CRX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | CA1 | sing | 1.48Å | 1.40Å | |
| N1 | H | sing | 0.99Å | 1.02Å | |
| N1 | H2 | sing | 0.99Å | 1.02Å | |
| CA1 | CB1 | sing | 1.52Å | 1.48Å | |
| CA1 | C1 | sing | 1.52Å | 1.53Å | |
| CA1 | HA1 | sing | 1.10Å | 1.12Å | |
| CB1 | HB11 | sing | 1.09Å | 1.11Å | |
| CB1 | HB12 | sing | 1.10Å | 1.12Å | |
| CB1 | HB13 | sing | 1.10Å | 1.11Å | |
| C1 | N2 | sing | 1.45Å | 1.46Å | |
| C1 | N3 | sing | 1.46Å | 1.45Å | |
| C1 | O1 | sing | 1.42Å | 1.44Å | |
| N2 | CA2 | sing | 1.36Å | 1.39Å | |
| N2 | HN2 | sing | 1.01Å | 1.02Å | |
| N3 | C2 | sing | 1.40Å | 1.44Å | |
| N3 | CA3 | sing | 1.45Å | 1.41Å | |
| C2 | O2 | doub | 1.22Å | 1.24Å | |
| C2 | CA2 | sing | 1.49Å | 1.42Å | |
| CA2 | CB2 | doub | 1.33Å | 1.31Å | |
| CA3 | C3 | sing | 1.50Å | 1.46Å | |
| CA3 | HA31 | sing | 1.09Å | 1.11Å | |
| CA3 | HA32 | sing | 1.09Å | 1.11Å | |
| C3 | O3 | doub | 1.22Å | 1.24Å | |
| C3 | OXT | sing | 1.36Å | 34.47Å | |
| CB2 | HB21 | sing | 1.08Å | 1.10Å | |
| CB2 | HB22 | sing | 1.08Å | 1.10Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| OXT | HXT | sing | 0.98Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA1 | N1 | H | 114.1° | 116.9° |
| CA1 | N1 | H2 | 104.6° | 116.9° |
| N1 | CA1 | CB1 | 104.6° | 109.1° |
| N1 | CA1 | C1 | 118.4° | 108.9° |
| N1 | CA1 | HA1 | 106.5° | 108.0° |
| H | N1 | H2 | 114.0° | 124.7° |
| CB1 | CA1 | C1 | 108.1° | 111.7° |
| CB1 | CA1 | HA1 | 117.1° | 109.6° |
| CA1 | CB1 | HB11 | 114.0° | 110.9° |
| CA1 | CB1 | HB12 | 104.6° | 111.4° |
| CA1 | CB1 | HB13 | 114.0° | 110.8° |
| C1 | CA1 | HA1 | 102.8° | 109.4° |
| CA1 | C1 | N2 | 114.0° | 110.1° |
| CA1 | C1 | N3 | 112.4° | 113.6° |
| CA1 | C1 | O1 | 102.9° | 110.6° |
| HB11 | CB1 | HB12 | 114.1° | 108.1° |
| HB11 | CB1 | HB13 | 96.4° | 108.1° |
| HB12 | CB1 | HB13 | 114.0° | 107.4° |
| N2 | C1 | N3 | 104.2° | 101.3° |
| N2 | C1 | O1 | 108.0° | 110.6° |
| C1 | N2 | CA2 | 105.1° | 113.8° |
| C1 | N2 | HN2 | 113.9° | 124.2° |
| N3 | C1 | O1 | 115.5° | 110.2° |
| C1 | N3 | C2 | 108.6° | 113.1° |
| C1 | N3 | CA3 | 126.7° | 122.9° |
| C1 | O1 | HO1 | 102.9° | 106.9° |
| CA2 | N2 | HN2 | 113.8° | 122.0° |
| N2 | CA2 | C2 | 113.6° | 107.2° |
| N2 | CA2 | CB2 | 120.7° | 130.6° |
| C2 | N3 | CA3 | 123.7° | 124.0° |
| N3 | C2 | O2 | 124.0° | 129.4° |
| N3 | C2 | CA2 | 102.4° | 104.6° |
| N3 | CA3 | C3 | 118.0° | 108.7° |
| N3 | CA3 | HA31 | 109.1° | 108.9° |
| N3 | CA3 | HA32 | 109.1° | 109.1° |
| O2 | C2 | CA2 | 133.1° | 126.0° |
| C2 | CA2 | CB2 | 125.6° | 122.2° |
| CA2 | CB2 | HB21 | 120.7° | 120.8° |
| CA2 | CB2 | HB22 | 125.6° | 120.7° |
| C3 | CA3 | HA31 | 109.1° | 109.6° |
| C3 | CA3 | HA32 | 109.1° | 109.9° |
| CA3 | C3 | O3 | 121.9° | 126.5° |
| CA3 | C3 | OXT | 130.1° | 110.0° |
| HA31 | CA3 | HA32 | 101.0° | 110.6° |
| O3 | C3 | OXT | 56.3° | 123.6° |
| C3 | OXT | HXT | 130.1° | 111.9° |
| HB21 | CB2 | HB22 | 113.6° | 118.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA1 | N1 | H | H2 | 120.1° | 165.4° |
| N1 | CA1 | CB1 | C1 | 127.0° | 120.5° |
| N1 | CA1 | CB1 | HA1 | 117.5° | 118.1° |
| N1 | CA1 | C1 | HA1 | 117.0° | 117.9° |
| N1 | CA1 | CB1 | HB11 | 54.7° | 1.0° |
| N1 | CA1 | CB1 | HB12 | 180.0° | 121.5° |
| N1 | CA1 | CB1 | HB13 | 54.8° | 119.0° |
| N1 | CA1 | C1 | N2 | 75.3° | 60.6° |
| N1 | CA1 | C1 | N3 | 43.0° | 52.2° |
| N1 | CA1 | C1 | O1 | 168.0° | 176.8° |
| H | N1 | CA1 | CB1 | 54.7° | 43.2° |
| H | N1 | CA1 | C1 | 175.1° | 79.0° |
| H | N1 | CA1 | HA1 | 69.8° | 162.2° |
| H2 | N1 | CA1 | CB1 | 180.0° | 150.3° |
| H2 | N1 | CA1 | C1 | 59.6° | 87.5° |
| H2 | N1 | CA1 | HA1 | 55.4° | 31.2° |
| CB1 | CA1 | C1 | HA1 | 124.4° | 121.5° |
| CA1 | CB1 | HB11 | HB12 | 120.1° | 122.4° |
| CA1 | CB1 | HB11 | HB13 | 120.0° | 121.6° |
| CA1 | CB1 | HB12 | HB13 | 125.2° | 121.5° |
| CB1 | CA1 | C1 | N2 | 43.3° | 60.0° |
| CB1 | CA1 | C1 | N3 | 161.6° | 172.8° |
| CB1 | CA1 | C1 | O1 | 73.4° | 62.6° |
| C1 | CA1 | CB1 | HB11 | 72.3° | 119.4° |
| C1 | CA1 | CB1 | HB12 | 53.0° | 1.0° |
| C1 | CA1 | CB1 | HB13 | 178.2° | 120.6° |
| CA1 | C1 | N2 | N3 | 122.9° | 120.5° |
| CA1 | C1 | N2 | O1 | 113.7° | 122.6° |
| CA1 | C1 | N3 | O1 | 117.7° | 124.8° |
| CA1 | C1 | N2 | CA2 | 143.1° | 120.8° |
| CA1 | C1 | N2 | HN2 | 17.8° | 60.6° |
| CA1 | C1 | N3 | C2 | 149.3° | 118.3° |
| CA1 | C1 | N3 | CA3 | 41.7° | 62.3° |
| CA1 | C1 | O1 | HO1 | 180.0° | 90.3° |
| HA1 | CA1 | CB1 | HB11 | 172.2° | 119.1° |
| HA1 | CA1 | CB1 | HB12 | 62.5° | 120.4° |
| HA1 | CA1 | CB1 | HB13 | 62.7° | 0.9° |
| HA1 | CA1 | C1 | N2 | 167.7° | 178.5° |
| HA1 | CA1 | C1 | N3 | 73.9° | 65.7° |
| HA1 | CA1 | C1 | O1 | 51.0° | 58.9° |
| HB11 | CB1 | HB12 | HB13 | 109.5° | 116.4° |
| N2 | C1 | N3 | O1 | 118.3° | 117.2° |
| C1 | N2 | CA2 | HN2 | 125.3° | 178.6° |
| N2 | C1 | N3 | C2 | 25.4° | 0.3° |
| N2 | C1 | N3 | CA3 | 165.6° | 179.7° |
| C1 | N2 | CA2 | C2 | 8.4° | 0.2° |
| C1 | N2 | CA2 | CB2 | 169.5° | 179.7° |
| N2 | C1 | O1 | HO1 | 59.1° | 32.0° |
| N3 | C1 | N2 | CA2 | 20.1° | 0.3° |
| N3 | C1 | N2 | HN2 | 105.1° | 178.9° |
| C1 | N3 | C2 | CA3 | 169.3° | 179.3° |
| C1 | N3 | C2 | O2 | 167.3° | 179.8° |
| C1 | N3 | C2 | CA2 | 20.0° | 0.2° |
| C1 | N3 | CA3 | C3 | 78.6° | 88.7° |
| C1 | N3 | CA3 | HA31 | 46.7° | 30.7° |
| C1 | N3 | CA3 | HA32 | 156.2° | 151.5° |
| N3 | C1 | O1 | HO1 | 57.1° | 143.2° |
| O1 | C1 | N2 | CA2 | 103.2° | 116.6° |
| O1 | C1 | N2 | HN2 | 131.5° | 62.0° |
| O1 | C1 | N3 | C2 | 92.9° | 116.9° |
| O1 | C1 | N3 | CA3 | 76.0° | 62.5° |
| N2 | CA2 | C2 | N3 | 7.0° | 0.0° |
| N2 | CA2 | C2 | O2 | 178.7° | 180.0° |
| N2 | CA2 | C2 | CB2 | 177.8° | 179.9° |
| N2 | CA2 | CB2 | HB21 | 180.0° | 0.1° |
| N2 | CA2 | CB2 | HB22 | 2.3° | 179.8° |
| HN2 | N2 | CA2 | C2 | 116.9° | 178.8° |
| HN2 | N2 | CA2 | CB2 | 65.2° | 1.1° |
| N3 | C2 | O2 | CA2 | 170.2° | 180.0° |
| N3 | C2 | CA2 | CB2 | 175.2° | 179.9° |
| C2 | N3 | CA3 | C3 | 88.8° | 90.6° |
| C2 | N3 | CA3 | HA31 | 146.0° | 150.0° |
| C2 | N3 | CA3 | HA32 | 36.5° | 29.3° |
| CA3 | N3 | C2 | O2 | 2.0° | 0.4° |
| CA3 | N3 | C2 | CA2 | 170.7° | 179.5° |
| N3 | CA3 | C3 | HA31 | 125.3° | 118.9° |
| N3 | CA3 | C3 | HA32 | 125.3° | 119.4° |
| N3 | CA3 | HA31 | HA32 | 114.9° | 119.9° |
| N3 | CA3 | C3 | O3 | 148.7° | 31.1° |
| N3 | CA3 | C3 | OXT | 140.5° | 149.0° |
| O2 | C2 | CA2 | CB2 | 3.5° | 0.1° |
| C2 | CA2 | CB2 | HB21 | 2.3° | 180.0° |
| C2 | CA2 | CB2 | HB22 | 180.0° | 0.1° |
| CA2 | CB2 | HB21 | HB22 | 178.0° | 179.9° |
| C3 | CA3 | HA31 | HA32 | 114.8° | 121.3° |
| CA3 | C3 | O3 | OXT | 119.8° | 179.9° |
| CA3 | C3 | OXT | HXT | 180.0° | 180.0° |
| HA31 | CA3 | C3 | O3 | 86.0° | 150.0° |
| HA31 | CA3 | C3 | OXT | 15.2° | 30.1° |
| HA32 | CA3 | C3 | O3 | 23.5° | 88.3° |
| HA32 | CA3 | C3 | OXT | 94.2° | 91.6° |
| O3 | C3 | OXT | HXT | 74.4° | 0.1° |
