A1JDC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C35 | N34 | sing | 1.47Å | 1.52Å | |
| N34 | C33 | sing | 1.47Å | 1.49Å | |
| N34 | C36 | sing | 1.47Å | 1.49Å | |
| C33 | C32 | sing | 1.53Å | 1.52Å | |
| C32 | N31 | sing | 1.47Å | 1.46Å | |
| C36 | C37 | sing | 1.53Å | 1.57Å | |
| N31 | C37 | sing | 1.47Å | 1.48Å | |
| N31 | C30 | sing | 1.40Å | 1.45Å | |
| C29 | C30 | doub | 1.38Å | 1.40Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.40Å | Aromatic |
| C30 | C38 | sing | 1.39Å | 1.41Å | Aromatic |
| C28 | C27 | doub | 1.40Å | 1.40Å | Aromatic |
| C38 | C11 | sing | 1.49Å | 1.51Å | |
| C38 | C39 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | O10 | sing | 1.43Å | 1.42Å | |
| C27 | C39 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | N26 | sing | 1.41Å | 1.44Å | |
| N26 | C25 | sing | 1.39Å | 1.44Å | |
| O10 | C09 | sing | 1.44Å | 1.40Å | |
| C09 | C08 | sing | 1.51Å | 1.55Å | |
| C25 | N24 | doub | 1.31Å | 1.38Å | Aromatic |
| C25 | N40 | sing | 1.34Å | 1.38Å | Aromatic |
| N24 | C04 | sing | 1.33Å | 1.39Å | Aromatic |
| N40 | C41 | doub | 1.32Å | 1.33Å | Aromatic |
| C08 | C07 | doub | 1.38Å | 1.41Å | Aromatic |
| C08 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C07 | C06 | sing | 1.39Å | 1.43Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C04 | C03 | doub | 1.41Å | 1.44Å | Aromatic |
| C04 | N05 | sing | 1.38Å | 1.43Å | |
| C41 | C03 | sing | 1.39Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.54Å | 1.54Å | |
| C16 | C14 | sing | 1.54Å | 1.56Å | |
| C06 | N05 | sing | 1.39Å | 1.48Å | |
| C06 | N19 | doub | 1.32Å | 1.36Å | Aromatic |
| C13 | N19 | sing | 1.32Å | 1.35Å | Aromatic |
| C13 | C14 | sing | 1.51Å | 1.53Å | |
| C17 | C18 | sing | 1.54Å | 1.54Å | |
| C03 | C02 | sing | 1.47Å | 1.46Å | |
| N05 | N20 | sing | 1.40Å | 1.44Å | |
| C14 | C18 | sing | 1.54Å | 1.57Å | |
| C14 | O15 | sing | 1.43Å | 1.38Å | |
| C02 | N20 | sing | 1.35Å | 1.46Å | |
| C02 | O01 | doub | 1.22Å | 1.20Å | |
| N20 | C21 | sing | 1.46Å | 1.50Å | |
| C21 | C22 | sing | 1.51Å | 1.50Å | |
| C22 | C23 | doub | 1.31Å | 1.33Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H353 | sing | 1.09Å | 1.10Å | |
| C36 | H361 | sing | 1.09Å | 1.10Å | |
| C36 | H362 | sing | 1.09Å | 1.10Å | |
| C37 | H371 | sing | 1.09Å | 1.10Å | |
| C37 | H372 | sing | 1.09Å | 1.10Å | |
| C39 | H391 | sing | 1.08Å | 1.08Å | |
| C41 | H411 | sing | 1.08Å | 1.08Å | |
| N26 | H261 | sing | 0.97Å | 1.00Å | |
| O15 | H151 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C35 | N34 | C33 | 107.8° | 111.0° |
| C35 | N34 | C36 | 108.1° | 111.0° |
| N34 | C35 | H352 | 109.5° | 109.5° |
| N34 | C35 | H351 | 109.5° | 109.5° |
| N34 | C35 | H353 | 109.4° | 109.4° |
| C33 | N34 | C36 | 111.6° | 110.9° |
| N34 | C33 | C32 | 110.5° | 109.3° |
| N34 | C33 | H331 | 109.2° | 109.5° |
| N34 | C33 | H332 | 109.2° | 109.5° |
| N34 | C36 | C37 | 113.4° | 109.4° |
| N34 | C36 | H361 | 108.5° | 109.5° |
| N34 | C36 | H362 | 108.5° | 109.5° |
| C33 | C32 | N31 | 116.1° | 109.4° |
| C33 | C32 | H321 | 107.8° | 109.5° |
| C33 | C32 | H322 | 107.8° | 109.5° |
| C32 | C33 | H331 | 109.2° | 109.5° |
| C32 | C33 | H332 | 109.2° | 109.5° |
| C32 | N31 | C37 | 106.6° | 110.9° |
| C32 | N31 | C30 | 127.7° | 111.0° |
| N31 | C32 | H321 | 107.8° | 109.5° |
| N31 | C32 | H322 | 107.8° | 109.5° |
| C36 | C37 | N31 | 116.4° | 109.4° |
| C37 | C36 | H361 | 108.5° | 109.5° |
| C37 | C36 | H362 | 108.5° | 109.5° |
| C36 | C37 | H371 | 107.7° | 109.4° |
| C36 | C37 | H372 | 107.7° | 109.5° |
| C37 | N31 | C30 | 124.9° | 111.0° |
| N31 | C37 | H371 | 107.7° | 109.5° |
| N31 | C37 | H372 | 107.7° | 109.5° |
| N31 | C30 | C29 | 123.9° | 119.7° |
| N31 | C30 | C38 | 120.8° | 119.6° |
| C30 | C29 | C28 | 123.2° | 119.8° |
| C29 | C30 | C38 | 115.3° | 120.7° |
| C30 | C29 | H291 | 118.4° | 120.2° |
| C29 | C28 | C27 | 120.7° | 120.0° |
| C29 | C28 | H281 | 119.7° | 120.0° |
| C28 | C29 | H291 | 118.4° | 120.1° |
| C30 | C38 | C11 | 125.0° | 118.8° |
| C30 | C38 | C39 | 121.1° | 119.4° |
| C28 | C27 | C39 | 116.5° | 120.1° |
| C28 | C27 | N26 | 120.1° | 115.3° |
| C27 | C28 | H281 | 119.7° | 120.0° |
| C11 | C38 | C39 | 113.9° | 121.9° |
| C38 | C11 | O10 | 109.4° | 111.9° |
| C38 | C11 | H112 | 109.5° | 109.0° |
| C38 | C11 | H111 | 109.5° | 109.0° |
| C38 | C39 | C27 | 123.3° | 120.1° |
| C38 | C39 | H391 | 118.4° | 120.0° |
| C11 | O10 | C09 | 119.5° | 112.1° |
| O10 | C11 | H112 | 109.5° | 109.0° |
| O10 | C11 | H111 | 109.5° | 109.0° |
| C39 | C27 | N26 | 123.3° | 124.6° |
| C27 | C39 | H391 | 118.4° | 119.9° |
| C27 | N26 | C25 | 125.1° | 121.6° |
| C27 | N26 | H261 | 117.5° | 119.2° |
| N26 | C25 | N24 | 121.2° | 124.1° |
| N26 | C25 | N40 | 112.5° | 113.4° |
| C25 | N26 | H261 | 117.5° | 119.2° |
| O10 | C09 | C08 | 110.5° | 110.2° |
| O10 | C09 | H092 | 109.2° | 109.4° |
| O10 | C09 | H091 | 109.2° | 109.2° |
| C09 | C08 | C07 | 120.8° | 120.2° |
| C09 | C08 | C12 | 121.5° | 121.2° |
| C08 | C09 | H092 | 109.2° | 109.4° |
| C08 | C09 | H091 | 109.2° | 109.4° |
| N24 | C25 | N40 | 126.3° | 122.5° |
| C25 | N24 | C04 | 113.9° | 120.5° |
| C25 | N40 | C41 | 118.3° | 121.3° |
| N24 | C04 | C03 | 121.3° | 118.0° |
| N24 | C04 | N05 | 128.7° | 134.8° |
| N40 | C41 | C03 | 120.7° | 118.0° |
| N40 | C41 | H411 | 119.7° | 121.0° |
| C07 | C08 | C12 | 117.7° | 118.5° |
| C08 | C07 | C06 | 119.1° | 119.1° |
| C08 | C07 | H071 | 120.5° | 120.4° |
| C08 | C12 | C13 | 120.4° | 119.2° |
| C08 | C12 | H121 | 119.8° | 120.4° |
| C07 | C06 | N05 | 118.3° | 120.0° |
| C07 | C06 | N19 | 122.0° | 120.7° |
| C06 | C07 | H071 | 120.4° | 120.4° |
| C12 | C13 | N19 | 122.8° | 121.0° |
| C12 | C13 | C14 | 120.4° | 119.5° |
| C13 | C12 | H121 | 119.8° | 120.4° |
| C03 | C04 | N05 | 110.0° | 107.2° |
| C04 | C03 | C41 | 119.5° | 119.7° |
| C04 | C03 | C02 | 108.8° | 106.7° |
| C04 | N05 | C06 | 123.7° | 127.2° |
| C04 | N05 | N20 | 105.4° | 109.5° |
| C41 | C03 | C02 | 131.7° | 133.6° |
| C03 | C41 | H411 | 119.6° | 121.0° |
| C17 | C16 | C14 | 90.6° | 87.1° |
| C16 | C17 | C18 | 89.8° | 87.1° |
| C16 | C17 | H172 | 114.1° | 113.6° |
| C16 | C17 | H171 | 114.2° | 113.7° |
| C17 | C16 | H161 | 114.0° | 113.6° |
| C17 | C16 | H162 | 113.9° | 113.6° |
| C16 | C14 | C13 | 118.0° | 113.6° |
| C16 | C14 | C18 | 87.8° | 87.1° |
| C16 | C14 | O15 | 114.9° | 113.7° |
| C14 | C16 | H161 | 114.0° | 113.6° |
| C14 | C16 | H162 | 114.0° | 113.6° |
| N05 | C06 | N19 | 119.6° | 119.3° |
| C06 | N05 | N20 | 130.9° | 123.3° |
| C06 | N19 | C13 | 118.0° | 121.5° |
| N19 | C13 | C14 | 116.9° | 119.5° |
| C13 | C14 | C18 | 121.3° | 113.6° |
| C13 | C14 | O15 | 104.2° | 112.9° |
| C17 | C18 | C14 | 90.1° | 87.1° |
| C18 | C17 | H172 | 114.1° | 113.6° |
| C18 | C17 | H171 | 114.1° | 113.6° |
| C17 | C18 | H181 | 114.1° | 113.6° |
| C17 | C18 | H182 | 114.0° | 113.6° |
| C03 | C02 | N20 | 104.4° | 106.9° |
| C03 | C02 | O01 | 131.6° | 126.6° |
| N05 | N20 | C02 | 111.5° | 109.7° |
| N05 | N20 | C21 | 130.9° | 125.2° |
| C18 | C14 | O15 | 110.6° | 113.6° |
| C14 | C18 | H181 | 114.1° | 113.6° |
| C14 | C18 | H182 | 114.1° | 113.6° |
| C14 | O15 | H151 | 109.5° | 114.0° |
| N20 | C02 | O01 | 124.0° | 126.6° |
| C02 | N20 | C21 | 117.5° | 125.1° |
| N20 | C21 | C22 | 108.9° | 109.5° |
| N20 | C21 | H211 | 109.6° | 109.5° |
| N20 | C21 | H212 | 109.6° | 109.5° |
| C21 | C22 | C23 | 123.0° | 120.0° |
| C22 | C21 | H211 | 109.6° | 109.4° |
| C22 | C21 | H212 | 109.6° | 109.5° |
| C21 | C22 | H221 | 118.5° | 120.0° |
| C23 | C22 | H221 | 118.5° | 120.0° |
| C22 | C23 | H232 | 120.0° | 120.0° |
| C22 | C23 | H231 | 120.0° | 120.1° |
| H172 | C17 | H171 | 109.5° | 112.8° |
| H211 | C21 | H212 | 109.5° | 109.4° |
| H092 | C09 | H091 | 109.5° | 109.3° |
| H112 | C11 | H111 | 109.4° | 109.0° |
| H161 | C16 | H162 | 109.5° | 112.9° |
| H181 | C18 | H182 | 109.5° | 113.0° |
| H232 | C23 | H231 | 120.0° | 119.9° |
| H321 | C32 | H322 | 109.4° | 109.5° |
| H331 | C33 | H332 | 109.5° | 109.5° |
| H352 | C35 | H351 | 109.4° | 109.5° |
| H352 | C35 | H353 | 109.5° | 109.5° |
| H351 | C35 | H353 | 109.5° | 109.5° |
| H361 | C36 | H362 | 109.5° | 109.5° |
| H371 | C37 | H372 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C35 | N34 | C33 | C36 | 118.6° | 123.9° |
| C35 | N34 | C33 | C32 | 101.0° | 64.6° |
| C35 | N34 | C36 | C37 | 153.3° | 64.6° |
| C35 | N34 | C33 | H331 | 138.8° | 55.4° |
| C35 | N34 | C33 | H332 | 19.1° | 175.4° |
| N34 | C35 | H352 | H351 | 120.0° | 120.0° |
| N34 | C35 | H352 | H353 | 120.0° | 120.0° |
| N34 | C35 | H351 | H353 | 120.0° | 119.9° |
| C35 | N34 | C36 | H361 | 32.7° | 175.5° |
| C35 | N34 | C36 | H362 | 86.1° | 55.4° |
| N34 | C33 | C32 | H331 | 120.2° | 120.0° |
| N34 | C33 | C32 | H332 | 120.2° | 120.0° |
| N34 | C33 | C32 | N31 | 66.6° | 58.4° |
| C33 | N34 | C36 | C37 | 34.9° | 59.3° |
| N34 | C33 | C32 | H321 | 172.4° | 178.4° |
| N34 | C33 | C32 | H322 | 54.4° | 61.6° |
| N34 | C33 | H331 | H332 | 119.5° | 120.0° |
| C33 | N34 | C35 | H352 | 180.0° | 60.0° |
| C33 | N34 | C35 | H351 | 60.0° | 180.0° |
| C33 | N34 | C35 | H353 | 60.0° | 60.0° |
| C33 | N34 | C36 | H361 | 85.7° | 60.7° |
| C33 | N34 | C36 | H362 | 155.5° | 179.3° |
| C36 | N34 | C33 | C32 | 17.5° | 59.3° |
| N34 | C36 | C37 | H361 | 120.6° | 120.0° |
| N34 | C36 | C37 | H362 | 120.6° | 120.0° |
| N34 | C36 | C37 | N31 | 53.0° | 58.4° |
| C36 | N34 | C33 | H331 | 102.6° | 179.3° |
| C36 | N34 | C33 | H332 | 137.7° | 60.7° |
| C36 | N34 | C35 | H352 | 59.2° | 176.2° |
| C36 | N34 | C35 | H351 | 60.8° | 56.1° |
| C36 | N34 | C35 | H353 | 179.2° | 63.8° |
| N34 | C36 | H361 | H362 | 118.2° | 120.1° |
| N34 | C36 | C37 | H371 | 174.0° | 61.5° |
| N34 | C36 | C37 | H372 | 68.0° | 178.4° |
| C33 | C32 | N31 | H321 | 121.0° | 119.9° |
| C33 | C32 | N31 | H322 | 121.0° | 120.1° |
| C33 | C32 | N31 | C37 | 48.5° | 59.3° |
| C33 | C32 | N31 | C30 | 141.9° | 176.8° |
| C33 | C32 | H321 | H322 | 117.0° | 120.1° |
| C32 | C33 | H331 | H332 | 119.5° | 120.1° |
| C32 | N31 | C37 | C36 | 9.3° | 59.3° |
| C32 | N31 | C37 | C30 | 170.0° | 123.8° |
| C32 | N31 | C30 | C29 | 94.7° | 60.0° |
| C32 | N31 | C30 | C38 | 84.0° | 120.1° |
| N31 | C32 | H321 | H322 | 117.0° | 120.0° |
| N31 | C32 | C33 | H331 | 53.6° | 178.4° |
| N31 | C32 | C33 | H332 | 173.3° | 61.5° |
| C32 | N31 | C37 | H371 | 130.3° | 60.6° |
| C32 | N31 | C37 | H372 | 111.7° | 179.4° |
| C36 | C37 | N31 | H371 | 121.0° | 119.9° |
| C36 | C37 | N31 | H372 | 121.0° | 120.1° |
| C36 | C37 | N31 | C30 | 160.7° | 176.9° |
| C37 | C36 | H361 | H362 | 118.2° | 120.0° |
| C36 | C37 | H371 | H372 | 116.9° | 120.1° |
| C37 | N31 | C30 | C29 | 73.1° | 63.8° |
| C37 | N31 | C30 | C38 | 108.2° | 116.2° |
| C37 | N31 | C32 | H321 | 169.4° | 179.3° |
| C37 | N31 | C32 | H322 | 72.5° | 60.7° |
| N31 | C37 | C36 | H361 | 67.6° | 61.6° |
| N31 | C37 | C36 | H362 | 173.6° | 178.4° |
| N31 | C37 | H371 | H372 | 116.8° | 120.1° |
| N31 | C30 | C29 | C38 | 178.8° | 179.9° |
| N31 | C30 | C29 | C28 | 179.6° | 179.9° |
| N31 | C30 | C38 | C11 | 1.4° | 0.2° |
| N31 | C30 | C38 | C39 | 179.8° | 179.6° |
| N31 | C30 | C29 | H291 | 0.4° | 0.0° |
| C30 | N31 | C32 | H321 | 21.0° | 56.9° |
| C30 | N31 | C32 | H322 | 97.1° | 63.1° |
| C30 | N31 | C37 | H371 | 39.7° | 63.2° |
| C30 | N31 | C37 | H372 | 78.3° | 56.8° |
| C30 | C29 | C28 | H291 | 180.0° | 179.9° |
| C30 | C29 | C28 | C27 | 0.0° | 0.2° |
| C29 | C30 | C38 | C11 | 179.8° | 179.8° |
| C29 | C30 | C38 | C39 | 0.9° | 0.5° |
| C30 | C29 | C28 | H281 | 180.0° | 179.7° |
| C28 | C29 | C30 | C38 | 0.8° | 0.2° |
| C29 | C28 | C27 | H281 | 180.0° | 180.0° |
| C29 | C28 | C27 | C39 | 0.7° | 0.4° |
| C29 | C28 | C27 | N26 | 179.2° | 178.1° |
| C30 | C38 | C11 | C39 | 178.9° | 179.8° |
| C30 | C38 | C11 | O10 | 121.8° | 145.8° |
| C30 | C38 | C39 | C27 | 0.3° | 0.3° |
| C30 | C38 | C11 | H112 | 1.7° | 25.2° |
| C30 | C38 | C11 | H111 | 118.2° | 93.6° |
| C38 | C30 | C29 | H291 | 179.2° | 179.9° |
| C30 | C38 | C39 | H391 | 179.8° | 179.7° |
| C28 | C27 | C39 | C38 | 0.6° | 0.1° |
| C28 | C27 | C39 | N26 | 178.5° | 178.3° |
| C28 | C27 | N26 | C25 | 151.5° | 177.6° |
| C27 | C28 | C29 | H291 | 180.0° | 179.7° |
| C28 | C27 | C39 | H391 | 179.4° | 179.9° |
| C28 | C27 | N26 | H261 | 28.4° | 2.9° |
| C38 | C11 | O10 | H112 | 120.0° | 120.6° |
| C38 | C11 | O10 | H111 | 120.0° | 120.6° |
| C11 | C38 | C39 | C27 | 179.2° | 179.9° |
| C38 | C11 | O10 | C09 | 164.8° | 143.4° |
| C38 | C11 | H112 | H111 | 120.0° | 118.8° |
| C11 | C38 | C39 | H391 | 0.8° | 0.1° |
| C39 | C38 | C11 | O10 | 57.2° | 34.5° |
| C38 | C39 | C27 | H391 | 180.0° | 180.0° |
| C38 | C39 | C27 | N26 | 179.1° | 178.2° |
| C39 | C38 | C11 | H112 | 177.2° | 155.1° |
| C39 | C38 | C11 | H111 | 62.8° | 86.2° |
| C11 | O10 | C09 | C08 | 115.0° | 128.5° |
| C11 | O10 | C09 | H092 | 124.9° | 8.3° |
| C11 | O10 | C09 | H091 | 5.2° | 111.3° |
| O10 | C11 | H112 | H111 | 120.0° | 118.8° |
| C39 | C27 | N26 | C25 | 30.0° | 0.8° |
| C39 | C27 | C28 | H281 | 179.4° | 179.6° |
| C39 | C27 | N26 | H261 | 150.0° | 178.7° |
| C27 | N26 | C25 | H261 | 180.0° | 179.5° |
| C27 | N26 | C25 | N24 | 23.8° | 0.4° |
| C27 | N26 | C25 | N40 | 157.4° | 179.8° |
| N26 | C27 | C28 | H281 | 0.8° | 1.9° |
| N26 | C27 | C39 | H391 | 0.9° | 1.7° |
| N26 | C25 | N24 | N40 | 178.6° | 179.7° |
| N26 | C25 | N24 | C04 | 179.5° | 179.3° |
| N26 | C25 | N40 | C41 | 179.6° | 179.2° |
| O10 | C09 | C08 | H092 | 120.2° | 120.2° |
| O10 | C09 | C08 | H091 | 120.2° | 120.1° |
| O10 | C09 | C08 | C07 | 14.4° | 23.3° |
| O10 | C09 | C08 | C12 | 165.3° | 155.1° |
| O10 | C09 | H092 | H091 | 119.5° | 119.5° |
| C09 | O10 | C11 | H112 | 75.3° | 96.0° |
| C09 | O10 | C11 | H111 | 44.7° | 22.7° |
| C09 | C08 | C07 | C12 | 179.7° | 178.4° |
| C09 | C08 | C07 | C06 | 179.6° | 178.4° |
| C09 | C08 | C12 | C13 | 179.6° | 178.1° |
| C09 | C08 | C07 | H071 | 0.4° | 2.2° |
| C08 | C09 | H092 | H091 | 119.5° | 119.8° |
| C09 | C08 | C12 | H121 | 0.4° | 2.0° |
| N24 | C25 | N40 | C41 | 0.9° | 0.6° |
| C25 | N24 | C04 | C03 | 0.4° | 0.3° |
| C25 | N24 | C04 | N05 | 178.8° | 179.5° |
| N24 | C25 | N26 | H261 | 156.2° | 180.0° |
| N40 | C25 | N24 | C04 | 0.8° | 0.4° |
| C25 | N40 | C41 | C03 | 0.4° | 0.1° |
| C25 | N40 | C41 | H411 | 179.6° | 179.8° |
| N40 | C25 | N26 | H261 | 22.6° | 0.3° |
| N24 | C04 | C03 | N05 | 179.3° | 179.9° |
| N24 | C04 | C03 | C41 | 0.0° | 1.0° |
| N24 | C04 | N05 | C06 | 2.2° | 1.9° |
| N24 | C04 | C03 | C02 | 180.0° | 179.0° |
| N24 | C04 | N05 | N20 | 179.2° | 178.6° |
| N40 | C41 | C03 | C04 | 0.0° | 0.9° |
| N40 | C41 | C03 | H411 | 180.0° | 179.9° |
| N40 | C41 | C03 | C02 | 180.0° | 179.1° |
| C08 | C07 | C06 | H071 | 180.0° | 179.5° |
| C07 | C08 | C12 | C13 | 0.0° | 0.4° |
| C08 | C07 | C06 | N05 | 179.4° | 179.7° |
| C08 | C07 | C06 | N19 | 0.1° | 0.4° |
| C07 | C08 | C09 | H092 | 105.8° | 96.9° |
| C07 | C08 | C09 | H091 | 134.5° | 143.4° |
| C07 | C08 | C12 | H121 | 179.9° | 179.6° |
| C12 | C08 | C07 | C06 | 0.0° | 0.1° |
| C08 | C12 | C13 | H121 | 180.0° | 179.9° |
| C08 | C12 | C13 | N19 | 0.1° | 0.2° |
| C08 | C12 | C13 | C14 | 179.9° | 179.9° |
| C12 | C08 | C07 | H071 | 179.9° | 179.4° |
| C12 | C08 | C09 | H092 | 74.5° | 84.7° |
| C12 | C08 | C09 | H091 | 45.2° | 35.0° |
| C07 | C06 | N05 | C04 | 29.9° | 0.0° |
| C07 | C06 | N05 | N19 | 179.4° | 179.3° |
| C07 | C06 | N19 | C13 | 0.2° | 0.7° |
| C07 | C06 | N05 | N20 | 154.0° | 179.5° |
| C12 | C13 | C14 | C16 | 53.6° | 142.8° |
| C12 | C13 | N19 | C06 | 0.2° | 0.4° |
| C12 | C13 | N19 | C14 | 179.8° | 179.7° |
| C12 | C13 | C14 | C18 | 52.1° | 119.7° |
| C12 | C13 | C14 | O15 | 177.5° | 11.5° |
| C04 | C03 | C41 | C02 | 180.0° | 180.0° |
| C03 | C04 | N05 | C06 | 178.5° | 178.0° |
| C03 | C04 | N05 | N20 | 1.6° | 1.5° |
| C04 | C03 | C02 | N20 | 0.5° | 0.2° |
| C04 | C03 | C02 | O01 | 179.9° | 179.7° |
| C04 | C03 | C41 | H411 | 180.0° | 179.0° |
| N05 | C04 | C03 | C41 | 179.3° | 178.9° |
| C04 | N05 | C06 | N20 | 176.1° | 179.5° |
| C04 | N05 | C06 | N19 | 149.5° | 179.3° |
| N05 | C04 | C03 | C02 | 0.7° | 1.1° |
| C04 | N05 | N20 | C02 | 1.9° | 1.4° |
| C04 | N05 | N20 | C21 | 178.7° | 178.6° |
| C41 | C03 | C02 | N20 | 179.5° | 179.7° |
| C41 | C03 | C02 | O01 | 0.1° | 0.3° |
| C17 | C16 | C14 | H161 | 116.7° | 114.5° |
| C17 | C16 | C14 | H162 | 116.7° | 114.6° |
| C17 | C16 | C14 | C13 | 114.7° | 140.0° |
| C16 | C17 | C18 | H172 | 116.5° | 114.5° |
| C16 | C17 | C18 | H171 | 116.5° | 114.7° |
| C17 | C16 | C14 | C18 | 9.8° | 25.5° |
| C17 | C16 | C14 | O15 | 121.6° | 89.1° |
| C16 | C17 | H172 | H171 | 129.4° | 131.3° |
| C17 | C16 | H161 | H162 | 128.9° | 131.3° |
| C16 | C17 | C18 | H181 | 126.6° | 89.1° |
| C16 | C17 | C18 | H182 | 106.6° | 140.0° |
| C16 | C14 | C13 | N19 | 126.2° | 37.5° |
| C16 | C14 | C13 | C18 | 105.7° | 97.5° |
| C16 | C14 | C13 | O15 | 128.9° | 131.3° |
| C16 | C14 | C18 | O15 | 115.9° | 114.6° |
| C14 | C16 | C17 | H172 | 106.4° | 140.0° |
| C14 | C16 | C17 | H171 | 126.6° | 89.1° |
| C14 | C16 | H161 | H162 | 128.9° | 131.2° |
| C16 | C14 | C18 | H181 | 126.4° | 89.0° |
| C16 | C14 | C18 | H182 | 106.7° | 139.9° |
| C16 | C14 | O15 | H151 | 180.0° | 81.0° |
| N05 | C06 | N19 | C13 | 179.5° | 180.0° |
| C06 | N05 | N20 | C02 | 178.6° | 178.1° |
| C06 | N05 | N20 | C21 | 4.6° | 1.9° |
| N05 | C06 | C07 | H071 | 0.6° | 0.8° |
| C06 | N19 | C13 | C14 | 180.0° | 179.4° |
| N19 | C06 | N05 | N20 | 26.7° | 0.1° |
| N19 | C06 | C07 | H071 | 179.9° | 179.9° |
| N19 | C13 | C14 | C18 | 128.0° | 60.0° |
| N19 | C13 | C14 | O15 | 2.6° | 168.8° |
| N19 | C13 | C12 | H121 | 179.9° | 179.8° |
| C13 | C14 | C18 | C17 | 111.9° | 140.0° |
| C13 | C14 | C18 | O15 | 122.4° | 130.8° |
| C14 | C13 | C12 | H121 | 0.1° | 0.1° |
| C13 | C14 | C16 | H161 | 128.6° | 105.5° |
| C13 | C14 | C16 | H162 | 1.9° | 25.4° |
| C13 | C14 | C18 | H181 | 4.7° | 25.5° |
| C13 | C14 | C18 | H182 | 131.5° | 105.5° |
| C13 | C14 | O15 | H151 | 49.3° | 50.3° |
| C17 | C18 | C14 | H181 | 116.6° | 114.5° |
| C17 | C18 | C14 | H182 | 116.6° | 114.5° |
| C17 | C18 | C14 | O15 | 125.7° | 89.2° |
| C18 | C17 | H172 | H171 | 129.3° | 131.2° |
| C18 | C17 | C16 | H161 | 106.6° | 140.0° |
| C18 | C17 | C16 | H162 | 126.8° | 89.1° |
| C17 | C18 | H181 | H182 | 129.2° | 131.2° |
| C03 | C02 | N20 | N05 | 1.5° | 0.7° |
| C03 | C02 | N20 | O01 | 179.4° | 179.9° |
| C03 | C02 | N20 | C21 | 178.8° | 179.3° |
| C02 | C03 | C41 | H411 | 0.0° | 0.9° |
| N05 | N20 | C02 | C21 | 177.2° | 180.0° |
| N05 | N20 | C02 | O01 | 179.1° | 179.3° |
| N05 | N20 | C21 | C22 | 66.0° | 95.0° |
| N05 | N20 | C21 | H211 | 53.9° | 25.0° |
| N05 | N20 | C21 | H212 | 174.1° | 145.0° |
| C14 | C18 | C17 | H172 | 106.5° | 140.0° |
| C14 | C18 | C17 | H171 | 126.5° | 89.2° |
| C18 | C14 | C16 | H161 | 106.8° | 140.0° |
| C18 | C14 | C16 | H162 | 126.5° | 89.1° |
| C14 | C18 | H181 | H182 | 129.2° | 131.3° |
| C18 | C14 | O15 | H151 | 82.6° | 178.5° |
| O15 | C14 | C16 | H161 | 4.9° | 25.5° |
| O15 | C14 | C16 | H162 | 121.7° | 156.3° |
| O15 | C14 | C18 | H181 | 117.7° | 156.3° |
| O15 | C14 | C18 | H182 | 9.2° | 25.3° |
| C02 | N20 | C21 | C22 | 110.6° | 85.0° |
| C02 | N20 | C21 | H211 | 129.5° | 155.0° |
| C02 | N20 | C21 | H212 | 9.4° | 35.0° |
| O01 | C02 | N20 | C21 | 1.8° | 0.6° |
| N20 | C21 | C22 | H211 | 119.9° | 120.0° |
| N20 | C21 | C22 | H212 | 119.9° | 120.1° |
| N20 | C21 | C22 | C23 | 103.4° | 125.0° |
| N20 | C21 | H211 | H212 | 120.3° | 120.1° |
| N20 | C21 | C22 | H221 | 76.6° | 54.9° |
| C21 | C22 | C23 | H221 | 180.0° | 179.9° |
| C22 | C21 | H211 | H212 | 120.2° | 119.9° |
| C21 | C22 | C23 | H232 | 180.0° | 179.9° |
| C21 | C22 | C23 | H231 | 0.0° | 0.1° |
| C23 | C22 | C21 | H211 | 136.7° | 115.0° |
| C23 | C22 | C21 | H212 | 16.5° | 4.9° |
| C22 | C23 | H232 | H231 | 180.0° | 179.9° |
| H172 | C17 | C16 | H161 | 136.9° | 105.5° |
| H172 | C17 | C16 | H162 | 10.2° | 25.4° |
| H172 | C17 | C18 | H181 | 10.1° | 25.4° |
| H172 | C17 | C18 | H182 | 136.9° | 105.5° |
| H171 | C17 | C16 | H161 | 9.9° | 25.4° |
| H171 | C17 | C16 | H162 | 116.7° | 156.3° |
| H171 | C17 | C18 | H181 | 116.9° | 156.2° |
| H171 | C17 | C18 | H182 | 9.9° | 25.3° |
| H211 | C21 | C22 | H221 | 43.3° | 65.1° |
| H212 | C21 | C22 | H221 | 163.5° | 175.0° |
| H221 | C22 | C23 | H232 | 0.0° | 0.0° |
| H221 | C22 | C23 | H231 | 180.0° | 180.0° |
| H281 | C28 | C29 | H291 | 0.0° | 0.4° |
| H321 | C32 | C33 | H331 | 67.4° | 61.7° |
| H321 | C32 | C33 | H332 | 52.3° | 58.4° |
| H322 | C32 | C33 | H331 | 174.6° | 58.4° |
| H322 | C32 | C33 | H332 | 65.8° | 178.4° |
| H352 | C35 | H351 | H353 | 120.0° | 120.0° |
| H361 | C36 | C37 | H371 | 53.4° | 178.5° |
| H361 | C36 | C37 | H372 | 171.4° | 58.4° |
| H362 | C36 | C37 | H371 | 65.4° | 58.5° |
| H362 | C36 | C37 | H372 | 52.6° | 61.6° |
