C9D
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAE | SAY | doub | 1.42Å | 1.49Å | |
| OAF | SAY | doub | 1.42Å | 1.50Å | |
| SAY | OAR | sing | 1.52Å | 1.52Å | |
| SAY | OAD | sing | 1.52Å | 1.50Å | |
| OAR | NAQ | sing | 1.46Å | 1.46Å | |
| NAQ | CAU | sing | 1.47Å | 1.49Å | |
| CB | CAJ | sing | 1.53Å | 1.48Å | |
| CB | CA | sing | 1.53Å | 1.54Å | |
| CAJ | CAU | sing | 1.53Å | 1.52Å | |
| OAA | CAG | doub | 1.21Å | 1.22Å | |
| CAU | CAM | sing | 1.53Å | 1.57Å | |
| CAG | N | sing | 1.35Å | 1.35Å | |
| CA | N | sing | 1.47Å | 1.45Å | |
| CA | C | sing | 1.51Å | 1.37Å | |
| N | CAM | sing | 1.47Å | 1.51Å | |
| NAP | C | sing | 1.35Å | 1.35Å | |
| NAP | NAO | sing | 1.40Å | 1.40Å | |
| C | O | doub | 1.21Å | 1.24Å | |
| NAO | CAS | sing | 1.35Å | 1.35Å | |
| OAB | CAS | doub | 1.21Å | 1.22Å | |
| CAS | CAV | sing | 1.51Å | 1.54Å | |
| CAH | CAI | sing | 1.55Å | 1.49Å | |
| CAH | NAN | sing | 1.49Å | 1.49Å | |
| CAI | CAV | sing | 1.55Å | 1.51Å | |
| CAV | CAL | sing | 1.54Å | 1.51Å | |
| NAN | CAL | sing | 1.48Å | 1.46Å | |
| NAQ | H1 | sing | 1.01Å | 1.00Å | |
| CAU | H2 | sing | 1.09Å | 1.10Å | |
| CAJ | H3 | sing | 1.09Å | 1.10Å | |
| CAJ | H4 | sing | 1.09Å | 1.10Å | |
| CB | H5 | sing | 1.09Å | 1.10Å | |
| CB | H6 | sing | 1.09Å | 1.10Å | |
| CAM | H7 | sing | 1.09Å | 1.10Å | |
| CAM | H8 | sing | 1.09Å | 1.10Å | |
| CAG | H9 | sing | 1.08Å | 1.08Å | |
| CA | H10 | sing | 1.09Å | 1.10Å | |
| NAP | H11 | sing | 0.97Å | 1.00Å | |
| NAO | H12 | sing | 0.97Å | 1.00Å | |
| CAV | H13 | sing | 1.09Å | 1.10Å | |
| CAI | H14 | sing | 1.09Å | 1.10Å | |
| CAI | H15 | sing | 1.09Å | 1.10Å | |
| CAH | H16 | sing | 1.09Å | 1.10Å | |
| CAH | H17 | sing | 1.09Å | 1.10Å | |
| NAN | H18 | sing | 1.01Å | 1.00Å | |
| CAL | H20 | sing | 1.09Å | 1.10Å | |
| CAL | H21 | sing | 1.09Å | 1.10Å | |
| OAD | H22 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAE | SAY | OAF | 111.5° | 123.2° |
| OAE | SAY | OAR | 108.1° | 106.4° |
| OAE | SAY | OAD | 112.2° | 106.4° |
| OAF | SAY | OAR | 113.0° | 106.4° |
| OAF | SAY | OAD | 100.6° | 106.4° |
| OAR | SAY | OAD | 111.5° | 107.2° |
| SAY | OAR | NAQ | 113.4° | 114.0° |
| SAY | OAD | H22 | 109.5° | 114.1° |
| OAR | NAQ | CAU | 114.0° | 111.0° |
| OAR | NAQ | H1 | 108.3° | 111.0° |
| NAQ | CAU | CAJ | 116.5° | 109.5° |
| NAQ | CAU | CAM | 113.6° | 109.5° |
| CAU | NAQ | H1 | 108.3° | 111.0° |
| NAQ | CAU | H2 | 106.3° | 109.5° |
| CAJ | CB | CA | 109.8° | 109.3° |
| CB | CAJ | CAU | 111.5° | 109.5° |
| CB | CAJ | H3 | 109.0° | 109.4° |
| CB | CAJ | H4 | 109.0° | 109.4° |
| CAJ | CB | H5 | 109.4° | 109.5° |
| CAJ | CB | H6 | 109.4° | 109.5° |
| CB | CA | N | 103.6° | 108.8° |
| CB | CA | C | 122.7° | 109.6° |
| CA | CB | H5 | 109.4° | 109.5° |
| CA | CB | H6 | 109.4° | 109.5° |
| CB | CA | H10 | 103.1° | 109.6° |
| CAJ | CAU | CAM | 108.3° | 109.3° |
| CAJ | CAU | H2 | 105.9° | 109.6° |
| CAU | CAJ | H3 | 109.0° | 109.5° |
| CAU | CAJ | H4 | 109.0° | 109.5° |
| OAA | CAG | N | 127.5° | 120.0° |
| OAA | CAG | H9 | 116.3° | 120.0° |
| CAU | CAM | N | 110.8° | 108.8° |
| CAM | CAU | H2 | 105.3° | 109.5° |
| CAU | CAM | H7 | 109.1° | 109.6° |
| CAU | CAM | H8 | 109.2° | 109.6° |
| CAG | N | CA | 124.4° | 120.7° |
| CAG | N | CAM | 123.0° | 120.6° |
| N | CAG | H9 | 116.2° | 120.0° |
| N | CA | C | 116.6° | 109.6° |
| CA | N | CAM | 112.5° | 118.7° |
| N | CA | H10 | 103.9° | 109.6° |
| CA | C | NAP | 115.2° | 120.0° |
| CA | C | O | 123.4° | 120.0° |
| C | CA | H10 | 104.8° | 109.7° |
| N | CAM | H7 | 109.2° | 109.6° |
| N | CAM | H8 | 109.1° | 109.7° |
| C | NAP | NAO | 117.6° | 120.0° |
| NAP | C | O | 120.8° | 120.0° |
| C | NAP | H11 | 121.2° | 120.0° |
| NAP | NAO | CAS | 116.7° | 120.0° |
| NAO | NAP | H11 | 121.2° | 120.0° |
| NAP | NAO | H12 | 121.7° | 120.0° |
| NAO | CAS | OAB | 125.1° | 120.0° |
| NAO | CAS | CAV | 113.8° | 120.0° |
| CAS | NAO | H12 | 121.7° | 120.0° |
| OAB | CAS | CAV | 120.0° | 120.0° |
| CAS | CAV | CAI | 109.7° | 110.3° |
| CAS | CAV | CAL | 111.9° | 110.3° |
| CAS | CAV | H13 | 110.3° | 110.3° |
| CAI | CAH | NAN | 106.7° | 103.2° |
| CAH | CAI | CAV | 103.9° | 102.9° |
| CAH | CAI | H14 | 110.9° | 110.8° |
| CAH | CAI | H15 | 110.8° | 110.9° |
| CAI | CAH | H16 | 110.2° | 110.7° |
| CAI | CAH | H17 | 110.1° | 110.7° |
| CAH | NAN | CAL | 107.9° | 105.8° |
| NAN | CAH | H16 | 110.1° | 110.7° |
| NAN | CAH | H17 | 110.2° | 110.7° |
| CAH | NAN | H18 | 109.8° | 111.0° |
| CAI | CAV | CAL | 103.4° | 105.1° |
| CAI | CAV | H13 | 110.7° | 110.4° |
| CAV | CAI | H14 | 110.8° | 110.7° |
| CAV | CAI | H15 | 110.9° | 110.7° |
| CAV | CAL | NAN | 105.8° | 107.1° |
| CAL | CAV | H13 | 110.8° | 110.3° |
| CAV | CAL | H20 | 110.4° | 110.0° |
| CAV | CAL | H21 | 110.4° | 109.9° |
| CAL | NAN | H18 | 109.8° | 111.0° |
| NAN | CAL | H20 | 110.4° | 109.9° |
| NAN | CAL | H21 | 110.4° | 109.9° |
| H3 | CAJ | H4 | 109.4° | 109.5° |
| H5 | CB | H6 | 109.5° | 109.6° |
| H7 | CAM | H8 | 109.5° | 109.5° |
| H14 | CAI | H15 | 109.5° | 110.6° |
| H16 | CAH | H17 | 109.5° | 110.7° |
| H20 | CAL | H21 | 109.5° | 110.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAE | SAY | OAF | OAR | 122.0° | 122.9° |
| OAE | SAY | OAF | OAD | 119.1° | 123.0° |
| OAE | SAY | OAR | OAD | 123.7° | 113.5° |
| OAE | SAY | OAR | NAQ | 177.5° | 38.5° |
| OAE | SAY | OAD | H22 | 118.6° | 66.5° |
| OAF | SAY | OAR | OAD | 112.4° | 113.6° |
| OAF | SAY | OAR | NAQ | 53.6° | 171.5° |
| OAF | SAY | OAD | H22 | 0.0° | 66.4° |
| SAY | OAR | NAQ | CAU | 139.0° | 180.0° |
| SAY | OAR | NAQ | H1 | 100.4° | 56.0° |
| OAR | SAY | OAD | H22 | 120.0° | 180.0° |
| OAD | SAY | OAR | NAQ | 58.8° | 75.0° |
| OAR | NAQ | CAU | H1 | 120.7° | 124.0° |
| OAR | NAQ | CAU | CAJ | 41.3° | 150.2° |
| OAR | NAQ | CAU | CAM | 85.7° | 90.0° |
| OAR | NAQ | CAU | H2 | 158.9° | 30.1° |
| NAQ | CAU | CAJ | CB | 77.2° | 178.7° |
| NAQ | CAU | CAJ | CAM | 129.6° | 119.9° |
| NAQ | CAU | CAJ | H2 | 117.9° | 120.1° |
| NAQ | CAU | CAM | H2 | 115.9° | 120.0° |
| NAQ | CAU | CAM | N | 82.2° | 174.6° |
| NAQ | CAU | CAJ | H3 | 162.4° | 61.3° |
| NAQ | CAU | CAJ | H4 | 43.1° | 58.7° |
| NAQ | CAU | CAM | H7 | 157.6° | 65.6° |
| NAQ | CAU | CAM | H8 | 38.0° | 54.6° |
| CAJ | CB | CA | H5 | 120.1° | 119.9° |
| CAJ | CB | CA | H6 | 120.1° | 119.9° |
| CB | CAJ | CAU | H3 | 120.3° | 120.0° |
| CB | CAJ | CAU | H4 | 120.3° | 120.0° |
| CB | CAJ | CAU | CAM | 52.3° | 61.4° |
| CAJ | CB | CA | N | 67.2° | 54.6° |
| CAJ | CB | CA | C | 67.3° | 174.4° |
| CB | CAJ | CAU | H2 | 164.9° | 58.6° |
| CB | CAJ | H3 | H4 | 119.1° | 119.9° |
| CAJ | CB | H5 | H6 | 119.9° | 120.1° |
| CAJ | CB | CA | H10 | 175.3° | 65.2° |
| CA | CB | CAJ | CAU | 63.4° | 61.4° |
| CB | CA | N | CAG | 110.2° | 126.4° |
| CB | CA | N | C | 137.9° | 119.8° |
| CB | CA | N | H10 | 107.4° | 119.8° |
| CB | CA | C | H10 | 116.5° | 120.3° |
| CB | CA | N | CAM | 65.8° | 53.6° |
| CB | CA | C | NAP | 39.6° | 105.7° |
| CB | CA | C | O | 130.8° | 74.3° |
| CA | CB | CAJ | H3 | 56.9° | 58.7° |
| CA | CB | CAJ | H4 | 176.3° | 178.6° |
| CA | CB | H5 | H6 | 119.8° | 120.1° |
| CAJ | CAU | CAM | H2 | 112.9° | 120.0° |
| CAJ | CAU | CAM | N | 48.9° | 54.7° |
| CAJ | CAU | NAQ | H1 | 79.4° | 85.8° |
| CAU | CAJ | H3 | H4 | 119.1° | 120.0° |
| CAU | CAJ | CB | H5 | 56.7° | 178.7° |
| CAU | CAJ | CB | H6 | 176.6° | 58.6° |
| CAJ | CAU | CAM | H7 | 71.3° | 174.5° |
| CAJ | CAU | CAM | H8 | 169.1° | 65.3° |
| OAA | CAG | N | H9 | 180.0° | 179.9° |
| OAA | CAG | N | CA | 11.8° | 174.6° |
| OAA | CAG | N | CAM | 163.7° | 5.5° |
| CAU | CAM | N | CAG | 116.3° | 126.4° |
| CAU | CAM | N | CA | 59.8° | 53.6° |
| CAU | CAM | N | H7 | 120.2° | 119.8° |
| CAU | CAM | N | H8 | 120.2° | 119.9° |
| CAM | CAU | NAQ | H1 | 153.6° | 34.0° |
| CAM | CAU | CAJ | H3 | 68.0° | 58.6° |
| CAM | CAU | CAJ | H4 | 172.7° | 178.6° |
| CAU | CAM | H7 | H8 | 119.4° | 120.3° |
| CAG | N | CA | CAM | 176.0° | 179.9° |
| CAG | N | CA | C | 111.9° | 6.7° |
| CAG | N | CAM | H7 | 123.5° | 6.6° |
| CAG | N | CAM | H8 | 3.9° | 113.7° |
| CAG | N | CA | H10 | 2.8° | 113.7° |
| N | CA | C | H10 | 114.2° | 120.4° |
| N | CA | C | NAP | 168.8° | 135.0° |
| N | CA | C | O | 1.5° | 45.0° |
| N | CA | CB | H5 | 52.8° | 174.6° |
| N | CA | CB | H6 | 172.7° | 65.3° |
| CA | N | CAM | H7 | 60.4° | 173.4° |
| CA | N | CAM | H8 | 180.0° | 66.3° |
| CA | N | CAG | H9 | 168.2° | 5.3° |
| C | CA | N | CAM | 72.1° | 173.4° |
| CA | C | NAP | O | 170.6° | 179.9° |
| CA | C | NAP | NAO | 179.0° | 180.0° |
| C | CA | CB | H5 | 172.6° | 65.6° |
| C | CA | CB | H6 | 52.7° | 54.5° |
| CA | C | NAP | H11 | 1.0° | 0.1° |
| N | CAM | CAU | H2 | 161.9° | 65.3° |
| N | CAM | H7 | H8 | 119.4° | 120.4° |
| CAM | N | CAG | H9 | 16.3° | 174.6° |
| CAM | N | CA | H10 | 173.2° | 66.2° |
| C | NAP | NAO | H11 | 180.0° | 179.9° |
| C | NAP | NAO | CAS | 100.6° | 180.0° |
| NAP | C | CA | H10 | 76.9° | 14.7° |
| C | NAP | NAO | H12 | 79.4° | 0.0° |
| NAO | NAP | C | O | 10.4° | 0.1° |
| NAP | NAO | CAS | H12 | 180.0° | 180.0° |
| NAP | NAO | CAS | OAB | 24.5° | 0.0° |
| NAP | NAO | CAS | CAV | 168.0° | 180.0° |
| O | C | CA | H10 | 112.7° | 165.4° |
| O | C | NAP | H11 | 169.6° | 180.0° |
| NAO | CAS | OAB | CAV | 166.8° | 180.0° |
| NAO | CAS | CAV | CAI | 97.3° | 177.2° |
| NAO | CAS | CAV | CAL | 148.6° | 61.5° |
| CAS | NAO | NAP | H11 | 79.3° | 0.0° |
| NAO | CAS | CAV | H13 | 24.9° | 60.6° |
| OAB | CAS | CAV | CAI | 94.5° | 2.8° |
| OAB | CAS | CAV | CAL | 19.6° | 118.5° |
| OAB | CAS | NAO | H12 | 155.5° | 180.0° |
| OAB | CAS | CAV | H13 | 143.3° | 119.4° |
| CAS | CAV | CAI | CAH | 84.5° | 140.9° |
| CAS | CAV | CAI | CAL | 119.4° | 118.9° |
| CAS | CAV | CAI | H13 | 121.9° | 122.1° |
| CAS | CAV | CAL | H13 | 123.5° | 122.1° |
| CAS | CAV | CAL | NAN | 86.6° | 117.7° |
| CAV | CAS | NAO | H12 | 12.0° | 0.0° |
| CAS | CAV | CAI | H14 | 156.4° | 22.5° |
| CAS | CAV | CAI | H15 | 34.6° | 100.6° |
| CAS | CAV | CAL | H20 | 153.9° | 122.9° |
| CAS | CAV | CAL | H21 | 32.8° | 1.7° |
| CAI | CAH | NAN | H16 | 119.6° | 118.4° |
| CAI | CAH | NAN | H17 | 119.6° | 118.4° |
| CAH | CAI | CAV | H14 | 119.1° | 118.4° |
| CAH | CAI | CAV | H15 | 119.1° | 118.5° |
| CAH | CAI | CAV | CAL | 34.9° | 22.0° |
| CAI | CAH | NAN | CAL | 6.7° | 39.2° |
| CAH | CAI | CAV | H13 | 153.5° | 97.0° |
| CAH | CAI | H14 | H15 | 122.6° | 123.4° |
| CAI | CAH | H16 | H17 | 121.3° | 123.1° |
| CAI | CAH | NAN | H18 | 126.4° | 81.3° |
| NAN | CAH | CAI | CAV | 25.9° | 37.4° |
| CAH | NAN | CAL | CAV | 15.5° | 25.3° |
| CAH | NAN | CAL | H18 | 119.7° | 120.5° |
| NAN | CAH | CAI | H14 | 93.2° | 81.0° |
| NAN | CAH | CAI | H15 | 145.0° | 155.8° |
| NAN | CAH | H16 | H17 | 121.3° | 123.1° |
| CAH | NAN | CAL | H20 | 103.9° | 94.1° |
| CAH | NAN | CAL | H21 | 135.0° | 144.7° |
| CAI | CAV | CAL | H13 | 118.6° | 119.0° |
| CAI | CAV | CAL | NAN | 31.3° | 1.2° |
| CAV | CAI | H14 | H15 | 122.6° | 123.1° |
| CAV | CAI | CAH | H16 | 93.6° | 155.9° |
| CAV | CAI | CAH | H17 | 145.5° | 81.0° |
| CAI | CAV | CAL | H20 | 88.2° | 118.2° |
| CAI | CAV | CAL | H21 | 150.7° | 120.6° |
| CAV | CAL | NAN | H20 | 119.4° | 119.4° |
| CAV | CAL | NAN | H21 | 119.4° | 119.4° |
| CAL | CAV | CAI | H14 | 84.2° | 96.5° |
| CAL | CAV | CAI | H15 | 154.0° | 140.5° |
| CAV | CAL | NAN | H18 | 104.2° | 95.2° |
| CAV | CAL | H20 | H21 | 121.7° | 121.2° |
| NAN | CAL | CAV | H13 | 149.8° | 120.3° |
| CAL | NAN | CAH | H16 | 112.9° | 157.6° |
| CAL | NAN | CAH | H17 | 126.2° | 79.2° |
| NAN | CAL | H20 | H21 | 121.7° | 121.2° |
| H1 | NAQ | CAU | H2 | 38.3° | 154.0° |
| H2 | CAU | CAJ | H3 | 44.6° | 178.6° |
| H2 | CAU | CAJ | H4 | 74.8° | 61.4° |
| H2 | CAU | CAM | H7 | 41.7° | 54.5° |
| H2 | CAU | CAM | H8 | 77.9° | 174.7° |
| H3 | CAJ | CB | H5 | 177.0° | 61.3° |
| H3 | CAJ | CB | H6 | 63.1° | 178.6° |
| H4 | CAJ | CB | H5 | 63.7° | 58.7° |
| H4 | CAJ | CB | H6 | 56.2° | 61.4° |
| H5 | CB | CA | H10 | 55.3° | 54.7° |
| H6 | CB | CA | H10 | 64.6° | 174.9° |
| H11 | NAP | NAO | H12 | 100.7° | 180.0° |
| H13 | CAV | CAI | H14 | 34.4° | 144.6° |
| H13 | CAV | CAI | H15 | 87.4° | 21.6° |
| H13 | CAV | CAL | H20 | 30.4° | 0.8° |
| H13 | CAV | CAL | H21 | 90.7° | 120.4° |
| H14 | CAI | CAH | H16 | 147.3° | 37.5° |
| H14 | CAI | CAH | H17 | 26.4° | 160.6° |
| H15 | CAI | CAH | H16 | 25.5° | 85.7° |
| H15 | CAI | CAH | H17 | 95.4° | 37.4° |
| H16 | CAH | NAN | H18 | 6.8° | 37.1° |
| H17 | CAH | NAN | H18 | 114.1° | 160.3° |
| H18 | NAN | CAL | H20 | 136.4° | 145.4° |
| H18 | NAN | CAL | H21 | 15.2° | 24.2° |
