PMT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O11 | P' | doub | 1.48Å | 1.61Å | |
| P' | O12 | sing | 1.61Å | 1.61Å | |
| P' | O13 | sing | 1.61Å | 1.48Å | |
| P' | O7' | sing | 1.61Å | 1.61Å | |
| O12 | HP' | sing | 0.97Å | 0.95Å | |
| O13 | H4 | sing | 0.97Å | 0.95Å | |
| O7' | C7' | sing | 1.43Å | 1.43Å | |
| C7' | C6' | sing | 1.53Å | 1.53Å | |
| C7' | H7'1 | sing | 1.09Å | 1.12Å | |
| C7' | H7'2 | sing | 1.09Å | 1.11Å | |
| C6' | C9' | sing | 1.53Å | 1.53Å | |
| C6' | C8' | sing | 1.53Å | 1.53Å | |
| C6' | C5' | sing | 1.53Å | 1.53Å | |
| C9' | H9'1 | sing | 1.09Å | 1.12Å | |
| C9' | H9'2 | sing | 1.09Å | 1.12Å | |
| C9' | H9'3 | sing | 1.09Å | 1.11Å | |
| C8' | H8'1 | sing | 1.09Å | 1.12Å | |
| C8' | H8'2 | sing | 1.09Å | 1.12Å | |
| C8' | H8'3 | sing | 1.09Å | 1.12Å | |
| C5' | O5' | sing | 1.43Å | 1.43Å | |
| C5' | C4' | sing | 1.51Å | 1.53Å | |
| C5' | H1 | sing | 1.09Å | 1.11Å | |
| O5' | H5' | sing | 0.97Å | 0.95Å | |
| C4' | O4' | doub | 1.21Å | 1.23Å | |
| C4' | N3' | sing | 1.35Å | 1.33Å | |
| N3' | C3' | sing | 1.46Å | 1.47Å | |
| N3' | H3' | sing | 0.97Å | 1.02Å | |
| C3' | C2' | sing | 1.53Å | 1.53Å | |
| C3' | H3'1 | sing | 1.09Å | 1.12Å | |
| C3' | H3'2 | sing | 1.09Å | 1.11Å | |
| C2' | C1' | sing | 1.51Å | 1.53Å | |
| C2' | H2'1 | sing | 1.09Å | 1.11Å | |
| C2' | H2'2 | sing | 1.09Å | 1.12Å | |
| C1' | O1' | doub | 1.21Å | 1.23Å | |
| C1' | OP2 | sing | 1.34Å | 1.36Å | |
| OP2 | P | sing | 1.61Å | 1.61Å | |
| P | OP1 | doub | 1.48Å | 1.61Å | |
| P | OP3 | sing | 1.61Å | 1.48Å | |
| P | O5B | sing | 1.61Å | 1.60Å | |
| OP3 | H3P | sing | 0.97Å | 0.95Å | |
| O5B | C5B | sing | 1.43Å | 1.42Å | |
| C5B | C4B | sing | 1.53Å | 1.53Å | |
| C5B | H5'1 | sing | 1.09Å | 1.12Å | |
| C5B | H5'' | sing | 1.09Å | 1.12Å | |
| C4B | O4B | sing | 1.44Å | 1.43Å | |
| C4B | C3B | sing | 1.54Å | 1.53Å | |
| C4B | H4' | sing | 1.09Å | 1.12Å | |
| O4B | C1B | sing | 1.44Å | 1.44Å | |
| C3B | O3' | sing | 1.43Å | 1.43Å | |
| C3B | C2B | sing | 1.55Å | 1.53Å | |
| C3B | H3B | sing | 1.09Å | 1.12Å | |
| O3' | H3 | sing | 0.97Å | 0.95Å | |
| C2B | O2' | sing | 1.43Å | 1.43Å | |
| C2B | C1B | sing | 1.55Å | 1.53Å | |
| C2B | H2' | sing | 1.09Å | 1.12Å | |
| O2' | H2 | sing | 0.97Å | 0.95Å | |
| C1B | N1 | sing | 1.46Å | 1.48Å | |
| C1B | H1' | sing | 1.09Å | 1.12Å | |
| N1 | C6 | sing | 1.36Å | 1.40Å | |
| N1 | C2 | sing | 1.35Å | 1.40Å | |
| C6 | C5 | doub | 1.35Å | 1.39Å | |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| C5 | C4 | sing | 1.41Å | 1.39Å | |
| C5 | H5 | sing | 1.08Å | 1.10Å | |
| C4 | N4 | sing | 1.38Å | 1.33Å | |
| C4 | N3 | doub | 1.33Å | 1.40Å | |
| N4 | HN41 | sing | 0.97Å | 1.02Å | |
| N4 | HN42 | sing | 0.97Å | 1.02Å | |
| N3 | C2 | sing | 1.33Å | 1.40Å | |
| C2 | O2 | doub | 1.22Å | 1.23Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O11 | P' | O12 | 106.0° | 109.5° |
| O11 | P' | O13 | 112.3° | 109.5° |
| O11 | P' | O7' | 105.9° | 109.4° |
| O12 | P' | O13 | 111.9° | 109.5° |
| O12 | P' | O7' | 106.5° | 109.5° |
| P' | O12 | HP' | 106.0° | 106.8° |
| O13 | P' | O7' | 113.8° | 109.5° |
| P' | O13 | H4 | 112.3° | 106.8° |
| P' | O7' | C7' | 119.1° | 106.8° |
| O7' | C7' | C6' | 111.1° | 109.4° |
| O7' | C7' | H7'1 | 111.6° | 109.5° |
| O7' | C7' | H7'2 | 111.6° | 109.5° |
| C6' | C7' | H7'1 | 111.6° | 109.4° |
| C6' | C7' | H7'2 | 111.6° | 109.5° |
| C7' | C6' | C9' | 109.2° | 109.5° |
| C7' | C6' | C8' | 108.8° | 109.5° |
| C7' | C6' | C5' | 108.3° | 109.5° |
| H7'1 | C7' | H7'2 | 98.8° | 109.5° |
| C9' | C6' | C8' | 108.8° | 109.5° |
| C9' | C6' | C5' | 110.6° | 109.5° |
| C6' | C9' | H9'1 | 112.3° | 109.5° |
| C6' | C9' | H9'2 | 109.2° | 109.4° |
| C6' | C9' | H9'3 | 112.3° | 109.5° |
| C8' | C6' | C5' | 111.2° | 109.4° |
| C6' | C8' | H8'1 | 112.5° | 109.4° |
| C6' | C8' | H8'2 | 108.8° | 109.5° |
| C6' | C8' | H8'3 | 112.4° | 109.5° |
| C6' | C5' | O5' | 110.5° | 109.5° |
| C6' | C5' | C4' | 111.9° | 109.5° |
| C6' | C5' | H1 | 106.7° | 109.5° |
| H9'1 | C9' | H9'2 | 112.3° | 109.5° |
| H9'1 | C9' | H9'3 | 98.1° | 109.5° |
| H9'2 | C9' | H9'3 | 112.3° | 109.4° |
| H8'1 | C8' | H8'2 | 112.4° | 109.4° |
| H8'1 | C8' | H8'3 | 98.0° | 109.5° |
| H8'2 | C8' | H8'3 | 112.5° | 109.5° |
| O5' | C5' | C4' | 108.2° | 109.4° |
| O5' | C5' | H1 | 110.4° | 109.5° |
| C5' | O5' | H5' | 110.6° | 106.8° |
| C4' | C5' | H1 | 109.1° | 109.5° |
| C5' | C4' | O4' | 121.1° | 120.0° |
| C5' | C4' | N3' | 114.0° | 120.0° |
| O4' | C4' | N3' | 124.9° | 120.0° |
| C4' | N3' | C3' | 122.5° | 120.0° |
| C4' | N3' | H3' | 113.6° | 120.0° |
| C3' | N3' | H3' | 123.9° | 120.0° |
| N3' | C3' | C2' | 109.5° | 109.5° |
| N3' | C3' | H3'1 | 112.2° | 109.5° |
| N3' | C3' | H3'2 | 112.2° | 109.4° |
| C2' | C3' | H3'1 | 112.2° | 109.5° |
| C2' | C3' | H3'2 | 112.2° | 109.5° |
| C3' | C2' | C1' | 110.1° | 109.5° |
| C3' | C2' | H2'1 | 112.0° | 109.4° |
| C3' | C2' | H2'2 | 111.9° | 109.4° |
| H3'1 | C3' | H3'2 | 98.2° | 109.5° |
| C1' | C2' | H2'1 | 112.0° | 109.5° |
| C1' | C2' | H2'2 | 112.0° | 109.5° |
| C2' | C1' | O1' | 121.2° | 120.0° |
| C2' | C1' | OP2 | 113.3° | 120.0° |
| H2'1 | C2' | H2'2 | 98.5° | 109.5° |
| O1' | C1' | OP2 | 125.5° | 120.0° |
| C1' | OP2 | P | 115.9° | 120.0° |
| OP2 | P | OP1 | 103.2° | 109.5° |
| OP2 | P | OP3 | 115.8° | 109.5° |
| OP2 | P | O5B | 107.2° | 109.4° |
| OP1 | P | OP3 | 113.3° | 109.5° |
| OP1 | P | O5B | 100.3° | 109.5° |
| OP3 | P | O5B | 115.3° | 109.4° |
| P | OP3 | H3P | 115.8° | 106.9° |
| P | O5B | C5B | 121.4° | 106.8° |
| O5B | C5B | C4B | 109.3° | 109.5° |
| O5B | C5B | H5'1 | 112.3° | 109.5° |
| O5B | C5B | H5'' | 112.3° | 109.5° |
| C4B | C5B | H5'1 | 112.3° | 109.4° |
| C4B | C5B | H5'' | 112.3° | 109.4° |
| C5B | C4B | O4B | 107.5° | 109.9° |
| C5B | C4B | C3B | 111.8° | 109.9° |
| C5B | C4B | H4' | 107.4° | 109.9° |
| H5'1 | C5B | H5'' | 98.2° | 109.5° |
| O4B | C4B | C3B | 103.0° | 107.4° |
| O4B | C4B | H4' | 115.7° | 109.9° |
| C4B | O4B | C1B | 107.3° | 107.0° |
| C3B | C4B | H4' | 111.6° | 109.9° |
| C4B | C3B | O3' | 109.9° | 110.8° |
| C4B | C3B | C2B | 99.7° | 104.0° |
| C4B | C3B | H3B | 115.3° | 110.5° |
| O4B | C1B | C2B | 107.9° | 103.5° |
| O4B | C1B | N1 | 108.7° | 110.6° |
| O4B | C1B | H1' | 112.9° | 110.6° |
| O3' | C3B | C2B | 109.4° | 110.5° |
| O3' | C3B | H3B | 106.6° | 110.5° |
| C3B | O3' | H3 | 109.9° | 106.8° |
| C2B | C3B | H3B | 115.8° | 110.4° |
| C3B | C2B | O2' | 109.5° | 110.8° |
| C3B | C2B | C1B | 100.4° | 102.1° |
| C3B | C2B | H2' | 115.0° | 111.0° |
| O2' | C2B | C1B | 109.2° | 110.9° |
| O2' | C2B | H2' | 107.1° | 110.8° |
| C2B | O2' | H2 | 109.5° | 106.8° |
| C1B | C2B | H2' | 115.4° | 111.0° |
| C2B | C1B | N1 | 114.4° | 110.7° |
| C2B | C1B | H1' | 107.0° | 110.6° |
| N1 | C1B | H1' | 106.2° | 110.6° |
| C1B | N1 | C6 | 121.4° | 119.8° |
| C1B | N1 | C2 | 118.1° | 119.9° |
| C6 | N1 | C2 | 120.3° | 120.3° |
| N1 | C6 | C5 | 120.4° | 119.3° |
| N1 | C6 | H6 | 120.2° | 120.4° |
| N1 | C2 | N3 | 119.0° | 121.1° |
| N1 | C2 | O2 | 120.7° | 119.4° |
| C5 | C6 | H6 | 119.4° | 120.4° |
| C6 | C5 | C4 | 119.4° | 119.0° |
| C6 | C5 | H5 | 120.3° | 120.5° |
| C4 | C5 | H5 | 120.3° | 120.5° |
| C5 | C4 | N4 | 120.4° | 120.2° |
| C5 | C4 | N3 | 120.6° | 119.6° |
| N4 | C4 | N3 | 119.1° | 120.2° |
| C4 | N4 | HN41 | 108.3° | 120.0° |
| C4 | N4 | HN42 | 120.3° | 120.0° |
| C4 | N3 | C2 | 120.3° | 120.7° |
| HN41 | N4 | HN42 | 108.3° | 120.0° |
| N3 | C2 | O2 | 120.2° | 119.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O11 | P' | O12 | O13 | 122.7° | 120.0° |
| O11 | P' | O12 | O7' | 112.4° | 120.0° |
| O11 | P' | O13 | O7' | 120.3° | 120.0° |
| O11 | P' | O12 | HP' | 180.0° | 60.0° |
| O11 | P' | O13 | H4 | 180.0° | 179.9° |
| O11 | P' | O7' | C7' | 56.7° | 55.0° |
| O12 | P' | O13 | O7' | 120.7° | 120.0° |
| O12 | P' | O13 | H4 | 61.0° | 60.0° |
| O12 | P' | O7' | C7' | 55.8° | 175.0° |
| O13 | P' | O12 | HP' | 57.3° | 60.0° |
| O13 | P' | O7' | C7' | 179.5° | 65.0° |
| O7' | P' | O12 | HP' | 67.6° | 180.0° |
| O7' | P' | O13 | H4 | 59.7° | 60.0° |
| P' | O7' | C7' | C6' | 138.3° | 180.0° |
| P' | O7' | C7' | H7'1 | 96.5° | 60.0° |
| P' | O7' | C7' | H7'2 | 13.0° | 60.0° |
| O7' | C7' | C6' | H7'1 | 125.3° | 120.0° |
| O7' | C7' | C6' | H7'2 | 125.3° | 120.0° |
| O7' | C7' | H7'1 | H7'2 | 117.5° | 120.1° |
| O7' | C7' | C6' | C9' | 53.9° | 60.0° |
| O7' | C7' | C6' | C8' | 64.7° | 60.0° |
| O7' | C7' | C6' | C5' | 174.4° | 180.0° |
| C6' | C7' | H7'1 | H7'2 | 117.5° | 120.0° |
| C7' | C6' | C9' | C8' | 118.6° | 120.0° |
| C7' | C6' | C9' | C5' | 119.0° | 120.0° |
| C7' | C6' | C8' | C5' | 119.1° | 120.0° |
| C7' | C6' | C9' | H9'1 | 54.7° | 172.7° |
| C7' | C6' | C9' | H9'2 | 180.0° | 52.7° |
| C7' | C6' | C9' | H9'3 | 54.7° | 67.3° |
| C7' | C6' | C8' | H8'1 | 54.8° | 56.5° |
| C7' | C6' | C8' | H8'2 | 180.0° | 63.4° |
| C7' | C6' | C8' | H8'3 | 54.7° | 176.5° |
| C7' | C6' | C5' | O5' | 66.0° | 65.4° |
| C7' | C6' | C5' | C4' | 173.3° | 54.5° |
| C7' | C6' | C5' | H1 | 54.1° | 174.5° |
| H7'1 | C7' | C6' | C9' | 179.2° | 60.0° |
| H7'1 | C7' | C6' | C8' | 60.6° | 180.0° |
| H7'1 | C7' | C6' | C5' | 60.3° | 60.0° |
| H7'2 | C7' | C6' | C9' | 71.3° | 180.0° |
| H7'2 | C7' | C6' | C8' | 170.1° | 60.0° |
| H7'2 | C7' | C6' | C5' | 49.1° | 60.0° |
| C9' | C6' | C8' | C5' | 122.0° | 120.0° |
| C6' | C9' | H9'1 | H9'2 | 123.5° | 120.0° |
| C6' | C9' | H9'1 | H9'3 | 118.2° | 120.0° |
| C6' | C9' | H9'2 | H9'3 | 125.3° | 120.0° |
| C9' | C6' | C8' | H8'1 | 64.1° | 63.6° |
| C9' | C6' | C8' | H8'2 | 61.1° | 176.5° |
| C9' | C6' | C8' | H8'3 | 173.6° | 56.5° |
| C9' | C6' | C5' | O5' | 174.4° | 174.5° |
| C9' | C6' | C5' | C4' | 53.7° | 65.5° |
| C9' | C6' | C5' | H1 | 65.5° | 54.5° |
| C8' | C6' | C9' | H9'1 | 173.3° | 67.3° |
| C8' | C6' | C9' | H9'2 | 61.4° | 172.7° |
| C8' | C6' | C9' | H9'3 | 63.8° | 52.7° |
| C6' | C8' | H8'1 | H8'2 | 123.2° | 119.9° |
| C6' | C8' | H8'1 | H8'3 | 118.4° | 120.1° |
| C6' | C8' | H8'2 | H8'3 | 125.2° | 120.1° |
| C8' | C6' | C5' | O5' | 53.4° | 54.6° |
| C8' | C6' | C5' | C4' | 67.3° | 174.5° |
| C8' | C6' | C5' | H1 | 173.5° | 65.5° |
| C5' | C6' | C9' | H9'1 | 64.3° | 52.7° |
| C5' | C6' | C9' | H9'2 | 61.0° | 67.3° |
| C5' | C6' | C9' | H9'3 | 173.8° | 172.7° |
| C5' | C6' | C8' | H8'1 | 173.9° | 176.4° |
| C5' | C6' | C8' | H8'2 | 60.9° | 56.5° |
| C5' | C6' | C8' | H8'3 | 64.4° | 63.5° |
| C6' | C5' | O5' | C4' | 122.8° | 120.0° |
| C6' | C5' | O5' | H1 | 117.8° | 120.0° |
| C6' | C5' | C4' | H1 | 117.8° | 120.0° |
| C6' | C5' | O5' | H5' | 180.0° | 60.0° |
| C6' | C5' | C4' | O4' | 83.9° | 105.9° |
| C6' | C5' | C4' | N3' | 96.6° | 74.0° |
| H9'1 | C9' | H9'2 | H9'3 | 109.5° | 120.0° |
| H8'1 | C8' | H8'2 | H8'3 | 109.5° | 120.0° |
| O5' | C5' | C4' | H1 | 120.2° | 120.0° |
| O5' | C5' | C4' | O4' | 38.1° | 14.1° |
| O5' | C5' | C4' | N3' | 141.3° | 166.0° |
| C4' | C5' | O5' | H5' | 57.2° | 60.0° |
| C5' | C4' | O4' | N3' | 179.4° | 179.9° |
| C5' | C4' | N3' | C3' | 178.7° | 178.8° |
| C5' | C4' | N3' | H3' | 1.4° | 1.2° |
| H1 | C5' | O5' | H5' | 62.2° | 180.0° |
| H1 | C5' | C4' | O4' | 158.3° | 134.1° |
| H1 | C5' | C4' | N3' | 21.2° | 46.0° |
| O4' | C4' | N3' | C3' | 1.9° | 1.3° |
| O4' | C4' | N3' | H3' | 178.1° | 178.7° |
| C4' | N3' | C3' | H3' | 180.0° | 179.9° |
| C4' | N3' | C3' | C2' | 104.4° | 180.0° |
| C4' | N3' | C3' | H3'1 | 20.9° | 59.9° |
| C4' | N3' | C3' | H3'2 | 130.4° | 60.1° |
| N3' | C3' | C2' | H3'1 | 125.3° | 120.1° |
| N3' | C3' | C2' | H3'2 | 125.2° | 120.0° |
| N3' | C3' | H3'1 | H3'2 | 118.1° | 120.0° |
| N3' | C3' | C2' | C1' | 171.4° | 180.0° |
| N3' | C3' | C2' | H2'1 | 63.4° | 59.9° |
| N3' | C3' | C2' | H2'2 | 46.1° | 60.0° |
| H3' | N3' | C3' | C2' | 75.7° | 0.0° |
| H3' | N3' | C3' | H3'1 | 159.1° | 120.0° |
| H3' | N3' | C3' | H3'2 | 49.6° | 120.0° |
| C2' | C3' | H3'1 | H3'2 | 118.1° | 120.0° |
| C3' | C2' | C1' | H2'1 | 125.2° | 120.0° |
| C3' | C2' | C1' | H2'2 | 125.2° | 120.0° |
| C3' | C2' | H2'1 | H2'2 | 117.9° | 119.9° |
| C3' | C2' | C1' | O1' | 133.7° | 0.0° |
| C3' | C2' | C1' | OP2 | 44.3° | 180.0° |
| H3'1 | C3' | C2' | C1' | 46.1° | 60.0° |
| H3'1 | C3' | C2' | H2'1 | 171.4° | 180.0° |
| H3'1 | C3' | C2' | H2'2 | 79.1° | 60.0° |
| H3'2 | C3' | C2' | C1' | 63.4° | 60.0° |
| H3'2 | C3' | C2' | H2'1 | 61.9° | 60.0° |
| H3'2 | C3' | C2' | H2'2 | 171.4° | 180.0° |
| C1' | C2' | H2'1 | H2'2 | 117.9° | 120.0° |
| C2' | C1' | O1' | OP2 | 177.7° | 180.0° |
| C2' | C1' | OP2 | P | 178.3° | 180.0° |
| H2'1 | C2' | C1' | O1' | 8.5° | 120.0° |
| H2'1 | C2' | C1' | OP2 | 169.5° | 60.0° |
| H2'2 | C2' | C1' | O1' | 101.1° | 120.0° |
| H2'2 | C2' | C1' | OP2 | 80.9° | 60.0° |
| O1' | C1' | OP2 | P | 3.8° | 0.0° |
| C1' | OP2 | P | OP1 | 146.1° | 55.0° |
| C1' | OP2 | P | OP3 | 21.7° | 65.0° |
| C1' | OP2 | P | O5B | 108.6° | 175.0° |
| OP2 | P | OP1 | OP3 | 126.0° | 120.1° |
| OP2 | P | OP1 | O5B | 110.5° | 120.0° |
| OP2 | P | OP3 | O5B | 126.3° | 120.0° |
| OP2 | P | OP3 | H3P | 180.0° | 60.0° |
| OP2 | P | O5B | C5B | 101.4° | 175.0° |
| OP1 | P | OP3 | O5B | 114.8° | 120.0° |
| OP1 | P | OP3 | H3P | 61.1° | 180.0° |
| OP1 | P | O5B | C5B | 151.2° | 55.0° |
| OP3 | P | O5B | C5B | 29.1° | 65.0° |
| O5B | P | OP3 | H3P | 53.7° | 60.0° |
| P | O5B | C5B | C4B | 134.4° | 180.0° |
| P | O5B | C5B | H5'1 | 9.2° | 60.0° |
| P | O5B | C5B | H5'' | 100.3° | 60.0° |
| O5B | C5B | C4B | H5'1 | 125.2° | 120.0° |
| O5B | C5B | C4B | H5'' | 125.3° | 120.0° |
| O5B | C5B | H5'1 | H5'' | 118.2° | 120.1° |
| O5B | C5B | C4B | O4B | 176.6° | 66.7° |
| O5B | C5B | C4B | C3B | 64.3° | 175.3° |
| O5B | C5B | C4B | H4' | 58.4° | 54.3° |
| C4B | C5B | H5'1 | H5'' | 118.2° | 119.9° |
| C5B | C4B | O4B | C3B | 118.2° | 119.5° |
| C5B | C4B | O4B | H4' | 119.9° | 121.0° |
| C5B | C4B | C3B | H4' | 120.3° | 121.0° |
| C5B | C4B | O4B | C1B | 85.1° | 146.0° |
| C5B | C4B | C3B | O3' | 176.3° | 119.9° |
| C5B | C4B | C3B | C2B | 68.9° | 121.4° |
| C5B | C4B | C3B | H3B | 55.8° | 2.9° |
| H5'1 | C5B | C4B | O4B | 51.4° | 53.3° |
| H5'1 | C5B | C4B | C3B | 60.9° | 64.7° |
| H5'1 | C5B | C4B | H4' | 176.4° | 174.3° |
| H5'' | C5B | C4B | O4B | 58.1° | 173.3° |
| H5'' | C5B | C4B | C3B | 170.4° | 55.3° |
| H5'' | C5B | C4B | H4' | 66.9° | 65.7° |
| O4B | C4B | C3B | H4' | 124.7° | 119.5° |
| O4B | C4B | C3B | O3' | 68.7° | 120.6° |
| O4B | C4B | C3B | C2B | 46.2° | 1.9° |
| O4B | C4B | C3B | H3B | 170.9° | 116.6° |
| C4B | O4B | C1B | C2B | 6.7° | 40.1° |
| C4B | O4B | C1B | N1 | 117.8° | 158.7° |
| C4B | O4B | C1B | H1' | 124.7° | 78.4° |
| C3B | C4B | O4B | C1B | 33.1° | 26.4° |
| C4B | C3B | O3' | C2B | 108.5° | 114.8° |
| C4B | C3B | O3' | H3B | 125.6° | 122.7° |
| C4B | C3B | C2B | H3B | 124.3° | 118.5° |
| C4B | C3B | O3' | H3 | 180.0° | 176.2° |
| C4B | C3B | C2B | O2' | 155.1° | 139.2° |
| C4B | C3B | C2B | C1B | 40.3° | 21.1° |
| C4B | C3B | C2B | H2' | 84.2° | 97.3° |
| H4' | C4B | O4B | C1B | 155.1° | 93.1° |
| H4' | C4B | C3B | O3' | 56.0° | 1.2° |
| H4' | C4B | C3B | C2B | 170.8° | 117.6° |
| H4' | C4B | C3B | H3B | 64.5° | 123.9° |
| O4B | C1B | C2B | C3B | 22.2° | 37.2° |
| O4B | C1B | C2B | O2' | 137.3° | 155.3° |
| O4B | C1B | C2B | N1 | 121.0° | 118.5° |
| O4B | C1B | C2B | H1' | 121.7° | 118.5° |
| O4B | C1B | C2B | H2' | 102.1° | 81.2° |
| O4B | C1B | N1 | H1' | 121.7° | 122.9° |
| O4B | C1B | N1 | C6 | 69.8° | 126.4° |
| O4B | C1B | N1 | C2 | 105.5° | 53.3° |
| O3' | C3B | C2B | H3B | 120.4° | 122.5° |
| O3' | C3B | C2B | O2' | 39.8° | 20.2° |
| O3' | C3B | C2B | C1B | 75.0° | 97.9° |
| O3' | C3B | C2B | H2' | 160.5° | 143.8° |
| C2B | C3B | O3' | H3 | 71.5° | 61.4° |
| C3B | C2B | O2' | C1B | 109.1° | 112.6° |
| C3B | C2B | O2' | H2' | 125.4° | 123.7° |
| C3B | C2B | C1B | H2' | 124.3° | 118.4° |
| C3B | C2B | O2' | H2 | 180.0° | 67.4° |
| C3B | C2B | C1B | N1 | 143.2° | 155.7° |
| C3B | C2B | C1B | H1' | 99.5° | 81.3° |
| H3B | C3B | O3' | H3 | 54.4° | 61.1° |
| H3B | C3B | C2B | O2' | 80.6° | 102.3° |
| H3B | C3B | C2B | C1B | 164.6° | 139.6° |
| H3B | C3B | C2B | H2' | 40.1° | 21.3° |
| O2' | C2B | C1B | H2' | 120.6° | 123.6° |
| O2' | C2B | C1B | N1 | 101.7° | 86.2° |
| O2' | C2B | C1B | H1' | 15.6° | 36.7° |
| C1B | C2B | O2' | H2 | 70.9° | 180.0° |
| C2B | C1B | N1 | H1' | 117.8° | 123.0° |
| C2B | C1B | N1 | C6 | 50.8° | 119.5° |
| C2B | C1B | N1 | C2 | 133.9° | 60.8° |
| H2' | C2B | O2' | H2 | 54.7° | 56.3° |
| H2' | C2B | C1B | N1 | 18.9° | 37.3° |
| H2' | C2B | C1B | H1' | 136.2° | 160.3° |
| C1B | N1 | C6 | C2 | 175.2° | 179.7° |
| C1B | N1 | C6 | C5 | 174.9° | 180.0° |
| C1B | N1 | C6 | H6 | 5.1° | 0.1° |
| C1B | N1 | C2 | N3 | 175.1° | 179.8° |
| C1B | N1 | C2 | O2 | 2.1° | 0.2° |
| H1' | C1B | N1 | C6 | 168.6° | 3.5° |
| H1' | C1B | N1 | C2 | 16.2° | 176.2° |
| N1 | C6 | C5 | H6 | 180.0° | 179.9° |
| N1 | C6 | C5 | C4 | 0.1° | 0.1° |
| N1 | C6 | C5 | H5 | 179.9° | 180.0° |
| C6 | N1 | C2 | N3 | 0.2° | 0.5° |
| C6 | N1 | C2 | O2 | 177.4° | 179.9° |
| C2 | N1 | C6 | C5 | 0.3° | 0.3° |
| C2 | N1 | C6 | H6 | 179.7° | 179.8° |
| N1 | C2 | N3 | C4 | 0.1° | 0.5° |
| N1 | C2 | N3 | O2 | 177.2° | 179.5° |
| C6 | C5 | C4 | H5 | 180.0° | 179.9° |
| C6 | C5 | C4 | N4 | 179.8° | 180.0° |
| C6 | C5 | C4 | N3 | 0.2° | 0.0° |
| H6 | C6 | C5 | C4 | 179.9° | 180.0° |
| H6 | C6 | C5 | H5 | 0.1° | 0.1° |
| C5 | C4 | N4 | N3 | 180.0° | 180.0° |
| C5 | C4 | N4 | HN41 | 54.7° | 0.0° |
| C5 | C4 | N4 | HN42 | 180.0° | 180.0° |
| C5 | C4 | N3 | C2 | 0.3° | 0.2° |
| H5 | C5 | C4 | N4 | 0.2° | 0.0° |
| H5 | C5 | C4 | N3 | 179.8° | 180.0° |
| C4 | N4 | HN41 | HN42 | 132.1° | 179.9° |
| N4 | C4 | N3 | C2 | 179.7° | 179.8° |
| N3 | C4 | N4 | HN41 | 125.3° | 180.0° |
| N3 | C4 | N4 | HN42 | 0.0° | 0.1° |
| C4 | N3 | C2 | O2 | 177.1° | 180.0° |
