GCG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | CA1 | sing | 1.51Å | 1.53Å | |
| C1 | O11 | sing | 1.34Å | 1.24Å | |
| C1 | O21 | doub | 1.21Å | 1.23Å | |
| CA1 | CB1 | sing | 1.53Å | 1.58Å | |
| CA1 | N1 | sing | 1.47Å | 1.49Å | |
| CA1 | HA1 | sing | 1.09Å | 1.11Å | |
| O11 | HO11 | sing | 0.97Å | 0.95Å | |
| CB1 | CG1 | sing | 1.53Å | 1.56Å | |
| CB1 | HB11 | sing | 1.09Å | 1.11Å | |
| CB1 | HB12 | sing | 1.09Å | 1.11Å | |
| N1 | HN11 | sing | 1.01Å | 1.02Å | |
| N1 | HN12 | sing | 1.01Å | 1.02Å | |
| CG1 | CD1 | sing | 1.51Å | 1.54Å | |
| CG1 | HG11 | sing | 1.09Å | 1.12Å | |
| CG1 | HG12 | sing | 1.09Å | 1.12Å | |
| CD1 | OD1 | doub | 1.21Å | 1.23Å | |
| CD1 | N2 | sing | 1.35Å | 1.34Å | |
| N2 | CA2 | sing | 1.46Å | 1.46Å | |
| N2 | H2 | sing | 0.97Å | 1.02Å | |
| CA2 | C2 | sing | 1.51Å | 1.53Å | |
| CA2 | CB2 | sing | 1.53Å | 1.53Å | |
| CA2 | HA2 | sing | 1.09Å | 1.12Å | |
| C2 | O2 | doub | 1.21Å | 1.24Å | |
| C2 | N3 | sing | 1.35Å | 1.35Å | |
| CB2 | SG2 | sing | 1.81Å | 1.83Å | |
| CB2 | HB21 | sing | 1.09Å | 1.12Å | |
| CB2 | HB22 | sing | 1.09Å | 1.12Å | |
| SG2 | HG2 | sing | 1.34Å | 0.95Å | |
| N3 | CA3 | sing | 1.46Å | 1.46Å | |
| N3 | H3 | sing | 0.97Å | 1.02Å | |
| CA3 | C3 | sing | 1.51Å | 1.52Å | |
| CA3 | HA31 | sing | 1.09Å | 1.12Å | |
| CA3 | HA32 | sing | 1.09Å | 1.11Å | |
| C3 | O3 | doub | 1.21Å | 1.23Å | |
| C3 | N1S | sing | 1.35Å | 1.34Å | |
| N1S | C2S | sing | 1.46Å | 1.46Å | |
| N1S | HNS1 | sing | 0.97Å | 1.02Å | |
| C2S | C3S | sing | 1.53Å | 1.54Å | |
| C2S | H2S1 | sing | 1.09Å | 1.11Å | |
| C2S | H2S2 | sing | 1.09Å | 1.11Å | |
| C3S | C4S | sing | 1.53Å | 1.54Å | |
| C3S | H3S1 | sing | 1.09Å | 1.11Å | |
| C3S | H3S2 | sing | 1.09Å | 1.11Å | |
| C4S | C5S | sing | 1.53Å | 1.54Å | |
| C4S | H4S1 | sing | 1.09Å | 1.12Å | |
| C4S | H4S2 | sing | 1.09Å | 1.12Å | |
| C5S | N6S | sing | 1.47Å | 1.46Å | |
| C5S | H5S1 | sing | 1.09Å | 1.12Å | |
| C5S | H5S2 | sing | 1.09Å | 1.11Å | |
| C7S | N6S | sing | 1.47Å | 1.46Å | |
| C7S | C8S | sing | 1.53Å | 1.53Å | |
| C7S | H7S1 | sing | 1.09Å | 1.12Å | |
| C7S | H7S2 | sing | 1.09Å | 1.12Å | |
| N6S | HNS6 | sing | 1.01Å | 1.02Å | |
| C8S | C9S | sing | 1.53Å | 1.56Å | |
| C8S | H8S1 | sing | 1.09Å | 1.11Å | |
| C8S | H8S2 | sing | 1.09Å | 1.12Å | |
| C9S | N11 | sing | 1.47Å | 1.47Å | |
| C9S | H9S1 | sing | 1.09Å | 1.12Å | |
| C9S | H9S2 | sing | 1.09Å | 1.11Å | |
| N11 | C5 | sing | 1.35Å | 1.35Å | |
| N11 | H10S | sing | 0.97Å | 1.02Å | |
| C5 | CA5 | sing | 1.51Å | 1.52Å | |
| C5 | O5 | doub | 1.21Å | 1.24Å | |
| N5 | CA5 | sing | 1.47Å | 1.45Å | |
| N5 | C6 | sing | 1.35Å | 1.32Å | |
| N5 | H5 | sing | 0.97Å | 1.02Å | |
| CA5 | HA51 | sing | 1.09Å | 1.12Å | |
| CA5 | HA52 | sing | 1.09Å | 1.11Å | |
| C6 | CA6 | sing | 1.51Å | 1.52Å | |
| C6 | O6 | doub | 1.21Å | 1.23Å | |
| N6 | CA6 | sing | 1.46Å | 1.46Å | |
| N6 | CD7 | sing | 1.35Å | 1.35Å | |
| N6 | H6 | sing | 0.97Å | 1.02Å | |
| CA6 | CB6 | sing | 1.53Å | 1.49Å | |
| CA6 | HA6 | sing | 1.09Å | 1.11Å | |
| CB6 | SG6 | sing | 1.81Å | 1.83Å | |
| CB6 | HB61 | sing | 1.09Å | 1.12Å | |
| CB6 | HB62 | sing | 1.09Å | 1.12Å | |
| SG6 | HG6 | sing | 1.34Å | 0.95Å | |
| CD7 | CG7 | sing | 1.51Å | 1.53Å | |
| CD7 | OD7 | doub | 1.21Å | 1.23Å | |
| C7 | CA7 | sing | 1.51Å | 1.53Å | |
| C7 | O17 | sing | 1.34Å | 1.23Å | |
| C7 | O27 | doub | 1.21Å | 1.24Å | |
| CA7 | CB7 | sing | 1.53Å | 1.53Å | |
| CA7 | N7 | sing | 1.47Å | 1.49Å | |
| CA7 | HA7 | sing | 1.09Å | 1.11Å | |
| O17 | HO17 | sing | 0.97Å | 0.95Å | |
| CB7 | CG7 | sing | 1.53Å | 1.51Å | |
| CB7 | HB71 | sing | 1.09Å | 1.12Å | |
| CB7 | HB72 | sing | 1.09Å | 1.11Å | |
| N7 | HN71 | sing | 1.01Å | 1.02Å | |
| N7 | HN72 | sing | 1.01Å | 1.02Å | |
| CG7 | HG71 | sing | 1.09Å | 1.11Å | |
| CG7 | HG72 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CA1 | C1 | O11 | 116.5° | 120.0° |
| CA1 | C1 | O21 | 120.9° | 120.0° |
| C1 | CA1 | CB1 | 111.5° | 109.5° |
| C1 | CA1 | N1 | 99.2° | 109.5° |
| C1 | CA1 | HA1 | 115.3° | 109.4° |
| O11 | C1 | O21 | 122.6° | 120.0° |
| C1 | O11 | HO11 | 116.5° | 120.0° |
| CB1 | CA1 | N1 | 110.9° | 109.5° |
| CB1 | CA1 | HA1 | 104.4° | 109.5° |
| CA1 | CB1 | CG1 | 114.8° | 109.5° |
| CA1 | CB1 | HB11 | 110.2° | 109.5° |
| CA1 | CB1 | HB12 | 110.3° | 109.5° |
| N1 | CA1 | HA1 | 115.8° | 109.4° |
| CA1 | N1 | HN11 | 99.2° | 106.7° |
| CA1 | N1 | HN12 | 116.2° | 106.7° |
| CG1 | CB1 | HB11 | 110.2° | 109.4° |
| CG1 | CB1 | HB12 | 110.2° | 109.4° |
| CB1 | CG1 | CD1 | 113.4° | 109.6° |
| CB1 | CG1 | HG11 | 110.8° | 109.4° |
| CB1 | CG1 | HG12 | 110.8° | 109.5° |
| HB11 | CB1 | HB12 | 100.1° | 109.5° |
| HN11 | N1 | HN12 | 116.1° | 106.6° |
| CD1 | CG1 | HG11 | 110.8° | 109.5° |
| CD1 | CG1 | HG12 | 110.8° | 109.5° |
| CG1 | CD1 | OD1 | 120.2° | 119.9° |
| CG1 | CD1 | N2 | 117.5° | 120.1° |
| HG11 | CG1 | HG12 | 99.5° | 109.4° |
| OD1 | CD1 | N2 | 122.3° | 120.0° |
| CD1 | N2 | CA2 | 120.3° | 120.0° |
| CD1 | N2 | H2 | 115.5° | 120.0° |
| CA2 | N2 | H2 | 124.2° | 120.0° |
| N2 | CA2 | C2 | 108.1° | 109.5° |
| N2 | CA2 | CB2 | 110.3° | 109.5° |
| N2 | CA2 | HA2 | 110.1° | 109.5° |
| C2 | CA2 | CB2 | 110.3° | 109.5° |
| C2 | CA2 | HA2 | 110.2° | 109.4° |
| CA2 | C2 | O2 | 119.9° | 120.0° |
| CA2 | C2 | N3 | 116.7° | 120.1° |
| CB2 | CA2 | HA2 | 107.9° | 109.4° |
| CA2 | CB2 | SG2 | 115.5° | 109.5° |
| CA2 | CB2 | HB21 | 110.0° | 109.4° |
| CA2 | CB2 | HB22 | 110.0° | 109.5° |
| O2 | C2 | N3 | 123.4° | 119.9° |
| C2 | N3 | CA3 | 121.5° | 120.1° |
| C2 | N3 | H3 | 115.3° | 120.0° |
| SG2 | CB2 | HB21 | 110.0° | 109.4° |
| SG2 | CB2 | HB22 | 110.0° | 109.5° |
| CB2 | SG2 | HG2 | 115.4° | 100.0° |
| HB21 | CB2 | HB22 | 100.2° | 109.5° |
| CA3 | N3 | H3 | 123.2° | 120.0° |
| N3 | CA3 | C3 | 116.3° | 109.5° |
| N3 | CA3 | HA31 | 109.7° | 109.4° |
| N3 | CA3 | HA32 | 109.7° | 109.5° |
| C3 | CA3 | HA31 | 109.7° | 109.5° |
| C3 | CA3 | HA32 | 109.8° | 109.4° |
| CA3 | C3 | O3 | 120.9° | 120.0° |
| CA3 | C3 | N1S | 116.5° | 120.0° |
| HA31 | CA3 | HA32 | 100.5° | 109.5° |
| O3 | C3 | N1S | 122.5° | 120.0° |
| C3 | N1S | C2S | 124.2° | 120.0° |
| C3 | N1S | HNS1 | 113.3° | 120.0° |
| C2S | N1S | HNS1 | 122.5° | 120.0° |
| N1S | C2S | C3S | 120.3° | 109.5° |
| N1S | C2S | H2S1 | 108.3° | 109.5° |
| N1S | C2S | H2S2 | 108.3° | 109.5° |
| C3S | C2S | H2S1 | 108.4° | 109.5° |
| C3S | C2S | H2S2 | 108.3° | 109.4° |
| C2S | C3S | C4S | 125.3° | 109.6° |
| C2S | C3S | H3S1 | 106.7° | 109.5° |
| C2S | C3S | H3S2 | 106.7° | 109.5° |
| H2S1 | C2S | H2S2 | 101.6° | 109.4° |
| C4S | C3S | H3S1 | 106.6° | 109.4° |
| C4S | C3S | H3S2 | 106.6° | 109.4° |
| C3S | C4S | C5S | 119.5° | 109.5° |
| C3S | C4S | H4S1 | 108.7° | 109.5° |
| C3S | C4S | H4S2 | 108.6° | 109.4° |
| H3S1 | C3S | H3S2 | 103.0° | 109.4° |
| C5S | C4S | H4S1 | 108.6° | 109.5° |
| C5S | C4S | H4S2 | 108.6° | 109.5° |
| C4S | C5S | N6S | 112.6° | 109.5° |
| C4S | C5S | H5S1 | 111.0° | 109.4° |
| C4S | C5S | H5S2 | 111.1° | 109.4° |
| H4S1 | C4S | H4S2 | 101.4° | 109.4° |
| N6S | C5S | H5S1 | 111.0° | 109.5° |
| N6S | C5S | H5S2 | 111.0° | 109.5° |
| C5S | N6S | C7S | 112.3° | 106.7° |
| C5S | N6S | HNS6 | 111.2° | 106.7° |
| H5S1 | C5S | H5S2 | 99.2° | 109.5° |
| N6S | C7S | C8S | 117.0° | 109.5° |
| N6S | C7S | H7S1 | 109.5° | 109.5° |
| N6S | C7S | H7S2 | 109.6° | 109.4° |
| C7S | N6S | HNS6 | 111.2° | 106.7° |
| C8S | C7S | H7S1 | 109.5° | 109.5° |
| C8S | C7S | H7S2 | 109.5° | 109.4° |
| C7S | C8S | C9S | 112.8° | 109.5° |
| C7S | C8S | H8S1 | 111.0° | 109.5° |
| C7S | C8S | H8S2 | 111.0° | 109.4° |
| H7S1 | C7S | H7S2 | 100.6° | 109.4° |
| C9S | C8S | H8S1 | 110.9° | 109.5° |
| C9S | C8S | H8S2 | 110.9° | 109.5° |
| C8S | C9S | N11 | 121.6° | 109.5° |
| C8S | C9S | H9S1 | 107.9° | 109.4° |
| C8S | C9S | H9S2 | 107.9° | 109.5° |
| H8S1 | C8S | H8S2 | 99.4° | 109.4° |
| N11 | C9S | H9S1 | 107.8° | 109.4° |
| N11 | C9S | H9S2 | 107.9° | 109.5° |
| C9S | N11 | C5 | 124.2° | 120.0° |
| C9S | N11 | H10S | 122.4° | 120.0° |
| H9S1 | C9S | H9S2 | 102.0° | 109.4° |
| C5 | N11 | H10S | 113.3° | 120.1° |
| N11 | C5 | CA5 | 117.7° | 120.0° |
| N11 | C5 | O5 | 123.0° | 120.0° |
| CA5 | C5 | O5 | 119.3° | 120.0° |
| C5 | CA5 | N5 | 104.1° | 109.4° |
| C5 | CA5 | HA51 | 114.3° | 109.4° |
| C5 | CA5 | HA52 | 114.2° | 109.5° |
| CA5 | N5 | C6 | 123.5° | 120.0° |
| CA5 | N5 | H5 | 123.0° | 120.0° |
| N5 | CA5 | HA51 | 114.2° | 109.5° |
| N5 | CA5 | HA52 | 114.3° | 109.5° |
| C6 | N5 | H5 | 113.4° | 120.0° |
| N5 | C6 | CA6 | 112.8° | 120.0° |
| N5 | C6 | O6 | 124.1° | 120.0° |
| HA51 | CA5 | HA52 | 96.2° | 109.5° |
| CA6 | C6 | O6 | 123.1° | 120.0° |
| C6 | CA6 | N6 | 113.3° | 109.5° |
| C6 | CA6 | CB6 | 110.1° | 109.4° |
| C6 | CA6 | HA6 | 107.4° | 109.5° |
| CA6 | N6 | CD7 | 117.1° | 120.0° |
| CA6 | N6 | H6 | 125.1° | 120.0° |
| N6 | CA6 | CB6 | 112.4° | 109.5° |
| N6 | CA6 | HA6 | 104.8° | 109.5° |
| CD7 | N6 | H6 | 117.8° | 119.9° |
| N6 | CD7 | CG7 | 117.4° | 120.1° |
| N6 | CD7 | OD7 | 122.5° | 120.0° |
| CB6 | CA6 | HA6 | 108.4° | 109.4° |
| CA6 | CB6 | SG6 | 111.8° | 109.5° |
| CA6 | CB6 | HB61 | 111.4° | 109.5° |
| CA6 | CB6 | HB62 | 111.4° | 109.4° |
| SG6 | CB6 | HB61 | 111.4° | 109.4° |
| SG6 | CB6 | HB62 | 111.4° | 109.4° |
| CB6 | SG6 | HG6 | 111.7° | 100.0° |
| HB61 | CB6 | HB62 | 98.9° | 109.5° |
| CG7 | CD7 | OD7 | 120.1° | 119.9° |
| CD7 | CG7 | CB7 | 114.1° | 109.6° |
| CD7 | CG7 | HG71 | 110.6° | 109.4° |
| CD7 | CG7 | HG72 | 110.5° | 109.5° |
| CA7 | C7 | O17 | 119.3° | 120.0° |
| CA7 | C7 | O27 | 117.9° | 120.0° |
| C7 | CA7 | CB7 | 110.1° | 109.5° |
| C7 | CA7 | N7 | 103.1° | 109.5° |
| C7 | CA7 | HA7 | 113.4° | 109.5° |
| O17 | C7 | O27 | 122.8° | 120.0° |
| C7 | O17 | HO17 | 119.3° | 120.0° |
| CB7 | CA7 | N7 | 110.3° | 109.4° |
| CB7 | CA7 | HA7 | 106.7° | 109.5° |
| CA7 | CB7 | CG7 | 114.3° | 109.5° |
| CA7 | CB7 | HB71 | 110.4° | 109.4° |
| CA7 | CB7 | HB72 | 110.4° | 109.5° |
| N7 | CA7 | HA7 | 113.3° | 109.5° |
| CA7 | N7 | HN71 | 103.1° | 106.7° |
| CA7 | N7 | HN72 | 114.6° | 106.7° |
| CG7 | CB7 | HB71 | 110.5° | 109.4° |
| CG7 | CB7 | HB72 | 110.5° | 109.5° |
| CB7 | CG7 | HG71 | 110.5° | 109.4° |
| CB7 | CG7 | HG72 | 110.5° | 109.5° |
| HB71 | CB7 | HB72 | 99.8° | 109.5° |
| HN71 | N7 | HN72 | 114.7° | 106.7° |
| HG71 | CG7 | HG72 | 99.8° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CA1 | C1 | O11 | O21 | 178.3° | 179.9° |
| C1 | CA1 | CB1 | N1 | 109.5° | 120.0° |
| C1 | CA1 | CB1 | HA1 | 125.1° | 120.0° |
| C1 | CA1 | N1 | HA1 | 123.9° | 119.9° |
| CA1 | C1 | O11 | HO11 | 180.0° | 180.0° |
| C1 | CA1 | CB1 | CG1 | 165.8° | 180.0° |
| C1 | CA1 | CB1 | HB11 | 40.6° | 60.0° |
| C1 | CA1 | CB1 | HB12 | 69.0° | 60.0° |
| C1 | CA1 | N1 | HN11 | 180.0° | 60.1° |
| C1 | CA1 | N1 | HN12 | 54.8° | 173.8° |
| O11 | C1 | CA1 | CB1 | 166.2° | 90.0° |
| O11 | C1 | CA1 | N1 | 76.9° | 150.0° |
| O11 | C1 | CA1 | HA1 | 47.4° | 30.1° |
| O21 | C1 | CA1 | CB1 | 15.5° | 90.0° |
| O21 | C1 | CA1 | N1 | 101.4° | 30.1° |
| O21 | C1 | CA1 | HA1 | 134.3° | 150.0° |
| O21 | C1 | O11 | HO11 | 1.7° | 0.1° |
| CB1 | CA1 | N1 | HA1 | 118.7° | 120.0° |
| CA1 | CB1 | CG1 | HB11 | 125.2° | 120.1° |
| CA1 | CB1 | CG1 | HB12 | 125.3° | 120.0° |
| CA1 | CB1 | HB11 | HB12 | 116.1° | 120.1° |
| CB1 | CA1 | N1 | HN11 | 62.7° | 59.9° |
| CB1 | CA1 | N1 | HN12 | 62.6° | 53.7° |
| CA1 | CB1 | CG1 | CD1 | 172.2° | 180.0° |
| CA1 | CB1 | CG1 | HG11 | 46.9° | 59.9° |
| CA1 | CB1 | CG1 | HG12 | 62.5° | 59.9° |
| N1 | CA1 | CB1 | CG1 | 56.3° | 60.0° |
| N1 | CA1 | CB1 | HB11 | 69.0° | 60.0° |
| N1 | CA1 | CB1 | HB12 | 178.5° | 180.0° |
| CA1 | N1 | HN11 | HN12 | 125.3° | 113.7° |
| HA1 | CA1 | CB1 | CG1 | 69.1° | 60.0° |
| HA1 | CA1 | CB1 | HB11 | 165.7° | 180.0° |
| HA1 | CA1 | CB1 | HB12 | 56.1° | 60.0° |
| HA1 | CA1 | N1 | HN11 | 56.0° | 180.0° |
| HA1 | CA1 | N1 | HN12 | 178.7° | 66.3° |
| CG1 | CB1 | HB11 | HB12 | 116.1° | 119.9° |
| CB1 | CG1 | CD1 | HG11 | 125.3° | 120.0° |
| CB1 | CG1 | CD1 | HG12 | 125.3° | 120.1° |
| CB1 | CG1 | HG11 | HG12 | 116.6° | 119.9° |
| CB1 | CG1 | CD1 | OD1 | 83.8° | 0.1° |
| CB1 | CG1 | CD1 | N2 | 98.6° | 180.0° |
| HB11 | CB1 | CG1 | CD1 | 62.6° | 60.0° |
| HB11 | CB1 | CG1 | HG11 | 172.1° | 180.0° |
| HB11 | CB1 | CG1 | HG12 | 62.7° | 60.1° |
| HB12 | CB1 | CG1 | CD1 | 47.0° | 59.9° |
| HB12 | CB1 | CG1 | HG11 | 78.3° | 60.1° |
| HB12 | CB1 | CG1 | HG12 | 172.2° | 179.9° |
| CD1 | CG1 | HG11 | HG12 | 116.6° | 120.0° |
| CG1 | CD1 | OD1 | N2 | 177.5° | 179.9° |
| CG1 | CD1 | N2 | CA2 | 179.4° | 179.9° |
| CG1 | CD1 | N2 | H2 | 0.6° | 0.1° |
| HG11 | CG1 | CD1 | OD1 | 41.5° | 120.1° |
| HG11 | CG1 | CD1 | N2 | 136.1° | 60.1° |
| HG12 | CG1 | CD1 | OD1 | 150.9° | 120.0° |
| HG12 | CG1 | CD1 | N2 | 26.7° | 59.9° |
| OD1 | CD1 | N2 | CA2 | 3.1° | 0.1° |
| OD1 | CD1 | N2 | H2 | 176.9° | 179.9° |
| CD1 | N2 | CA2 | H2 | 180.0° | 180.0° |
| CD1 | N2 | CA2 | C2 | 118.1° | 150.0° |
| CD1 | N2 | CA2 | CB2 | 121.2° | 89.9° |
| CD1 | N2 | CA2 | HA2 | 2.3° | 30.0° |
| N2 | CA2 | C2 | CB2 | 120.7° | 120.0° |
| N2 | CA2 | C2 | HA2 | 120.3° | 120.0° |
| N2 | CA2 | CB2 | HA2 | 120.3° | 120.0° |
| N2 | CA2 | C2 | O2 | 67.4° | 0.0° |
| N2 | CA2 | C2 | N3 | 112.3° | 180.0° |
| N2 | CA2 | CB2 | SG2 | 129.4° | 59.9° |
| N2 | CA2 | CB2 | HB21 | 4.1° | 60.0° |
| N2 | CA2 | CB2 | HB22 | 105.3° | 180.0° |
| H2 | N2 | CA2 | C2 | 61.9° | 30.0° |
| H2 | N2 | CA2 | CB2 | 58.7° | 90.1° |
| H2 | N2 | CA2 | HA2 | 177.7° | 150.0° |
| C2 | CA2 | CB2 | HA2 | 120.4° | 119.9° |
| CA2 | C2 | O2 | N3 | 179.6° | 179.9° |
| C2 | CA2 | CB2 | SG2 | 111.3° | 180.0° |
| C2 | CA2 | CB2 | HB21 | 123.5° | 60.1° |
| C2 | CA2 | CB2 | HB22 | 14.0° | 59.9° |
| CA2 | C2 | N3 | CA3 | 178.7° | 180.0° |
| CA2 | C2 | N3 | H3 | 1.3° | 0.0° |
| CB2 | CA2 | C2 | O2 | 53.3° | 120.0° |
| CB2 | CA2 | C2 | N3 | 127.0° | 59.9° |
| CA2 | CB2 | SG2 | HB21 | 125.3° | 119.9° |
| CA2 | CB2 | SG2 | HB22 | 125.3° | 120.1° |
| CA2 | CB2 | HB21 | HB22 | 115.8° | 120.0° |
| CA2 | CB2 | SG2 | HG2 | 180.0° | 180.0° |
| HA2 | CA2 | C2 | O2 | 172.3° | 120.1° |
| HA2 | CA2 | C2 | N3 | 8.1° | 60.0° |
| HA2 | CA2 | CB2 | SG2 | 9.1° | 60.1° |
| HA2 | CA2 | CB2 | HB21 | 116.1° | 180.0° |
| HA2 | CA2 | CB2 | HB22 | 134.4° | 60.0° |
| O2 | C2 | N3 | CA3 | 1.0° | 0.0° |
| O2 | C2 | N3 | H3 | 179.0° | 179.9° |
| C2 | N3 | CA3 | H3 | 180.0° | 180.0° |
| C2 | N3 | CA3 | C3 | 55.3° | 180.0° |
| C2 | N3 | CA3 | HA31 | 69.9° | 60.0° |
| C2 | N3 | CA3 | HA32 | 179.4° | 60.0° |
| SG2 | CB2 | HB21 | HB22 | 115.8° | 120.0° |
| HB21 | CB2 | SG2 | HG2 | 54.7° | 60.0° |
| HB22 | CB2 | SG2 | HG2 | 54.7° | 59.9° |
| N3 | CA3 | C3 | HA31 | 125.3° | 120.0° |
| N3 | CA3 | C3 | HA32 | 125.2° | 120.0° |
| N3 | CA3 | HA31 | HA32 | 115.5° | 120.0° |
| N3 | CA3 | C3 | O3 | 15.1° | 0.0° |
| N3 | CA3 | C3 | N1S | 163.7° | 180.0° |
| H3 | N3 | CA3 | C3 | 124.7° | 0.1° |
| H3 | N3 | CA3 | HA31 | 110.0° | 120.0° |
| H3 | N3 | CA3 | HA32 | 0.5° | 120.0° |
| C3 | CA3 | HA31 | HA32 | 115.6° | 120.0° |
| CA3 | C3 | O3 | N1S | 178.7° | 179.9° |
| CA3 | C3 | N1S | C2S | 179.1° | 180.0° |
| CA3 | C3 | N1S | HNS1 | 0.9° | 0.0° |
| HA31 | CA3 | C3 | O3 | 140.3° | 119.9° |
| HA31 | CA3 | C3 | N1S | 38.5° | 60.0° |
| HA32 | CA3 | C3 | O3 | 110.2° | 120.0° |
| HA32 | CA3 | C3 | N1S | 71.0° | 60.0° |
| O3 | C3 | N1S | C2S | 2.1° | 0.0° |
| O3 | C3 | N1S | HNS1 | 177.8° | 179.9° |
| C3 | N1S | C2S | HNS1 | 180.0° | 180.0° |
| C3 | N1S | C2S | C3S | 100.0° | 180.0° |
| C3 | N1S | C2S | H2S1 | 134.8° | 60.0° |
| C3 | N1S | C2S | H2S2 | 25.3° | 60.0° |
| N1S | C2S | C3S | H2S1 | 125.3° | 120.1° |
| N1S | C2S | C3S | H2S2 | 125.2° | 120.0° |
| N1S | C2S | H2S1 | H2S2 | 114.0° | 120.0° |
| N1S | C2S | C3S | C4S | 66.4° | 180.0° |
| N1S | C2S | C3S | H3S1 | 58.8° | 60.0° |
| N1S | C2S | C3S | H3S2 | 168.3° | 60.0° |
| HNS1 | N1S | C2S | C3S | 80.0° | 0.0° |
| HNS1 | N1S | C2S | H2S1 | 45.3° | 120.1° |
| HNS1 | N1S | C2S | H2S2 | 154.8° | 120.0° |
| C3S | C2S | H2S1 | H2S2 | 114.0° | 119.9° |
| C2S | C3S | C4S | H3S1 | 125.3° | 120.1° |
| C2S | C3S | C4S | H3S2 | 125.3° | 120.0° |
| C2S | C3S | H3S1 | H3S2 | 112.1° | 120.0° |
| C2S | C3S | C4S | C5S | 57.5° | 180.0° |
| C2S | C3S | C4S | H4S1 | 67.7° | 59.9° |
| C2S | C3S | C4S | H4S2 | 177.2° | 60.0° |
| H2S1 | C2S | C3S | C4S | 168.3° | 59.9° |
| H2S1 | C2S | C3S | H3S1 | 66.5° | 180.0° |
| H2S1 | C2S | C3S | H3S2 | 43.1° | 60.1° |
| H2S2 | C2S | C3S | C4S | 58.8° | 60.0° |
| H2S2 | C2S | C3S | H3S1 | 176.0° | 60.1° |
| H2S2 | C2S | C3S | H3S2 | 66.4° | 180.0° |
| C4S | C3S | H3S1 | H3S2 | 112.0° | 119.9° |
| C3S | C4S | C5S | H4S1 | 125.3° | 120.1° |
| C3S | C4S | C5S | H4S2 | 125.3° | 120.0° |
| C3S | C4S | H4S1 | H4S2 | 114.3° | 119.9° |
| C3S | C4S | C5S | N6S | 80.9° | 180.0° |
| C3S | C4S | C5S | H5S1 | 153.8° | 60.0° |
| C3S | C4S | C5S | H5S2 | 44.4° | 60.0° |
| H3S1 | C3S | C4S | C5S | 177.2° | 59.9° |
| H3S1 | C3S | C4S | H4S1 | 57.5° | 180.0° |
| H3S1 | C3S | C4S | H4S2 | 52.0° | 60.1° |
| H3S2 | C3S | C4S | C5S | 67.7° | 60.0° |
| H3S2 | C3S | C4S | H4S1 | 167.0° | 60.1° |
| H3S2 | C3S | C4S | H4S2 | 57.5° | 180.0° |
| C5S | C4S | H4S1 | H4S2 | 114.3° | 120.0° |
| C4S | C5S | N6S | H5S1 | 125.3° | 120.0° |
| C4S | C5S | N6S | H5S2 | 125.3° | 120.0° |
| C4S | C5S | H5S1 | H5S2 | 117.0° | 119.9° |
| C4S | C5S | N6S | C7S | 148.0° | 180.0° |
| C4S | C5S | N6S | HNS6 | 22.7° | 66.2° |
| H4S1 | C4S | C5S | N6S | 44.4° | 59.9° |
| H4S1 | C4S | C5S | H5S1 | 80.8° | 180.0° |
| H4S1 | C4S | C5S | H5S2 | 169.7° | 60.1° |
| H4S2 | C4S | C5S | N6S | 153.8° | 60.0° |
| H4S2 | C4S | C5S | H5S1 | 28.6° | 60.0° |
| H4S2 | C4S | C5S | H5S2 | 80.9° | 180.0° |
| N6S | C5S | H5S1 | H5S2 | 116.9° | 120.1° |
| C5S | N6S | C7S | HNS6 | 125.2° | 113.8° |
| C5S | N6S | C7S | C8S | 79.1° | 180.0° |
| C5S | N6S | C7S | H7S1 | 155.6° | 59.9° |
| C5S | N6S | C7S | H7S2 | 46.1° | 60.0° |
| H5S1 | C5S | N6S | C7S | 22.7° | 60.0° |
| H5S1 | C5S | N6S | HNS6 | 102.5° | 173.8° |
| H5S2 | C5S | N6S | C7S | 86.7° | 60.0° |
| H5S2 | C5S | N6S | HNS6 | 148.0° | 53.7° |
| N6S | C7S | C8S | H7S1 | 125.3° | 120.1° |
| N6S | C7S | C8S | H7S2 | 125.3° | 120.0° |
| N6S | C7S | H7S1 | H7S2 | 115.3° | 120.0° |
| N6S | C7S | C8S | C9S | 172.9° | 180.0° |
| N6S | C7S | C8S | H8S1 | 47.7° | 59.9° |
| N6S | C7S | C8S | H8S2 | 61.9° | 60.0° |
| C8S | C7S | H7S1 | H7S2 | 115.2° | 119.9° |
| C8S | C7S | N6S | HNS6 | 155.6° | 66.2° |
| C7S | C8S | C9S | H8S1 | 125.2° | 120.1° |
| C7S | C8S | C9S | H8S2 | 125.3° | 120.0° |
| C7S | C8S | H8S1 | H8S2 | 116.9° | 119.9° |
| C7S | C8S | C9S | N11 | 74.0° | 180.0° |
| C7S | C8S | C9S | H9S1 | 51.3° | 60.0° |
| C7S | C8S | C9S | H9S2 | 160.8° | 60.0° |
| H7S1 | C7S | N6S | HNS6 | 30.3° | 173.7° |
| H7S1 | C7S | C8S | C9S | 61.8° | 59.9° |
| H7S1 | C7S | C8S | H8S1 | 173.0° | 180.0° |
| H7S1 | C7S | C8S | H8S2 | 63.4° | 60.1° |
| H7S2 | C7S | N6S | HNS6 | 79.1° | 53.8° |
| H7S2 | C7S | C8S | C9S | 47.6° | 60.0° |
| H7S2 | C7S | C8S | H8S1 | 77.6° | 60.1° |
| H7S2 | C7S | C8S | H8S2 | 172.8° | 180.0° |
| C9S | C8S | H8S1 | H8S2 | 116.8° | 120.0° |
| C8S | C9S | N11 | H9S1 | 125.3° | 120.0° |
| C8S | C9S | N11 | H9S2 | 125.3° | 120.1° |
| C8S | C9S | H9S1 | H9S2 | 113.5° | 120.0° |
| C8S | C9S | N11 | C5 | 70.8° | 180.0° |
| C8S | C9S | N11 | H10S | 109.2° | 0.1° |
| H8S1 | C8S | C9S | N11 | 160.8° | 60.0° |
| H8S1 | C8S | C9S | H9S1 | 74.0° | 179.9° |
| H8S1 | C8S | C9S | H9S2 | 35.5° | 60.1° |
| H8S2 | C8S | C9S | N11 | 51.3° | 60.0° |
| H8S2 | C8S | C9S | H9S1 | 176.5° | 60.0° |
| H8S2 | C8S | C9S | H9S2 | 74.0° | 179.9° |
| N11 | C9S | H9S1 | H9S2 | 113.4° | 120.0° |
| C9S | N11 | C5 | H10S | 180.0° | 179.9° |
| C9S | N11 | C5 | CA5 | 179.8° | 180.0° |
| C9S | N11 | C5 | O5 | 1.8° | 0.1° |
| H9S1 | C9S | N11 | C5 | 54.4° | 60.0° |
| H9S1 | C9S | N11 | H10S | 125.5° | 119.9° |
| H9S2 | C9S | N11 | C5 | 163.9° | 59.9° |
| H9S2 | C9S | N11 | H10S | 16.1° | 120.1° |
| N11 | C5 | CA5 | O5 | 178.5° | 179.9° |
| N11 | C5 | CA5 | N5 | 162.0° | 180.0° |
| N11 | C5 | CA5 | HA51 | 72.7° | 60.1° |
| N11 | C5 | CA5 | HA52 | 36.7° | 60.0° |
| H10S | N11 | C5 | CA5 | 0.2° | 0.0° |
| H10S | N11 | C5 | O5 | 178.3° | 179.9° |
| C5 | CA5 | N5 | HA51 | 125.3° | 119.9° |
| C5 | CA5 | N5 | HA52 | 125.3° | 120.0° |
| C5 | CA5 | N5 | C6 | 148.1° | 180.0° |
| C5 | CA5 | N5 | H5 | 31.9° | 0.0° |
| C5 | CA5 | HA51 | HA52 | 120.1° | 120.0° |
| O5 | C5 | CA5 | N5 | 16.5° | 0.1° |
| O5 | C5 | CA5 | HA51 | 108.8° | 120.0° |
| O5 | C5 | CA5 | HA52 | 141.8° | 119.9° |
| CA5 | N5 | C6 | H5 | 180.0° | 180.0° |
| N5 | CA5 | HA51 | HA52 | 120.1° | 120.0° |
| CA5 | N5 | C6 | CA6 | 178.7° | 180.0° |
| CA5 | N5 | C6 | O6 | 1.2° | 0.0° |
| C6 | N5 | CA5 | HA51 | 22.8° | 60.0° |
| C6 | N5 | CA5 | HA52 | 86.6° | 60.0° |
| N5 | C6 | CA6 | O6 | 179.8° | 180.0° |
| N5 | C6 | CA6 | N6 | 126.0° | 180.0° |
| N5 | C6 | CA6 | CB6 | 107.1° | 60.0° |
| N5 | C6 | CA6 | HA6 | 10.8° | 59.9° |
| H5 | N5 | CA5 | HA51 | 157.2° | 120.0° |
| H5 | N5 | CA5 | HA52 | 93.4° | 120.0° |
| H5 | N5 | C6 | CA6 | 1.3° | 0.0° |
| H5 | N5 | C6 | O6 | 178.9° | 180.0° |
| C6 | CA6 | N6 | CB6 | 125.6° | 119.9° |
| C6 | CA6 | N6 | HA6 | 116.8° | 120.1° |
| C6 | CA6 | N6 | CD7 | 154.5° | 150.1° |
| C6 | CA6 | N6 | H6 | 25.5° | 30.0° |
| C6 | CA6 | CB6 | HA6 | 117.3° | 120.0° |
| C6 | CA6 | CB6 | SG6 | 96.8° | 180.0° |
| C6 | CA6 | CB6 | HB61 | 137.9° | 60.0° |
| C6 | CA6 | CB6 | HB62 | 28.5° | 60.0° |
| O6 | C6 | CA6 | N6 | 53.8° | 0.0° |
| O6 | C6 | CA6 | CB6 | 73.1° | 120.0° |
| O6 | C6 | CA6 | HA6 | 169.1° | 120.1° |
| CA6 | N6 | CD7 | H6 | 180.0° | 179.9° |
| N6 | CA6 | CB6 | HA6 | 115.4° | 120.0° |
| N6 | CA6 | CB6 | SG6 | 135.9° | 60.0° |
| N6 | CA6 | CB6 | HB61 | 10.6° | 60.0° |
| N6 | CA6 | CB6 | HB62 | 98.8° | 180.0° |
| CA6 | N6 | CD7 | CG7 | 177.9° | 180.0° |
| CA6 | N6 | CD7 | OD7 | 3.6° | 0.0° |
| CD7 | N6 | CA6 | CB6 | 79.9° | 90.0° |
| CD7 | N6 | CA6 | HA6 | 37.7° | 30.0° |
| N6 | CD7 | CG7 | OD7 | 178.5° | 180.0° |
| N6 | CD7 | CG7 | CB7 | 75.9° | 179.9° |
| N6 | CD7 | CG7 | HG71 | 158.8° | 60.0° |
| N6 | CD7 | CG7 | HG72 | 49.3° | 60.0° |
| H6 | N6 | CA6 | CB6 | 100.0° | 89.9° |
| H6 | N6 | CA6 | HA6 | 142.4° | 150.1° |
| H6 | N6 | CD7 | CG7 | 2.1° | 0.1° |
| H6 | N6 | CD7 | OD7 | 176.4° | 179.9° |
| CA6 | CB6 | SG6 | HB61 | 125.3° | 120.1° |
| CA6 | CB6 | SG6 | HB62 | 125.3° | 119.9° |
| CA6 | CB6 | HB61 | HB62 | 117.2° | 120.0° |
| CA6 | CB6 | SG6 | HG6 | 180.0° | 180.0° |
| HA6 | CA6 | CB6 | SG6 | 20.5° | 60.0° |
| HA6 | CA6 | CB6 | HB61 | 104.8° | 180.0° |
| HA6 | CA6 | CB6 | HB62 | 145.8° | 60.0° |
| SG6 | CB6 | HB61 | HB62 | 117.3° | 120.0° |
| HB61 | CB6 | SG6 | HG6 | 54.7° | 59.9° |
| HB62 | CB6 | SG6 | HG6 | 54.7° | 60.0° |
| CD7 | CG7 | CB7 | CA7 | 81.5° | 180.0° |
| CD7 | CG7 | CB7 | HG71 | 125.3° | 119.9° |
| CD7 | CG7 | CB7 | HG72 | 125.2° | 120.1° |
| CD7 | CG7 | CB7 | HB71 | 153.2° | 60.0° |
| CD7 | CG7 | CB7 | HB72 | 43.7° | 59.9° |
| CD7 | CG7 | HG71 | HG72 | 116.4° | 120.0° |
| OD7 | CD7 | CG7 | CB7 | 102.6° | 0.1° |
| OD7 | CD7 | CG7 | HG71 | 22.6° | 120.0° |
| OD7 | CD7 | CG7 | HG72 | 132.2° | 120.0° |
| CA7 | C7 | O17 | O27 | 179.3° | 180.0° |
| C7 | CA7 | CB7 | N7 | 113.1° | 120.0° |
| C7 | CA7 | CB7 | HA7 | 123.5° | 120.0° |
| C7 | CA7 | N7 | HA7 | 123.0° | 120.0° |
| CA7 | C7 | O17 | HO17 | 180.0° | 179.9° |
| C7 | CA7 | CB7 | CG7 | 162.8° | 180.0° |
| C7 | CA7 | CB7 | HB71 | 37.6° | 60.0° |
| C7 | CA7 | CB7 | HB72 | 71.8° | 60.0° |
| C7 | CA7 | N7 | HN71 | 180.0° | 60.0° |
| C7 | CA7 | N7 | HN72 | 54.7° | 173.7° |
| O17 | C7 | CA7 | CB7 | 29.2° | 90.1° |
| O17 | C7 | CA7 | N7 | 146.9° | 150.0° |
| O17 | C7 | CA7 | HA7 | 90.2° | 29.9° |
| O27 | C7 | CA7 | CB7 | 150.1° | 89.9° |
| O27 | C7 | CA7 | N7 | 32.4° | 30.0° |
| O27 | C7 | CA7 | HA7 | 90.5° | 150.0° |
| O27 | C7 | O17 | HO17 | 0.7° | 0.1° |
| CB7 | CA7 | N7 | HA7 | 119.5° | 120.0° |
| CA7 | CB7 | CG7 | HB71 | 125.3° | 120.0° |
| CA7 | CB7 | CG7 | HB72 | 125.2° | 120.1° |
| CA7 | CB7 | HB71 | HB72 | 116.2° | 120.0° |
| CB7 | CA7 | N7 | HN71 | 62.5° | 60.0° |
| CB7 | CA7 | N7 | HN72 | 62.9° | 53.8° |
| CA7 | CB7 | CG7 | HG71 | 153.2° | 60.1° |
| CA7 | CB7 | CG7 | HG72 | 43.7° | 59.9° |
| N7 | CA7 | CB7 | CG7 | 49.7° | 60.0° |
| N7 | CA7 | CB7 | HB71 | 75.6° | 180.0° |
| N7 | CA7 | CB7 | HB72 | 175.0° | 60.0° |
| CA7 | N7 | HN71 | HN72 | 125.2° | 113.8° |
| HA7 | CA7 | CB7 | CG7 | 73.7° | 59.9° |
| HA7 | CA7 | CB7 | HB71 | 161.0° | 60.0° |
| HA7 | CA7 | CB7 | HB72 | 51.6° | 180.0° |
| HA7 | CA7 | N7 | HN71 | 57.0° | 180.0° |
| HA7 | CA7 | N7 | HN72 | 177.7° | 66.2° |
| CG7 | CB7 | HB71 | HB72 | 116.4° | 120.0° |
| CB7 | CG7 | HG71 | HG72 | 116.3° | 120.0° |
| HB71 | CB7 | CG7 | HG71 | 27.9° | 180.0° |
| HB71 | CB7 | CG7 | HG72 | 81.5° | 60.1° |
| HB72 | CB7 | CG7 | HG71 | 81.6° | 60.0° |
| HB72 | CB7 | CG7 | HG72 | 169.0° | 180.0° |
