A1ALN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | O01 | doub | 1.22Å | 1.19Å | |
| C07 | C06 | sing | 1.53Å | 1.54Å | |
| C08 | C06 | sing | 1.53Å | 1.55Å | |
| C06 | C05 | sing | 1.53Å | 1.56Å | |
| C05 | C04 | sing | 1.53Å | 1.49Å | |
| C09 | C04 | sing | 1.51Å | 1.53Å | |
| C14 | C13 | sing | 1.51Å | 1.53Å | |
| C17 | C16 | sing | 1.54Å | 1.56Å | |
| C16 | N15 | sing | 1.47Å | 1.47Å | |
| N15 | C14 | sing | 1.34Å | 1.39Å | |
| O18 | C14 | doub | 1.21Å | 1.20Å | |
| C13 | C12 | sing | 1.53Å | 1.55Å | |
| C12 | C11 | sing | 1.53Å | 1.55Å | |
| C19 | C11 | sing | 1.51Å | 1.56Å | |
| N20 | C19 | doub | 1.28Å | 1.28Å | |
| C11 | N10 | sing | 1.47Å | 1.48Å | |
| N10 | C09 | sing | 1.35Å | 1.42Å | |
| O21 | C09 | doub | 1.21Å | 1.20Å | |
| C04 | N03 | sing | 1.46Å | 1.47Å | |
| N03 | C02 | sing | 1.35Å | 1.39Å | |
| C22 | C02 | sing | 1.48Å | 1.47Å | |
| C23 | C22 | doub | 1.40Å | 1.41Å | Aromatic |
| C27 | C26 | doub | 1.40Å | 1.44Å | Aromatic |
| C30 | C29 | sing | 1.41Å | 1.42Å | Aromatic |
| C31 | C30 | doub | 1.40Å | 1.41Å | Aromatic |
| C32 | C30 | sing | 1.46Å | 1.45Å | Aromatic |
| N34 | N33 | sing | 1.40Å | 1.36Å | Aromatic |
| C35 | N34 | sing | 1.46Å | 1.47Å | |
| N33 | C32 | doub | 1.30Å | 1.35Å | Aromatic |
| C29 | C28 | doub | 1.39Å | 1.40Å | Aromatic |
| C28 | C27 | sing | 1.36Å | 1.36Å | Aromatic |
| C26 | C25 | sing | 1.48Å | 1.45Å | |
| C36 | C25 | sing | 1.39Å | 1.40Å | Aromatic |
| C37 | C36 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C24 | doub | 1.40Å | 1.42Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.40Å | Aromatic |
| C13 | C17 | sing | 1.55Å | 1.53Å | |
| C22 | C37 | sing | 1.40Å | 1.37Å | Aromatic |
| C26 | C31 | sing | 1.39Å | 1.38Å | Aromatic |
| C29 | N34 | sing | 1.37Å | 1.37Å | Aromatic |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C07 | H073 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C08 | H083 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C35 | H353 | sing | 1.09Å | 1.10Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| C37 | H371 | sing | 1.08Å | 1.08Å | |
| N03 | H031 | sing | 0.97Å | 1.00Å | |
| N10 | H101 | sing | 0.97Å | 1.00Å | |
| N15 | H151 | sing | 0.97Å | 1.00Å | |
| N20 | H201 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C02 | N03 | 124.4° | 120.0° |
| O01 | C02 | C22 | 118.4° | 120.0° |
| C07 | C06 | C08 | 108.2° | 109.5° |
| C07 | C06 | C05 | 109.8° | 109.5° |
| C07 | C06 | H061 | 109.4° | 109.5° |
| C06 | C07 | H073 | 109.5° | 109.5° |
| C06 | C07 | H072 | 109.5° | 109.5° |
| C06 | C07 | H071 | 109.5° | 109.5° |
| C08 | C06 | C05 | 110.8° | 109.5° |
| C08 | C06 | H061 | 109.3° | 109.5° |
| C06 | C08 | H082 | 109.5° | 109.4° |
| C06 | C08 | H083 | 109.5° | 109.4° |
| C06 | C08 | H081 | 109.5° | 109.5° |
| C06 | C05 | C04 | 108.8° | 109.5° |
| C06 | C05 | H052 | 109.6° | 109.5° |
| C06 | C05 | H051 | 109.6° | 109.5° |
| C05 | C06 | H061 | 109.3° | 109.5° |
| C05 | C04 | C09 | 112.5° | 109.5° |
| C05 | C04 | N03 | 108.9° | 109.5° |
| C05 | C04 | H041 | 108.6° | 109.5° |
| C04 | C05 | H052 | 109.6° | 109.5° |
| C04 | C05 | H051 | 109.6° | 109.4° |
| C04 | C09 | N10 | 112.7° | 120.0° |
| C04 | C09 | O21 | 126.4° | 120.0° |
| C09 | C04 | N03 | 109.5° | 109.5° |
| C09 | C04 | H041 | 108.2° | 109.4° |
| C13 | C14 | N15 | 108.6° | 110.1° |
| C13 | C14 | O18 | 126.9° | 124.9° |
| C14 | C13 | C12 | 106.3° | 110.5° |
| C14 | C13 | C17 | 104.1° | 104.2° |
| C14 | C13 | H131 | 111.9° | 110.5° |
| C17 | C16 | N15 | 104.7° | 105.5° |
| C16 | C17 | C13 | 102.5° | 101.8° |
| C16 | C17 | H171 | 111.2° | 110.9° |
| C16 | C17 | H172 | 111.2° | 111.0° |
| C17 | C16 | H162 | 110.6° | 110.3° |
| C17 | C16 | H161 | 110.7° | 110.2° |
| C16 | N15 | C14 | 111.1° | 111.3° |
| N15 | C16 | H162 | 110.7° | 110.3° |
| N15 | C16 | H161 | 110.6° | 110.2° |
| C16 | N15 | H151 | 124.4° | 124.4° |
| N15 | C14 | O18 | 124.5° | 124.9° |
| C14 | N15 | H151 | 124.5° | 124.3° |
| C13 | C12 | C11 | 111.2° | 109.5° |
| C12 | C13 | C17 | 110.7° | 110.5° |
| C12 | C13 | H131 | 111.7° | 110.4° |
| C13 | C12 | H121 | 109.0° | 109.4° |
| C13 | C12 | H122 | 109.0° | 109.5° |
| C12 | C11 | C19 | 108.5° | 109.4° |
| C12 | C11 | N10 | 109.0° | 109.4° |
| C12 | C11 | H111 | 110.3° | 109.4° |
| C11 | C12 | H121 | 109.0° | 109.5° |
| C11 | C12 | H122 | 109.1° | 109.5° |
| C11 | C19 | N20 | 125.9° | 120.0° |
| C19 | C11 | N10 | 107.5° | 109.5° |
| C19 | C11 | H111 | 110.2° | 109.5° |
| C11 | C19 | H191 | 117.1° | 120.0° |
| N20 | C19 | H191 | 117.1° | 120.0° |
| C19 | N20 | H201 | 112.0° | 120.0° |
| C11 | N10 | C09 | 115.1° | 120.0° |
| N10 | C11 | H111 | 111.3° | 109.5° |
| C11 | N10 | H101 | 122.5° | 120.0° |
| N10 | C09 | O21 | 120.9° | 120.0° |
| C09 | N10 | H101 | 122.4° | 120.0° |
| C04 | N03 | C02 | 123.3° | 120.0° |
| N03 | C04 | H041 | 108.9° | 109.5° |
| C04 | N03 | H031 | 118.4° | 120.0° |
| N03 | C02 | C22 | 117.1° | 120.0° |
| C02 | N03 | H031 | 118.3° | 120.0° |
| C02 | C22 | C23 | 118.2° | 120.0° |
| C02 | C22 | C37 | 123.0° | 120.0° |
| C22 | C23 | C24 | 118.4° | 120.0° |
| C23 | C22 | C37 | 118.6° | 120.0° |
| C22 | C23 | H231 | 120.8° | 120.0° |
| C26 | C27 | C28 | 123.7° | 120.7° |
| C27 | C26 | C25 | 121.5° | 119.9° |
| C27 | C26 | C31 | 116.1° | 120.2° |
| C26 | C27 | H271 | 118.1° | 119.6° |
| C29 | C30 | C31 | 119.5° | 119.8° |
| C29 | C30 | C32 | 103.0° | 106.3° |
| C30 | C29 | C28 | 119.4° | 119.7° |
| C30 | C29 | N34 | 108.4° | 106.7° |
| C31 | C30 | C32 | 137.5° | 133.9° |
| C30 | C31 | C26 | 122.1° | 119.4° |
| C30 | C31 | H311 | 118.9° | 120.3° |
| C30 | C32 | N33 | 110.5° | 107.7° |
| C30 | C32 | H321 | 124.7° | 126.2° |
| N33 | N34 | C35 | 122.7° | 125.4° |
| N34 | N33 | C32 | 107.6° | 110.1° |
| N33 | N34 | C29 | 110.5° | 109.1° |
| C35 | N34 | C29 | 126.8° | 125.5° |
| N34 | C35 | H351 | 109.5° | 109.5° |
| N34 | C35 | H352 | 109.5° | 109.5° |
| N34 | C35 | H353 | 109.5° | 109.4° |
| N33 | C32 | H321 | 124.8° | 126.1° |
| C29 | C28 | C27 | 119.1° | 120.2° |
| C28 | C29 | N34 | 132.1° | 133.5° |
| C29 | C28 | H281 | 120.5° | 119.9° |
| C27 | C28 | H281 | 120.5° | 119.9° |
| C28 | C27 | H271 | 118.1° | 119.7° |
| C26 | C25 | C36 | 123.0° | 120.0° |
| C26 | C25 | C24 | 122.7° | 119.9° |
| C25 | C26 | C31 | 122.4° | 119.9° |
| C25 | C36 | C37 | 122.7° | 120.0° |
| C36 | C25 | C24 | 114.3° | 120.1° |
| C25 | C36 | H361 | 118.7° | 120.0° |
| C36 | C37 | C22 | 122.3° | 119.9° |
| C37 | C36 | H361 | 118.7° | 119.9° |
| C36 | C37 | H371 | 118.9° | 120.1° |
| C25 | C24 | C23 | 123.8° | 120.0° |
| C25 | C24 | H241 | 118.1° | 120.0° |
| C23 | C24 | H241 | 118.1° | 120.0° |
| C24 | C23 | H231 | 120.8° | 120.0° |
| C17 | C13 | H131 | 111.9° | 110.5° |
| C13 | C17 | H171 | 111.2° | 110.9° |
| C13 | C17 | H172 | 111.2° | 111.0° |
| C22 | C37 | H371 | 118.9° | 120.0° |
| C26 | C31 | H311 | 119.0° | 120.3° |
| H171 | C17 | H172 | 109.4° | 110.9° |
| H052 | C05 | H051 | 109.5° | 109.5° |
| H073 | C07 | H072 | 109.5° | 109.5° |
| H073 | C07 | H071 | 109.4° | 109.5° |
| H072 | C07 | H071 | 109.5° | 109.4° |
| H082 | C08 | H083 | 109.5° | 109.5° |
| H082 | C08 | H081 | 109.4° | 109.5° |
| H083 | C08 | H081 | 109.5° | 109.5° |
| H121 | C12 | H122 | 109.5° | 109.5° |
| H162 | C16 | H161 | 109.5° | 110.3° |
| H351 | C35 | H352 | 109.5° | 109.5° |
| H351 | C35 | H353 | 109.5° | 109.5° |
| H352 | C35 | H353 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C02 | N03 | C04 | 1.5° | 0.0° |
| O01 | C02 | N03 | C22 | 175.6° | 180.0° |
| O01 | C02 | C22 | C23 | 49.9° | 179.7° |
| O01 | C02 | C22 | C37 | 125.8° | 0.0° |
| O01 | C02 | N03 | H031 | 178.5° | 179.9° |
| C07 | C06 | C08 | C05 | 120.4° | 120.0° |
| C07 | C06 | C08 | H061 | 119.1° | 120.0° |
| C07 | C06 | C05 | H061 | 120.0° | 120.0° |
| C07 | C06 | C05 | C04 | 55.1° | 175.0° |
| C07 | C06 | C05 | H052 | 64.7° | 55.0° |
| C07 | C06 | C05 | H051 | 175.1° | 65.0° |
| C06 | C07 | H073 | H072 | 120.0° | 120.0° |
| C06 | C07 | H073 | H071 | 120.0° | 120.0° |
| C06 | C07 | H072 | H071 | 120.0° | 120.0° |
| C07 | C06 | C08 | H082 | 180.0° | 180.0° |
| C07 | C06 | C08 | H083 | 60.0° | 60.0° |
| C07 | C06 | C08 | H081 | 60.0° | 60.0° |
| C08 | C06 | C05 | H061 | 120.5° | 120.0° |
| C08 | C06 | C05 | C04 | 174.7° | 65.0° |
| C08 | C06 | C05 | H052 | 54.8° | 175.0° |
| C08 | C06 | C05 | H051 | 65.4° | 55.0° |
| C08 | C06 | C07 | H073 | 180.0° | 60.0° |
| C08 | C06 | C07 | H072 | 60.0° | 60.0° |
| C08 | C06 | C07 | H071 | 60.0° | 180.0° |
| C06 | C08 | H082 | H083 | 120.0° | 119.9° |
| C06 | C08 | H082 | H081 | 120.0° | 120.0° |
| C06 | C08 | H083 | H081 | 120.0° | 120.0° |
| C06 | C05 | C04 | H052 | 119.9° | 120.0° |
| C06 | C05 | C04 | H051 | 119.9° | 120.0° |
| C06 | C05 | C04 | C09 | 177.0° | 175.0° |
| C06 | C05 | C04 | N03 | 55.4° | 65.0° |
| C06 | C05 | C04 | H041 | 63.2° | 55.0° |
| C06 | C05 | H052 | H051 | 120.3° | 120.0° |
| C05 | C06 | C07 | H073 | 58.9° | 60.0° |
| C05 | C06 | C07 | H072 | 178.9° | 180.0° |
| C05 | C06 | C07 | H071 | 61.1° | 60.0° |
| C05 | C06 | C08 | H082 | 59.6° | 60.0° |
| C05 | C06 | C08 | H083 | 60.4° | 180.0° |
| C05 | C06 | C08 | H081 | 179.6° | 60.0° |
| C05 | C04 | C09 | N03 | 121.3° | 120.0° |
| C05 | C04 | C09 | H041 | 120.0° | 120.0° |
| C05 | C04 | C09 | N10 | 107.7° | 60.0° |
| C05 | C04 | C09 | O21 | 71.7° | 119.9° |
| C05 | C04 | N03 | H041 | 118.3° | 120.0° |
| C05 | C04 | N03 | C02 | 179.8° | 85.0° |
| C04 | C05 | H052 | H051 | 120.3° | 120.0° |
| C04 | C05 | C06 | H061 | 64.9° | 55.0° |
| C05 | C04 | N03 | H031 | 0.2° | 95.0° |
| C04 | C09 | N10 | C11 | 179.5° | 180.0° |
| C04 | C09 | N10 | O21 | 179.4° | 179.9° |
| C09 | C04 | N03 | H041 | 118.2° | 120.0° |
| C09 | C04 | N03 | C02 | 56.3° | 155.0° |
| C09 | C04 | C05 | H052 | 63.1° | 65.0° |
| C09 | C04 | C05 | H051 | 57.1° | 55.0° |
| C09 | C04 | N03 | H031 | 123.7° | 25.0° |
| C04 | C09 | N10 | H101 | 0.5° | 0.0° |
| C14 | C13 | C17 | C16 | 28.3° | 24.7° |
| C13 | C14 | N15 | C16 | 0.4° | 0.4° |
| C13 | C14 | N15 | O18 | 179.3° | 180.0° |
| C14 | C13 | C12 | C17 | 112.5° | 114.8° |
| C14 | C13 | C12 | H131 | 122.2° | 122.6° |
| C14 | C13 | C12 | C11 | 177.4° | 179.9° |
| C14 | C13 | C17 | H131 | 121.0° | 118.7° |
| C14 | C13 | C17 | H171 | 147.2° | 93.3° |
| C14 | C13 | C17 | H172 | 90.5° | 142.9° |
| C14 | C13 | C12 | H121 | 57.2° | 59.9° |
| C14 | C13 | C12 | H122 | 62.3° | 60.1° |
| C13 | C14 | N15 | H151 | 179.6° | 179.6° |
| C17 | C16 | N15 | H162 | 119.2° | 119.0° |
| C17 | C16 | N15 | H161 | 119.2° | 119.0° |
| C17 | C16 | N15 | C14 | 18.0° | 17.0° |
| C16 | C17 | C13 | C12 | 142.2° | 143.5° |
| C16 | C17 | C13 | H171 | 118.9° | 118.0° |
| C16 | C17 | C13 | H172 | 118.9° | 118.2° |
| C16 | C17 | C13 | H131 | 92.6° | 94.0° |
| C16 | C17 | H171 | H172 | 123.2° | 123.9° |
| C17 | C16 | H162 | H161 | 122.2° | 121.9° |
| C17 | C16 | N15 | H151 | 162.1° | 163.0° |
| C16 | N15 | C14 | H151 | 180.0° | 180.0° |
| C16 | N15 | C14 | O18 | 179.7° | 179.6° |
| N15 | C16 | C17 | C13 | 28.4° | 25.4° |
| N15 | C16 | C17 | H171 | 147.3° | 92.7° |
| N15 | C16 | C17 | H172 | 90.5° | 143.5° |
| N15 | C16 | H162 | H161 | 122.2° | 122.0° |
| N15 | C14 | C13 | C12 | 135.9° | 134.9° |
| N15 | C14 | C13 | C17 | 18.9° | 16.2° |
| N15 | C14 | C13 | H131 | 102.0° | 102.5° |
| C14 | N15 | C16 | H162 | 137.2° | 136.0° |
| C14 | N15 | C16 | H161 | 101.3° | 102.0° |
| O18 | C14 | C13 | C12 | 44.9° | 45.1° |
| O18 | C14 | C13 | C17 | 161.8° | 163.8° |
| O18 | C14 | C13 | H131 | 77.2° | 77.5° |
| O18 | C14 | N15 | H151 | 0.3° | 0.4° |
| C13 | C12 | C11 | H121 | 120.3° | 120.0° |
| C13 | C12 | C11 | H122 | 120.3° | 120.0° |
| C13 | C12 | C11 | C19 | 171.4° | 175.2° |
| C13 | C12 | C11 | N10 | 71.8° | 64.8° |
| C12 | C13 | C17 | H131 | 125.2° | 122.5° |
| C12 | C13 | C17 | H171 | 98.9° | 25.4° |
| C12 | C13 | C17 | H172 | 23.3° | 98.4° |
| C13 | C12 | C11 | H111 | 50.7° | 55.2° |
| C13 | C12 | H121 | H122 | 119.2° | 120.0° |
| C12 | C11 | C19 | N10 | 117.7° | 120.0° |
| C12 | C11 | C19 | H111 | 120.8° | 120.0° |
| C12 | C11 | C19 | N20 | 101.0° | 120.0° |
| C12 | C11 | N10 | H111 | 121.9° | 119.9° |
| C12 | C11 | N10 | C09 | 113.7° | 153.3° |
| C11 | C12 | C13 | C17 | 64.9° | 65.0° |
| C11 | C12 | C13 | H131 | 60.4° | 57.5° |
| C11 | C12 | H121 | H122 | 119.2° | 120.0° |
| C12 | C11 | C19 | H191 | 79.0° | 60.0° |
| C12 | C11 | N10 | H101 | 66.3° | 26.7° |
| C11 | C19 | N20 | H191 | 180.0° | 179.9° |
| C19 | C11 | N10 | H111 | 120.7° | 120.1° |
| C19 | C11 | N10 | C09 | 128.8° | 86.8° |
| C19 | C11 | C12 | H121 | 51.2° | 55.2° |
| C19 | C11 | C12 | H122 | 68.3° | 64.8° |
| C19 | C11 | N10 | H101 | 51.1° | 93.2° |
| C11 | C19 | N20 | H201 | 180.0° | 179.9° |
| N20 | C19 | C11 | N10 | 141.2° | 0.1° |
| N20 | C19 | C11 | H111 | 19.8° | 120.0° |
| C11 | N10 | C09 | H101 | 180.0° | 180.0° |
| C11 | N10 | C09 | O21 | 1.1° | 0.1° |
| N10 | C11 | C12 | H121 | 167.9° | 175.2° |
| N10 | C11 | C12 | H122 | 48.4° | 55.2° |
| N10 | C11 | C19 | H191 | 38.8° | 180.0° |
| N10 | C09 | C04 | N03 | 131.0° | 180.0° |
| N10 | C09 | C04 | H041 | 12.4° | 60.0° |
| C09 | N10 | C11 | H111 | 8.1° | 33.3° |
| O21 | C09 | C04 | N03 | 49.6° | 0.1° |
| O21 | C09 | C04 | H041 | 168.3° | 120.1° |
| O21 | C09 | N10 | H101 | 178.9° | 179.9° |
| C04 | N03 | C02 | H031 | 180.0° | 179.9° |
| C04 | N03 | C02 | C22 | 177.2° | 180.0° |
| N03 | C04 | C05 | H052 | 175.3° | 55.0° |
| N03 | C04 | C05 | H051 | 64.5° | 175.0° |
| N03 | C02 | C22 | C23 | 134.2° | 0.3° |
| N03 | C02 | C22 | C37 | 50.1° | 180.0° |
| C02 | N03 | C04 | H041 | 61.9° | 35.0° |
| C02 | C22 | C23 | C37 | 175.9° | 179.7° |
| C02 | C22 | C37 | C36 | 177.6° | 180.0° |
| C02 | C22 | C23 | C24 | 178.0° | 180.0° |
| C02 | C22 | C23 | H231 | 2.0° | 0.0° |
| C02 | C22 | C37 | H371 | 2.4° | 0.0° |
| C22 | C02 | N03 | H031 | 2.8° | 0.1° |
| C23 | C22 | C37 | C36 | 1.9° | 0.3° |
| C22 | C23 | C24 | C25 | 1.0° | 0.1° |
| C22 | C23 | C24 | H231 | 180.0° | 179.9° |
| C22 | C23 | C24 | H241 | 179.1° | 180.0° |
| C23 | C22 | C37 | H371 | 178.1° | 179.7° |
| C27 | C26 | C31 | C30 | 1.4° | 0.3° |
| C26 | C27 | C28 | C29 | 0.4° | 0.0° |
| C26 | C27 | C28 | H271 | 180.0° | 179.9° |
| C27 | C26 | C25 | C31 | 179.0° | 179.7° |
| C27 | C26 | C25 | C36 | 31.8° | 179.4° |
| C27 | C26 | C25 | C24 | 150.0° | 0.4° |
| C26 | C27 | C28 | H281 | 179.7° | 179.9° |
| C27 | C26 | C31 | H311 | 178.6° | 179.7° |
| C29 | C30 | C31 | C32 | 179.4° | 179.7° |
| C30 | C29 | N34 | N33 | 0.4° | 0.3° |
| C30 | C29 | N34 | C35 | 179.8° | 179.7° |
| C29 | C30 | C32 | N33 | 0.6° | 0.0° |
| C30 | C29 | C28 | N34 | 179.0° | 179.7° |
| C30 | C29 | C28 | C27 | 0.3° | 0.3° |
| C29 | C30 | C31 | C26 | 1.6° | 0.0° |
| C30 | C29 | C28 | H281 | 179.8° | 179.8° |
| C29 | C30 | C31 | H311 | 178.4° | 180.0° |
| C29 | C30 | C32 | H321 | 179.4° | 180.0° |
| C31 | C30 | C32 | N33 | 180.0° | 179.7° |
| C31 | C30 | C29 | C28 | 0.7° | 0.3° |
| C30 | C31 | C26 | C25 | 179.6° | 180.0° |
| C30 | C31 | C26 | H311 | 180.0° | 180.0° |
| C31 | C30 | C29 | N34 | 179.9° | 179.9° |
| C31 | C30 | C32 | H321 | 0.0° | 0.3° |
| C30 | C32 | N33 | N34 | 0.4° | 0.2° |
| C30 | C32 | N33 | H321 | 180.0° | 179.9° |
| C32 | C30 | C29 | C28 | 179.8° | 179.9° |
| C32 | C30 | C31 | C26 | 179.1° | 179.7° |
| C32 | C30 | C29 | N34 | 0.6° | 0.2° |
| C32 | C30 | C31 | H311 | 0.9° | 0.3° |
| N33 | N34 | C35 | C29 | 179.9° | 180.0° |
| N33 | N34 | C29 | C28 | 179.5° | 180.0° |
| N34 | N33 | C32 | H321 | 179.6° | 179.8° |
| N33 | N34 | C35 | H351 | 0.0° | 90.0° |
| N33 | N34 | C35 | H352 | 120.0° | 30.0° |
| N33 | N34 | C35 | H353 | 120.0° | 150.0° |
| C35 | N34 | N33 | C32 | 179.9° | 179.7° |
| C35 | N34 | C29 | C28 | 0.6° | 0.0° |
| N34 | C35 | H351 | H352 | 120.0° | 120.0° |
| N34 | C35 | H351 | H353 | 120.0° | 120.0° |
| N34 | C35 | H352 | H353 | 120.0° | 120.0° |
| C32 | N33 | N34 | C29 | 0.0° | 0.3° |
| C29 | C28 | C27 | H281 | 180.0° | 179.9° |
| C29 | C28 | C27 | H271 | 179.6° | 179.9° |
| C28 | C27 | C26 | C25 | 179.5° | 180.0° |
| C28 | C27 | C26 | C31 | 0.5° | 0.3° |
| C27 | C28 | C29 | N34 | 178.8° | 180.0° |
| C26 | C25 | C36 | C24 | 178.3° | 179.8° |
| C26 | C25 | C36 | C37 | 179.1° | 180.0° |
| C26 | C25 | C24 | C23 | 178.8° | 180.0° |
| C26 | C25 | C24 | H241 | 1.2° | 0.0° |
| C25 | C26 | C27 | H271 | 0.5° | 0.1° |
| C25 | C26 | C31 | H311 | 0.4° | 0.0° |
| C26 | C25 | C36 | H361 | 0.9° | 0.0° |
| C25 | C36 | C37 | H361 | 180.0° | 180.0° |
| C36 | C25 | C24 | C23 | 0.5° | 0.2° |
| C25 | C36 | C37 | C22 | 0.4° | 0.0° |
| C36 | C25 | C26 | C31 | 147.2° | 0.3° |
| C36 | C25 | C24 | H241 | 179.5° | 179.7° |
| C25 | C36 | C37 | H371 | 179.6° | 180.0° |
| C37 | C36 | C25 | C24 | 0.8° | 0.2° |
| C36 | C37 | C22 | H371 | 180.0° | 180.0° |
| C25 | C24 | C23 | H241 | 180.0° | 179.9° |
| C24 | C25 | C26 | C31 | 31.0° | 180.0° |
| C25 | C24 | C23 | H231 | 179.1° | 180.0° |
| C24 | C25 | C36 | H361 | 179.2° | 179.8° |
| C24 | C23 | C22 | C37 | 2.1° | 0.3° |
| C13 | C17 | H171 | H172 | 123.2° | 123.8° |
| C17 | C13 | C12 | H121 | 55.3° | 55.0° |
| C17 | C13 | C12 | H122 | 174.8° | 174.9° |
| C13 | C17 | C16 | H162 | 147.7° | 144.4° |
| C13 | C17 | C16 | H161 | 90.8° | 93.6° |
| C37 | C22 | C23 | H231 | 177.9° | 179.8° |
| C22 | C37 | C36 | H361 | 179.6° | 180.0° |
| C31 | C26 | C27 | H271 | 179.5° | 179.8° |
| N34 | C29 | C28 | H281 | 1.2° | 0.1° |
| C29 | N34 | C35 | H351 | 179.9° | 90.0° |
| C29 | N34 | C35 | H352 | 60.1° | 150.0° |
| C29 | N34 | C35 | H353 | 59.9° | 30.0° |
| H131 | C13 | C17 | H171 | 26.3° | 147.9° |
| H131 | C13 | C17 | H172 | 148.5° | 24.2° |
| H131 | C13 | C12 | H121 | 179.4° | 177.5° |
| H131 | C13 | C12 | H122 | 59.9° | 62.5° |
| H171 | C17 | C16 | H162 | 93.4° | 26.4° |
| H171 | C17 | C16 | H161 | 28.1° | 148.4° |
| H172 | C17 | C16 | H162 | 28.8° | 97.5° |
| H172 | C17 | C16 | H161 | 150.3° | 24.5° |
| H241 | C24 | C23 | H231 | 0.9° | 0.1° |
| H281 | C28 | C27 | H271 | 0.3° | 0.0° |
| H041 | C04 | C05 | H052 | 56.7° | 175.0° |
| H041 | C04 | C05 | H051 | 176.9° | 65.0° |
| H041 | C04 | N03 | H031 | 118.1° | 144.9° |
| H052 | C05 | C06 | H061 | 175.2° | 65.0° |
| H051 | C05 | C06 | H061 | 55.0° | 175.0° |
| H061 | C06 | C07 | H073 | 61.0° | 180.0° |
| H061 | C06 | C07 | H072 | 59.0° | 60.0° |
| H061 | C06 | C07 | H071 | 179.0° | 60.0° |
| H061 | C06 | C08 | H082 | 60.9° | 60.0° |
| H061 | C06 | C08 | H083 | 179.1° | 60.0° |
| H061 | C06 | C08 | H081 | 59.1° | 180.0° |
| H073 | C07 | H072 | H071 | 120.0° | 120.0° |
| H082 | C08 | H083 | H081 | 120.0° | 120.1° |
| H111 | C11 | C12 | H121 | 69.6° | 64.8° |
| H111 | C11 | C12 | H122 | 170.9° | 175.2° |
| H111 | C11 | C19 | H191 | 160.2° | 59.9° |
| H111 | C11 | N10 | H101 | 171.8° | 146.7° |
| H162 | C16 | N15 | H151 | 42.8° | 44.0° |
| H161 | C16 | N15 | H151 | 78.7° | 78.0° |
| H191 | C19 | N20 | H201 | 0.0° | 0.0° |
| H351 | C35 | H352 | H353 | 120.0° | 120.0° |
| H361 | C36 | C37 | H371 | 0.4° | 0.0° |
