PRD_000308
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | sing | 1.43Å | 1.41Å | |
| C | CZ | sing | 1.53Å | 1.54Å | |
| C | CA | sing | 1.53Å | 1.52Å | |
| CZ | HZA | sing | 1.09Å | 1.10Å | |
| CZ | HZB | sing | 1.09Å | 1.10Å | |
| CZ | N1 | sing | 1.47Å | 1.32Å | |
| CA | N | sing | 1.47Å | 1.47Å | |
| CA | CB | sing | 1.53Å | 1.53Å | |
| CA | HA | sing | 1.09Å | 1.10Å | |
| N | HN | sing | 1.01Å | 1.00Å | |
| N | HNA | sing | 1.01Å | 1.00Å | |
| CB | CG | sing | 1.53Å | 1.53Å | |
| CB | HB | sing | 1.09Å | 1.10Å | |
| CB | HBA | sing | 1.09Å | 1.10Å | |
| CG | CD2 | sing | 1.53Å | 1.53Å | |
| CG | CD1 | sing | 1.53Å | 1.53Å | |
| CG | HG | sing | 1.09Å | 1.10Å | |
| CD2 | HD2 | sing | 1.09Å | 1.10Å | |
| CD2 | HD2A | sing | 1.09Å | 1.10Å | |
| CD2 | HD2B | sing | 1.09Å | 1.10Å | |
| CD1 | HD1 | sing | 1.09Å | 1.10Å | |
| CD1 | HD1A | sing | 1.09Å | 1.10Å | |
| CD1 | HD1B | sing | 1.09Å | 1.10Å | |
| N1 | CA1 | sing | 1.47Å | 1.47Å | |
| N1 | H | sing | 1.01Å | 1.00Å | |
| CA1 | C1 | sing | 1.51Å | 1.52Å | |
| CA1 | CB1 | sing | 1.53Å | 1.53Å | |
| CA1 | HA1 | sing | 1.09Å | 1.10Å | |
| C1 | O1 | doub | 1.21Å | 1.24Å | |
| C1 | N2 | sing | 1.35Å | 1.31Å | |
| CB1 | CG1 | sing | 1.53Å | 1.53Å | |
| CB1 | CG2 | sing | 1.53Å | 1.53Å | |
| CB1 | HB1 | sing | 1.09Å | 1.10Å | |
| CG1 | HG11 | sing | 1.09Å | 1.10Å | |
| CG1 | HG12 | sing | 1.09Å | 1.10Å | |
| CG1 | HG13 | sing | 1.09Å | 1.10Å | |
| CG2 | HG21 | sing | 1.09Å | 1.10Å | |
| CG2 | HG22 | sing | 1.09Å | 1.10Å | |
| CG2 | HG23 | sing | 1.09Å | 1.10Å | |
| N2 | CA2 | sing | 1.46Å | 1.46Å | |
| N2 | H1 | sing | 0.97Å | 1.00Å | |
| CA2 | C2 | sing | 1.51Å | 1.53Å | |
| CA2 | CB2 | sing | 1.53Å | 1.53Å | |
| CA2 | HA2 | sing | 1.09Å | 1.10Å | |
| C2 | O2 | doub | 1.21Å | 1.24Å | |
| C2 | N3 | sing | 1.35Å | 1.32Å | |
| CB2 | CG11 | sing | 1.53Å | 1.53Å | |
| CB2 | CG21 | sing | 1.53Å | 1.53Å | |
| CB2 | HB2 | sing | 1.09Å | 1.10Å | |
| CG11 | CD11 | sing | 1.53Å | 1.53Å | |
| CG11 | HG14 | sing | 1.09Å | 1.10Å | |
| CG11 | HG15 | sing | 1.09Å | 1.10Å | |
| CG21 | HG24 | sing | 1.09Å | 1.10Å | |
| CG21 | HG25 | sing | 1.09Å | 1.10Å | |
| CG21 | HG26 | sing | 1.09Å | 1.10Å | |
| CD11 | HD11 | sing | 1.09Å | 1.10Å | |
| CD11 | HD12 | sing | 1.09Å | 1.10Å | |
| CD11 | HD13 | sing | 1.09Å | 1.10Å | |
| N3 | CA3 | sing | 1.46Å | 1.47Å | |
| N3 | HN2 | sing | 0.97Å | 1.00Å | |
| CA3 | C3 | sing | 1.51Å | 1.53Å | |
| CA3 | CB3 | sing | 1.53Å | 1.53Å | |
| CA3 | HA3 | sing | 1.09Å | 1.10Å | |
| C3 | O3 | doub | 1.21Å | 1.24Å | |
| C3 | OXT | sing | 1.34Å | 1.42Å | |
| CB3 | CG3 | sing | 1.51Å | 1.53Å | |
| CB3 | HBC1 | sing | 1.09Å | 1.10Å | |
| CB3 | HBC2 | sing | 1.09Å | 1.10Å | |
| CG3 | CD12 | sing | 1.38Å | 1.40Å | Aromatic |
| CG3 | CD21 | doub | 1.38Å | 1.40Å | Aromatic |
| CD12 | CE1 | doub | 1.38Å | 1.40Å | Aromatic |
| CD12 | HD14 | sing | 1.08Å | 1.08Å | |
| CD21 | CE2 | sing | 1.38Å | 1.40Å | Aromatic |
| CD21 | HD21 | sing | 1.08Å | 1.08Å | |
| CE1 | CZ1 | sing | 1.38Å | 1.40Å | Aromatic |
| CE1 | HE1 | sing | 1.08Å | 1.08Å | |
| CE2 | CZ1 | doub | 1.38Å | 1.40Å | Aromatic |
| CE2 | HE2 | sing | 1.08Å | 1.08Å | |
| CZ1 | HZ | sing | 1.08Å | 1.08Å | |
| CM | HMC1 | sing | 1.09Å | 1.10Å | |
| CM | HMC2 | sing | 1.09Å | 1.10Å | |
| CM | HMC3 | sing | 1.09Å | 1.10Å | |
| OXT | CM | sing | 1.45Å | 1.42Å | |
| O | H47 | sing | 0.97Å | 0.95Å | |
| C | H48 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | CZ | 111.6° | 109.5° |
| O | C | CA | 109.3° | 109.5° |
| C | O | H47 | 109.5° | 114.0° |
| O | C | H48 | 109.4° | 109.5° |
| CZ | C | CA | 112.9° | 109.4° |
| C | CZ | HZA | 107.8° | 109.5° |
| C | CZ | HZB | 107.8° | 109.5° |
| C | CZ | N1 | 114.6° | 109.5° |
| CZ | C | H48 | 105.6° | 109.5° |
| C | CA | N | 110.1° | 109.5° |
| C | CA | CB | 106.4° | 109.5° |
| C | CA | HA | 111.2° | 109.5° |
| CA | C | H48 | 108.0° | 109.4° |
| HZA | CZ | HZB | 111.1° | 109.4° |
| HZA | CZ | N1 | 107.8° | 109.5° |
| HZB | CZ | N1 | 107.8° | 109.4° |
| CZ | N1 | CA1 | 122.6° | 111.0° |
| CZ | N1 | H | 105.3° | 111.0° |
| N | CA | CB | 110.0° | 109.4° |
| N | CA | HA | 107.8° | 109.5° |
| CA | N | HN | 109.5° | 111.0° |
| CA | N | HNA | 109.4° | 111.0° |
| CB | CA | HA | 111.3° | 109.5° |
| CA | CB | CG | 113.0° | 109.5° |
| CA | CB | HB | 108.3° | 109.5° |
| CA | CB | HBA | 108.3° | 109.4° |
| HN | N | HNA | 109.5° | 111.0° |
| CG | CB | HB | 108.3° | 109.5° |
| CG | CB | HBA | 108.3° | 109.4° |
| CB | CG | CD2 | 113.0° | 109.5° |
| CB | CG | CD1 | 113.0° | 109.5° |
| CB | CG | HG | 103.4° | 109.5° |
| HB | CB | HBA | 110.6° | 109.5° |
| CD2 | CG | CD1 | 105.8° | 109.5° |
| CD2 | CG | HG | 110.9° | 109.4° |
| CG | CD2 | HD2 | 109.5° | 109.4° |
| CG | CD2 | HD2A | 109.5° | 109.5° |
| CG | CD2 | HD2B | 109.5° | 109.5° |
| CD1 | CG | HG | 110.9° | 109.4° |
| CG | CD1 | HD1 | 109.5° | 109.5° |
| CG | CD1 | HD1A | 109.5° | 109.5° |
| CG | CD1 | HD1B | 109.5° | 109.4° |
| HD2 | CD2 | HD2A | 109.5° | 109.4° |
| HD2 | CD2 | HD2B | 109.4° | 109.5° |
| HD2A | CD2 | HD2B | 109.5° | 109.5° |
| HD1 | CD1 | HD1A | 109.5° | 109.5° |
| HD1 | CD1 | HD1B | 109.5° | 109.5° |
| HD1A | CD1 | HD1B | 109.4° | 109.5° |
| CA1 | N1 | H | 105.3° | 111.0° |
| N1 | CA1 | C1 | 110.2° | 109.5° |
| N1 | CA1 | CB1 | 110.6° | 109.5° |
| N1 | CA1 | HA1 | 106.7° | 109.4° |
| C1 | CA1 | CB1 | 104.2° | 109.5° |
| C1 | CA1 | HA1 | 112.8° | 109.5° |
| CA1 | C1 | O1 | 121.0° | 120.0° |
| CA1 | C1 | N2 | 114.1° | 120.0° |
| CB1 | CA1 | HA1 | 112.4° | 109.5° |
| CA1 | CB1 | CG1 | 112.9° | 109.5° |
| CA1 | CB1 | CG2 | 113.1° | 109.5° |
| CA1 | CB1 | HB1 | 103.3° | 109.5° |
| O1 | C1 | N2 | 124.9° | 120.0° |
| C1 | N2 | CA2 | 122.6° | 120.0° |
| C1 | N2 | H1 | 118.7° | 119.9° |
| CG1 | CB1 | CG2 | 105.8° | 109.5° |
| CG1 | CB1 | HB1 | 111.0° | 109.5° |
| CB1 | CG1 | HG11 | 109.5° | 109.5° |
| CB1 | CG1 | HG12 | 109.5° | 109.5° |
| CB1 | CG1 | HG13 | 109.5° | 109.5° |
| CG2 | CB1 | HB1 | 110.8° | 109.5° |
| CB1 | CG2 | HG21 | 109.5° | 109.5° |
| CB1 | CG2 | HG22 | 109.5° | 109.5° |
| CB1 | CG2 | HG23 | 109.5° | 109.5° |
| HG11 | CG1 | HG12 | 109.5° | 109.5° |
| HG11 | CG1 | HG13 | 109.5° | 109.4° |
| HG12 | CG1 | HG13 | 109.5° | 109.5° |
| HG21 | CG2 | HG22 | 109.4° | 109.5° |
| HG21 | CG2 | HG23 | 109.5° | 109.5° |
| HG22 | CG2 | HG23 | 109.5° | 109.5° |
| CA2 | N2 | H1 | 118.7° | 120.0° |
| N2 | CA2 | C2 | 109.6° | 109.5° |
| N2 | CA2 | CB2 | 110.0° | 109.5° |
| N2 | CA2 | HA2 | 109.1° | 109.5° |
| C2 | CA2 | CB2 | 109.6° | 109.5° |
| C2 | CA2 | HA2 | 109.5° | 109.5° |
| CA2 | C2 | O2 | 121.0° | 120.0° |
| CA2 | C2 | N3 | 114.0° | 120.0° |
| CB2 | CA2 | HA2 | 109.1° | 109.4° |
| CA2 | CB2 | CG11 | 112.9° | 109.5° |
| CA2 | CB2 | CG21 | 113.0° | 109.4° |
| CA2 | CB2 | HB2 | 103.5° | 109.5° |
| O2 | C2 | N3 | 125.0° | 120.0° |
| C2 | N3 | CA3 | 123.0° | 120.0° |
| C2 | N3 | HN2 | 118.5° | 120.0° |
| CG11 | CB2 | CG21 | 105.9° | 109.5° |
| CG11 | CB2 | HB2 | 110.9° | 109.5° |
| CB2 | CG11 | CD11 | 113.0° | 109.5° |
| CB2 | CG11 | HG14 | 108.3° | 109.4° |
| CB2 | CG11 | HG15 | 108.3° | 109.5° |
| CG21 | CB2 | HB2 | 110.8° | 109.5° |
| CB2 | CG21 | HG24 | 109.5° | 109.5° |
| CB2 | CG21 | HG25 | 109.5° | 109.5° |
| CB2 | CG21 | HG26 | 109.5° | 109.5° |
| CD11 | CG11 | HG14 | 108.3° | 109.4° |
| CD11 | CG11 | HG15 | 108.4° | 109.5° |
| CG11 | CD11 | HD11 | 109.5° | 109.5° |
| CG11 | CD11 | HD12 | 109.5° | 109.4° |
| CG11 | CD11 | HD13 | 109.5° | 109.5° |
| HG14 | CG11 | HG15 | 110.6° | 109.5° |
| HG24 | CG21 | HG25 | 109.5° | 109.4° |
| HG24 | CG21 | HG26 | 109.5° | 109.5° |
| HG25 | CG21 | HG26 | 109.5° | 109.5° |
| HD11 | CD11 | HD12 | 109.5° | 109.5° |
| HD11 | CD11 | HD13 | 109.4° | 109.5° |
| HD12 | CD11 | HD13 | 109.5° | 109.5° |
| CA3 | N3 | HN2 | 118.5° | 120.0° |
| N3 | CA3 | C3 | 109.9° | 109.5° |
| N3 | CA3 | CB3 | 110.0° | 109.5° |
| N3 | CA3 | HA3 | 108.6° | 109.5° |
| C3 | CA3 | CB3 | 108.7° | 109.5° |
| C3 | CA3 | HA3 | 109.8° | 109.5° |
| CA3 | C3 | O3 | 121.0° | 120.0° |
| CA3 | C3 | OXT | 120.0° | 120.0° |
| CB3 | CA3 | HA3 | 109.8° | 109.4° |
| CA3 | CB3 | CG3 | 113.2° | 109.6° |
| CA3 | CB3 | HBC1 | 108.2° | 109.4° |
| CA3 | CB3 | HBC2 | 108.3° | 109.5° |
| O3 | C3 | OXT | 119.0° | 120.0° |
| C3 | OXT | CM | 110.0° | 117.0° |
| CG3 | CB3 | HBC1 | 108.3° | 109.5° |
| CG3 | CB3 | HBC2 | 108.2° | 109.5° |
| CB3 | CG3 | CD12 | 120.1° | 120.0° |
| CB3 | CG3 | CD21 | 120.0° | 120.0° |
| HBC1 | CB3 | HBC2 | 110.7° | 109.4° |
| CD12 | CG3 | CD21 | 119.9° | 120.0° |
| CG3 | CD12 | CE1 | 120.0° | 120.0° |
| CG3 | CD12 | HD14 | 120.0° | 120.0° |
| CG3 | CD21 | CE2 | 120.0° | 120.0° |
| CG3 | CD21 | HD21 | 120.0° | 120.0° |
| CE1 | CD12 | HD14 | 120.0° | 120.0° |
| CD12 | CE1 | CZ1 | 120.0° | 120.0° |
| CD12 | CE1 | HE1 | 120.0° | 120.0° |
| CE2 | CD21 | HD21 | 120.0° | 119.9° |
| CD21 | CE2 | CZ1 | 120.0° | 119.9° |
| CD21 | CE2 | HE2 | 120.0° | 120.1° |
| CZ1 | CE1 | HE1 | 120.0° | 120.0° |
| CE1 | CZ1 | CE2 | 120.0° | 120.1° |
| CE1 | CZ1 | HZ | 120.0° | 120.0° |
| CZ1 | CE2 | HE2 | 120.0° | 120.0° |
| CE2 | CZ1 | HZ | 120.0° | 120.0° |
| HMC1 | CM | HMC2 | 109.4° | 109.5° |
| HMC1 | CM | HMC3 | 109.5° | 109.4° |
| HMC1 | CM | OXT | 109.5° | 109.5° |
| HMC2 | CM | HMC3 | 109.5° | 109.5° |
| HMC2 | CM | OXT | 109.5° | 109.5° |
| HMC3 | CM | OXT | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | CZ | CA | 123.5° | 120.0° |
| O | C | CZ | H48 | 118.7° | 120.1° |
| O | C | CA | H48 | 118.9° | 120.0° |
| O | C | CZ | HZA | 138.1° | 60.0° |
| O | C | CZ | HZB | 101.9° | 180.0° |
| O | C | CZ | N1 | 18.1° | 60.1° |
| O | C | CA | N | 55.3° | 60.0° |
| O | C | CA | CB | 63.9° | 60.0° |
| O | C | CA | HA | 174.7° | 180.0° |
| CZ | C | CA | H48 | 116.3° | 120.0° |
| C | CZ | HZA | HZB | 117.9° | 120.0° |
| C | CZ | HZA | N1 | 124.3° | 120.0° |
| C | CZ | HZB | N1 | 124.2° | 120.0° |
| CZ | C | CA | N | 69.5° | 60.0° |
| CZ | C | CA | CB | 171.3° | 180.0° |
| CZ | C | CA | HA | 49.9° | 60.0° |
| C | CZ | N1 | CA1 | 155.8° | 174.6° |
| C | CZ | N1 | H | 35.8° | 61.4° |
| CZ | C | O | H47 | 180.0° | 60.0° |
| CA | C | CZ | HZA | 14.5° | 60.0° |
| CA | C | CZ | HZB | 134.5° | 60.0° |
| CA | C | CZ | N1 | 105.5° | 180.0° |
| C | CA | N | CB | 117.0° | 120.0° |
| C | CA | N | HA | 121.5° | 120.1° |
| C | CA | CB | HA | 121.4° | 120.1° |
| C | CA | N | HN | 180.0° | 66.3° |
| C | CA | N | HNA | 60.0° | 169.7° |
| C | CA | CB | CG | 130.9° | 174.7° |
| C | CA | CB | HB | 109.1° | 65.3° |
| C | CA | CB | HBA | 10.9° | 54.8° |
| CA | C | O | H47 | 54.5° | 60.0° |
| HZA | CZ | HZB | N1 | 117.9° | 120.0° |
| HZA | CZ | N1 | CA1 | 84.2° | 54.5° |
| HZA | CZ | N1 | H | 155.8° | 178.5° |
| HZA | CZ | C | H48 | 103.2° | 179.9° |
| HZB | CZ | N1 | CA1 | 35.8° | 65.4° |
| HZB | CZ | N1 | H | 84.2° | 58.6° |
| HZB | CZ | C | H48 | 16.8° | 60.0° |
| CZ | N1 | CA1 | H | 120.0° | 124.0° |
| CZ | N1 | CA1 | C1 | 12.0° | 136.0° |
| CZ | N1 | CA1 | CB1 | 126.7° | 104.0° |
| CZ | N1 | CA1 | HA1 | 110.8° | 16.0° |
| N1 | CZ | C | H48 | 136.8° | 60.0° |
| N | CA | CB | HA | 119.4° | 120.0° |
| CA | N | HN | HNA | 120.0° | 124.0° |
| N | CA | CB | CG | 109.9° | 65.3° |
| N | CA | CB | HB | 10.1° | 54.7° |
| N | CA | CB | HBA | 130.1° | 174.7° |
| N | CA | C | H48 | 174.2° | 180.0° |
| CB | CA | N | HN | 63.0° | 53.6° |
| CB | CA | N | HNA | 177.0° | 70.4° |
| CA | CB | CG | HB | 120.0° | 120.1° |
| CA | CB | CG | HBA | 120.0° | 119.9° |
| CA | CB | HB | HBA | 118.5° | 120.0° |
| CA | CB | CG | CD2 | 55.9° | 172.6° |
| CA | CB | CG | CD1 | 176.0° | 67.4° |
| CA | CB | CG | HG | 64.0° | 52.6° |
| CB | CA | C | H48 | 55.0° | 60.0° |
| HA | CA | N | HN | 58.5° | 173.6° |
| HA | CA | N | HNA | 61.5° | 49.6° |
| HA | CA | CB | CG | 9.5° | 54.6° |
| HA | CA | CB | HB | 129.5° | 174.6° |
| HA | CA | CB | HBA | 110.5° | 65.3° |
| HA | CA | C | H48 | 66.4° | 60.0° |
| CG | CB | HB | HBA | 118.6° | 120.0° |
| CB | CG | CD2 | CD1 | 124.1° | 120.1° |
| CB | CG | CD2 | HG | 115.6° | 120.0° |
| CB | CG | CD1 | HG | 115.6° | 120.0° |
| CB | CG | CD2 | HD2 | 180.0° | 64.9° |
| CB | CG | CD2 | HD2A | 60.0° | 175.2° |
| CB | CG | CD2 | HD2B | 60.0° | 55.1° |
| CB | CG | CD1 | HD1 | 180.0° | 60.0° |
| CB | CG | CD1 | HD1A | 60.0° | 180.0° |
| CB | CG | CD1 | HD1B | 60.0° | 60.0° |
| HB | CB | CG | CD2 | 176.0° | 52.5° |
| HB | CB | CG | CD1 | 64.0° | 172.6° |
| HB | CB | CG | HG | 56.0° | 67.4° |
| HBA | CB | CG | CD2 | 64.0° | 67.5° |
| HBA | CB | CG | CD1 | 56.0° | 52.6° |
| HBA | CB | CG | HG | 176.0° | 172.6° |
| CD2 | CG | CD1 | HG | 120.3° | 119.9° |
| CG | CD2 | HD2 | HD2A | 120.0° | 120.0° |
| CG | CD2 | HD2 | HD2B | 120.0° | 120.0° |
| CG | CD2 | HD2A | HD2B | 120.0° | 120.1° |
| CD2 | CG | CD1 | HD1 | 55.9° | 180.0° |
| CD2 | CG | CD1 | HD1A | 175.9° | 60.0° |
| CD2 | CG | CD1 | HD1B | 64.1° | 60.0° |
| CD1 | CG | CD2 | HD2 | 55.9° | 55.2° |
| CD1 | CG | CD2 | HD2A | 64.1° | 64.8° |
| CD1 | CG | CD2 | HD2B | 175.9° | 175.2° |
| CG | CD1 | HD1 | HD1A | 120.0° | 120.0° |
| CG | CD1 | HD1 | HD1B | 120.0° | 120.0° |
| CG | CD1 | HD1A | HD1B | 120.0° | 119.9° |
| HG | CG | CD2 | HD2 | 64.4° | 175.1° |
| HG | CG | CD2 | HD2A | 175.6° | 55.2° |
| HG | CG | CD2 | HD2B | 55.5° | 64.9° |
| HG | CG | CD1 | HD1 | 64.4° | 60.1° |
| HG | CG | CD1 | HD1A | 55.6° | 60.0° |
| HG | CG | CD1 | HD1B | 175.6° | 179.9° |
| HD2 | CD2 | HD2A | HD2B | 119.9° | 120.0° |
| HD1 | CD1 | HD1A | HD1B | 120.0° | 120.0° |
| N1 | CA1 | C1 | CB1 | 118.7° | 120.0° |
| N1 | CA1 | C1 | HA1 | 119.1° | 120.0° |
| N1 | CA1 | CB1 | HA1 | 119.1° | 120.0° |
| N1 | CA1 | C1 | O1 | 68.2° | 8.3° |
| N1 | CA1 | C1 | N2 | 112.0° | 171.6° |
| N1 | CA1 | CB1 | CG1 | 170.7° | 59.2° |
| N1 | CA1 | CB1 | CG2 | 69.2° | 60.8° |
| N1 | CA1 | CB1 | HB1 | 50.7° | 179.2° |
| H | N1 | CA1 | C1 | 132.0° | 100.0° |
| H | N1 | CA1 | CB1 | 113.3° | 20.0° |
| H | N1 | CA1 | HA1 | 9.3° | 140.0° |
| C1 | CA1 | CB1 | HA1 | 122.5° | 120.0° |
| CA1 | C1 | O1 | N2 | 179.8° | 180.0° |
| C1 | CA1 | CB1 | CG1 | 52.3° | 179.2° |
| C1 | CA1 | CB1 | CG2 | 172.4° | 59.3° |
| C1 | CA1 | CB1 | HB1 | 67.7° | 60.8° |
| CA1 | C1 | N2 | CA2 | 177.1° | 174.9° |
| CA1 | C1 | N2 | H1 | 2.9° | 5.0° |
| CB1 | CA1 | C1 | O1 | 50.5° | 111.7° |
| CB1 | CA1 | C1 | N2 | 129.3° | 68.3° |
| CA1 | CB1 | CG1 | CG2 | 124.2° | 120.0° |
| CA1 | CB1 | CG1 | HB1 | 115.5° | 120.0° |
| CA1 | CB1 | CG2 | HB1 | 115.5° | 120.0° |
| CA1 | CB1 | CG1 | HG11 | 180.0° | 66.4° |
| CA1 | CB1 | CG1 | HG12 | 60.0° | 173.6° |
| CA1 | CB1 | CG1 | HG13 | 60.0° | 53.6° |
| CA1 | CB1 | CG2 | HG21 | 180.0° | 56.1° |
| CA1 | CB1 | CG2 | HG22 | 60.0° | 63.9° |
| CA1 | CB1 | CG2 | HG23 | 60.0° | 176.1° |
| HA1 | CA1 | C1 | O1 | 172.7° | 128.3° |
| HA1 | CA1 | C1 | N2 | 7.1° | 51.7° |
| HA1 | CA1 | CB1 | CG1 | 70.2° | 60.7° |
| HA1 | CA1 | CB1 | CG2 | 49.9° | 179.3° |
| HA1 | CA1 | CB1 | HB1 | 169.8° | 59.3° |
| O1 | C1 | N2 | CA2 | 2.6° | 5.0° |
| O1 | C1 | N2 | H1 | 177.4° | 175.0° |
| C1 | N2 | CA2 | H1 | 180.0° | 180.0° |
| C1 | N2 | CA2 | C2 | 63.2° | 157.0° |
| C1 | N2 | CA2 | CB2 | 176.3° | 83.0° |
| C1 | N2 | CA2 | HA2 | 56.7° | 36.9° |
| CG1 | CB1 | CG2 | HB1 | 120.4° | 120.0° |
| CB1 | CG1 | HG11 | HG12 | 120.0° | 120.0° |
| CB1 | CG1 | HG11 | HG13 | 120.0° | 120.0° |
| CB1 | CG1 | HG12 | HG13 | 120.0° | 120.0° |
| CG1 | CB1 | CG2 | HG21 | 55.9° | 63.9° |
| CG1 | CB1 | CG2 | HG22 | 64.1° | 176.1° |
| CG1 | CB1 | CG2 | HG23 | 175.9° | 56.1° |
| CG2 | CB1 | CG1 | HG11 | 55.8° | 53.6° |
| CG2 | CB1 | CG1 | HG12 | 175.8° | 66.4° |
| CG2 | CB1 | CG1 | HG13 | 64.2° | 173.6° |
| CB1 | CG2 | HG21 | HG22 | 120.0° | 120.0° |
| CB1 | CG2 | HG21 | HG23 | 120.0° | 120.0° |
| CB1 | CG2 | HG22 | HG23 | 120.0° | 120.0° |
| HB1 | CB1 | CG1 | HG11 | 64.5° | 173.6° |
| HB1 | CB1 | CG1 | HG12 | 55.5° | 53.6° |
| HB1 | CB1 | CG1 | HG13 | 175.5° | 66.4° |
| HB1 | CB1 | CG2 | HG21 | 64.5° | 176.1° |
| HB1 | CB1 | CG2 | HG22 | 175.5° | 56.1° |
| HB1 | CB1 | CG2 | HG23 | 55.5° | 63.9° |
| HG11 | CG1 | HG12 | HG13 | 120.0° | 120.0° |
| HG21 | CG2 | HG22 | HG23 | 120.0° | 120.0° |
| N2 | CA2 | C2 | CB2 | 120.8° | 120.0° |
| N2 | CA2 | C2 | HA2 | 119.6° | 120.0° |
| N2 | CA2 | CB2 | HA2 | 119.6° | 120.0° |
| N2 | CA2 | C2 | O2 | 53.1° | 11.4° |
| N2 | CA2 | C2 | N3 | 126.1° | 168.5° |
| N2 | CA2 | CB2 | CG11 | 172.1° | 174.6° |
| N2 | CA2 | CB2 | CG21 | 51.9° | 65.4° |
| N2 | CA2 | CB2 | HB2 | 68.0° | 54.6° |
| H1 | N2 | CA2 | C2 | 116.8° | 23.0° |
| H1 | N2 | CA2 | CB2 | 3.7° | 97.0° |
| H1 | N2 | CA2 | HA2 | 123.3° | 143.1° |
| C2 | CA2 | CB2 | HA2 | 119.9° | 120.0° |
| CA2 | C2 | O2 | N3 | 179.2° | 180.0° |
| C2 | CA2 | CB2 | CG11 | 51.6° | 65.4° |
| C2 | CA2 | CB2 | CG21 | 68.6° | 54.6° |
| C2 | CA2 | CB2 | HB2 | 171.5° | 174.6° |
| CA2 | C2 | N3 | CA3 | 179.7° | 177.0° |
| CA2 | C2 | N3 | HN2 | 0.3° | 2.9° |
| CB2 | CA2 | C2 | O2 | 67.6° | 108.6° |
| CB2 | CA2 | C2 | N3 | 113.1° | 71.4° |
| CA2 | CB2 | CG11 | CG21 | 124.2° | 119.9° |
| CA2 | CB2 | CG11 | HB2 | 115.6° | 120.0° |
| CA2 | CB2 | CG21 | HB2 | 115.6° | 120.0° |
| CA2 | CB2 | CG11 | CD11 | 139.5° | 66.7° |
| CA2 | CB2 | CG11 | HG14 | 100.5° | 173.3° |
| CA2 | CB2 | CG11 | HG15 | 19.5° | 53.3° |
| CA2 | CB2 | CG21 | HG24 | 180.0° | 65.1° |
| CA2 | CB2 | CG21 | HG25 | 60.0° | 174.9° |
| CA2 | CB2 | CG21 | HG26 | 60.0° | 55.0° |
| HA2 | CA2 | C2 | O2 | 172.7° | 131.5° |
| HA2 | CA2 | C2 | N3 | 6.5° | 48.5° |
| HA2 | CA2 | CB2 | CG11 | 68.3° | 54.6° |
| HA2 | CA2 | CB2 | CG21 | 171.5° | 174.6° |
| HA2 | CA2 | CB2 | HB2 | 51.7° | 65.4° |
| O2 | C2 | N3 | CA3 | 0.5° | 3.0° |
| O2 | C2 | N3 | HN2 | 179.5° | 177.0° |
| C2 | N3 | CA3 | HN2 | 180.0° | 180.0° |
| C2 | N3 | CA3 | C3 | 110.8° | 85.0° |
| C2 | N3 | CA3 | CB3 | 129.5° | 155.0° |
| C2 | N3 | CA3 | HA3 | 9.4° | 35.1° |
| CG11 | CB2 | CG21 | HB2 | 120.3° | 120.1° |
| CB2 | CG11 | CD11 | HG14 | 120.0° | 119.9° |
| CB2 | CG11 | CD11 | HG15 | 120.0° | 120.0° |
| CB2 | CG11 | HG14 | HG15 | 118.5° | 120.0° |
| CG11 | CB2 | CG21 | HG24 | 55.9° | 54.8° |
| CG11 | CB2 | CG21 | HG25 | 175.9° | 65.1° |
| CG11 | CB2 | CG21 | HG26 | 64.1° | 174.9° |
| CB2 | CG11 | CD11 | HD11 | 180.0° | 176.4° |
| CB2 | CG11 | CD11 | HD12 | 60.0° | 56.4° |
| CB2 | CG11 | CD11 | HD13 | 60.0° | 63.5° |
| CG21 | CB2 | CG11 | CD11 | 96.3° | 173.4° |
| CG21 | CB2 | CG11 | HG14 | 23.7° | 53.4° |
| CG21 | CB2 | CG11 | HG15 | 143.7° | 66.6° |
| CB2 | CG21 | HG24 | HG25 | 120.0° | 120.0° |
| CB2 | CG21 | HG24 | HG26 | 120.0° | 120.1° |
| CB2 | CG21 | HG25 | HG26 | 120.0° | 120.0° |
| HB2 | CB2 | CG11 | CD11 | 23.9° | 53.3° |
| HB2 | CB2 | CG11 | HG14 | 144.0° | 66.6° |
| HB2 | CB2 | CG11 | HG15 | 96.1° | 173.3° |
| HB2 | CB2 | CG21 | HG24 | 64.4° | 174.9° |
| HB2 | CB2 | CG21 | HG25 | 55.6° | 55.0° |
| HB2 | CB2 | CG21 | HG26 | 175.6° | 65.0° |
| CD11 | CG11 | HG14 | HG15 | 118.6° | 120.0° |
| CG11 | CD11 | HD11 | HD12 | 120.0° | 120.0° |
| CG11 | CD11 | HD11 | HD13 | 120.0° | 120.0° |
| CG11 | CD11 | HD12 | HD13 | 120.0° | 120.0° |
| HG14 | CG11 | CD11 | HD11 | 60.0° | 63.6° |
| HG14 | CG11 | CD11 | HD12 | 180.0° | 176.4° |
| HG14 | CG11 | CD11 | HD13 | 60.0° | 56.4° |
| HG15 | CG11 | CD11 | HD11 | 60.0° | 56.4° |
| HG15 | CG11 | CD11 | HD12 | 60.0° | 63.6° |
| HG15 | CG11 | CD11 | HD13 | 180.0° | 176.4° |
| HG24 | CG21 | HG25 | HG26 | 120.0° | 120.0° |
| HD11 | CD11 | HD12 | HD13 | 120.0° | 120.0° |
| N3 | CA3 | C3 | CB3 | 120.5° | 120.1° |
| N3 | CA3 | C3 | HA3 | 119.4° | 120.0° |
| N3 | CA3 | CB3 | HA3 | 119.4° | 120.0° |
| N3 | CA3 | C3 | O3 | 148.0° | 0.1° |
| N3 | CA3 | C3 | OXT | 32.0° | 180.0° |
| N3 | CA3 | CB3 | CG3 | 91.0° | 64.9° |
| N3 | CA3 | CB3 | HBC1 | 29.0° | 55.1° |
| N3 | CA3 | CB3 | HBC2 | 149.0° | 175.0° |
| HN2 | N3 | CA3 | C3 | 69.2° | 95.0° |
| HN2 | N3 | CA3 | CB3 | 50.5° | 25.1° |
| HN2 | N3 | CA3 | HA3 | 170.6° | 145.0° |
| C3 | CA3 | CB3 | HA3 | 120.2° | 120.0° |
| CA3 | C3 | O3 | OXT | 179.9° | 179.9° |
| C3 | CA3 | CB3 | CG3 | 148.6° | 175.0° |
| C3 | CA3 | CB3 | HBC1 | 91.4° | 65.0° |
| C3 | CA3 | CB3 | HBC2 | 28.6° | 54.9° |
| CA3 | C3 | OXT | CM | 107.1° | 180.0° |
| CB3 | CA3 | C3 | O3 | 27.5° | 120.1° |
| CB3 | CA3 | C3 | OXT | 152.4° | 60.0° |
| CA3 | CB3 | CG3 | HBC1 | 120.0° | 120.0° |
| CA3 | CB3 | CG3 | HBC2 | 120.0° | 120.1° |
| CA3 | CB3 | HBC1 | HBC2 | 118.5° | 120.0° |
| CA3 | CB3 | CG3 | CD12 | 28.9° | 89.9° |
| CA3 | CB3 | CG3 | CD21 | 151.2° | 90.3° |
| HA3 | CA3 | C3 | O3 | 92.6° | 120.0° |
| HA3 | CA3 | C3 | OXT | 87.4° | 59.9° |
| HA3 | CA3 | CB3 | CG3 | 28.4° | 55.0° |
| HA3 | CA3 | CB3 | HBC1 | 148.4° | 175.0° |
| HA3 | CA3 | CB3 | HBC2 | 91.6° | 65.1° |
| O3 | C3 | OXT | CM | 72.9° | 0.1° |
| C3 | OXT | CM | HMC1 | 180.0° | 60.0° |
| C3 | OXT | CM | HMC2 | 60.0° | 60.0° |
| C3 | OXT | CM | HMC3 | 60.0° | 179.9° |
| CG3 | CB3 | HBC1 | HBC2 | 118.5° | 120.0° |
| CB3 | CG3 | CD12 | CD21 | 179.9° | 179.8° |
| CB3 | CG3 | CD12 | CE1 | 179.8° | 180.0° |
| CB3 | CG3 | CD12 | HD14 | 0.3° | 0.0° |
| CB3 | CG3 | CD21 | CE2 | 179.7° | 179.9° |
| CB3 | CG3 | CD21 | HD21 | 0.3° | 0.0° |
| HBC1 | CB3 | CG3 | CD12 | 91.1° | 30.1° |
| HBC1 | CB3 | CG3 | CD21 | 88.8° | 149.7° |
| HBC2 | CB3 | CG3 | CD12 | 148.9° | 150.0° |
| HBC2 | CB3 | CG3 | CD21 | 31.2° | 29.8° |
| CG3 | CD12 | CE1 | HD14 | 180.0° | 180.0° |
| CD12 | CG3 | CD21 | CE2 | 0.1° | 0.3° |
| CD12 | CG3 | CD21 | HD21 | 179.8° | 179.8° |
| CG3 | CD12 | CE1 | CZ1 | 0.0° | 0.0° |
| CG3 | CD12 | CE1 | HE1 | 180.0° | 180.0° |
| CD21 | CG3 | CD12 | CE1 | 0.1° | 0.2° |
| CD21 | CG3 | CD12 | HD14 | 179.9° | 179.8° |
| CG3 | CD21 | CE2 | HD21 | 180.0° | 180.0° |
| CG3 | CD21 | CE2 | CZ1 | 0.1° | 0.0° |
| CG3 | CD21 | CE2 | HE2 | 179.9° | 180.0° |
| CD12 | CE1 | CZ1 | HE1 | 180.0° | 180.0° |
| CD12 | CE1 | CZ1 | CE2 | 0.1° | 0.2° |
| CD12 | CE1 | CZ1 | HZ | 180.0° | 180.0° |
| HD14 | CD12 | CE1 | CZ1 | 180.0° | 180.0° |
| HD14 | CD12 | CE1 | HE1 | 0.0° | 0.0° |
| CD21 | CE2 | CZ1 | CE1 | 0.0° | 0.2° |
| CD21 | CE2 | CZ1 | HE2 | 180.0° | 180.0° |
| CD21 | CE2 | CZ1 | HZ | 180.0° | 180.0° |
| HD21 | CD21 | CE2 | CZ1 | 179.9° | 180.0° |
| HD21 | CD21 | CE2 | HE2 | 0.1° | 0.0° |
| CE1 | CZ1 | CE2 | HZ | 180.0° | 179.8° |
| CE1 | CZ1 | CE2 | HE2 | 179.9° | 179.8° |
| HE1 | CE1 | CZ1 | CE2 | 180.0° | 179.8° |
| HE1 | CE1 | CZ1 | HZ | 0.0° | 0.0° |
| HE2 | CE2 | CZ1 | HZ | 0.0° | 0.0° |
| HMC1 | CM | HMC2 | HMC3 | 120.0° | 119.9° |
| HMC1 | CM | HMC2 | OXT | 120.0° | 120.0° |
| HMC1 | CM | HMC3 | OXT | 120.0° | 120.0° |
| HMC2 | CM | HMC3 | OXT | 120.0° | 120.0° |
| H47 | O | C | H48 | 63.6° | 180.0° |
