4TM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAB | CAW | sing | 1.53Å | 1.54Å | |
| OAF | NAN | sing | 1.42Å | 1.44Å | |
| CAW | CAC | sing | 1.53Å | 1.53Å | |
| CAW | CAA | sing | 1.53Å | 1.53Å | |
| CAW | CAR | sing | 1.51Å | 1.55Å | |
| NAN | C | sing | 1.35Å | 1.34Å | |
| O | C | doub | 1.21Å | 1.23Å | |
| CAR | N | sing | 1.35Å | 1.34Å | |
| CAR | OAE | doub | 1.21Å | 1.23Å | |
| C | CA | sing | 1.51Å | 1.53Å | |
| N | CA | sing | 1.46Å | 1.48Å | |
| CA | CAU | sing | 1.51Å | 1.42Å | |
| CAU | CAK | doub | 1.38Å | 1.40Å | Aromatic |
| CAU | CAL | sing | 1.38Å | 1.40Å | Aromatic |
| CAK | CAI | sing | 1.38Å | 1.41Å | Aromatic |
| CAL | CAJ | doub | 1.38Å | 1.40Å | Aromatic |
| CAI | CAS | doub | 1.39Å | 1.40Å | Aromatic |
| CAJ | CAS | sing | 1.39Å | 1.40Å | Aromatic |
| CAS | CAT | sing | 1.48Å | 1.35Å | |
| CAT | CAH | sing | 1.39Å | 1.36Å | Aromatic |
| CAT | CAM | doub | 1.35Å | 1.35Å | Aromatic |
| CAH | CAG | doub | 1.33Å | 1.36Å | Aromatic |
| CAM | SAP | sing | 1.76Å | 1.71Å | Aromatic |
| CAG | SAP | sing | 1.76Å | 1.66Å | Aromatic |
| CAA | H1 | sing | 1.09Å | 1.10Å | |
| CAA | H2 | sing | 1.09Å | 1.10Å | |
| CAA | H3 | sing | 1.09Å | 1.10Å | |
| CAB | H4 | sing | 1.09Å | 1.10Å | |
| CAB | H5 | sing | 1.09Å | 1.10Å | |
| CAB | H6 | sing | 1.09Å | 1.10Å | |
| CAC | H7 | sing | 1.09Å | 1.10Å | |
| CAC | H8 | sing | 1.09Å | 1.10Å | |
| CAC | H9 | sing | 1.09Å | 1.10Å | |
| N | H10 | sing | 0.97Å | 1.00Å | |
| CA | H11 | sing | 1.09Å | 1.10Å | |
| NAN | H12 | sing | 0.97Å | 1.00Å | |
| OAF | H13 | sing | 0.97Å | 0.95Å | |
| CAL | H14 | sing | 1.08Å | 1.08Å | |
| CAJ | H15 | sing | 1.08Å | 1.08Å | |
| CAK | H16 | sing | 1.08Å | 1.08Å | |
| CAI | H17 | sing | 1.08Å | 1.08Å | |
| CAH | H18 | sing | 1.08Å | 1.08Å | |
| CAG | H19 | sing | 1.08Å | 1.08Å | |
| CAM | H20 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAB | CAW | CAC | 107.9° | 109.5° |
| CAB | CAW | CAA | 109.4° | 109.5° |
| CAB | CAW | CAR | 106.1° | 109.5° |
| CAW | CAB | H4 | 109.5° | 109.5° |
| CAW | CAB | H5 | 109.5° | 109.5° |
| CAW | CAB | H6 | 109.5° | 109.5° |
| OAF | NAN | C | 117.9° | 120.0° |
| OAF | NAN | H12 | 121.1° | 120.0° |
| NAN | OAF | H13 | 109.5° | 114.0° |
| CAC | CAW | CAA | 109.8° | 109.5° |
| CAC | CAW | CAR | 112.6° | 109.5° |
| CAW | CAC | H7 | 109.5° | 109.5° |
| CAW | CAC | H8 | 109.5° | 109.4° |
| CAW | CAC | H9 | 109.5° | 109.5° |
| CAA | CAW | CAR | 110.9° | 109.5° |
| CAW | CAA | H1 | 109.5° | 109.5° |
| CAW | CAA | H2 | 109.5° | 109.5° |
| CAW | CAA | H3 | 109.5° | 109.5° |
| CAW | CAR | N | 115.9° | 120.0° |
| CAW | CAR | OAE | 121.3° | 120.0° |
| NAN | C | O | 124.5° | 120.1° |
| NAN | C | CA | 113.9° | 120.0° |
| C | NAN | H12 | 121.1° | 120.0° |
| O | C | CA | 121.1° | 119.9° |
| N | CAR | OAE | 122.8° | 120.0° |
| CAR | N | CA | 121.1° | 120.0° |
| CAR | N | H10 | 119.5° | 120.0° |
| C | CA | N | 102.6° | 109.5° |
| C | CA | CAU | 113.7° | 109.5° |
| C | CA | H11 | 105.4° | 109.4° |
| N | CA | CAU | 121.2° | 109.5° |
| CA | N | H10 | 119.5° | 120.0° |
| N | CA | H11 | 106.0° | 109.5° |
| CA | CAU | CAK | 117.7° | 119.9° |
| CA | CAU | CAL | 123.6° | 119.9° |
| CAU | CA | H11 | 106.7° | 109.5° |
| CAK | CAU | CAL | 118.6° | 120.2° |
| CAU | CAK | CAI | 122.0° | 120.1° |
| CAU | CAK | H16 | 119.0° | 119.9° |
| CAU | CAL | CAJ | 119.4° | 120.1° |
| CAU | CAL | H14 | 120.3° | 119.9° |
| CAK | CAI | CAS | 119.4° | 119.9° |
| CAI | CAK | H16 | 119.0° | 120.0° |
| CAK | CAI | H17 | 120.3° | 120.1° |
| CAL | CAJ | CAS | 122.4° | 119.9° |
| CAJ | CAL | H14 | 120.3° | 120.0° |
| CAL | CAJ | H15 | 118.8° | 120.0° |
| CAI | CAS | CAJ | 118.3° | 119.7° |
| CAI | CAS | CAT | 121.8° | 120.1° |
| CAS | CAI | H17 | 120.3° | 120.0° |
| CAJ | CAS | CAT | 119.9° | 120.1° |
| CAS | CAJ | H15 | 118.8° | 120.1° |
| CAS | CAT | CAH | 123.9° | 122.8° |
| CAS | CAT | CAM | 121.7° | 122.8° |
| CAH | CAT | CAM | 114.3° | 114.4° |
| CAT | CAH | CAG | 116.8° | 114.9° |
| CAT | CAH | H18 | 121.6° | 122.5° |
| CAT | CAM | SAP | 106.1° | 109.5° |
| CAT | CAM | H20 | 126.9° | 125.2° |
| CAH | CAG | SAP | 105.6° | 109.9° |
| CAG | CAH | H18 | 121.6° | 122.5° |
| CAH | CAG | H19 | 127.2° | 125.1° |
| CAM | SAP | CAG | 97.1° | 91.2° |
| SAP | CAM | H20 | 127.0° | 125.3° |
| SAP | CAG | H19 | 127.2° | 125.0° |
| H1 | CAA | H2 | 109.5° | 109.4° |
| H1 | CAA | H3 | 109.4° | 109.5° |
| H2 | CAA | H3 | 109.5° | 109.5° |
| H4 | CAB | H5 | 109.4° | 109.4° |
| H4 | CAB | H6 | 109.5° | 109.5° |
| H5 | CAB | H6 | 109.5° | 109.5° |
| H7 | CAC | H8 | 109.4° | 109.5° |
| H7 | CAC | H9 | 109.5° | 109.5° |
| H8 | CAC | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAB | CAW | CAC | CAA | 119.2° | 120.0° |
| CAB | CAW | CAC | CAR | 116.8° | 120.0° |
| CAB | CAW | CAA | CAR | 116.7° | 120.0° |
| CAB | CAW | CAR | N | 85.9° | 60.0° |
| CAB | CAW | CAR | OAE | 91.7° | 120.0° |
| CAB | CAW | CAA | H1 | 180.0° | 60.0° |
| CAB | CAW | CAA | H2 | 60.0° | 60.0° |
| CAB | CAW | CAA | H3 | 60.0° | 180.0° |
| CAW | CAB | H4 | H5 | 120.0° | 120.0° |
| CAW | CAB | H4 | H6 | 120.0° | 120.0° |
| CAW | CAB | H5 | H6 | 120.0° | 120.0° |
| CAB | CAW | CAC | H7 | 180.0° | 180.0° |
| CAB | CAW | CAC | H8 | 60.0° | 60.0° |
| CAB | CAW | CAC | H9 | 60.0° | 60.0° |
| OAF | NAN | C | H12 | 180.0° | 180.0° |
| OAF | NAN | C | O | 7.2° | 0.0° |
| OAF | NAN | C | CA | 179.0° | 180.0° |
| CAC | CAW | CAA | CAR | 125.1° | 120.0° |
| CAC | CAW | CAR | N | 156.3° | 180.0° |
| CAC | CAW | CAR | OAE | 26.1° | 0.0° |
| CAC | CAW | CAA | H1 | 61.8° | 60.0° |
| CAC | CAW | CAA | H2 | 178.2° | 180.0° |
| CAC | CAW | CAA | H3 | 58.2° | 60.0° |
| CAC | CAW | CAB | H4 | 180.0° | 60.0° |
| CAC | CAW | CAB | H5 | 60.0° | 180.0° |
| CAC | CAW | CAB | H6 | 60.0° | 60.0° |
| CAW | CAC | H7 | H8 | 120.0° | 120.0° |
| CAW | CAC | H7 | H9 | 120.0° | 120.0° |
| CAW | CAC | H8 | H9 | 120.0° | 120.0° |
| CAA | CAW | CAR | N | 32.8° | 60.0° |
| CAA | CAW | CAR | OAE | 149.6° | 120.0° |
| CAW | CAA | H1 | H2 | 120.0° | 120.0° |
| CAW | CAA | H1 | H3 | 120.0° | 120.0° |
| CAW | CAA | H2 | H3 | 120.0° | 120.0° |
| CAA | CAW | CAB | H4 | 60.6° | 180.0° |
| CAA | CAW | CAB | H5 | 179.4° | 60.0° |
| CAA | CAW | CAB | H6 | 59.4° | 60.0° |
| CAA | CAW | CAC | H7 | 60.9° | 60.0° |
| CAA | CAW | CAC | H8 | 59.1° | 180.0° |
| CAA | CAW | CAC | H9 | 179.1° | 60.0° |
| CAW | CAR | N | OAE | 177.6° | 180.0° |
| CAW | CAR | N | CA | 169.6° | 180.0° |
| CAR | CAW | CAA | H1 | 63.3° | 180.0° |
| CAR | CAW | CAA | H2 | 56.7° | 60.0° |
| CAR | CAW | CAA | H3 | 176.7° | 60.0° |
| CAR | CAW | CAB | H4 | 59.1° | 60.0° |
| CAR | CAW | CAB | H5 | 60.9° | 60.0° |
| CAR | CAW | CAB | H6 | 179.1° | 180.0° |
| CAR | CAW | CAC | H7 | 63.2° | 60.0° |
| CAR | CAW | CAC | H8 | 176.8° | 60.0° |
| CAR | CAW | CAC | H9 | 56.8° | 180.0° |
| CAW | CAR | N | H10 | 10.4° | 0.1° |
| NAN | C | O | CA | 171.3° | 180.0° |
| NAN | C | CA | N | 103.5° | 180.0° |
| NAN | C | CA | CAU | 123.8° | 60.0° |
| NAN | C | CA | H11 | 7.3° | 60.0° |
| C | NAN | OAF | H13 | 3.2° | 180.0° |
| O | C | CA | N | 68.7° | 0.0° |
| O | C | CA | CAU | 64.1° | 120.0° |
| O | C | CA | H11 | 179.4° | 120.0° |
| O | C | NAN | H12 | 172.8° | 180.0° |
| CAR | N | CA | C | 117.3° | 85.0° |
| CAR | N | CA | H10 | 180.0° | 179.9° |
| CAR | N | CA | CAU | 114.6° | 155.0° |
| CAR | N | CA | H11 | 7.0° | 35.0° |
| OAE | CAR | N | CA | 8.0° | 0.0° |
| OAE | CAR | N | H10 | 172.0° | 180.0° |
| C | CA | N | CAU | 128.1° | 120.0° |
| C | CA | N | H11 | 110.3° | 120.0° |
| C | CA | CAU | H11 | 115.7° | 120.0° |
| C | CA | CAU | CAK | 46.0° | 100.0° |
| C | CA | CAU | CAL | 137.3° | 80.3° |
| C | CA | N | H10 | 62.7° | 95.0° |
| CA | C | NAN | H12 | 1.0° | 0.0° |
| N | CA | CAU | H11 | 121.2° | 120.0° |
| N | CA | CAU | CAK | 169.0° | 140.0° |
| N | CA | CAU | CAL | 14.3° | 39.7° |
| CA | CAU | CAK | CAL | 176.8° | 179.7° |
| CA | CAU | CAK | CAI | 178.0° | 180.0° |
| CA | CAU | CAL | CAJ | 177.5° | 180.0° |
| CAU | CA | N | H10 | 65.5° | 25.0° |
| CA | CAU | CAL | H14 | 2.5° | 0.1° |
| CA | CAU | CAK | H16 | 2.0° | 0.0° |
| CAU | CAK | CAI | H16 | 180.0° | 180.0° |
| CAK | CAU | CAL | CAJ | 0.9° | 0.3° |
| CAU | CAK | CAI | CAS | 0.6° | 0.0° |
| CAK | CAU | CA | H11 | 69.7° | 20.0° |
| CAK | CAU | CAL | H14 | 179.1° | 179.8° |
| CAU | CAK | CAI | H17 | 179.4° | 180.0° |
| CAL | CAU | CAK | CAI | 1.2° | 0.3° |
| CAU | CAL | CAJ | H14 | 180.0° | 180.0° |
| CAU | CAL | CAJ | CAS | 0.0° | 0.0° |
| CAL | CAU | CA | H11 | 106.9° | 159.7° |
| CAU | CAL | CAJ | H15 | 180.0° | 180.0° |
| CAL | CAU | CAK | H16 | 178.8° | 179.7° |
| CAK | CAI | CAS | H17 | 180.0° | 180.0° |
| CAK | CAI | CAS | CAJ | 0.3° | 0.3° |
| CAK | CAI | CAS | CAT | 178.7° | 180.0° |
| CAL | CAJ | CAS | CAI | 0.6° | 0.3° |
| CAL | CAJ | CAS | H15 | 180.0° | 180.0° |
| CAL | CAJ | CAS | CAT | 179.0° | 180.0° |
| CAI | CAS | CAJ | CAT | 178.3° | 179.8° |
| CAI | CAS | CAT | CAH | 0.3° | 0.3° |
| CAI | CAS | CAT | CAM | 178.3° | 179.9° |
| CAI | CAS | CAJ | H15 | 179.4° | 179.8° |
| CAS | CAI | CAK | H16 | 179.4° | 180.0° |
| CAJ | CAS | CAT | CAH | 178.0° | 180.0° |
| CAJ | CAS | CAT | CAM | 0.0° | 0.3° |
| CAS | CAJ | CAL | H14 | 180.0° | 180.0° |
| CAJ | CAS | CAI | H17 | 179.7° | 179.7° |
| CAS | CAT | CAH | CAM | 178.2° | 179.7° |
| CAS | CAT | CAH | CAG | 179.3° | 180.0° |
| CAS | CAT | CAM | SAP | 178.8° | 179.9° |
| CAT | CAS | CAJ | H15 | 1.0° | 0.0° |
| CAT | CAS | CAI | H17 | 1.4° | 0.1° |
| CAS | CAT | CAH | H18 | 0.7° | 0.0° |
| CAS | CAT | CAM | H20 | 1.2° | 0.0° |
| CAT | CAH | CAG | H18 | 180.0° | 179.9° |
| CAH | CAT | CAM | SAP | 0.6° | 0.4° |
| CAT | CAH | CAG | SAP | 1.1° | 0.0° |
| CAT | CAH | CAG | H19 | 179.0° | 180.0° |
| CAH | CAT | CAM | H20 | 179.4° | 179.7° |
| CAM | CAT | CAH | CAG | 1.1° | 0.3° |
| CAT | CAM | SAP | H20 | 180.0° | 179.9° |
| CAT | CAM | SAP | CAG | 0.0° | 0.3° |
| CAM | CAT | CAH | H18 | 178.9° | 179.8° |
| CAH | CAG | SAP | CAM | 0.6° | 0.2° |
| CAH | CAG | SAP | H19 | 180.0° | 180.0° |
| CAM | SAP | CAG | H19 | 179.4° | 179.8° |
| SAP | CAG | CAH | H18 | 178.9° | 180.0° |
| CAG | SAP | CAM | H20 | 179.9° | 179.8° |
| H1 | CAA | H2 | H3 | 120.0° | 120.0° |
| H4 | CAB | H5 | H6 | 120.0° | 120.0° |
| H7 | CAC | H8 | H9 | 120.0° | 120.0° |
| H10 | N | CA | H11 | 173.0° | 145.1° |
| H12 | NAN | OAF | H13 | 176.8° | 0.0° |
| H14 | CAL | CAJ | H15 | 0.0° | 0.0° |
| H16 | CAK | CAI | H17 | 0.6° | 0.1° |
| H18 | CAH | CAG | H19 | 1.0° | 0.0° |
