | CP2 | H32 | 1.5° | 60.0° |
| CP3 | NP1 | CP2 | H33 | 120.2° | 59.9° |
| CP3 | CP4 | CP5 | H27 | 62.5° | 60.0° |
| CP3 | CP4 | CP5 | H28 | 57.0° | 60.0° |
| CP3 | CP4 | H29 | H30 | 120.3° | 120.0° |
| CP4 | CP3 | NP1 | H31 | 4.2° | 0.0° |
| O12 | P1 | O11 | O5' | 114.7° | 120.0° |
| O12 | P1 | O11 | O6 | 120.2° | 120.0° |
| O12 | P1 | O5' | C5' | 40.2° | 55.0° |
| O12 | P1 | O5' | O6 | 114.9° | 120.0° |
| O12 | P1 | O6 | P2 | 117.8° | 45.0° |
| O12 | P1 | O11 | H14 | 0.0° | 180.0° |
| O11 | P1 | O5' | C5' | 165.6° | 65.0° |
| O11 | P1 | O5' | O6 | 119.8° | 120.0° |
| O11 | P1 | O6 | P2 | 7.8° | 75.1° |
| NP2 | CP6 | CP7 | OP3 | 13.2° | 168.8° |
| NP2 | CP6 | OP2 | CP7 | 173.3° | 180.0° |
| NP2 | CP6 | CP7 | CPA | 107.0° | 71.3° |
| NP2 | CP6 | CP7 | H24 | 132.8° | 48.7° |
| CP6 | NP2 | CP5 | H27 | 49.6° | 60.0° |
| CP6 | NP2 | CP5 | H28 | 169.1° | 60.0° |
| C5' | O5' | P1 | O6 | 74.7° | 175.0° |
| O5' | C5' | C4' | H9 | 158.1° | 52.8° |
| O5' | C5' | H10 | H11 | 121.7° | 120.1° |
| O5' | P1 | O6 | P2 | 134.4° | 165.0° |
| P1 | O5' | C5' | H10 | 106.9° | 60.0° |
| P1 | O5' | C5' | H11 | 14.3° | 60.0° |
| O5' | P1 | O11 | H14 | 114.7° | 60.0° |
| P1 | O6 | P2 | O21 | 59.7° | 45.0° |
| P1 | O6 | P2 | O7 | 64.6° | 165.0° |
| P1 | O6 | P2 | O22 | 178.5° | 74.9° |
| O6 | P1 | O11 | H14 | 120.2° | 60.0° |
| OP3 | CP7 | CP6 | OP2 | 173.0° | 11.2° |
| OP3 | CP7 | CP6 | CPA | 120.2° | 120.0° |
| OP3 | CP7 | CP6 | H24 | 119.7° | 120.1° |
| OP3 | CP7 | CPA | H24 | 121.4° | 120.0° |
| OP3 | CP7 | CPA | CP8 | 65.8° | 56.6° |
| OP3 | CP7 | CPA | CPB | 50.8° | 63.4° |
| OP3 | CP7 | CPA | CP9 | 172.1° | 176.5° |
| OP2 | CP6 | CP7 | CPA | 66.8° | 108.7° |
| OP2 | CP6 | CP7 | H24 | 53.3° | 131.3° |
| OP2 | CP6 | NP2 | H26 | 177.5° | 175.3° |
| CP6 | CP7 | CPA | H24 | 120.6° | 120.0° |
| CP6 | CP7 | CPA | CP8 | 52.2° | 176.6° |
| CP6 | CP7 | CPA | CPB | 168.8° | 56.6° |
| CP6 | CP7 | CPA | CP9 | 69.9° | 63.5° |
| CP6 | CP7 | OP3 | H25 | 180.0° | 59.9° |
| CP7 | CP6 | NP2 | H26 | 3.8° | 4.7° |
| CP7 | CPA | CP8 | CPB | 119.9° | 120.0° |
| CP7 | CPA | CP8 | CP9 | 123.6° | 120.0° |
| CP7 | CPA | CPB | CP9 | 123.1° | 120.0° |
| CP7 | CPA | CPB | O7 | 54.6° | 180.0° |
| CP7 | CPA | CPB | H16 | 174.1° | 60.0° |
| CP7 | CPA | CPB | H17 | 64.9° | 60.0° |
| CP7 | CPA | CP9 | H18 | 180.0° | 56.1° |
| CP7 | CPA | CP9 | H19 | 60.0° | 63.9° |
| CP7 | CPA | CP9 | H20 | 60.0° | 176.1° |
| CP7 | CPA | CP8 | H21 | 180.0° | 65.1° |
| CP7 | CPA | CP8 | H22 | 60.0° | 54.8° |
| CP7 | CPA | CP8 | H23 | 60.0° | 174.8° |
| CPA | CP7 | OP3 | H25 | 59.3° | 60.0° |
| O6 | P2 | O21 | O7 | 131.9° | 120.0° |
| O6 | P2 | O21 | O22 | 110.2° | 120.0° |
| O6 | P2 | O7 | O22 | 112.4° | 120.1° |
| O6 | P2 | O7 | CPB | 54.0° | 175.0° |
| O6 | P2 | O22 | H15 | 117.3° | 60.0° |
| O21 | P2 | O7 | O22 | 121.1° | 120.0° |
| O21 | P2 | O7 | CPB | 179.4° | 55.0° |
| O21 | P2 | O22 | H15 | 0.0° | 180.0° |
| CP8 | CPA | CPB | CP9 | 116.8° | 120.0° |
| CP8 | CPA | CPB | O7 | 174.6° | 60.0° |
| CP8 | CPA | CPB | H16 | 65.8° | 60.0° |
| CP8 | CPA | CPB | H17 | 55.1° | 180.0° |
| CP8 | CPA | CP9 | H18 | 56.8° | 63.9° |
| CP8 | CPA | CP9 | H19 | 176.9° | 176.1° |
| CP8 | CPA | CP9 | H20 | 63.2° | 56.2° |
| CPA | CP8 | H21 | H22 | 120.0° | 120.0° |
| CPA | CP8 | H21 | H23 | 120.0° | 120.1° |
| CPA | CP8 | H22 | H23 | 120.0° | 120.0° |
| CP8 | CPA | CP7 | H24 | 172.8° | 63.4° |
| CPA | CPB | O7 | P2 | 157.8° | 180.0° |
| CPA | CPB | O7 | H16 | 119.5° | 120.0° |
| CPA | CPB | O7 | H17 | 119.5° | 120.0° |
| CPA | CPB | H16 | H17 | 121.4° | 119.9° |
| CPB | CPA | CP9 | H18 | 57.5° | 176.1° |
| CPB | CPA | CP9 | H19 | 62.6° | 56.1° |
| CPB | CPA | CP9 | H20 | 177.4° | 63.8° |
| CPB | CPA | CP8 | H21 | 60.1° | 54.9° |
| CPB | CPA | CP8 | H22 | 179.9° | 174.8° |
| CPB | CPA | CP8 | H23 | 60.0° | 65.2° |
| CPB | CPA | CP7 | H24 | 70.6° | 176.6° |
| CP9 | CPA | CPB | O7 | 68.5° | 60.0° |
| CP9 | CPA | CPB | H16 | 51.0° | 180.0° |
| CP9 | CPA | CPB | H17 | 172.0° | 60.1° |
| CPA | CP9 | H18 | H19 | 120.0° | 120.0° |
| CPA | CP9 | H18 | H20 | 120.0° | 120.1° |
| CPA | CP9 | H19 | H20 | 120.0° | 120.0° |
| CP9 | CPA | CP8 | H21 | 56.4° | 174.9° |
| CP9 | CPA | CP8 | H22 | 63.6° | 65.2° |
| CP9 | CPA | CP8 | H23 | 176.5° | 54.8° |
| CP9 | CPA | CP7 | H24 | 50.7° | 56.5° |
| O7 | P2 | O22 | H15 | 116.9° | 60.0° |
| P2 | O7 | CPB | H16 | 82.7° | 60.0° |
| P2 | O7 | CPB | H17 | 38.3° | 60.0° |
| O22 | P2 | O7 | CPB | 58.3° | 65.0° |
| O7 | CPB | H16 | H17 | 121.5° | 120.1° |
| H5 | C1' | C2' | H6 | 162.0° | 146.5° |
| H6 | C2' | O2' | H7 | 56.5° | 57.4° |
| H6 | C2' | C3' | H8 | 40.4° | 0.0° |
| H8 | C3' | C4' | H9 | 94.9° | 146.4° |
| H9 | C4' | C5' | H10 | 82.4° | 67.2° |
| H9 | C4' | C5' | H11 | 38.7° | 172.8° |
| H18 | CP9 | H19 | H20 | 120.0° | 120.0° |
| H21 | CP8 | H22 | H23 | 120.0° | 120.0° |
| H24 | CP7 | OP3 | H25 | 61.0° | 180.0° |
| H26 | NP2 | CP5 | H27 | 130.4° | 120.0° |
| H26 | NP2 | CP5 | H28 | 10.9° | 120.0° |
| H27 | CP5 | CP4 | H29 | 177.6° | 180.0° |
| H27 | CP5 | CP4 | H30 | 57.4° | 60.0° |
| H28 | CP5 | CP4 | H29 | 62.9° | 60.0° |
| H28 | CP5 | CP4 | H30 | 177.0° | 180.0° |
| H31 | NP1 | CP2 | H32 | 178.5° | 120.0° |
| H31 | NP1 | CP2 | H33 | 59.8° | 120.0° |
| H32 | CP2 | CP1 | H34 | 172.2° | 180.0° |
| H32 | CP2 | CP1 | H35 | 66.2° | 60.0° |
| H33 | CP2 | CP1 | H34 | 53.5° | 60.0° |
| H33 | CP2 | CP1 | H35 | 175.1° | 180.0° |
| H34 | CP1 | N | H36 | 157.5° | 120.0° |
| H35 | CP1 | N | H36 | 35.9° | 120.0° |
| H38 | CS3 | H39 | H40 | 120.0° | 120.0° |
