CRO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CG1 | CB1 | sing | 1.53Å | 1.50Å | |
| OG1 | CB1 | sing | 1.43Å | 1.41Å | |
| CB1 | CA1 | sing | 1.53Å | 1.54Å | |
| N1 | CA1 | sing | 1.47Å | 1.47Å | |
| OH | CZ | sing | 1.36Å | 1.48Å | |
| CE1 | CZ | doub | 1.39Å | 1.44Å | Aromatic |
| CE1 | CD1 | sing | 1.37Å | 1.43Å | Aromatic |
| CA1 | C1 | sing | 1.51Å | 1.51Å | |
| CZ | CE2 | sing | 1.39Å | 1.39Å | Aromatic |
| CD1 | CG2 | doub | 1.40Å | 1.41Å | Aromatic |
| N2 | C1 | doub | 1.30Å | 1.39Å | |
| N2 | CA2 | sing | 1.37Å | 1.41Å | |
| C1 | N3 | sing | 1.37Å | 1.34Å | |
| CE2 | CD2 | doub | 1.37Å | 1.41Å | Aromatic |
| CG2 | CD2 | sing | 1.40Å | 1.45Å | Aromatic |
| CG2 | CB2 | sing | 1.46Å | 1.49Å | |
| N3 | CA3 | sing | 1.46Å | 1.45Å | |
| N3 | C2 | sing | 1.35Å | 1.38Å | |
| CA2 | CB2 | doub | 1.38Å | 1.35Å | |
| CA2 | C2 | sing | 1.47Å | 1.48Å | |
| CA3 | C3 | sing | 1.51Å | 1.50Å | |
| OXT | C3 | sing | 1.34Å | 1.33Å | |
| C3 | O3 | doub | 1.21Å | 1.22Å | |
| C2 | O2 | doub | 1.22Å | 1.20Å | |
| N1 | H | sing | 1.01Å | 1.00Å | |
| N1 | H2 | sing | 1.01Å | 1.00Å | |
| CA1 | HA1 | sing | 1.09Å | 1.10Å | |
| 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 | |
| OG1 | HOG1 | sing | 0.97Å | 0.95Å | |
| CA3 | HA31 | sing | 1.09Å | 1.10Å | |
| CA3 | HA32 | sing | 1.09Å | 1.10Å | |
| OXT | HXT | sing | 0.97Å | 0.95Å | |
| CB2 | HB2 | sing | 1.08Å | 1.08Å | |
| CD1 | HD1 | sing | 1.08Å | 1.08Å | |
| CD2 | HD2 | sing | 1.08Å | 1.08Å | |
| CE1 | HE1 | sing | 1.08Å | 1.08Å | |
| CE2 | HE2 | sing | 1.08Å | 1.08Å | |
| OH | HOH | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CG1 | CB1 | OG1 | 109.9° | 109.5° |
| CG1 | CB1 | CA1 | 111.8° | 109.5° |
| CG1 | CB1 | HB1 | 108.0° | 109.5° |
| CB1 | CG1 | HG11 | 109.5° | 109.5° |
| CB1 | CG1 | HG12 | 109.4° | 109.5° |
| CB1 | CG1 | HG13 | 109.5° | 109.4° |
| OG1 | CB1 | CA1 | 110.1° | 109.5° |
| OG1 | CB1 | HB1 | 109.3° | 109.4° |
| CB1 | OG1 | HOG1 | 109.5° | 114.0° |
| CB1 | CA1 | N1 | 110.2° | 109.5° |
| CB1 | CA1 | C1 | 114.4° | 109.5° |
| CB1 | CA1 | HA1 | 108.7° | 109.4° |
| CA1 | CB1 | HB1 | 107.6° | 109.5° |
| N1 | CA1 | C1 | 104.8° | 109.5° |
| CA1 | N1 | H | 109.5° | 111.0° |
| CA1 | N1 | H2 | 109.5° | 110.9° |
| N1 | CA1 | HA1 | 109.6° | 109.5° |
| OH | CZ | CE1 | 119.6° | 119.9° |
| OH | CZ | CE2 | 119.4° | 119.8° |
| CZ | OH | HOH | 109.5° | 114.0° |
| CZ | CE1 | CD1 | 119.8° | 120.2° |
| CE1 | CZ | CE2 | 121.0° | 120.3° |
| CZ | CE1 | HE1 | 120.1° | 119.9° |
| CE1 | CD1 | CG2 | 119.0° | 119.8° |
| CE1 | CD1 | HD1 | 120.5° | 120.1° |
| CD1 | CE1 | HE1 | 120.1° | 119.9° |
| CA1 | C1 | N2 | 126.7° | 124.3° |
| CA1 | C1 | N3 | 124.9° | 124.3° |
| C1 | CA1 | HA1 | 109.1° | 109.5° |
| CZ | CE2 | CD2 | 119.9° | 120.1° |
| CZ | CE2 | HE2 | 120.1° | 120.0° |
| CD1 | CG2 | CD2 | 120.1° | 119.8° |
| CD1 | CG2 | CB2 | 122.3° | 120.1° |
| CG2 | CD1 | HD1 | 120.5° | 120.0° |
| C1 | N2 | CA2 | 106.5° | 109.3° |
| N2 | C1 | N3 | 108.5° | 111.4° |
| N2 | CA2 | CB2 | 126.4° | 127.1° |
| N2 | CA2 | C2 | 108.5° | 105.8° |
| C1 | N3 | CA3 | 121.9° | 125.8° |
| C1 | N3 | C2 | 113.9° | 108.3° |
| CE2 | CD2 | CG2 | 120.1° | 119.9° |
| CE2 | CD2 | HD2 | 120.0° | 120.0° |
| CD2 | CE2 | HE2 | 120.0° | 119.9° |
| CD2 | CG2 | CB2 | 117.4° | 120.1° |
| CG2 | CD2 | HD2 | 120.0° | 120.1° |
| CG2 | CB2 | CA2 | 126.5° | 120.0° |
| CG2 | CB2 | HB2 | 116.8° | 120.0° |
| CA3 | N3 | C2 | 121.9° | 125.8° |
| N3 | CA3 | C3 | 116.5° | 109.5° |
| N3 | CA3 | HA31 | 107.7° | 109.4° |
| N3 | CA3 | HA32 | 107.7° | 109.5° |
| N3 | C2 | CA2 | 102.0° | 105.3° |
| N3 | C2 | O2 | 130.8° | 127.4° |
| CB2 | CA2 | C2 | 124.6° | 127.2° |
| CA2 | CB2 | HB2 | 116.7° | 119.9° |
| CA2 | C2 | O2 | 124.9° | 127.4° |
| CA3 | C3 | OXT | 117.2° | 119.9° |
| CA3 | C3 | O3 | 118.7° | 120.0° |
| C3 | CA3 | HA31 | 107.7° | 109.5° |
| C3 | CA3 | HA32 | 107.7° | 109.5° |
| OXT | C3 | O3 | 124.1° | 120.0° |
| C3 | OXT | HXT | 109.5° | 117.0° |
| H | N1 | H2 | 109.4° | 111.1° |
| HG11 | CG1 | HG12 | 109.5° | 109.5° |
| HG11 | CG1 | HG13 | 109.5° | 109.5° |
| HG12 | CG1 | HG13 | 109.5° | 109.5° |
| HA31 | CA3 | HA32 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CG1 | CB1 | OG1 | CA1 | 123.6° | 120.0° |
| CG1 | CB1 | OG1 | HB1 | 118.4° | 120.0° |
| CG1 | CB1 | CA1 | HB1 | 118.5° | 120.0° |
| CG1 | CB1 | CA1 | N1 | 62.0° | 55.0° |
| CG1 | CB1 | CA1 | C1 | 179.8° | 175.0° |
| CG1 | CB1 | CA1 | HA1 | 58.1° | 65.0° |
| CB1 | CG1 | HG11 | HG12 | 120.0° | 120.0° |
| CB1 | CG1 | HG11 | HG13 | 120.0° | 119.9° |
| CB1 | CG1 | HG12 | HG13 | 120.0° | 119.9° |
| CG1 | CB1 | OG1 | HOG1 | 180.0° | 60.0° |
| OG1 | CB1 | CA1 | HB1 | 119.1° | 120.0° |
| OG1 | CB1 | CA1 | N1 | 60.5° | 65.0° |
| OG1 | CB1 | CA1 | C1 | 57.3° | 55.0° |
| OG1 | CB1 | CA1 | HA1 | 179.5° | 175.0° |
| OG1 | CB1 | CG1 | HG11 | 180.0° | 60.1° |
| OG1 | CB1 | CG1 | HG12 | 60.0° | 60.0° |
| OG1 | CB1 | CG1 | HG13 | 60.0° | 180.0° |
| CB1 | CA1 | N1 | C1 | 123.5° | 120.0° |
| CB1 | CA1 | N1 | HA1 | 119.5° | 120.0° |
| CB1 | CA1 | C1 | HA1 | 121.9° | 120.0° |
| CB1 | CA1 | C1 | N2 | 24.0° | 85.3° |
| CB1 | CA1 | C1 | N3 | 154.4° | 95.0° |
| CB1 | CA1 | N1 | H | 180.0° | 60.0° |
| CB1 | CA1 | N1 | H2 | 60.0° | 64.0° |
| CA1 | CB1 | CG1 | HG11 | 57.4° | 59.9° |
| CA1 | CB1 | CG1 | HG12 | 62.6° | 180.0° |
| CA1 | CB1 | CG1 | HG13 | 177.4° | 60.0° |
| CA1 | CB1 | OG1 | HOG1 | 56.4° | 60.0° |
| N1 | CA1 | C1 | HA1 | 117.3° | 120.0° |
| N1 | CA1 | C1 | N2 | 96.8° | 34.7° |
| N1 | CA1 | C1 | N3 | 84.8° | 145.0° |
| CA1 | N1 | H | H2 | 120.0° | 123.9° |
| N1 | CA1 | CB1 | HB1 | 179.5° | 175.0° |
| OH | CZ | CE1 | CE2 | 179.8° | 179.7° |
| OH | CZ | CE1 | CD1 | 177.5° | 180.0° |
| OH | CZ | CE2 | CD2 | 178.8° | 179.7° |
| OH | CZ | CE1 | HE1 | 2.5° | 0.3° |
| OH | CZ | CE2 | HE2 | 1.2° | 0.3° |
| CZ | CE1 | CD1 | HE1 | 180.0° | 179.6° |
| CZ | CE1 | CD1 | CG2 | 2.7° | 0.0° |
| CE1 | CZ | CE2 | CD2 | 1.4° | 0.6° |
| CZ | CE1 | CD1 | HD1 | 177.3° | 180.0° |
| CE1 | CZ | CE2 | HE2 | 178.6° | 180.0° |
| CE1 | CZ | OH | HOH | 180.0° | 90.0° |
| CD1 | CE1 | CZ | CE2 | 2.7° | 0.3° |
| CE1 | CD1 | CG2 | HD1 | 180.0° | 180.0° |
| CE1 | CD1 | CG2 | CD2 | 1.4° | 0.0° |
| CE1 | CD1 | CG2 | CB2 | 173.5° | 179.7° |
| CA1 | C1 | N2 | N3 | 178.6° | 179.8° |
| CA1 | C1 | N2 | CA2 | 176.0° | 180.0° |
| CA1 | C1 | N3 | CA3 | 10.3° | 0.0° |
| CA1 | C1 | N3 | C2 | 173.7° | 180.0° |
| C1 | CA1 | N1 | H | 56.5° | 60.0° |
| C1 | CA1 | N1 | H2 | 63.5° | 176.0° |
| C1 | CA1 | CB1 | HB1 | 61.7° | 65.0° |
| CZ | CE2 | CD2 | HE2 | 180.0° | 179.4° |
| CZ | CE2 | CD2 | CG2 | 0.0° | 0.6° |
| CZ | CE2 | CD2 | HD2 | 180.0° | 179.4° |
| CE2 | CZ | CE1 | HE1 | 177.3° | 180.0° |
| CE2 | CZ | OH | HOH | 0.2° | 90.4° |
| CD1 | CG2 | CD2 | CE2 | 0.0° | 0.3° |
| CD1 | CG2 | CD2 | CB2 | 175.1° | 179.7° |
| CD1 | CG2 | CB2 | CA2 | 13.0° | 6.3° |
| CD1 | CG2 | CB2 | HB2 | 167.0° | 173.6° |
| CD1 | CG2 | CD2 | HD2 | 180.0° | 179.7° |
| CG2 | CD1 | CE1 | HE1 | 177.3° | 179.7° |
| N2 | C1 | N3 | CA3 | 171.0° | 179.7° |
| N2 | C1 | N3 | C2 | 7.7° | 0.2° |
| C1 | N2 | CA2 | CB2 | 173.7° | 179.9° |
| C1 | N2 | CA2 | C2 | 1.6° | 0.1° |
| N2 | C1 | CA1 | HA1 | 145.9° | 154.7° |
| CA2 | N2 | C1 | N3 | 5.4° | 0.2° |
| N2 | CA2 | CB2 | CG2 | 17.6° | 5.1° |
| N2 | CA2 | C2 | N3 | 2.6° | 0.0° |
| N2 | CA2 | CB2 | C2 | 170.9° | 179.9° |
| N2 | CA2 | C2 | O2 | 166.9° | 179.9° |
| N2 | CA2 | CB2 | HB2 | 162.4° | 174.8° |
| C1 | N3 | CA3 | C2 | 162.1° | 180.0° |
| C1 | N3 | C2 | CA2 | 6.2° | 0.2° |
| C1 | N3 | CA3 | C3 | 98.8° | 90.0° |
| C1 | N3 | C2 | O2 | 169.2° | 180.0° |
| N3 | C1 | CA1 | HA1 | 32.5° | 25.0° |
| C1 | N3 | CA3 | HA31 | 140.2° | 150.0° |
| C1 | N3 | CA3 | HA32 | 22.2° | 30.0° |
| CE2 | CD2 | CG2 | HD2 | 180.0° | 180.0° |
| CE2 | CD2 | CG2 | CB2 | 175.1° | 180.0° |
| CD2 | CG2 | CB2 | CA2 | 172.0° | 174.0° |
| CD2 | CG2 | CB2 | HB2 | 8.0° | 6.1° |
| CD2 | CG2 | CD1 | HD1 | 178.6° | 180.0° |
| CG2 | CD2 | CE2 | HE2 | 180.0° | 180.0° |
| CG2 | CB2 | CA2 | HB2 | 180.0° | 179.9° |
| CG2 | CB2 | CA2 | C2 | 171.6° | 175.0° |
| CB2 | CG2 | CD1 | HD1 | 6.5° | 0.3° |
| CB2 | CG2 | CD2 | HD2 | 4.9° | 0.0° |
| CA3 | N3 | C2 | CA2 | 169.6° | 179.8° |
| N3 | CA3 | C3 | HA31 | 121.0° | 120.0° |
| N3 | CA3 | C3 | HA32 | 121.0° | 120.0° |
| N3 | CA3 | C3 | OXT | 35.4° | 180.0° |
| N3 | CA3 | C3 | O3 | 146.0° | 0.0° |
| CA3 | N3 | C2 | O2 | 27.4° | 0.0° |
| N3 | CA3 | HA31 | HA32 | 116.8° | 120.0° |
| N3 | C2 | CA2 | CB2 | 169.7° | 179.9° |
| N3 | C2 | CA2 | O2 | 164.3° | 179.9° |
| C2 | N3 | CA3 | C3 | 99.1° | 90.0° |
| C2 | N3 | CA3 | HA31 | 21.9° | 30.0° |
| C2 | N3 | CA3 | HA32 | 139.9° | 150.0° |
| CB2 | CA2 | C2 | O2 | 5.4° | 0.1° |
| C2 | CA2 | CB2 | HB2 | 8.4° | 5.1° |
| CA3 | C3 | OXT | O3 | 178.5° | 180.0° |
| C3 | CA3 | HA31 | HA32 | 116.8° | 120.1° |
| CA3 | C3 | OXT | HXT | 178.5° | 180.0° |
| OXT | C3 | CA3 | HA31 | 156.4° | 60.0° |
| OXT | C3 | CA3 | HA32 | 85.6° | 60.0° |
| O3 | C3 | CA3 | HA31 | 25.0° | 120.0° |
| O3 | C3 | CA3 | HA32 | 93.0° | 120.0° |
| O3 | C3 | OXT | HXT | 0.0° | 0.1° |
| H | N1 | CA1 | HA1 | 60.5° | 180.0° |
| H2 | N1 | CA1 | HA1 | 179.6° | 56.0° |
| HA1 | CA1 | CB1 | HB1 | 60.4° | 55.0° |
| HB1 | CB1 | CG1 | HG11 | 60.8° | 180.0° |
| HB1 | CB1 | CG1 | HG12 | 179.2° | 60.0° |
| HB1 | CB1 | CG1 | HG13 | 59.2° | 60.0° |
| HB1 | CB1 | OG1 | HOG1 | 61.6° | 179.9° |
| HG11 | CG1 | HG12 | HG13 | 120.0° | 120.1° |
| HD1 | CD1 | CE1 | HE1 | 2.7° | 0.3° |
| HD2 | CD2 | CE2 | HE2 | 0.0° | 0.0° |
