GKA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C05 | doub | 1.34Å | 1.34Å | |
| C18 | C17 | sing | 1.55Å | 1.55Å | |
| C05 | C06 | sing | 1.52Å | 1.52Å | |
| C04 | C17 | sing | 1.54Å | 1.54Å | |
| C04 | C16 | sing | 1.55Å | 1.55Å | |
| O57 | C21 | doub | 1.20Å | 1.20Å | |
| O50 | S55 | doub | 1.46Å | 1.46Å | |
| C16 | C03 | sing | 1.55Å | 1.55Å | |
| O51 | S55 | doub | 1.46Å | 1.46Å | |
| C06 | C07 | sing | 1.54Å | 1.54Å | |
| C06 | C19 | sing | 1.50Å | 1.50Å | |
| C21 | C19 | sing | 1.52Å | 1.52Å | |
| C21 | N42 | sing | 1.42Å | 1.42Å | |
| S55 | N42 | sing | 1.66Å | 1.66Å | |
| S55 | C22 | sing | 1.80Å | 1.80Å | |
| C07 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | N41 | sing | 1.44Å | 1.44Å | |
| C03 | C15 | sing | 1.56Å | 1.56Å | |
| C24 | C22 | sing | 1.53Å | 1.53Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C22 | C34 | sing | 1.56Å | 1.56Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C15 | C02 | sing | 1.52Å | 1.52Å | |
| O49 | C20 | doub | 1.21Å | 1.21Å | |
| N41 | C20 | sing | 1.46Å | 1.46Å | |
| O48 | C14 | doub | 1.18Å | 1.18Å | |
| O54 | C36 | doub | 1.19Å | 1.19Å | |
| C20 | C13 | sing | 1.55Å | 1.55Å | |
| C02 | C14 | sing | 1.54Å | 1.54Å | |
| C02 | N43 | sing | 1.44Å | 1.44Å | |
| C14 | N40 | sing | 1.47Å | 1.47Å | |
| N43 | C25 | sing | 1.46Å | 1.46Å | |
| C36 | C56 | sing | 1.54Å | 1.54Å | |
| C36 | N44 | sing | 1.46Å | 1.46Å | |
| N40 | C13 | sing | 1.32Å | 1.32Å | |
| N40 | C01 | sing | 1.54Å | 1.54Å | |
| C13 | C12 | sing | 1.63Å | 1.63Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C25 | O52 | doub | 1.18Å | 1.18Å | |
| C26 | N44 | sing | 1.45Å | 1.45Å | |
| C26 | C35 | sing | 1.53Å | 1.53Å | |
| C01 | C11 | sing | 1.56Å | 1.56Å | |
| C12 | C11 | sing | 1.28Å | 1.28Å | |
| C37 | C35 | sing | 1.55Å | 1.55Å | |
| C35 | C39 | sing | 1.55Å | 1.55Å | |
| C35 | C38 | sing | 1.55Å | 1.55Å | |
| C11 | O47 | sing | 1.51Å | 1.51Å | |
| O47 | C10 | sing | 1.38Å | 1.38Å | |
| C10 | N45 | doub | 1.43Å | 1.43Å | Aromatic |
| C10 | C09 | sing | 1.52Å | 1.52Å | Aromatic |
| C08 | C09 | sing | 1.52Å | 1.52Å | |
| N45 | C27 | sing | 1.45Å | 1.45Å | Aromatic |
| C09 | N46 | doub | 1.44Å | 1.44Å | Aromatic |
| C27 | C28 | doub | 1.52Å | 1.52Å | Aromatic |
| C27 | C33 | sing | 1.51Å | 1.51Å | Aromatic |
| N46 | C33 | sing | 1.45Å | 1.45Å | Aromatic |
| C28 | C29 | sing | 1.52Å | 1.52Å | Aromatic |
| C33 | C32 | doub | 1.53Å | 1.53Å | Aromatic |
| C30 | O53 | sing | 1.42Å | 1.42Å | |
| C29 | O53 | sing | 1.39Å | 1.39Å | |
| C29 | C31 | doub | 1.53Å | 1.53Å | Aromatic |
| C32 | C31 | sing | 1.51Å | 1.51Å | Aromatic |
| C13 | H131 | sing | 1.10Å | 1.10Å | |
| C15 | H151 | sing | 1.10Å | 1.10Å | |
| C15 | H152 | sing | 1.10Å | 1.10Å | |
| C17 | H172 | sing | 1.10Å | 1.10Å | |
| C17 | H171 | sing | 1.10Å | 1.10Å | |
| C24 | H241 | sing | 1.10Å | 1.10Å | |
| C24 | H242 | sing | 1.10Å | 1.10Å | |
| C26 | H261 | sing | 1.10Å | 1.10Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C01 | H011 | sing | 1.10Å | 1.10Å | |
| C01 | H012 | sing | 1.10Å | 1.10Å | |
| C02 | H021 | sing | 1.10Å | 1.10Å | |
| C03 | H031 | sing | 1.10Å | 1.10Å | |
| C03 | H032 | sing | 1.10Å | 1.10Å | |
| C04 | H041 | sing | 1.10Å | 1.10Å | |
| C04 | H042 | sing | 1.10Å | 1.10Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.10Å | 1.10Å | |
| C07 | H071 | sing | 1.10Å | 1.10Å | |
| C07 | H072 | sing | 1.10Å | 1.10Å | |
| C08 | H082 | sing | 1.10Å | 1.10Å | |
| C08 | H083 | sing | 1.10Å | 1.10Å | |
| C08 | H081 | sing | 1.10Å | 1.10Å | |
| C11 | H111 | sing | 1.10Å | 1.10Å | |
| C12 | H122 | sing | 1.10Å | 1.10Å | |
| C12 | H121 | sing | 1.10Å | 1.10Å | |
| C16 | H161 | sing | 1.10Å | 1.10Å | |
| C16 | H162 | sing | 1.10Å | 1.10Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C23 | H232 | sing | 1.10Å | 1.10Å | |
| C23 | H231 | sing | 1.10Å | 1.10Å | |
| C30 | H303 | sing | 1.10Å | 1.10Å | |
| C30 | H301 | sing | 1.10Å | 1.10Å | |
| C30 | H302 | sing | 1.10Å | 1.10Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.10Å | 1.10Å | |
| C34 | H342 | sing | 1.10Å | 1.10Å | |
| C34 | H343 | sing | 1.10Å | 1.10Å | |
| C37 | H372 | sing | 1.10Å | 1.10Å | |
| C37 | H371 | sing | 1.10Å | 1.10Å | |
| C37 | H373 | sing | 1.10Å | 1.10Å | |
| C38 | H383 | sing | 1.10Å | 1.10Å | |
| C38 | H381 | sing | 1.10Å | 1.10Å | |
| C38 | H382 | sing | 1.10Å | 1.10Å | |
| C39 | H391 | sing | 1.10Å | 1.10Å | |
| C39 | H392 | sing | 1.10Å | 1.10Å | |
| C39 | H393 | sing | 1.10Å | 1.10Å | |
| C56 | H562 | sing | 1.10Å | 1.10Å | |
| C56 | H561 | sing | 1.10Å | 1.10Å | |
| C56 | H563 | sing | 1.10Å | 1.10Å | |
| N41 | H411 | sing | 1.00Å | 1.00Å | |
| N42 | H421 | sing | 1.00Å | 1.00Å | |
| N43 | H431 | sing | 1.00Å | 1.00Å | |
| N44 | H441 | sing | 1.00Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C05 | C18 | C17 | 125.3° | 125.3° |
| C18 | C05 | C06 | 119.7° | 119.7° |
| C18 | C05 | H051 | 120.2° | 120.2° |
| C05 | C18 | H181 | 117.4° | 117.3° |
| C18 | C17 | C04 | 111.3° | 111.3° |
| C18 | C17 | H172 | 109.0° | 109.0° |
| C18 | C17 | H171 | 109.0° | 109.0° |
| C17 | C18 | H181 | 117.3° | 117.4° |
| C05 | C06 | C07 | 116.4° | 116.4° |
| C05 | C06 | C19 | 136.8° | 136.8° |
| C06 | C05 | H051 | 120.2° | 120.2° |
| C05 | C06 | H061 | 110.3° | 110.3° |
| C17 | C04 | C16 | 110.4° | 110.4° |
| C04 | C17 | H172 | 109.0° | 109.0° |
| C04 | C17 | H171 | 109.0° | 109.0° |
| C17 | C04 | H041 | 109.3° | 109.2° |
| C17 | C04 | H042 | 109.2° | 109.3° |
| C04 | C16 | C03 | 110.5° | 110.5° |
| C16 | C04 | H041 | 109.2° | 109.3° |
| C16 | C04 | H042 | 109.2° | 109.2° |
| C04 | C16 | H161 | 109.3° | 109.3° |
| C04 | C16 | H162 | 109.2° | 109.2° |
| O57 | C21 | C19 | 123.7° | 123.7° |
| O57 | C21 | N42 | 121.7° | 121.7° |
| O50 | S55 | O51 | 107.8° | 107.8° |
| O50 | S55 | N42 | 108.3° | 108.3° |
| O50 | S55 | C22 | 107.8° | 107.8° |
| C16 | C03 | C15 | 109.6° | 109.6° |
| C16 | C03 | H031 | 109.5° | 109.5° |
| C16 | C03 | H032 | 109.4° | 109.4° |
| C03 | C16 | H161 | 109.2° | 109.2° |
| C03 | C16 | H162 | 109.2° | 109.2° |
| O51 | S55 | N42 | 115.3° | 115.3° |
| O51 | S55 | C22 | 112.3° | 112.3° |
| C07 | C06 | C19 | 60.5° | 60.5° |
| C06 | C07 | C19 | 58.5° | 58.5° |
| C07 | C06 | H061 | 110.0° | 110.0° |
| C06 | C07 | H071 | 120.2° | 120.2° |
| C06 | C07 | H072 | 120.2° | 120.2° |
| C06 | C19 | C21 | 108.2° | 108.2° |
| C06 | C19 | C07 | 61.0° | 61.0° |
| C06 | C19 | N41 | 121.1° | 121.1° |
| C19 | C06 | H061 | 110.5° | 110.5° |
| C19 | C21 | N42 | 114.5° | 114.5° |
| C21 | C19 | C07 | 110.1° | 110.1° |
| C21 | C19 | N41 | 123.7° | 123.7° |
| C21 | N42 | S55 | 115.3° | 115.3° |
| C21 | N42 | H421 | 122.3° | 122.3° |
| N42 | S55 | C22 | 105.1° | 105.1° |
| S55 | N42 | H421 | 122.3° | 122.3° |
| S55 | C22 | C24 | 112.0° | 112.0° |
| S55 | C22 | C34 | 117.1° | 117.1° |
| S55 | C22 | C23 | 116.0° | 116.0° |
| C07 | C19 | N41 | 116.2° | 116.2° |
| C19 | C07 | H071 | 120.2° | 120.2° |
| C19 | C07 | H072 | 120.3° | 120.3° |
| C19 | N41 | C20 | 117.8° | 117.8° |
| C19 | N41 | H411 | 121.1° | 121.1° |
| C03 | C15 | C02 | 112.2° | 112.2° |
| C03 | C15 | H151 | 108.8° | 108.8° |
| C03 | C15 | H152 | 108.8° | 108.8° |
| C15 | C03 | H031 | 109.4° | 109.4° |
| C15 | C03 | H032 | 109.4° | 109.4° |
| C22 | C24 | C23 | 59.9° | 59.9° |
| C24 | C22 | C34 | 119.0° | 119.0° |
| C24 | C22 | C23 | 60.4° | 60.4° |
| C22 | C24 | H241 | 120.0° | 120.0° |
| C22 | C24 | H242 | 120.0° | 120.0° |
| C24 | C23 | C22 | 59.8° | 59.8° |
| C23 | C24 | H241 | 120.0° | 120.0° |
| C23 | C24 | H242 | 120.0° | 120.0° |
| C24 | C23 | H232 | 120.0° | 120.0° |
| C24 | C23 | H231 | 120.0° | 120.0° |
| C34 | C22 | C23 | 119.8° | 119.8° |
| C22 | C34 | H341 | 109.5° | 109.5° |
| C22 | C34 | H342 | 109.4° | 109.4° |
| C22 | C34 | H343 | 109.5° | 109.5° |
| C22 | C23 | H232 | 120.0° | 120.0° |
| C22 | C23 | H231 | 120.0° | 120.0° |
| C15 | C02 | C14 | 106.7° | 106.7° |
| C15 | C02 | N43 | 107.1° | 107.1° |
| C02 | C15 | H151 | 108.8° | 108.8° |
| C02 | C15 | H152 | 108.8° | 108.8° |
| C15 | C02 | H021 | 110.0° | 110.0° |
| O49 | C20 | N41 | 123.2° | 123.2° |
| O49 | C20 | C13 | 122.4° | 122.4° |
| N41 | C20 | C13 | 114.4° | 114.4° |
| C20 | N41 | H411 | 121.1° | 121.1° |
| O48 | C14 | C02 | 120.7° | 120.7° |
| O48 | C14 | N40 | 119.6° | 119.6° |
| O54 | C36 | C56 | 120.2° | 120.2° |
| O54 | C36 | N44 | 119.8° | 119.8° |
| C20 | C13 | N40 | 102.7° | 102.7° |
| C20 | C13 | C12 | 117.9° | 117.9° |
| C20 | C13 | H131 | 109.4° | 109.4° |
| C14 | C02 | N43 | 112.2° | 112.2° |
| C02 | C14 | N40 | 119.6° | 119.6° |
| C14 | C02 | H021 | 109.7° | 109.7° |
| C02 | N43 | C25 | 120.1° | 120.1° |
| N43 | C02 | H021 | 111.2° | 111.2° |
| C02 | N43 | H431 | 120.0° | 120.0° |
| C14 | N40 | C13 | 126.5° | 126.5° |
| C14 | N40 | C01 | 125.2° | 125.2° |
| N43 | C25 | C26 | 116.1° | 116.1° |
| N43 | C25 | O52 | 120.4° | 120.4° |
| C25 | N43 | H431 | 120.0° | 120.0° |
| C56 | C36 | N44 | 120.0° | 120.0° |
| C36 | C56 | H562 | 109.5° | 109.5° |
| C36 | C56 | H561 | 109.5° | 109.4° |
| C36 | C56 | H563 | 109.5° | 109.5° |
| C36 | N44 | C26 | 118.6° | 118.6° |
| C36 | N44 | H441 | 120.7° | 120.7° |
| C13 | N40 | C01 | 108.3° | 108.3° |
| N40 | C13 | C12 | 105.7° | 105.7° |
| N40 | C13 | H131 | 112.8° | 112.8° |
| N40 | C01 | C11 | 98.8° | 98.8° |
| N40 | C01 | H011 | 112.0° | 112.0° |
| N40 | C01 | H012 | 112.1° | 112.1° |
| C13 | C12 | C11 | 101.1° | 101.1° |
| C12 | C13 | H131 | 108.3° | 108.3° |
| C13 | C12 | H122 | 111.5° | 111.5° |
| C13 | C12 | H121 | 111.5° | 111.5° |
| C26 | C25 | O52 | 123.4° | 123.4° |
| C25 | C26 | N44 | 106.3° | 106.3° |
| C25 | C26 | C35 | 112.4° | 112.4° |
| C25 | C26 | H261 | 108.4° | 108.4° |
| N44 | C26 | C35 | 111.8° | 111.8° |
| N44 | C26 | H261 | 109.5° | 109.5° |
| C26 | N44 | H441 | 120.7° | 120.7° |
| C26 | C35 | C37 | 110.3° | 110.3° |
| C26 | C35 | C39 | 108.7° | 108.7° |
| C26 | C35 | C38 | 110.0° | 110.0° |
| C35 | C26 | H261 | 108.4° | 108.4° |
| C01 | C11 | C12 | 104.9° | 104.9° |
| C01 | C11 | O47 | 100.3° | 100.3° |
| C11 | C01 | H011 | 112.1° | 112.1° |
| C11 | C01 | H012 | 112.1° | 112.1° |
| C01 | C11 | H111 | 110.5° | 110.5° |
| C12 | C11 | O47 | 113.0° | 113.0° |
| C12 | C11 | H111 | 115.4° | 115.4° |
| C11 | C12 | H122 | 111.5° | 111.5° |
| C11 | C12 | H121 | 111.5° | 111.5° |
| C37 | C35 | C39 | 108.2° | 108.2° |
| C37 | C35 | C38 | 108.8° | 108.8° |
| C35 | C37 | H372 | 109.5° | 109.5° |
| C35 | C37 | H371 | 109.5° | 109.5° |
| C35 | C37 | H373 | 109.4° | 109.4° |
| C39 | C35 | C38 | 110.9° | 110.9° |
| C35 | C39 | H391 | 109.5° | 109.5° |
| C35 | C39 | H392 | 109.5° | 109.5° |
| C35 | C39 | H393 | 109.5° | 109.5° |
| C35 | C38 | H383 | 109.5° | 109.5° |
| C35 | C38 | H381 | 109.5° | 109.5° |
| C35 | C38 | H382 | 109.5° | 109.5° |
| C11 | O47 | C10 | 111.3° | 111.3° |
| O47 | C11 | H111 | 111.4° | 111.4° |
| O47 | C10 | N45 | 118.9° | 118.9° |
| O47 | C10 | C09 | 117.3° | 117.3° |
| N45 | C10 | C09 | 123.8° | 123.8° |
| C10 | N45 | C27 | 116.0° | 116.0° |
| C10 | C09 | C08 | 120.0° | 120.0° |
| C10 | C09 | N46 | 119.2° | 119.2° |
| C08 | C09 | N46 | 120.8° | 120.8° |
| C09 | C08 | H082 | 109.5° | 109.5° |
| C09 | C08 | H083 | 109.5° | 109.5° |
| C09 | C08 | H081 | 109.5° | 109.5° |
| N45 | C27 | C28 | 116.4° | 116.4° |
| N45 | C27 | C33 | 121.5° | 121.5° |
| C09 | N46 | C33 | 118.1° | 118.1° |
| C28 | C27 | C33 | 122.1° | 122.1° |
| C27 | C28 | C29 | 117.2° | 117.2° |
| C27 | C28 | H281 | 121.4° | 121.4° |
| C27 | C33 | N46 | 121.4° | 121.4° |
| C27 | C33 | C32 | 120.6° | 120.6° |
| N46 | C33 | C32 | 118.0° | 118.0° |
| C28 | C29 | O53 | 120.3° | 120.3° |
| C28 | C29 | C31 | 120.9° | 120.9° |
| C29 | C28 | H281 | 121.4° | 121.4° |
| C33 | C32 | C31 | 117.7° | 117.7° |
| C33 | C32 | H321 | 121.1° | 121.1° |
| C30 | O53 | C29 | 117.9° | 117.9° |
| O53 | C30 | H303 | 109.5° | 109.5° |
| O53 | C30 | H301 | 109.4° | 109.4° |
| O53 | C30 | H302 | 109.4° | 109.4° |
| O53 | C29 | C31 | 118.8° | 118.8° |
| C29 | C31 | C32 | 121.4° | 121.4° |
| C29 | C31 | H311 | 119.3° | 119.3° |
| C32 | C31 | H311 | 119.3° | 119.3° |
| C31 | C32 | H321 | 121.1° | 121.1° |
| H151 | C15 | H152 | 109.5° | 109.5° |
| H172 | C17 | H171 | 109.5° | 109.5° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H031 | C03 | H032 | 109.4° | 109.4° |
| H041 | C04 | H042 | 109.5° | 109.5° |
| H071 | C07 | H072 | 109.5° | 109.5° |
| H082 | C08 | H083 | 109.4° | 109.5° |
| H082 | C08 | H081 | 109.5° | 109.4° |
| H083 | C08 | H081 | 109.5° | 109.5° |
| H122 | C12 | H121 | 109.5° | 109.5° |
| H161 | C16 | H162 | 109.5° | 109.5° |
| H232 | C23 | H231 | 109.5° | 109.5° |
| H303 | C30 | H301 | 109.5° | 109.5° |
| H303 | C30 | H302 | 109.5° | 109.5° |
| H301 | C30 | H302 | 109.5° | 109.5° |
| H341 | C34 | H342 | 109.5° | 109.4° |
| H341 | C34 | H343 | 109.5° | 109.5° |
| H342 | C34 | H343 | 109.5° | 109.5° |
| H372 | C37 | H371 | 109.5° | 109.4° |
| H372 | C37 | H373 | 109.5° | 109.5° |
| H371 | C37 | H373 | 109.5° | 109.5° |
| H383 | C38 | H381 | 109.4° | 109.4° |
| H383 | C38 | H382 | 109.5° | 109.5° |
| H381 | C38 | H382 | 109.5° | 109.5° |
| H391 | C39 | H392 | 109.4° | 109.4° |
| H391 | C39 | H393 | 109.5° | 109.5° |
| H392 | C39 | H393 | 109.5° | 109.5° |
| H562 | C56 | H561 | 109.5° | 109.5° |
| H562 | C56 | H563 | 109.4° | 109.4° |
| H561 | C56 | H563 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C05 | C18 | C17 | H181 | 180.0° | 180.0° |
| C18 | C05 | C06 | H051 | 180.0° | 180.0° |
| C05 | C18 | C17 | C04 | 118.5° | 118.5° |
| C18 | C05 | C06 | C07 | 158.3° | 158.3° |
| C18 | C05 | C06 | C19 | 127.7° | 127.7° |
| C05 | C18 | C17 | H172 | 1.8° | 1.8° |
| C05 | C18 | C17 | H171 | 121.2° | 121.2° |
| C18 | C05 | C06 | H061 | 32.1° | 32.1° |
| C17 | C18 | C05 | C06 | 3.1° | 3.1° |
| C18 | C17 | C04 | H172 | 120.3° | 120.3° |
| C18 | C17 | C04 | H171 | 120.3° | 120.3° |
| C18 | C17 | C04 | C16 | 177.4° | 177.4° |
| C18 | C17 | H172 | H171 | 119.1° | 119.2° |
| C18 | C17 | C04 | H041 | 57.3° | 57.3° |
| C18 | C17 | C04 | H042 | 62.5° | 62.5° |
| C17 | C18 | C05 | H051 | 176.9° | 176.9° |
| C05 | C06 | C07 | C19 | 130.8° | 130.8° |
| C05 | C06 | C07 | H061 | 126.3° | 126.3° |
| C05 | C06 | C19 | H061 | 159.8° | 159.8° |
| C05 | C06 | C19 | C21 | 5.2° | 5.2° |
| C05 | C06 | C19 | N41 | 156.9° | 156.9° |
| C05 | C06 | C07 | H071 | 21.8° | 21.8° |
| C05 | C06 | C07 | H072 | 120.1° | 120.1° |
| C06 | C05 | C18 | H181 | 176.9° | 176.9° |
| C17 | C04 | C16 | H041 | 120.2° | 120.1° |
| C17 | C04 | C16 | H042 | 120.1° | 120.2° |
| C17 | C04 | C16 | C03 | 65.5° | 65.5° |
| C04 | C17 | H172 | H171 | 119.2° | 119.2° |
| C17 | C04 | H041 | H042 | 119.6° | 119.6° |
| C17 | C04 | C16 | H161 | 54.6° | 54.6° |
| C17 | C04 | C16 | H162 | 174.4° | 174.4° |
| C04 | C17 | C18 | H181 | 61.5° | 61.5° |
| C04 | C16 | C03 | H161 | 120.2° | 120.2° |
| C04 | C16 | C03 | H162 | 120.1° | 120.1° |
| C04 | C16 | C03 | C15 | 110.4° | 110.4° |
| C16 | C04 | C17 | H172 | 62.3° | 62.3° |
| C16 | C04 | C17 | H171 | 57.2° | 57.1° |
| C04 | C16 | C03 | H031 | 129.6° | 129.6° |
| C04 | C16 | C03 | H032 | 9.6° | 9.6° |
| C16 | C04 | H041 | H042 | 119.6° | 119.6° |
| C04 | C16 | H161 | H162 | 119.6° | 119.6° |
| O57 | C21 | C19 | C06 | 40.4° | 40.4° |
| O57 | C21 | C19 | N42 | 179.4° | 179.4° |
| O57 | C21 | N42 | S55 | 1.8° | 1.8° |
| O57 | C21 | C19 | C07 | 24.6° | 24.6° |
| O57 | C21 | C19 | N41 | 168.8° | 168.8° |
| O57 | C21 | N42 | H421 | 178.2° | 178.2° |
| O50 | S55 | O51 | N42 | 121.1° | 121.1° |
| O50 | S55 | O51 | C22 | 118.6° | 118.6° |
| O50 | S55 | N42 | C21 | 62.5° | 62.5° |
| O50 | S55 | N42 | C22 | 115.0° | 115.0° |
| O50 | S55 | C22 | C24 | 84.3° | 84.3° |
| O50 | S55 | C22 | C34 | 58.4° | 58.4° |
| O50 | S55 | C22 | C23 | 150.9° | 150.9° |
| O50 | S55 | N42 | H421 | 117.5° | 117.5° |
| C16 | C03 | C15 | H031 | 120.0° | 120.0° |
| C16 | C03 | C15 | H032 | 120.0° | 120.0° |
| C16 | C03 | C15 | C02 | 175.0° | 175.0° |
| C16 | C03 | C15 | H151 | 54.6° | 54.6° |
| C16 | C03 | C15 | H152 | 64.6° | 64.6° |
| C16 | C03 | H031 | H032 | 120.0° | 120.0° |
| C03 | C16 | C04 | H041 | 174.3° | 174.4° |
| C03 | C16 | C04 | H042 | 54.6° | 54.6° |
| C03 | C16 | H161 | H162 | 119.5° | 119.5° |
| O51 | S55 | N42 | C21 | 58.3° | 58.3° |
| O51 | S55 | N42 | C22 | 124.2° | 124.2° |
| O51 | S55 | C22 | C24 | 34.4° | 34.4° |
| O51 | S55 | C22 | C34 | 177.1° | 177.1° |
| O51 | S55 | C22 | C23 | 32.3° | 32.3° |
| O51 | S55 | N42 | H421 | 121.7° | 121.7° |
| C07 | C06 | C19 | H061 | 102.0° | 102.0° |
| C06 | C07 | C19 | C21 | 100.2° | 100.2° |
| C06 | C07 | C19 | H071 | 109.0° | 109.0° |
| C06 | C07 | C19 | H072 | 109.1° | 109.1° |
| C07 | C06 | C19 | N41 | 104.8° | 104.8° |
| C07 | C06 | C05 | H051 | 21.7° | 21.7° |
| C06 | C07 | H071 | H072 | 145.5° | 145.5° |
| C06 | C19 | C21 | N41 | 150.8° | 150.8° |
| C06 | C19 | C21 | N42 | 140.2° | 140.2° |
| C06 | C19 | N41 | C20 | 66.8° | 66.8° |
| C19 | C06 | C05 | H051 | 52.3° | 52.3° |
| C06 | C19 | N41 | H411 | 113.2° | 113.2° |
| C19 | C21 | N42 | S55 | 178.8° | 178.8° |
| C21 | C19 | C07 | N41 | 147.1° | 147.1° |
| C21 | C19 | N41 | C20 | 80.5° | 80.5° |
| C21 | C19 | C06 | H061 | 154.6° | 154.6° |
| C21 | C19 | C07 | H071 | 8.8° | 8.8° |
| C21 | C19 | C07 | H072 | 150.7° | 150.7° |
| C21 | C19 | N41 | H411 | 99.5° | 99.5° |
| C19 | C21 | N42 | H421 | 1.2° | 1.2° |
| C21 | N42 | S55 | H421 | 180.0° | 180.0° |
| C21 | N42 | S55 | C22 | 177.5° | 177.5° |
| N42 | C21 | C19 | C07 | 154.8° | 154.8° |
| N42 | C21 | C19 | N41 | 10.6° | 10.6° |
| N42 | S55 | C22 | C24 | 160.4° | 160.4° |
| N42 | S55 | C22 | C34 | 56.9° | 56.9° |
| N42 | S55 | C22 | C23 | 93.7° | 93.7° |
| S55 | C22 | C24 | C34 | 141.9° | 141.9° |
| S55 | C22 | C24 | C23 | 108.3° | 108.3° |
| S55 | C22 | C34 | C23 | 149.5° | 149.5° |
| S55 | C22 | C24 | H241 | 142.3° | 142.3° |
| S55 | C22 | C24 | H242 | 1.2° | 1.2° |
| S55 | C22 | C23 | H232 | 148.9° | 148.9° |
| S55 | C22 | C23 | H231 | 7.7° | 7.7° |
| S55 | C22 | C34 | H341 | 180.0° | 180.0° |
| S55 | C22 | C34 | H342 | 60.0° | 60.0° |
| S55 | C22 | C34 | H343 | 60.0° | 60.0° |
| C22 | S55 | N42 | H421 | 2.5° | 2.5° |
| C07 | C19 | N41 | C20 | 137.3° | 137.3° |
| C19 | C07 | H071 | H072 | 145.6° | 145.6° |
| C07 | C19 | N41 | H411 | 42.7° | 42.7° |
| C19 | N41 | C20 | O49 | 10.3° | 10.3° |
| C19 | N41 | C20 | H411 | 180.0° | 180.0° |
| C19 | N41 | C20 | C13 | 169.1° | 169.1° |
| N41 | C19 | C06 | H061 | 2.9° | 2.9° |
| N41 | C19 | C07 | H071 | 138.3° | 138.3° |
| N41 | C19 | C07 | H072 | 3.6° | 3.6° |
| C03 | C15 | C02 | H151 | 120.4° | 120.4° |
| C03 | C15 | C02 | H152 | 120.4° | 120.4° |
| C03 | C15 | C02 | C14 | 59.3° | 59.3° |
| C03 | C15 | C02 | N43 | 179.5° | 179.5° |
| C03 | C15 | H151 | H152 | 118.8° | 118.8° |
| C03 | C15 | C02 | H021 | 59.6° | 59.6° |
| C15 | C03 | H031 | H032 | 119.9° | 119.9° |
| C15 | C03 | C16 | H161 | 9.8° | 9.8° |
| C15 | C03 | C16 | H162 | 129.5° | 129.5° |
| C22 | C24 | C23 | H241 | 109.4° | 109.4° |
| C22 | C24 | C23 | H242 | 109.4° | 109.4° |
| C24 | C22 | C34 | C23 | 70.5° | 70.5° |
| C22 | C24 | H241 | H242 | 144.8° | 144.8° |
| C22 | C24 | C23 | H232 | 109.4° | 109.4° |
| C22 | C24 | C23 | H231 | 109.4° | 109.4° |
| C24 | C22 | C34 | H341 | 40.0° | 40.0° |
| C24 | C22 | C34 | H342 | 160.0° | 160.0° |
| C24 | C22 | C34 | H343 | 80.0° | 80.0° |
| C23 | C24 | H241 | H242 | 144.8° | 144.8° |
| C24 | C23 | H232 | H231 | 144.9° | 144.9° |
| C34 | C22 | C24 | H241 | 0.4° | 0.4° |
| C34 | C22 | C24 | H242 | 140.8° | 140.8° |
| C34 | C22 | C23 | H232 | 0.9° | 0.9° |
| C34 | C22 | C23 | H231 | 142.1° | 142.1° |
| C22 | C34 | H341 | H342 | 120.0° | 120.0° |
| C22 | C34 | H341 | H343 | 120.0° | 120.0° |
| C22 | C34 | H342 | H343 | 120.0° | 120.0° |
| C22 | C23 | H232 | H231 | 144.8° | 144.8° |
| C23 | C22 | C34 | H341 | 30.5° | 30.5° |
| C23 | C22 | C34 | H342 | 89.5° | 89.5° |
| C23 | C22 | C34 | H343 | 150.5° | 150.5° |
| C15 | C02 | C14 | O48 | 52.9° | 52.9° |
| C15 | C02 | C14 | N43 | 116.9° | 116.9° |
| C15 | C02 | C14 | H021 | 119.1° | 119.1° |
| C15 | C02 | N43 | H021 | 120.2° | 120.2° |
| C15 | C02 | C14 | N40 | 125.9° | 125.9° |
| C15 | C02 | N43 | C25 | 121.2° | 121.2° |
| C02 | C15 | H151 | H152 | 118.8° | 118.8° |
| C02 | C15 | C03 | H031 | 64.9° | 64.9° |
| C02 | C15 | C03 | H032 | 55.0° | 55.0° |
| C15 | C02 | N43 | H431 | 58.8° | 58.8° |
| O49 | C20 | N41 | C13 | 179.4° | 179.4° |
| O49 | C20 | C13 | N40 | 49.5° | 49.5° |
| O49 | C20 | C13 | C12 | 66.2° | 66.2° |
| O49 | C20 | C13 | H131 | 169.5° | 169.5° |
| O49 | C20 | N41 | H411 | 169.7° | 169.7° |
| N41 | C20 | C13 | N40 | 129.9° | 129.9° |
| N41 | C20 | C13 | C12 | 114.4° | 114.4° |
| N41 | C20 | C13 | H131 | 9.9° | 9.9° |
| O48 | C14 | C02 | N40 | 178.8° | 178.8° |
| O48 | C14 | C02 | N43 | 64.0° | 64.0° |
| O48 | C14 | N40 | C13 | 1.1° | 1.1° |
| O48 | C14 | N40 | C01 | 179.2° | 179.2° |
| O48 | C14 | C02 | H021 | 172.0° | 172.0° |
| O54 | C36 | C56 | N44 | 179.8° | 179.8° |
| O54 | C36 | N44 | C26 | 0.6° | 0.6° |
| O54 | C36 | C56 | H562 | 0.0° | 0.0° |
| O54 | C36 | C56 | H561 | 120.0° | 120.0° |
| O54 | C36 | C56 | H563 | 120.0° | 120.0° |
| O54 | C36 | N44 | H441 | 179.4° | 179.4° |
| C20 | C13 | N40 | C14 | 48.9° | 48.9° |
| C20 | C13 | N40 | C12 | 124.2° | 124.2° |
| C20 | C13 | N40 | H131 | 117.6° | 117.6° |
| C20 | C13 | N40 | C01 | 130.8° | 130.8° |
| C20 | C13 | C12 | H131 | 124.8° | 124.8° |
| C20 | C13 | C12 | C11 | 148.7° | 148.7° |
| C20 | C13 | C12 | H122 | 30.0° | 30.0° |
| C20 | C13 | C12 | H121 | 92.7° | 92.7° |
| C13 | C20 | N41 | H411 | 10.9° | 10.9° |
| C14 | C02 | N43 | H021 | 123.2° | 123.2° |
| C14 | C02 | N43 | C25 | 122.1° | 122.1° |
| C02 | C14 | N40 | C13 | 177.7° | 177.7° |
| C02 | C14 | N40 | C01 | 2.0° | 2.0° |
| C14 | C02 | C15 | H151 | 61.1° | 61.1° |
| C14 | C02 | C15 | H152 | 179.7° | 179.7° |
| C14 | C02 | N43 | H431 | 57.9° | 57.9° |
| N43 | C02 | C14 | N40 | 117.2° | 117.2° |
| C02 | N43 | C25 | H431 | 180.0° | 180.0° |
| C02 | N43 | C25 | C26 | 177.9° | 177.9° |
| C02 | N43 | C25 | O52 | 1.6° | 1.6° |
| N43 | C02 | C15 | H151 | 59.1° | 59.1° |
| N43 | C02 | C15 | H152 | 60.1° | 60.1° |
| C14 | N40 | C13 | C01 | 179.7° | 179.7° |
| C14 | N40 | C13 | C12 | 173.1° | 173.1° |
| C14 | N40 | C01 | C11 | 162.7° | 162.7° |
| C14 | N40 | C13 | H131 | 68.7° | 68.7° |
| C14 | N40 | C01 | H011 | 44.5° | 44.5° |
| C14 | N40 | C01 | H012 | 79.1° | 79.1° |
| N40 | C14 | C02 | H021 | 6.8° | 6.8° |
| N43 | C25 | C26 | O52 | 179.5° | 179.5° |
| N43 | C25 | C26 | N44 | 128.3° | 128.3° |
| N43 | C25 | C26 | C35 | 109.1° | 109.1° |
| N43 | C25 | C26 | H261 | 10.7° | 10.7° |
| C25 | N43 | C02 | H021 | 1.1° | 1.1° |
| C56 | C36 | N44 | C26 | 179.7° | 179.7° |
| C36 | C56 | H562 | H561 | 120.0° | 120.0° |
| C36 | C56 | H562 | H563 | 120.0° | 120.0° |
| C36 | C56 | H561 | H563 | 120.0° | 120.0° |
| C56 | C36 | N44 | H441 | 0.4° | 0.4° |
| C36 | N44 | C26 | C25 | 96.2° | 96.2° |
| C36 | N44 | C26 | H441 | 180.0° | 180.0° |
| C36 | N44 | C26 | C35 | 140.7° | 140.7° |
| C36 | N44 | C26 | H261 | 20.7° | 20.7° |
| N44 | C36 | C56 | H562 | 179.8° | 179.8° |
| N44 | C36 | C56 | H561 | 60.2° | 60.2° |
| N44 | C36 | C56 | H563 | 59.8° | 59.8° |
| N40 | C13 | C12 | H131 | 121.1° | 121.1° |
| C13 | N40 | C01 | C11 | 17.6° | 17.6° |
| N40 | C13 | C12 | C11 | 34.6° | 34.6° |
| C13 | N40 | C01 | H011 | 135.8° | 135.8° |
| C13 | N40 | C01 | H012 | 100.6° | 100.6° |
| N40 | C13 | C12 | H122 | 84.1° | 84.1° |
| N40 | C13 | C12 | H121 | 153.2° | 153.2° |
| C01 | N40 | C13 | C12 | 6.6° | 6.6° |
| N40 | C01 | C11 | H011 | 118.2° | 118.2° |
| N40 | C01 | C11 | H012 | 118.3° | 118.3° |
| N40 | C01 | C11 | C12 | 42.0° | 42.0° |
| N40 | C01 | C11 | O47 | 75.3° | 75.3° |
| C01 | N40 | C13 | H131 | 111.6° | 111.6° |
| N40 | C01 | H011 | H012 | 125.0° | 125.0° |
| N40 | C01 | C11 | H111 | 167.1° | 167.1° |
| C13 | C12 | C11 | C01 | 45.2° | 45.2° |
| C13 | C12 | C11 | H122 | 118.6° | 118.6° |
| C13 | C12 | C11 | H121 | 118.6° | 118.6° |
| C13 | C12 | C11 | O47 | 63.1° | 63.1° |
| C13 | C12 | C11 | H111 | 167.1° | 167.1° |
| C13 | C12 | H122 | H121 | 123.9° | 123.9° |
| C25 | C26 | N44 | C35 | 123.0° | 123.0° |
| C25 | C26 | N44 | H261 | 116.9° | 116.9° |
| C25 | C26 | C35 | H261 | 119.8° | 119.8° |
| C25 | C26 | C35 | C37 | 55.6° | 55.6° |
| C25 | C26 | C35 | C39 | 174.0° | 174.0° |
| C25 | C26 | C35 | C38 | 64.4° | 64.4° |
| C26 | C25 | N43 | H431 | 2.1° | 2.1° |
| C25 | C26 | N44 | H441 | 83.8° | 83.8° |
| O52 | C25 | C26 | N44 | 51.2° | 51.2° |
| O52 | C25 | C26 | C35 | 71.4° | 71.4° |
| O52 | C25 | C26 | H261 | 168.8° | 168.8° |
| O52 | C25 | N43 | H431 | 178.4° | 178.4° |
| N44 | C26 | C35 | H261 | 120.7° | 120.7° |
| N44 | C26 | C35 | C37 | 175.1° | 175.1° |
| N44 | C26 | C35 | C39 | 66.5° | 66.5° |
| N44 | C26 | C35 | C38 | 55.1° | 55.1° |
| C26 | C35 | C37 | C39 | 118.8° | 118.8° |
| C26 | C35 | C37 | C38 | 120.7° | 120.7° |
| C26 | C35 | C39 | C38 | 121.0° | 121.0° |
| C26 | C35 | C37 | H372 | 180.0° | 180.0° |
| C26 | C35 | C37 | H371 | 60.0° | 60.0° |
| C26 | C35 | C37 | H373 | 60.0° | 60.0° |
| C26 | C35 | C38 | H383 | 180.0° | 180.0° |
| C26 | C35 | C38 | H381 | 60.0° | 60.0° |
| C26 | C35 | C38 | H382 | 60.0° | 60.0° |
| C26 | C35 | C39 | H391 | 180.0° | 180.0° |
| C26 | C35 | C39 | H392 | 60.0° | 60.0° |
| C26 | C35 | C39 | H393 | 60.0° | 60.0° |
| C35 | C26 | N44 | H441 | 39.2° | 39.2° |
| C01 | C11 | C12 | O47 | 108.4° | 108.4° |
| C01 | C11 | C12 | H111 | 121.9° | 121.9° |
| C01 | C11 | O47 | H111 | 117.0° | 117.0° |
| C01 | C11 | O47 | C10 | 160.2° | 160.2° |
| C11 | C01 | H011 | H012 | 125.0° | 125.0° |
| C01 | C11 | C12 | H122 | 73.4° | 73.4° |
| C01 | C11 | C12 | H121 | 163.8° | 163.8° |
| C12 | C11 | O47 | H111 | 131.8° | 131.8° |
| C12 | C11 | O47 | C10 | 88.5° | 88.5° |
| C11 | C12 | C13 | H131 | 86.6° | 86.6° |
| C12 | C11 | C01 | H011 | 160.3° | 160.3° |
| C12 | C11 | C01 | H012 | 76.2° | 76.2° |
| C11 | C12 | H122 | H121 | 123.9° | 123.9° |
| C37 | C35 | C39 | C38 | 119.2° | 119.2° |
| C37 | C35 | C26 | H261 | 64.2° | 64.2° |
| C35 | C37 | H372 | H371 | 120.0° | 120.0° |
| C35 | C37 | H372 | H373 | 120.0° | 120.0° |
| C35 | C37 | H371 | H373 | 120.0° | 120.0° |
| C37 | C35 | C38 | H383 | 59.1° | 59.1° |
| C37 | C35 | C38 | H381 | 179.1° | 179.1° |
| C37 | C35 | C38 | H382 | 60.9° | 60.9° |
| C37 | C35 | C39 | H391 | 60.2° | 60.2° |
| C37 | C35 | C39 | H392 | 59.8° | 59.8° |
| C37 | C35 | C39 | H393 | 179.8° | 179.8° |
| C39 | C35 | C26 | H261 | 54.2° | 54.2° |
| C39 | C35 | C37 | H372 | 61.2° | 61.2° |
| C39 | C35 | C37 | H371 | 178.8° | 178.8° |
| C39 | C35 | C37 | H373 | 58.8° | 58.8° |
| C39 | C35 | C38 | H383 | 59.7° | 59.7° |
| C39 | C35 | C38 | H381 | 60.3° | 60.3° |
| C39 | C35 | C38 | H382 | 179.7° | 179.7° |
| C35 | C39 | H391 | H392 | 120.0° | 120.0° |
| C35 | C39 | H391 | H393 | 120.0° | 120.0° |
| C35 | C39 | H392 | H393 | 120.0° | 120.0° |
| C38 | C35 | C26 | H261 | 175.8° | 175.8° |
| C38 | C35 | C37 | H372 | 59.3° | 59.3° |
| C38 | C35 | C37 | H371 | 60.7° | 60.7° |
| C38 | C35 | C37 | H373 | 179.3° | 179.3° |
| C35 | C38 | H383 | H381 | 120.0° | 120.0° |
| C35 | C38 | H383 | H382 | 120.0° | 120.0° |
| C35 | C38 | H381 | H382 | 120.0° | 120.0° |
| C38 | C35 | C39 | H391 | 59.0° | 59.0° |
| C38 | C35 | C39 | H392 | 179.0° | 179.0° |
| C38 | C35 | C39 | H393 | 61.0° | 61.0° |
| C11 | O47 | C10 | N45 | 6.1° | 6.1° |
| C11 | O47 | C10 | C09 | 171.9° | 171.9° |
| O47 | C11 | C01 | H011 | 42.9° | 42.9° |
| O47 | C11 | C01 | H012 | 166.4° | 166.4° |
| O47 | C11 | C12 | H122 | 178.3° | 178.3° |
| O47 | C11 | C12 | H121 | 55.5° | 55.5° |
| O47 | C10 | N45 | C09 | 177.8° | 177.8° |
| O47 | C10 | C09 | C08 | 1.8° | 1.8° |
| O47 | C10 | N45 | C27 | 179.6° | 179.6° |
| O47 | C10 | C09 | N46 | 179.3° | 179.3° |
| C10 | O47 | C11 | H111 | 43.3° | 43.3° |
| N45 | C10 | C09 | C08 | 179.7° | 179.7° |
| N45 | C10 | C09 | N46 | 1.5° | 1.5° |
| C10 | N45 | C27 | C28 | 179.5° | 179.5° |
| C10 | N45 | C27 | C33 | 1.5° | 1.5° |
| C10 | C09 | C08 | N46 | 178.9° | 178.9° |
| C09 | C10 | N45 | C27 | 1.7° | 1.7° |
| C10 | C09 | N46 | C33 | 0.8° | 0.8° |
| C10 | C09 | C08 | H082 | 178.9° | 178.8° |
| C10 | C09 | C08 | H083 | 61.2° | 61.2° |
| C10 | C09 | C08 | H081 | 58.8° | 58.9° |
| C08 | C09 | N46 | C33 | 179.7° | 179.7° |
| C09 | C08 | H082 | H083 | 120.0° | 120.0° |
| C09 | C08 | H082 | H081 | 120.0° | 120.0° |
| C09 | C08 | H083 | H081 | 120.0° | 120.0° |
| N45 | C27 | C28 | C33 | 179.0° | 179.0° |
| N45 | C27 | C33 | N46 | 1.0° | 1.0° |
| N45 | C27 | C28 | C29 | 179.0° | 179.0° |
| N45 | C27 | C33 | C32 | 179.0° | 179.0° |
| N45 | C27 | C28 | H281 | 1.0° | 1.0° |
| C09 | N46 | C33 | C27 | 0.6° | 0.6° |
| C09 | N46 | C33 | C32 | 179.3° | 179.3° |
| N46 | C09 | C08 | H082 | 0.0° | 0.0° |
| N46 | C09 | C08 | H083 | 120.0° | 120.0° |
| N46 | C09 | C08 | H081 | 120.0° | 120.0° |
| C28 | C27 | C33 | N46 | 180.0° | 180.0° |
| C27 | C28 | C29 | H281 | 180.0° | 180.0° |
| C28 | C27 | C33 | C32 | 0.0° | 0.0° |
| C27 | C28 | C29 | O53 | 179.6° | 179.6° |
| C27 | C28 | C29 | C31 | 0.6° | 0.6° |
| C27 | C33 | N46 | C32 | 179.9° | 179.9° |
| C33 | C27 | C28 | C29 | 0.1° | 0.1° |
| C27 | C33 | C32 | C31 | 0.5° | 0.5° |
| C33 | C27 | C28 | H281 | 179.9° | 179.9° |
| C27 | C33 | C32 | H321 | 179.5° | 179.5° |
| N46 | C33 | C32 | C31 | 179.6° | 179.6° |
| N46 | C33 | C32 | H321 | 0.4° | 0.4° |
| C28 | C29 | O53 | C30 | 2.8° | 2.8° |
| C28 | C29 | O53 | C31 | 179.0° | 179.0° |
| C28 | C29 | C31 | C32 | 1.1° | 1.1° |
| C28 | C29 | C31 | H311 | 178.9° | 178.9° |
| C33 | C32 | C31 | C29 | 1.0° | 1.0° |
| C33 | C32 | C31 | H321 | 180.0° | 180.0° |
| C33 | C32 | C31 | H311 | 178.9° | 179.0° |
| C30 | O53 | C29 | C31 | 176.2° | 176.2° |
| O53 | C30 | H303 | H301 | 120.0° | 120.0° |
| O53 | C30 | H303 | H302 | 120.0° | 120.0° |
| O53 | C30 | H301 | H302 | 119.9° | 119.9° |
| O53 | C29 | C31 | C32 | 179.9° | 179.9° |
| O53 | C29 | C28 | H281 | 0.4° | 0.4° |
| C29 | O53 | C30 | H303 | 180.0° | 180.0° |
| C29 | O53 | C30 | H301 | 60.0° | 60.0° |
| C29 | O53 | C30 | H302 | 60.0° | 60.0° |
| O53 | C29 | C31 | H311 | 0.1° | 0.1° |
| C29 | C31 | C32 | H311 | 180.0° | 180.0° |
| C31 | C29 | C28 | H281 | 179.4° | 179.4° |
| C29 | C31 | C32 | H321 | 179.0° | 179.0° |
| H131 | C13 | C12 | H122 | 154.8° | 154.8° |
| H131 | C13 | C12 | H121 | 32.1° | 32.1° |
| H151 | C15 | C02 | H021 | 180.0° | 180.0° |
| H151 | C15 | C03 | H031 | 174.7° | 174.7° |
| H151 | C15 | C03 | H032 | 65.4° | 65.4° |
| H152 | C15 | C02 | H021 | 60.8° | 60.8° |
| H152 | C15 | C03 | H031 | 55.5° | 55.5° |
| H152 | C15 | C03 | H032 | 175.4° | 175.4° |
| H172 | C17 | C04 | H041 | 177.5° | 177.5° |
| H172 | C17 | C04 | H042 | 57.8° | 57.8° |
| H172 | C17 | C18 | H181 | 178.2° | 178.3° |
| H171 | C17 | C04 | H041 | 63.0° | 63.0° |
| H171 | C17 | C04 | H042 | 177.3° | 177.3° |
| H171 | C17 | C18 | H181 | 58.8° | 58.8° |
| H241 | C24 | C23 | H232 | 0.1° | 0.1° |
| H241 | C24 | C23 | H231 | 141.2° | 141.2° |
| H242 | C24 | C23 | H232 | 141.2° | 141.2° |
| H242 | C24 | C23 | H231 | 0.0° | 0.0° |
| H261 | C26 | N44 | H441 | 159.3° | 159.3° |
| H011 | C01 | C11 | H111 | 74.7° | 74.7° |
| H012 | C01 | C11 | H111 | 48.8° | 48.8° |
| H021 | C02 | N43 | H431 | 178.9° | 178.9° |
| H031 | C03 | C16 | H161 | 110.3° | 110.3° |
| H031 | C03 | C16 | H162 | 9.4° | 9.4° |
| H032 | C03 | C16 | H161 | 129.8° | 129.8° |
| H032 | C03 | C16 | H162 | 110.5° | 110.5° |
| H041 | C04 | C16 | H161 | 65.5° | 65.5° |
| H041 | C04 | C16 | H162 | 54.2° | 54.2° |
| H042 | C04 | C16 | H161 | 174.7° | 174.8° |
| H042 | C04 | C16 | H162 | 65.5° | 65.5° |
| H051 | C05 | C06 | H061 | 147.9° | 147.9° |
| H051 | C05 | C18 | H181 | 3.1° | 3.1° |
| H061 | C06 | C07 | H071 | 148.1° | 148.1° |
| H061 | C06 | C07 | H072 | 6.3° | 6.3° |
| H082 | C08 | H083 | H081 | 120.0° | 120.0° |
| H111 | C11 | C12 | H122 | 48.5° | 48.5° |
| H111 | C11 | C12 | H121 | 74.3° | 74.3° |
| H303 | C30 | H301 | H302 | 120.0° | 120.0° |
| H311 | C31 | C32 | H321 | 1.1° | 1.0° |
| H341 | C34 | H342 | H343 | 120.0° | 120.0° |
| H372 | C37 | H371 | H373 | 120.0° | 120.0° |
| H383 | C38 | H381 | H382 | 120.0° | 120.0° |
| H391 | C39 | H392 | H393 | 120.0° | 120.0° |
| H562 | C56 | H561 | H563 | 120.0° | 120.0° |
