UM1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NCF | CCG | sing | 1.47Å | 1.49Å | |
| CCG | CCR | sing | 1.51Å | 1.51Å | |
| CCR | OCS | doub | 1.21Å | 1.24Å | |
| CCR | NCT | sing | 1.35Å | 1.33Å | |
| NCT | CCU | sing | 1.47Å | 1.47Å | |
| CCU | CCV | sing | 1.53Å | 1.54Å | |
| CCU | CCW | sing | 1.51Å | 1.52Å | |
| CCW | OCX | doub | 1.21Å | 1.24Å | |
| CCW | NCY | sing | 1.35Å | 1.31Å | |
| NCY | CCZ | sing | 1.46Å | 1.45Å | |
| CCZ | CDA | sing | 1.53Å | 1.55Å | |
| CCZ | CDB | sing | 1.51Å | 1.53Å | |
| CDB | ODC | doub | 1.21Å | 1.24Å | |
| CDB | ODB | sing | 1.34Å | 1.26Å | |
| NCF | HNCF | sing | 1.01Å | 1.00Å | |
| NCF | HNCA | sing | 1.01Å | 1.00Å | |
| CCG | HCG | sing | 1.09Å | 1.10Å | |
| CCG | HCGA | sing | 1.09Å | 1.10Å | |
| NCT | HNCT | sing | 0.97Å | 1.00Å | |
| CCU | HCU | sing | 1.09Å | 1.10Å | |
| CCV | HCV | sing | 1.09Å | 1.10Å | |
| CCV | HCVA | sing | 1.09Å | 1.10Å | |
| CCV | HCVB | sing | 1.09Å | 1.10Å | |
| NCY | HNCY | sing | 0.97Å | 1.00Å | |
| CCZ | HCZ | sing | 1.09Å | 1.10Å | |
| CDA | HDA | sing | 1.09Å | 1.10Å | |
| CDA | HDAA | sing | 1.09Å | 1.10Å | |
| CDA | HDAB | sing | 1.09Å | 1.10Å | |
| ODB | HODB | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NCF | CCG | CCR | 110.2° | 109.5° |
| CCG | NCF | HNCF | 109.5° | 111.0° |
| CCG | NCF | HNCA | 109.5° | 111.0° |
| NCF | CCG | HCG | 109.2° | 109.5° |
| NCF | CCG | HCGA | 109.1° | 109.5° |
| CCG | CCR | OCS | 121.0° | 120.0° |
| CCG | CCR | NCT | 113.8° | 120.0° |
| CCR | CCG | HCG | 109.2° | 109.5° |
| CCR | CCG | HCGA | 109.1° | 109.4° |
| OCS | CCR | NCT | 124.4° | 120.0° |
| CCR | NCT | CCU | 122.7° | 120.0° |
| CCR | NCT | HNCT | 118.6° | 120.0° |
| NCT | CCU | CCV | 108.1° | 109.4° |
| NCT | CCU | CCW | 108.8° | 109.5° |
| CCU | NCT | HNCT | 118.6° | 120.0° |
| NCT | CCU | HCU | 111.2° | 109.5° |
| CCV | CCU | CCW | 110.7° | 109.5° |
| CCV | CCU | HCU | 109.4° | 109.4° |
| CCU | CCV | HCV | 109.5° | 109.4° |
| CCU | CCV | HCVA | 109.5° | 109.5° |
| CCU | CCV | HCVB | 109.5° | 109.5° |
| CCU | CCW | OCX | 124.2° | 120.0° |
| CCU | CCW | NCY | 111.8° | 120.0° |
| CCW | CCU | HCU | 108.7° | 109.5° |
| OCX | CCW | NCY | 123.4° | 120.0° |
| CCW | NCY | CCZ | 120.7° | 120.0° |
| CCW | NCY | HNCY | 119.7° | 120.0° |
| NCY | CCZ | CDA | 107.6° | 109.5° |
| NCY | CCZ | CDB | 107.5° | 109.5° |
| CCZ | NCY | HNCY | 119.7° | 120.0° |
| NCY | CCZ | HCZ | 111.9° | 109.5° |
| CDA | CCZ | CDB | 109.3° | 109.5° |
| CDA | CCZ | HCZ | 110.2° | 109.4° |
| CCZ | CDA | HDA | 109.5° | 109.4° |
| CCZ | CDA | HDAA | 109.4° | 109.5° |
| CCZ | CDA | HDAB | 109.5° | 109.5° |
| CCZ | CDB | ODC | 119.7° | 120.0° |
| CCZ | CDB | ODB | 115.2° | 120.0° |
| CDB | CCZ | HCZ | 110.2° | 109.5° |
| ODC | CDB | ODB | 125.1° | 120.0° |
| CDB | ODB | HODB | 109.5° | 117.0° |
| HNCF | NCF | HNCA | 109.5° | 111.0° |
| HCG | CCG | HCGA | 110.0° | 109.5° |
| HCV | CCV | HCVA | 109.4° | 109.5° |
| HCV | CCV | HCVB | 109.5° | 109.5° |
| HCVA | CCV | HCVB | 109.5° | 109.5° |
| HDA | CDA | HDAA | 109.5° | 109.5° |
| HDA | CDA | HDAB | 109.4° | 109.5° |
| HDAA | CDA | HDAB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NCF | CCG | CCR | HCG | 120.0° | 120.0° |
| NCF | CCG | CCR | HCGA | 119.7° | 120.0° |
| NCF | CCG | CCR | OCS | 4.7° | 0.0° |
| NCF | CCG | CCR | NCT | 165.7° | 180.0° |
| CCG | NCF | HNCF | HNCA | 120.0° | 123.9° |
| NCF | CCG | HCG | HCGA | 119.7° | 120.0° |
| CCG | CCR | OCS | NCT | 169.3° | 179.9° |
| CCG | CCR | NCT | CCU | 172.4° | 180.0° |
| CCR | CCG | NCF | HNCF | 137.8° | 56.0° |
| CCR | CCG | NCF | HNCA | 102.2° | 179.9° |
| CCR | CCG | HCG | HCGA | 119.7° | 120.0° |
| CCG | CCR | NCT | HNCT | 7.7° | 0.0° |
| OCS | CCR | NCT | CCU | 17.6° | 0.0° |
| OCS | CCR | CCG | HCG | 124.7° | 120.0° |
| OCS | CCR | CCG | HCGA | 115.0° | 120.0° |
| OCS | CCR | NCT | HNCT | 162.4° | 179.9° |
| CCR | NCT | CCU | HNCT | 180.0° | 180.0° |
| CCR | NCT | CCU | CCV | 121.4° | 85.0° |
| CCR | NCT | CCU | CCW | 118.4° | 155.0° |
| NCT | CCR | CCG | HCG | 45.7° | 59.9° |
| NCT | CCR | CCG | HCGA | 74.6° | 60.0° |
| CCR | NCT | CCU | HCU | 1.3° | 35.0° |
| NCT | CCU | CCV | CCW | 119.0° | 120.0° |
| NCT | CCU | CCV | HCU | 121.2° | 120.0° |
| NCT | CCU | CCW | HCU | 121.2° | 120.0° |
| NCT | CCU | CCW | OCX | 8.7° | 0.1° |
| NCT | CCU | CCW | NCY | 179.8° | 180.0° |
| NCT | CCU | CCV | HCV | 56.0° | 60.0° |
| NCT | CCU | CCV | HCVA | 176.0° | 60.0° |
| NCT | CCU | CCV | HCVB | 64.1° | 180.0° |
| CCV | CCU | CCW | HCU | 120.1° | 120.0° |
| CCV | CCU | CCW | OCX | 127.4° | 120.0° |
| CCV | CCU | CCW | NCY | 61.1° | 60.0° |
| CCV | CCU | NCT | HNCT | 58.6° | 95.1° |
| CCU | CCV | HCV | HCVA | 120.0° | 120.0° |
| CCU | CCV | HCV | HCVB | 120.0° | 120.0° |
| CCU | CCV | HCVA | HCVB | 120.0° | 120.0° |
| CCU | CCW | OCX | NCY | 170.5° | 179.9° |
| CCU | CCW | NCY | CCZ | 169.6° | 180.0° |
| CCW | CCU | NCT | HNCT | 61.6° | 24.9° |
| CCW | CCU | CCV | HCV | 175.0° | 59.9° |
| CCW | CCU | CCV | HCVA | 65.0° | 180.0° |
| CCW | CCU | CCV | HCVB | 55.0° | 60.0° |
| CCU | CCW | NCY | HNCY | 10.4° | 0.0° |
| OCX | CCW | NCY | CCZ | 2.0° | 0.1° |
| OCX | CCW | CCU | HCU | 112.5° | 120.0° |
| OCX | CCW | NCY | HNCY | 178.0° | 180.0° |
| CCW | NCY | CCZ | HNCY | 180.0° | 180.0° |
| CCW | NCY | CCZ | CDA | 176.2° | 85.0° |
| CCW | NCY | CCZ | CDB | 58.5° | 155.0° |
| NCY | CCW | CCU | HCU | 59.0° | 59.9° |
| CCW | NCY | CCZ | HCZ | 62.7° | 35.0° |
| NCY | CCZ | CDA | CDB | 116.5° | 120.0° |
| NCY | CCZ | CDA | HCZ | 122.2° | 120.0° |
| NCY | CCZ | CDB | HCZ | 122.2° | 120.0° |
| NCY | CCZ | CDB | ODC | 37.9° | 0.0° |
| NCY | CCZ | CDB | ODB | 144.7° | 180.0° |
| NCY | CCZ | CDA | HDA | 18.8° | 60.0° |
| NCY | CCZ | CDA | HDAA | 138.8° | 180.0° |
| NCY | CCZ | CDA | HDAB | 101.2° | 60.0° |
| CDA | CCZ | CDB | HCZ | 121.3° | 120.0° |
| CDA | CCZ | CDB | ODC | 78.6° | 120.0° |
| CDA | CCZ | CDB | ODB | 98.8° | 60.0° |
| CDA | CCZ | NCY | HNCY | 3.8° | 95.0° |
| CCZ | CDA | HDA | HDAA | 120.0° | 120.0° |
| CCZ | CDA | HDA | HDAB | 120.0° | 120.0° |
| CCZ | CDA | HDAA | HDAB | 120.0° | 120.0° |
| CCZ | CDB | ODC | ODB | 177.1° | 180.0° |
| CDB | CCZ | NCY | HNCY | 121.5° | 25.0° |
| CDB | CCZ | CDA | HDA | 135.3° | 180.0° |
| CDB | CCZ | CDA | HDAA | 104.7° | 60.0° |
| CDB | CCZ | CDA | HDAB | 15.3° | 60.0° |
| CCZ | CDB | ODB | HODB | 177.2° | 180.0° |
| ODC | CDB | CCZ | HCZ | 160.1° | 120.0° |
| ODC | CDB | ODB | HODB | 0.0° | 0.0° |
| ODB | CDB | CCZ | HCZ | 22.5° | 60.0° |
| HNCF | NCF | CCG | HCG | 102.2° | 176.0° |
| HNCF | NCF | CCG | HCGA | 18.1° | 63.9° |
| HNCA | NCF | CCG | HCG | 17.8° | 60.1° |
| HNCA | NCF | CCG | HCGA | 138.1° | 60.0° |
| HNCT | NCT | CCU | HCU | 178.7° | 145.0° |
| HCU | CCU | CCV | HCV | 65.2° | 180.0° |
| HCU | CCU | CCV | HCVA | 54.7° | 60.0° |
| HCU | CCU | CCV | HCVB | 174.7° | 60.0° |
| HCV | CCV | HCVA | HCVB | 120.0° | 120.0° |
| HNCY | NCY | CCZ | HCZ | 117.3° | 145.0° |
| HCZ | CCZ | CDA | HDA | 103.4° | 60.0° |
| HCZ | CCZ | CDA | HDAA | 16.6° | 60.0° |
| HCZ | CCZ | CDA | HDAB | 136.6° | 180.0° |
| HDA | CDA | HDAA | HDAB | 120.0° | 120.0° |
