LVS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CB1 | CG1 | sing | 1.54Å | 1.53Å | |
| CB1 | CA1 | sing | 1.53Å | 1.54Å | |
| CB1 | HB11 | sing | 1.10Å | 1.10Å | |
| CB1 | HB12 | sing | 1.10Å | 1.10Å | |
| CG1 | CD1 | sing | 1.53Å | 1.50Å | |
| CG1 | CD2 | sing | 1.53Å | 1.50Å | |
| CG1 | HG1 | sing | 1.10Å | 1.10Å | |
| CD1 | HD11 | sing | 1.10Å | 1.10Å | |
| CD1 | HD12 | sing | 1.10Å | 1.10Å | |
| CD1 | HD13 | sing | 1.10Å | 1.10Å | |
| CD2 | HD21 | sing | 1.10Å | 1.10Å | |
| CD2 | HD22 | sing | 1.09Å | 1.10Å | |
| CD2 | HD23 | sing | 1.09Å | 1.10Å | |
| C1 | O1 | doub | 1.23Å | 1.23Å | |
| C1 | CA1 | sing | 1.53Å | 1.54Å | |
| C1 | N2 | sing | 1.39Å | 1.33Å | |
| N1 | CA1 | sing | 1.44Å | 1.51Å | |
| N1 | C3 | sing | 1.39Å | 207.66Å | |
| N1 | HN1 | sing | 1.02Å | 1.00Å | |
| CA1 | HA1 | sing | 1.09Å | 1.10Å | |
| N2 | CA2 | sing | 1.44Å | 1.46Å | |
| N2 | HN2 | sing | 1.02Å | 1.00Å | |
| CA2 | CB2 | sing | 1.53Å | 1.52Å | |
| CA2 | C2 | sing | 1.53Å | 1.48Å | |
| CA2 | HA2 | sing | 1.09Å | 1.10Å | |
| CB2 | CG2 | sing | 1.54Å | 1.52Å | |
| CB2 | HB21 | sing | 1.10Å | 1.10Å | |
| CB2 | HB22 | sing | 1.10Å | 1.10Å | |
| CG2 | CD3 | sing | 1.53Å | 1.57Å | |
| CG2 | CD4 | sing | 1.53Å | 1.52Å | |
| CG2 | HG2 | sing | 1.10Å | 1.10Å | |
| CD3 | HD31 | sing | 1.10Å | 1.10Å | |
| CD3 | HD32 | sing | 1.09Å | 1.10Å | |
| CD3 | HD33 | sing | 1.10Å | 1.10Å | |
| CD4 | HD41 | sing | 1.10Å | 1.10Å | |
| CD4 | HD42 | sing | 1.10Å | 1.10Å | |
| CD4 | HD43 | sing | 1.09Å | 1.10Å | |
| C2 | O2 | doub | 1.23Å | 1.23Å | |
| C2 | N3 | sing | 1.39Å | 1.32Å | |
| N3 | CA3 | sing | 1.44Å | 1.44Å | |
| N3 | HN3 | sing | 1.02Å | 1.00Å | |
| CA3 | CS | sing | 1.51Å | 1.49Å | |
| CA3 | CB3 | sing | 1.54Å | 1.55Å | |
| CA3 | HA3 | sing | 1.09Å | 1.10Å | |
| CS | C2' | doub | 1.34Å | 1.51Å | |
| CS | HCS | sing | 1.09Å | 1.08Å | |
| CB3 | CG3 | sing | 1.54Å | 1.54Å | |
| CB3 | HB31 | sing | 1.10Å | 1.10Å | |
| CB3 | HB32 | sing | 1.10Å | 1.10Å | |
| CG3 | CD5 | sing | 1.53Å | 1.52Å | |
| CG3 | CD6 | sing | 1.53Å | 1.50Å | |
| CG3 | HG3 | sing | 1.10Å | 1.10Å | |
| CD5 | HD51 | sing | 1.09Å | 1.10Å | |
| CD5 | HD52 | sing | 1.10Å | 1.10Å | |
| CD5 | HD53 | sing | 1.10Å | 1.10Å | |
| CD6 | HD61 | sing | 1.09Å | 1.10Å | |
| CD6 | HD62 | sing | 1.10Å | 1.10Å | |
| CD6 | HD63 | sing | 1.10Å | 1.10Å | |
| C1' | S | sing | 1.78Å | 1.81Å | |
| C1' | H1'1 | sing | 1.09Å | 1.10Å | |
| C1' | H1'2 | sing | 1.09Å | 1.10Å | |
| C1' | H1'3 | sing | 1.09Å | 1.10Å | |
| S | O1' | doub | 1.45Å | 1.49Å | |
| S | O2' | doub | 1.45Å | 1.49Å | |
| S | C2' | sing | 1.72Å | 1.85Å | |
| C2' | H2' | sing | 1.08Å | 1.08Å | |
| C3 | C4 | sing | 1.52Å | 0.00Å | |
| C3 | O6 | doub | 1.23Å | 0.00Å | |
| C4 | C5 | sing | 1.51Å | 0.00Å | |
| C4 | HC41 | sing | 1.10Å | 0.00Å | |
| C4 | HC42 | sing | 1.10Å | 0.00Å | |
| C5 | C6 | doub | 1.39Å | 0.00Å | Aromatic |
| C5 | C10 | sing | 1.39Å | 0.00Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 0.00Å | Aromatic |
| C6 | HC6 | sing | 1.09Å | 0.00Å | |
| C7 | C8 | doub | 1.40Å | 0.00Å | Aromatic |
| C7 | N4 | sing | 1.42Å | 0.00Å | |
| C8 | C9 | sing | 1.39Å | 0.00Å | Aromatic |
| C8 | O5 | sing | 1.37Å | 0.00Å | |
| C9 | C10 | doub | 1.40Å | 0.00Å | Aromatic |
| C9 | I | sing | 2.09Å | 0.00Å | |
| C10 | H10 | sing | 1.09Å | 0.00Å | |
| N4 | O3 | doub | 1.25Å | 0.00Å | |
| N4 | O4 | sing | 1.25Å | 0.00Å | |
| O5 | HO5 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CG1 | CB1 | CA1 | 117.0° | 114.8° |
| CG1 | CB1 | HB11 | 107.1° | 108.7° |
| CG1 | CB1 | HB12 | 105.3° | 109.1° |
| CB1 | CG1 | CD1 | 108.7° | 109.7° |
| CB1 | CG1 | CD2 | 111.9° | 112.4° |
| CB1 | CG1 | HG1 | 108.3° | 109.1° |
| CA1 | CB1 | HB11 | 107.0° | 108.8° |
| CA1 | CB1 | HB12 | 105.3° | 109.4° |
| CB1 | CA1 | C1 | 109.4° | 110.2° |
| CB1 | CA1 | N1 | 110.3° | 112.3° |
| CB1 | CA1 | HA1 | 109.4° | 111.4° |
| HB11 | CB1 | HB12 | 115.6° | 105.7° |
| CD1 | CG1 | CD2 | 109.1° | 109.7° |
| CD1 | CG1 | HG1 | 111.1° | 107.5° |
| CG1 | CD1 | HD11 | 109.5° | 110.9° |
| CG1 | CD1 | HD12 | 109.4° | 110.8° |
| CG1 | CD1 | HD13 | 109.4° | 111.3° |
| CD2 | CG1 | HG1 | 107.9° | 108.2° |
| CG1 | CD2 | HD21 | 109.5° | 111.2° |
| CG1 | CD2 | HD22 | 109.4° | 110.8° |
| CG1 | CD2 | HD23 | 109.4° | 111.4° |
| HD11 | CD1 | HD12 | 109.5° | 107.7° |
| HD11 | CD1 | HD13 | 109.5° | 108.1° |
| HD12 | CD1 | HD13 | 109.5° | 108.0° |
| HD21 | CD2 | HD22 | 109.5° | 108.0° |
| HD21 | CD2 | HD23 | 109.5° | 108.2° |
| HD22 | CD2 | HD23 | 109.5° | 107.1° |
| O1 | C1 | CA1 | 120.2° | 122.9° |
| O1 | C1 | N2 | 121.1° | 124.8° |
| CA1 | C1 | N2 | 118.8° | 112.2° |
| C1 | CA1 | N1 | 110.7° | 107.1° |
| C1 | CA1 | HA1 | 109.0° | 108.7° |
| C1 | N2 | CA2 | 118.3° | 123.4° |
| C1 | N2 | HN2 | 120.8° | 118.8° |
| CA1 | N1 | C3 | 171.0° | 122.7° |
| CA1 | N1 | HN1 | 94.5° | 118.7° |
| N1 | CA1 | HA1 | 108.0° | 107.0° |
| C3 | N1 | HN1 | 94.5° | 118.7° |
| N1 | C3 | C4 | 90.0° | 111.6° |
| N1 | C3 | O6 | 90.0° | 124.9° |
| CA2 | N2 | HN2 | 120.8° | 117.8° |
| N2 | CA2 | CB2 | 111.9° | 112.2° |
| N2 | CA2 | C2 | 113.2° | 107.1° |
| N2 | CA2 | HA2 | 104.3° | 107.1° |
| CB2 | CA2 | C2 | 106.6° | 110.2° |
| CB2 | CA2 | HA2 | 111.2° | 111.3° |
| CA2 | CB2 | CG2 | 118.0° | 114.8° |
| CA2 | CB2 | HB21 | 106.7° | 108.8° |
| CA2 | CB2 | HB22 | 104.7° | 109.3° |
| C2 | CA2 | HA2 | 109.8° | 108.8° |
| CA2 | C2 | O2 | 120.8° | 123.0° |
| CA2 | C2 | N3 | 115.2° | 112.1° |
| CG2 | CB2 | HB21 | 106.7° | 108.7° |
| CG2 | CB2 | HB22 | 104.7° | 109.1° |
| CB2 | CG2 | CD3 | 109.0° | 109.7° |
| CB2 | CG2 | CD4 | 108.4° | 112.4° |
| CB2 | CG2 | HG2 | 111.6° | 109.2° |
| HB21 | CB2 | HB22 | 116.4° | 105.8° |
| CD3 | CG2 | CD4 | 112.4° | 109.7° |
| CD3 | CG2 | HG2 | 107.5° | 107.5° |
| CG2 | CD3 | HD31 | 109.5° | 110.8° |
| CG2 | CD3 | HD32 | 109.5° | 110.8° |
| CG2 | CD3 | HD33 | 109.5° | 111.3° |
| CD4 | CG2 | HG2 | 108.0° | 108.2° |
| CG2 | CD4 | HD41 | 109.5° | 111.2° |
| CG2 | CD4 | HD42 | 109.5° | 110.7° |
| CG2 | CD4 | HD43 | 109.4° | 111.4° |
| HD31 | CD3 | HD32 | 109.5° | 107.7° |
| HD31 | CD3 | HD33 | 109.4° | 108.0° |
| HD32 | CD3 | HD33 | 109.4° | 108.0° |
| HD41 | CD4 | HD42 | 109.5° | 107.9° |
| HD41 | CD4 | HD43 | 109.5° | 108.3° |
| HD42 | CD4 | HD43 | 109.5° | 107.1° |
| O2 | C2 | N3 | 124.0° | 124.9° |
| C2 | N3 | CA3 | 121.1° | 123.3° |
| C2 | N3 | HN3 | 119.5° | 119.2° |
| CA3 | N3 | HN3 | 119.4° | 117.5° |
| N3 | CA3 | CS | 120.3° | 107.6° |
| N3 | CA3 | CB3 | 109.3° | 111.6° |
| N3 | CA3 | HA3 | 101.6° | 106.7° |
| CS | CA3 | CB3 | 109.1° | 110.7° |
| CS | CA3 | HA3 | 101.9° | 109.8° |
| CA3 | CS | C2' | 113.6° | 123.2° |
| CA3 | CS | HCS | 123.2° | 116.9° |
| CB3 | CA3 | HA3 | 114.6° | 110.4° |
| CA3 | CB3 | CG3 | 122.2° | 114.9° |
| CA3 | CB3 | HB31 | 105.4° | 109.1° |
| CA3 | CB3 | HB32 | 102.4° | 109.1° |
| C2' | CS | HCS | 123.2° | 119.9° |
| CS | C2' | S | 119.7° | 117.5° |
| CS | C2' | H2' | 120.2° | 122.8° |
| CG3 | CB3 | HB31 | 105.4° | 108.9° |
| CG3 | CB3 | HB32 | 102.4° | 108.3° |
| CB3 | CG3 | CD5 | 113.5° | 112.5° |
| CB3 | CG3 | CD6 | 108.7° | 109.7° |
| CB3 | CG3 | HG3 | 107.5° | 109.1° |
| HB31 | CB3 | HB32 | 120.2° | 106.3° |
| CD5 | CG3 | CD6 | 110.2° | 109.6° |
| CD5 | CG3 | HG3 | 106.0° | 108.3° |
| CG3 | CD5 | HD51 | 109.5° | 111.5° |
| CG3 | CD5 | HD52 | 109.5° | 110.8° |
| CG3 | CD5 | HD53 | 109.5° | 111.3° |
| CD6 | CG3 | HG3 | 111.0° | 107.5° |
| CG3 | CD6 | HD61 | 109.5° | 110.9° |
| CG3 | CD6 | HD62 | 109.5° | 110.8° |
| CG3 | CD6 | HD63 | 109.4° | 111.3° |
| HD51 | CD5 | HD52 | 109.4° | 107.0° |
| HD51 | CD5 | HD53 | 109.5° | 108.2° |
| HD52 | CD5 | HD53 | 109.5° | 107.9° |
| HD61 | CD6 | HD62 | 109.4° | 107.6° |
| HD61 | CD6 | HD63 | 109.5° | 108.1° |
| HD62 | CD6 | HD63 | 109.5° | 108.0° |
| S | C1' | H1'1 | 109.5° | 108.3° |
| S | C1' | H1'2 | 109.4° | 108.4° |
| S | C1' | H1'3 | 109.4° | 108.4° |
| C1' | S | O1' | 115.3° | 107.0° |
| C1' | S | O2' | 111.6° | 107.0° |
| C1' | S | C2' | 101.9° | 102.6° |
| H1'1 | C1' | H1'2 | 109.4° | 110.5° |
| H1'1 | C1' | H1'3 | 109.5° | 110.5° |
| H1'2 | C1' | H1'3 | 109.5° | 110.6° |
| O1' | S | O2' | 108.9° | 120.2° |
| O1' | S | C2' | 110.7° | 109.3° |
| O2' | S | C2' | 108.2° | 109.3° |
| S | C2' | H2' | 120.2° | 119.7° |
| C4 | C3 | O6 | 90.0° | 123.5° |
| C3 | C4 | C5 | 90.0° | 113.3° |
| C3 | C4 | HC41 | 90.0° | 108.8° |
| C3 | C4 | HC42 | 90.0° | 108.7° |
| C5 | C4 | HC41 | 90.0° | 109.5° |
| C5 | C4 | HC42 | 90.0° | 109.7° |
| C4 | C5 | C6 | 90.0° | 119.4° |
| C4 | C5 | C10 | 90.0° | 119.5° |
| HC41 | C4 | HC42 | 90.0° | 106.5° |
| C6 | C5 | C10 | 90.0° | 121.1° |
| C5 | C6 | C7 | 90.0° | 119.5° |
| C5 | C6 | HC6 | 90.0° | 120.2° |
| C5 | C10 | C9 | 90.0° | 119.5° |
| C5 | C10 | H10 | 90.0° | 119.7° |
| C7 | C6 | HC6 | 90.0° | 120.3° |
| C6 | C7 | C8 | 90.0° | 120.0° |
| C6 | C7 | N4 | 90.0° | 119.1° |
| C8 | C7 | N4 | 90.0° | 120.9° |
| C7 | C8 | C9 | 90.0° | 120.0° |
| C7 | C8 | O5 | 90.0° | 119.3° |
| C7 | N4 | O3 | 90.0° | 118.9° |
| C7 | N4 | O4 | 90.0° | 118.9° |
| C9 | C8 | O5 | 90.0° | 120.7° |
| C8 | C9 | C10 | 90.0° | 120.0° |
| C8 | C9 | I | 90.0° | 121.7° |
| C8 | O5 | HO5 | 90.0° | 110.0° |
| C10 | C9 | I | 90.0° | 118.3° |
| C9 | C10 | H10 | 90.0° | 120.8° |
| O3 | N4 | O4 | 90.0° | 122.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CG1 | CB1 | CA1 | HB11 | 120.0° | 122.0° |
| CG1 | CB1 | CA1 | HB12 | 116.5° | 123.0° |
| CG1 | CB1 | HB11 | HB12 | 116.9° | 117.0° |
| CB1 | CG1 | CD1 | CD2 | 122.2° | 124.0° |
| CB1 | CG1 | CD1 | HG1 | 119.0° | 118.6° |
| CB1 | CG1 | CD2 | HG1 | 119.0° | 120.6° |
| CB1 | CG1 | CD1 | HD11 | 72.5° | 177.7° |
| CB1 | CG1 | CD1 | HD12 | 167.5° | 58.3° |
| CB1 | CG1 | CD1 | HD13 | 47.5° | 61.9° |
| CB1 | CG1 | CD2 | HD21 | 19.4° | 55.6° |
| CB1 | CG1 | CD2 | HD22 | 139.5° | 175.7° |
| CB1 | CG1 | CD2 | HD23 | 100.5° | 65.1° |
| CG1 | CB1 | CA1 | C1 | 117.3° | 58.0° |
| CG1 | CB1 | CA1 | N1 | 120.7° | 61.2° |
| CG1 | CB1 | CA1 | HA1 | 2.0° | 178.8° |
| CA1 | CB1 | HB11 | HB12 | 116.9° | 117.4° |
| CA1 | CB1 | CG1 | CD1 | 62.0° | 58.0° |
| CA1 | CB1 | CG1 | CD2 | 177.5° | 64.4° |
| CA1 | CB1 | CG1 | HG1 | 58.8° | 175.5° |
| CB1 | CA1 | C1 | O1 | 68.7° | 117.7° |
| CB1 | CA1 | C1 | N1 | 121.8° | 122.4° |
| CB1 | CA1 | C1 | HA1 | 119.5° | 122.3° |
| CB1 | CA1 | C1 | N2 | 111.3° | 64.6° |
| CB1 | CA1 | N1 | HA1 | 119.5° | 122.5° |
| CB1 | CA1 | N1 | C3 | 167.4° | 92.4° |
| CB1 | CA1 | N1 | HN1 | 12.6° | 87.5° |
| HB11 | CB1 | CG1 | CD1 | 178.0° | 180.0° |
| HB11 | CB1 | CG1 | CD2 | 57.5° | 57.7° |
| HB11 | CB1 | CG1 | HG1 | 61.2° | 62.4° |
| HB11 | CB1 | CA1 | C1 | 2.7° | 180.0° |
| HB11 | CB1 | CA1 | N1 | 119.3° | 60.7° |
| HB11 | CB1 | CA1 | HA1 | 122.0° | 59.2° |
| HB12 | CB1 | CG1 | CD1 | 54.5° | 65.1° |
| HB12 | CB1 | CG1 | CD2 | 66.0° | 172.5° |
| HB12 | CB1 | CG1 | HG1 | 175.3° | 52.4° |
| HB12 | CB1 | CA1 | C1 | 126.2° | 64.9° |
| HB12 | CB1 | CA1 | N1 | 4.1° | 175.8° |
| HB12 | CB1 | CA1 | HA1 | 114.6° | 55.8° |
| CD1 | CG1 | CD2 | HG1 | 120.8° | 117.0° |
| CG1 | CD1 | HD11 | HD12 | 120.0° | 121.3° |
| CG1 | CD1 | HD11 | HD13 | 120.0° | 122.2° |
| CG1 | CD1 | HD12 | HD13 | 120.0° | 122.2° |
| CD1 | CG1 | CD2 | HD21 | 139.7° | 66.8° |
| CD1 | CG1 | CD2 | HD22 | 100.3° | 53.3° |
| CD1 | CG1 | CD2 | HD23 | 19.7° | 172.5° |
| CD2 | CG1 | CD1 | HD11 | 49.7° | 58.3° |
| CD2 | CG1 | CD1 | HD12 | 70.3° | 177.8° |
| CD2 | CG1 | CD1 | HD13 | 169.7° | 62.0° |
| CG1 | CD2 | HD21 | HD22 | 120.0° | 121.7° |
| CG1 | CD2 | HD21 | HD23 | 120.0° | 122.6° |
| CG1 | CD2 | HD22 | HD23 | 120.0° | 121.7° |
| HG1 | CG1 | CD1 | HD11 | 168.4° | 59.2° |
| HG1 | CG1 | CD1 | HD12 | 48.4° | 60.3° |
| HG1 | CG1 | CD1 | HD13 | 71.6° | 179.5° |
| HG1 | CG1 | CD2 | HD21 | 99.6° | 176.2° |
| HG1 | CG1 | CD2 | HD22 | 20.5° | 63.7° |
| HG1 | CG1 | CD2 | HD23 | 140.5° | 55.5° |
| HD11 | CD1 | HD12 | HD13 | 120.0° | 116.5° |
| HD21 | CD2 | HD22 | HD23 | 120.0° | 116.3° |
| O1 | C1 | CA1 | N2 | 179.9° | 177.7° |
| O1 | C1 | CA1 | N1 | 53.1° | 4.7° |
| O1 | C1 | CA1 | HA1 | 171.8° | 120.0° |
| O1 | C1 | N2 | CA2 | 2.8° | 0.0° |
| O1 | C1 | N2 | HN2 | 177.2° | 179.3° |
| C1 | CA1 | N1 | HA1 | 119.2° | 116.5° |
| C1 | CA1 | N1 | C3 | 71.4° | 146.5° |
| C1 | CA1 | N1 | HN1 | 108.7° | 33.6° |
| CA1 | C1 | N2 | CA2 | 177.3° | 177.6° |
| CA1 | C1 | N2 | HN2 | 2.8° | 1.7° |
| N2 | C1 | CA1 | N1 | 126.9° | 173.0° |
| N2 | C1 | CA1 | HA1 | 8.3° | 57.7° |
| C1 | N2 | CA2 | HN2 | 180.0° | 179.3° |
| C1 | N2 | CA2 | CB2 | 97.8° | 152.4° |
| C1 | N2 | CA2 | C2 | 141.8° | 86.5° |
| C1 | N2 | CA2 | HA2 | 22.5° | 30.0° |
| CA1 | N1 | C3 | HN1 | 180.0° | 180.0° |
| CA1 | N1 | C3 | C4 | 90.0° | 179.7° |
| CA1 | N1 | C3 | O6 | 90.0° | 0.0° |
| C3 | N1 | CA1 | HA1 | 47.9° | 30.0° |
| N1 | C3 | C4 | O6 | 90.0° | 179.7° |
| N1 | C3 | C4 | C5 | 90.0° | 120.2° |
| N1 | C3 | C4 | HC41 | 90.0° | 1.9° |
| N1 | C3 | C4 | HC42 | 90.0° | 117.5° |
| HN1 | N1 | CA1 | HA1 | 132.1° | 150.0° |
| HN1 | N1 | C3 | C4 | 90.0° | 0.3° |
| HN1 | N1 | C3 | O6 | 90.0° | 180.0° |
| N2 | CA2 | CB2 | C2 | 124.2° | 119.3° |
| N2 | CA2 | CB2 | HA2 | 116.1° | 120.0° |
| N2 | CA2 | C2 | HA2 | 116.1° | 115.4° |
| N2 | CA2 | CB2 | CG2 | 53.9° | 178.7° |
| N2 | CA2 | CB2 | HB21 | 66.1° | 59.3° |
| N2 | CA2 | CB2 | HB22 | 169.8° | 55.8° |
| N2 | CA2 | C2 | O2 | 0.9° | 34.7° |
| N2 | CA2 | C2 | N3 | 180.0° | 143.0° |
| HN2 | N2 | CA2 | CB2 | 82.3° | 26.9° |
| HN2 | N2 | CA2 | C2 | 38.1° | 94.2° |
| HN2 | N2 | CA2 | HA2 | 157.5° | 149.3° |
| CB2 | CA2 | C2 | HA2 | 120.5° | 122.3° |
| CA2 | CB2 | CG2 | HB21 | 120.0° | 122.1° |
| CA2 | CB2 | CG2 | HB22 | 116.0° | 123.0° |
| CA2 | CB2 | HB21 | HB22 | 116.5° | 117.3° |
| CA2 | CB2 | CG2 | CD3 | 87.2° | 57.9° |
| CA2 | CB2 | CG2 | CD4 | 150.2° | 64.4° |
| CA2 | CB2 | CG2 | HG2 | 31.3° | 175.5° |
| CB2 | CA2 | C2 | O2 | 122.4° | 87.7° |
| CB2 | CA2 | C2 | N3 | 56.6° | 94.7° |
| C2 | CA2 | CB2 | CG2 | 178.1° | 62.0° |
| C2 | CA2 | CB2 | HB21 | 58.1° | 60.0° |
| C2 | CA2 | CB2 | HB22 | 66.0° | 175.1° |
| CA2 | C2 | O2 | N3 | 179.0° | 177.4° |
| CA2 | C2 | N3 | CA3 | 179.1° | 177.6° |
| CA2 | C2 | N3 | HN3 | 1.0° | 1.7° |
| HA2 | CA2 | CB2 | CG2 | 62.3° | 58.7° |
| HA2 | CA2 | CB2 | HB21 | 177.7° | 179.3° |
| HA2 | CA2 | CB2 | HB22 | 53.7° | 64.2° |
| HA2 | CA2 | C2 | O2 | 117.0° | 150.0° |
| HA2 | CA2 | C2 | N3 | 63.9° | 27.6° |
| CG2 | CB2 | HB21 | HB22 | 116.5° | 117.0° |
| CB2 | CG2 | CD3 | CD4 | 120.2° | 124.0° |
| CB2 | CG2 | CD3 | HG2 | 121.1° | 118.6° |
| CB2 | CG2 | CD4 | HG2 | 121.1° | 120.6° |
| CB2 | CG2 | CD3 | HD31 | 62.7° | 177.8° |
| CB2 | CG2 | CD3 | HD32 | 57.4° | 58.3° |
| CB2 | CG2 | CD3 | HD33 | 177.4° | 62.0° |
| CB2 | CG2 | CD4 | HD41 | 94.4° | 55.7° |
| CB2 | CG2 | CD4 | HD42 | 25.6° | 175.7° |
| CB2 | CG2 | CD4 | HD43 | 145.6° | 65.2° |
| HB21 | CB2 | CG2 | CD3 | 32.8° | 180.0° |
| HB21 | CB2 | CG2 | CD4 | 89.8° | 57.6° |
| HB21 | CB2 | CG2 | HG2 | 151.3° | 62.4° |
| HB22 | CB2 | CG2 | CD3 | 156.8° | 65.1° |
| HB22 | CB2 | CG2 | CD4 | 34.2° | 172.5° |
| HB22 | CB2 | CG2 | HG2 | 84.6° | 52.5° |
| CD3 | CG2 | CD4 | HG2 | 118.4° | 117.0° |
| CG2 | CD3 | HD31 | HD32 | 120.0° | 121.4° |
| CG2 | CD3 | HD31 | HD33 | 120.0° | 122.1° |
| CG2 | CD3 | HD32 | HD33 | 120.0° | 122.1° |
| CD3 | CG2 | CD4 | HD41 | 26.1° | 66.7° |
| CD3 | CG2 | CD4 | HD42 | 146.1° | 53.3° |
| CD3 | CG2 | CD4 | HD43 | 93.9° | 172.4° |
| CD4 | CG2 | CD3 | HD31 | 177.2° | 58.2° |
| CD4 | CG2 | CD3 | HD32 | 62.8° | 177.8° |
| CD4 | CG2 | CD3 | HD33 | 57.2° | 62.0° |
| CG2 | CD4 | HD41 | HD42 | 120.0° | 121.6° |
| CG2 | CD4 | HD41 | HD43 | 120.0° | 122.7° |
| CG2 | CD4 | HD42 | HD43 | 120.0° | 121.7° |
| HG2 | CG2 | CD3 | HD31 | 58.4° | 59.2° |
| HG2 | CG2 | CD3 | HD32 | 178.5° | 60.3° |
| HG2 | CG2 | CD3 | HD33 | 61.6° | 179.4° |
| HG2 | CG2 | CD4 | HD41 | 144.5° | 176.4° |
| HG2 | CG2 | CD4 | HD42 | 95.5° | 63.7° |
| HG2 | CG2 | CD4 | HD43 | 24.5° | 55.5° |
| HD31 | CD3 | HD32 | HD33 | 119.9° | 116.5° |
| HD41 | CD4 | HD42 | HD43 | 120.0° | 116.4° |
| O2 | C2 | N3 | CA3 | 1.9° | 0.0° |
| O2 | C2 | N3 | HN3 | 178.1° | 179.3° |
| C2 | N3 | CA3 | HN3 | 180.0° | 179.3° |
| C2 | N3 | CA3 | CS | 167.3° | 87.8° |
| C2 | N3 | CA3 | CB3 | 65.5° | 150.6° |
| C2 | N3 | CA3 | HA3 | 56.0° | 30.0° |
| N3 | CA3 | CS | CB3 | 127.3° | 122.1° |
| N3 | CA3 | CS | HA3 | 111.1° | 115.8° |
| N3 | CA3 | CB3 | HA3 | 113.2° | 118.4° |
| N3 | CA3 | CS | C2' | 0.5° | 115.7° |
| N3 | CA3 | CS | HCS | 179.5° | 63.9° |
| N3 | CA3 | CB3 | CG3 | 39.9° | 62.8° |
| N3 | CA3 | CB3 | HB31 | 159.9° | 59.7° |
| N3 | CA3 | CB3 | HB32 | 73.6° | 175.5° |
| HN3 | N3 | CA3 | CS | 12.7° | 92.9° |
| HN3 | N3 | CA3 | CB3 | 114.5° | 28.7° |
| HN3 | N3 | CA3 | HA3 | 124.0° | 149.3° |
| CS | CA3 | CB3 | HA3 | 113.5° | 121.8° |
| CA3 | CS | C2' | HCS | 180.0° | 179.7° |
| CS | CA3 | CB3 | CG3 | 93.4° | 177.4° |
| CS | CA3 | CB3 | HB31 | 26.6° | 60.0° |
| CS | CA3 | CB3 | HB32 | 153.0° | 55.7° |
| CA3 | CS | C2' | S | 82.5° | 179.8° |
| CA3 | CS | C2' | H2' | 97.6° | 0.1° |
| CB3 | CA3 | CS | C2' | 126.9° | 122.1° |
| CB3 | CA3 | CS | HCS | 53.2° | 58.2° |
| CA3 | CB3 | CG3 | HB31 | 120.0° | 122.7° |
| CA3 | CB3 | CG3 | HB32 | 113.5° | 122.2° |
| CA3 | CB3 | HB31 | HB32 | 114.7° | 117.5° |
| CA3 | CB3 | CG3 | CD5 | 70.2° | 57.3° |
| CA3 | CB3 | CG3 | CD6 | 166.9° | 65.0° |
| CA3 | CB3 | CG3 | HG3 | 46.6° | 177.5° |
| HA3 | CA3 | CS | C2' | 111.6° | 0.0° |
| HA3 | CA3 | CS | HCS | 68.4° | 179.7° |
| HA3 | CA3 | CB3 | CG3 | 153.1° | 55.6° |
| HA3 | CA3 | CB3 | HB31 | 86.9° | 178.2° |
| HA3 | CA3 | CB3 | HB32 | 39.6° | 66.1° |
| CS | C2' | S | C1' | 13.0° | 180.0° |
| CS | C2' | S | O1' | 136.0° | 66.7° |
| CS | C2' | S | O2' | 104.7° | 66.7° |
| CS | C2' | S | H2' | 180.0° | 180.0° |
| HCS | CS | C2' | S | 97.5° | 0.2° |
| HCS | CS | C2' | H2' | 82.5° | 179.8° |
| CG3 | CB3 | HB31 | HB32 | 114.8° | 116.5° |
| CB3 | CG3 | CD5 | CD6 | 122.1° | 122.3° |
| CB3 | CG3 | CD5 | HG3 | 117.7° | 120.7° |
| CB3 | CG3 | CD6 | HG3 | 118.0° | 118.5° |
| CB3 | CG3 | CD5 | HD51 | 42.1° | 65.6° |
| CB3 | CG3 | CD5 | HD52 | 77.8° | 175.3° |
| CB3 | CG3 | CD5 | HD53 | 162.2° | 55.3° |
| CB3 | CG3 | CD6 | HD61 | 145.6° | 58.4° |
| CB3 | CG3 | CD6 | HD62 | 25.6° | 177.8° |
| CB3 | CG3 | CD6 | HD63 | 94.4° | 62.0° |
| HB31 | CB3 | CG3 | CD5 | 49.7° | 180.0° |
| HB31 | CB3 | CG3 | CD6 | 73.2° | 57.7° |
| HB31 | CB3 | CG3 | HG3 | 166.6° | 59.8° |
| HB32 | CB3 | CG3 | CD5 | 176.2° | 64.8° |
| HB32 | CB3 | CG3 | CD6 | 53.3° | 172.9° |
| HB32 | CB3 | CG3 | HG3 | 66.9° | 55.4° |
| CD5 | CG3 | CD6 | HG3 | 117.1° | 117.5° |
| CG3 | CD5 | HD51 | HD52 | 120.0° | 121.3° |
| CG3 | CD5 | HD51 | HD53 | 120.0° | 122.7° |
| CG3 | CD5 | HD52 | HD53 | 120.0° | 122.0° |
| CD5 | CG3 | CD6 | HD61 | 20.7° | 177.6° |
| CD5 | CG3 | CD6 | HD62 | 99.3° | 58.2° |
| CD5 | CG3 | CD6 | HD63 | 140.7° | 62.0° |
| CD6 | CG3 | CD5 | HD51 | 164.2° | 172.1° |
| CD6 | CG3 | CD5 | HD52 | 44.3° | 53.0° |
| CD6 | CG3 | CD5 | HD53 | 75.7° | 67.0° |
| CG3 | CD6 | HD61 | HD62 | 120.0° | 121.3° |
| CG3 | CD6 | HD61 | HD63 | 120.0° | 122.2° |
| CG3 | CD6 | HD62 | HD63 | 120.0° | 122.1° |
| HG3 | CG3 | CD5 | HD51 | 75.6° | 55.1° |
| HG3 | CG3 | CD5 | HD52 | 164.4° | 64.0° |
| HG3 | CG3 | CD5 | HD53 | 44.4° | 176.0° |
| HG3 | CG3 | CD6 | HD61 | 96.4° | 60.2° |
| HG3 | CG3 | CD6 | HD62 | 143.6° | 59.3° |
| HG3 | CG3 | CD6 | HD63 | 23.6° | 179.5° |
| HD51 | CD5 | HD52 | HD53 | 120.0° | 116.2° |
| HD61 | CD6 | HD62 | HD63 | 120.0° | 116.5° |
| S | C1' | H1'1 | H1'2 | 120.0° | 118.7° |
| S | C1' | H1'1 | H1'3 | 120.0° | 118.6° |
| S | C1' | H1'2 | H1'3 | 120.0° | 118.7° |
| C1' | S | O1' | O2' | 126.3° | 122.0° |
| C1' | S | O1' | C2' | 114.9° | 110.4° |
| C1' | S | O2' | C2' | 111.3° | 110.4° |
| C1' | S | C2' | H2' | 167.0° | 0.0° |
| H1'1 | C1' | H1'2 | H1'3 | 120.0° | 122.7° |
| H1'1 | C1' | S | O1' | 103.5° | 115.4° |
| H1'1 | C1' | S | O2' | 131.6° | 114.6° |
| H1'1 | C1' | S | C2' | 16.3° | 0.4° |
| H1'2 | C1' | S | O1' | 136.5° | 4.6° |
| H1'2 | C1' | S | O2' | 11.6° | 125.4° |
| H1'2 | C1' | S | C2' | 103.6° | 119.6° |
| H1'3 | C1' | S | O1' | 16.5° | 124.7° |
| H1'3 | C1' | S | O2' | 108.4° | 5.3° |
| H1'3 | C1' | S | C2' | 136.3° | 120.3° |
| O1' | S | O2' | C2' | 120.3° | 127.5° |
| O1' | S | C2' | H2' | 44.0° | 113.3° |
| O2' | S | C2' | H2' | 75.2° | 113.3° |
| C3 | C4 | C5 | HC41 | 90.0° | 121.8° |
| C3 | C4 | C5 | HC42 | 90.0° | 121.7° |
| C3 | C4 | HC41 | HC42 | 90.0° | 117.0° |
| C3 | C4 | C5 | C6 | 90.0° | 90.0° |
| C3 | C4 | C5 | C10 | 90.0° | 90.0° |
| O6 | C3 | C4 | C5 | 90.0° | 60.0° |
| O6 | C3 | C4 | HC41 | 90.0° | 177.8° |
| O6 | C3 | C4 | HC42 | 90.0° | 62.2° |
| C5 | C4 | HC41 | HC42 | 90.0° | 118.6° |
| C4 | C5 | C6 | C10 | 90.0° | 180.0° |
| C4 | C5 | C6 | C7 | 90.0° | 180.0° |
| C4 | C5 | C6 | HC6 | 90.0° | 0.1° |
| C4 | C5 | C10 | C9 | 90.0° | 180.0° |
| C4 | C5 | C10 | H10 | 90.0° | 0.1° |
| HC41 | C4 | C5 | C6 | 90.0° | 148.2° |
| HC41 | C4 | C5 | C10 | 90.0° | 31.8° |
| HC42 | C4 | C5 | C6 | 90.0° | 31.6° |
| HC42 | C4 | C5 | C10 | 90.0° | 148.4° |
| C5 | C6 | C7 | HC6 | 90.0° | 179.9° |
| C5 | C6 | C7 | C8 | 90.0° | 0.0° |
| C5 | C6 | C7 | N4 | 90.0° | 180.0° |
| C6 | C5 | C10 | C9 | 90.0° | 0.1° |
| C6 | C5 | C10 | H10 | 90.0° | 179.9° |
| C10 | C5 | C6 | C7 | 90.0° | 0.0° |
| C10 | C5 | C6 | HC6 | 90.0° | 179.9° |
| C5 | C10 | C9 | C8 | 90.0° | 0.1° |
| C5 | C10 | C9 | H10 | 90.0° | 179.8° |
| C5 | C10 | C9 | I | 90.0° | 179.9° |
| C6 | C7 | C8 | N4 | 90.0° | 180.0° |
| C6 | C7 | C8 | C9 | 90.0° | 0.0° |
| C6 | C7 | C8 | O5 | 90.0° | 180.0° |
| C6 | C7 | N4 | O3 | 90.0° | 180.0° |
| C6 | C7 | N4 | O4 | 90.0° | 0.0° |
| HC6 | C6 | C7 | C8 | 90.0° | 179.9° |
| HC6 | C6 | C7 | N4 | 90.0° | 0.1° |
| C7 | C8 | C9 | O5 | 90.0° | 180.0° |
| C7 | C8 | C9 | C10 | 90.0° | 0.0° |
| C7 | C8 | C9 | I | 90.0° | 179.9° |
| C8 | C7 | N4 | O3 | 90.0° | 0.0° |
| C8 | C7 | N4 | O4 | 90.0° | 179.9° |
| C7 | C8 | O5 | HO5 | 90.0° | 134.7° |
| N4 | C7 | C8 | C9 | 90.0° | 180.0° |
| N4 | C7 | C8 | O5 | 90.0° | 0.0° |
| C7 | N4 | O3 | O4 | 90.0° | 179.9° |
| C8 | C9 | C10 | I | 90.0° | 179.9° |
| C8 | C9 | C10 | H10 | 90.0° | 179.9° |
| C9 | C8 | O5 | HO5 | 90.0° | 45.3° |
| O5 | C8 | C9 | C10 | 90.0° | 179.9° |
| O5 | C8 | C9 | I | 90.0° | 0.1° |
| I | C9 | C10 | H10 | 90.0° | 0.0° |
