| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 48.8 | Very low | 51.5 | Low | 256 Ų | 256 | 136.9 Ų | 136.9 | 100% | 1.261 | 87% | 0.871 | S | S | * | * | 0 | 112.2 | 0 | -56.3 | -172.5 | -173.9 | 0 | 0 | 105.7 | |||||
| 2 | G | 57.9 | Low | 51.9 | Low | 80 Ų | 80 | 130.6 Ų | 130.6 | 83% | 0.825 | 85% | 0.851 | S | S | * | * | cis | 164.6 | 86.5 | 7.5 | 0 | 0 | 0 | 0 | 0 | 103.4 | ||||
| 3 | E | 42.7 | Very low | 52.5 | Low | 198 Ų | 198 | 132.6 Ų | 132.6 | 93% | 0.925 | 85% | 0.848 | S | S | * | * | trans | -88.2 | 137.7 | 177.7 | -64.4 | -169.4 | 152.3 | 0 | 0 | 110.1 | ||||
| 4 | A | 58.8 | Low | 53.4 | Low | 94 Ų | 94 | 129.7 Ų | 129.7 | 78% | 0.777 | 83% | 0.83 | S | S | * | * | trans | -175.6 | 96.7 | 140.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 5 | E | 54.2 | Low | 54 | Low | 187 Ų | 187 | 125.7 Ų | 125.7 | 87% | 0.874 | 82% | 0.822 | S | S | * | * | trans | -73.8 | 139.7 | 155.9 | -57.1 | -170.4 | 148.6 | 0 | 0 | 108.6 | ||||
| 6 | N | 54.4 | Low | 54.8 | Low | 163 Ų | 163 | 127 Ų | 127 | 87% | 0.872 | 82% | 0.818 | S | S | * | * | trans | -148.9 | 95.1 | 157.3 | -86.1 | -46.1 | 0 | 0 | 0 | 108.6 | ||||
| 7 | G | 42 | Very low | 55.9 | Low | 79 Ų | 79 | 129.4 Ų | 129.4 | 81% | 0.814 | 82% | 0.815 | S | S | * | * | trans | -75.1 | 135.8 | 162.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 8 | S | 53.3 | Low | 56.4 | Low | 118 Ų | 118 | 131.4 Ų | 131.4 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | trans | -131.6 | 100.5 | 165.1 | -178.6 | 0 | 0 | 0 | 0 | 108.4 | G10 | S8-G10 PolarHBondContact O-N 3.27Š| ||
| 9 | V | 51.3 | Low | 56.9 | Low | 144 Ų | 144 | 130 Ų | 130 | 87% | 0.873 | 81% | 0.805 | S | S | * | * | trans | -78.7 | 107.7 | 172.5 | -178.2 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 10 | G | 51.2 | Low | 57.3 | Low | 70 Ų | 70 | 131.7 Ų | 131.7 | 72% | 0.722 | 81% | 0.805 | S | S | * | * | trans | -131.1 | 73 | 175 | 0 | 0 | 0 | 0 | 0 | 110.7 | S8 G12 | S8-G10 PolarHBondContact O-N 3.27Å; G10-G12 PolarHBondContact O-N 3.03Å | ||
| 11 | S | 52.5 | Low | 57.5 | Low | 117 Ų | 117 | 136 Ų | 136 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -76.9 | 73.7 | 166.8 | 65.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 12 | G | 55.6 | Low | 57.9 | Low | 61 Ų | 61 | 132.4 Ų | 132.4 | 63% | 0.629 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -70.5 | 130.9 | 170.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | G10 P14 | G10-G12 PolarHBondContact O-N 3.03Å; G12-P14 VanDerWaalsContact O-CD 3.31Å; G12-P14 WeakPolarHBondContact O-CD 3.45Å |
| 13 | I | 59.2 | Low | 57.8 | Low | 157 Ų | 157 | 135.6 Ų | 135.6 | 81% | 0.805 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -58.9 | 118 | 170.6 | -60.4 | 174.6 | 0 | 0 | 0 | 107.4 | G15 | I13-G15 PolarHBondContact O-N 3.49Å; I13-G15 VanDerWaalsContact O-N 3.15Å |
| 14 | P | 65.2 | Low | 57.9 | Low | 92 Ų | 92 | 134.3 Ų | 134.3 | 60% | 0.597 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -64.5 | 120.1 | 176.9 | 23.8 | -30.5 | 0 | 0 | 0 | 109.1 | G12 | G12-P14 VanDerWaalsContact O-CD 3.31Å; G12-P14 WeakPolarHBondContact O-CD 3.45Å |
| 15 | G | 62.8 | Low | 57.7 | Low | 69 Ų | 69 | 135.2 Ų | 135.2 | 71% | 0.711 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 141.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | I13 H17 | I13-G15 PolarHBondContact O-N 3.49Å; I13-G15 VanDerWaalsContact O-N 3.15Å; G15-H17 PolarHBondContact O-N 2.91Å; G15-H17 VanDerWaalsContact O-N 3.08Å |
| 16 | I | 67.6 | Low | 57.3 | Low | 147 Ų | 147 | 130.1 Ų | 130.1 | 75% | 0.754 | 78% | 0.775 | S | S | * | * | trans | -76 | 96.4 | 177.9 | -50.3 | 171.4 | 0 | 0 | 0 | 107.8 | F18 | I16-F18 HydrophobicContact CG2-CD2 4.12Å; I16-F18 HydrophobicContact CG2-CE2 4.07Å; I16-F18 PolarHBondContact O-N 3.47Å | ||
| 17 | H | 73.3 | Confident | 56.6 | Low | 167 Ų | 167 | 126.1 Ų | 126.1 | 77% | 0.773 | 77% | 0.772 | S | S | * | * | trans | -78.8 | 99.7 | 177.7 | -172.2 | -89.6 | 0 | 0 | 0 | 110.6 | G15 C19 | G15-H17 PolarHBondContact O-N 2.91Å; G15-H17 VanDerWaalsContact O-N 3.08Å; H17-C19 PolarHBondContact O-N 3.24Å | ||
| 18 | F | 64.5 | Low | 56.8 | Low | 167 Ų | 167 | 128 Ų | 128 | 73% | 0.732 | 77% | 0.773 | S | S | * | * | trans | -75.4 | 105 | 167.4 | -93.8 | -90 | 0 | 0 | 0 | 109.7 | I16 M20 | I16-F18 HydrophobicContact CG2-CD2 4.12Å; I16-F18 HydrophobicContact CG2-CE2 4.07Å; I16-F18 PolarHBondContact O-N 3.47Å; F18-M20 PolarHBondContact O-N 3.13Å; F18-M20 VanDerWaalsContact O-N 3.14Å | ||
| 19 | C | 65.2 | Low | 56.2 | Low | 104 Ų | 104 | 127.3 Ų | 127.3 | 70% | 0.703 | 77% | 0.774 | S | S | * | * | trans | -77.6 | 95.1 | 170.1 | -177.7 | 0 | 0 | 0 | 0 | 110 | H17 R21 | H17-C19 PolarHBondContact O-N 3.24Å; C19-R21 PolarHBondContact O-N 2.8Å | ||
| 20 | M | 66.3 | Low | 55.6 | Low | 163 Ų | 163 | 128.8 Ų | 128.8 | 80% | 0.803 | 78% | 0.776 | S | S | * | * | trans | -76.3 | 111.4 | 163.6 | -72.3 | -73.1 | 173.2 | 0 | 0 | 108.7 | F18 K22 | F18-M20 PolarHBondContact O-N 3.13Å; F18-M20 VanDerWaalsContact O-N 3.14Å; M20-K22 PolarHBondContact O-N 2.76Å | ||
| 21 | R | 61.5 | Low | 55.4 | Low | 224 Ų | 224 | 129.6 Ų | 129.6 | 85% | 0.845 | 78% | 0.775 | S | S | * | * | trans | -76 | 111.1 | 172.4 | -173.6 | -178.3 | -66.4 | 173.9 | -1.6 | 108.7 | C19 | C19-R21 PolarHBondContact O-N 2.8Š| ||
| 22 | K | 57.2 | Low | 55.4 | Low | 179 Ų | 179 | 134.1 Ų | 134.1 | 78% | 0.778 | 78% | 0.78 | S | S | * | * | trans | -64.9 | 126.9 | 164.8 | -92.3 | -179.9 | 171.4 | -179 | 0 | 108.9 | M20 | M20-K22 PolarHBondContact O-N 2.76Š| ||
| 23 | N | 54.2 | Low | 54.9 | Low | 148 Ų | 148 | 140.5 Ų | 140.5 | 79% | 0.791 | 79% | 0.794 | S | S | * | * | trans | -90.2 | 110.4 | 166.4 | -105.4 | 11.6 | 0 | 0 | 0 | 107.8 | ||||
| 24 | E | 45.7 | Very low | 54 | Low | 170 Ų | 170 | 136.9 Ų | 136.9 | 79% | 0.794 | 80% | 0.796 | S | S | * | * | trans | -106.3 | 107.9 | 166.3 | -64.4 | -179.4 | -179.7 | 0 | 0 | 106.7 | ||||
| 25 | S | 53.9 | Low | 52.7 | Low | 113 Ų | 113 | 136.5 Ų | 136.5 | 79% | 0.79 | 81% | 0.808 | S | S | * | * | trans | -133.3 | 97.6 | 167.9 | 56.1 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 26 | G | 46.3 | Very low | 51.5 | Low | 81 Ų | 81 | 143 Ų | 143 | 84% | 0.835 | 82% | 0.82 | S | S | * | * | trans | -83.7 | 153.7 | 168.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 27 | G | 40.9 | Very low | 50.3 | Low | 79 Ų | 79 | 139.7 Ų | 139.7 | 81% | 0.814 | 82% | 0.822 | S | S | * | * | trans | 77.7 | 131.6 | 162.3 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 28 | S | 45.1 | Very low | 49.2 | Very low | 119 Ų | 119 | 137.9 Ų | 137.9 | 83% | 0.832 | 83% | 0.828 | S | S | * | * | cis | -161.8 | 138.3 | 6 | 48.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 29 | A | 41.5 | Very low | 48 | Very low | 103 Ų | 103 | 134.6 Ų | 134.6 | 85% | 0.851 | 83% | 0.826 | S | S | * | * | trans | -66.6 | 141.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 30 | L | 38.9 | Very low | 47 | Very low | 175 Ų | 175 | 134.3 Ų | 134.3 | 92% | 0.916 | 83% | 0.825 | S | S | * | * | trans | -140.1 | 114.3 | 150.7 | -167.3 | 68.8 | 0 | 0 | 0 | 109.1 | ||||
| 31 | A | 46.1 | Very low | 46.3 | Very low | 86 Ų | 86 | 133.1 Ų | 133.1 | 71% | 0.711 | 82% | 0.821 | S | S | * | * | trans | -77.2 | 149 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 32 | K | 51.9 | Low | 45.1 | Very low | 212 Ų | 212 | 133.8 Ų | 133.8 | 92% | 0.922 | 82% | 0.824 | S | S | * | * | trans | -159.7 | 138 | 133.8 | -118.6 | 173.6 | 178.3 | 176.4 | 0 | 111.4 | ||||
| 33 | E | 44.9 | Very low | 44.4 | Very low | 196 Ų | 196 | 130.5 Ų | 130.5 | 92% | 0.916 | 82% | 0.823 | S | S | * | * | trans | -89.1 | 165.3 | -162.7 | -51.7 | -165.1 | 144.9 | 0 | 0 | 114.1 | ||||
| 34 | G | 40.5 | Very low | 43.6 | Very low | 81 Ų | 81 | 133.9 Ų | 133.9 | 84% | 0.835 | 83% | 0.827 | S | S | * | * | trans | 138.4 | 113.6 | 148.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 35 | G | 38 | Very low | 43.4 | Very low | 83 Ų | 83 | 131 Ų | 131 | 86% | 0.856 | 83% | 0.825 | S | S | * | * | trans | 138.4 | 97.1 | 156.9 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 36 | E | 37.8 | Very low | 43.3 | Very low | 207 Ų | 207 | 130.5 Ų | 130.5 | 97% | 0.967 | 82% | 0.821 | S | S | * | * | trans | -70.6 | 135.9 | -179.3 | -59.4 | 153.4 | -165.2 | 0 | 0 | 111.8 | ||||
| 37 | G | 43.4 | Very low | 43.5 | Very low | 77 Ų | 77 | 130.6 Ų | 130.6 | 79% | 0.794 | 82% | 0.815 | S | S | * | * | trans | -178.2 | 74.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 38 | S | 49.8 | Very low | 43.7 | Very low | 128 Ų | 128 | 136.4 Ų | 136.4 | 90% | 0.895 | 82% | 0.818 | S | S | * | * | trans | 0.8 | 108 | 166.7 | -152.2 | 0 | 0 | 0 | 0 | 117.7 | S40 | S38-S40 PolarHBondContact O-N 2.83Š| ||
| 39 | S | 39.8 | Very low | 44.3 | Very low | 99 Ų | 99 | 139.9 Ų | 139.9 | 69% | 0.692 | 82% | 0.818 | S | S | * | * | trans | -75.4 | 111.3 | 176.8 | 57.7 | 0 | 0 | 0 | 0 | 112.5 | L41 | S39-L41 PolarHBondContact O-N 2.88Š| ||
| 40 | S | 43.9 | Very low | 44.8 | Very low | 97 Ų | 97 | 140.3 Ų | 140.3 | 68% | 0.678 | 81% | 0.812 | S | S | * | * | trans | -85.2 | 99.9 | 154.8 | 176.7 | 0 | 0 | 0 | 0 | 108.6 | S38 | S38-S40 PolarHBondContact O-N 2.83Š| ||
| 41 | L | 50.1 | Low | 45.2 | Very low | 139 Ų | 139 | 143.4 Ų | 143.4 | 73% | 0.728 | 81% | 0.813 | S | S | * | * | trans | -71.3 | 120.1 | 167.4 | -67 | 159.2 | 0 | 0 | 0 | 107 | S39 | S39-L41 PolarHBondContact O-N 2.88Š| ||
| 42 | W | 36.3 | Very low | 45.3 | Very low | 237 Ų | 237 | 142.7 Ų | 142.7 | 90% | 0.898 | 81% | 0.814 | S | S | * | * | trans | 103.7 | 42.4 | 171 | -47.6 | -3.3 | 0 | 0 | 0 | 118 | Y44 | W42-Y44 PolarHBondContact O-N 2.74Š| ||
| 43 | S | 43.3 | Very low | 45.2 | Very low | 110 Ų | 110 | 138.1 Ų | 138.1 | 77% | 0.769 | 81% | 0.808 | S | S | * | * | trans | -82.2 | 101.7 | 164.6 | -68.9 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 44 | Y | 38.4 | Very low | 45.4 | Very low | 220 Ų | 220 | 136.9 Ų | 136.9 | 86% | 0.863 | 81% | 0.807 | S | S | * | * | trans | -18.5 | 137.2 | 166.1 | -89.7 | -109.5 | 0 | 0 | 0 | 119.7 | W42 | W42-Y44 PolarHBondContact O-N 2.74Š| ||
| 45 | S | 40.3 | Very low | 45.9 | Very low | 108 Ų | 108 | 137.6 Ų | 137.6 | 76% | 0.755 | 81% | 0.805 | S | S | * | * | trans | -16.8 | 124.3 | 157.7 | -63.9 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 46 | S | 51.3 | Low | 46.7 | Very low | 103 Ų | 103 | 140 Ų | 140 | 72% | 0.72 | 80% | 0.803 | S | S | * | * | trans | -97.8 | 24.1 | 160.1 | 62.2 | 0 | 0 | 0 | 0 | 113.1 | F48 | S46-F48 VanDerWaalsContact C-N 3.33Å; S46-F48 PolarHBondContact O-N 3.35Å | ||
| 47 | A | 52.1 | Low | 47.2 | Very low | 84 Ų | 84 | 134.9 Ų | 134.9 | 69% | 0.694 | 79% | 0.79 | S | S | * | * | trans | -74.6 | 80.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 48 | F | 45.1 | Very low | 47.3 | Very low | 200 Ų | 200 | 136.5 Ų | 136.5 | 88% | 0.877 | 79% | 0.789 | S | S | * | * | trans | 172.4 | 97.5 | 142.2 | -116 | -102.6 | 0 | 0 | 0 | 107.7 | S46 | S46-F48 VanDerWaalsContact C-N 3.33Å; S46-F48 PolarHBondContact O-N 3.35Å | ||
| 49 | K | 57.9 | Low | 47.6 | Very low | 192 Ų | 192 | 139.9 Ų | 139.9 | 84% | 0.835 | 79% | 0.788 | S | S | * | * | trans | -117.2 | 121.4 | 157.2 | -75 | -174.9 | 178.2 | -178.7 | 0 | 107.1 | ||||
| 50 | P | 52.2 | Low | 48.2 | Very low | 112 Ų | 112 | 140.5 Ų | 140.5 | 73% | 0.727 | 79% | 0.792 | S | S | * | * | trans | -65 | 141.9 | 177.5 | 31.1 | -31.9 | 0 | 0 | 0 | 107.7 | G52 | P50-G52 PolarHBondContact O-N 2.86Š| ||
| 51 | Y | 45.7 | Very low | 48.2 | Very low | 241 Ų | 241 | 143.7 Ų | 143.7 | 95% | 0.945 | 80% | 0.802 | S | S | * | * | trans | -31.4 | 108.9 | -176 | -62 | -87.7 | 0 | 0 | 0 | 113.6 | S53 | Y51-S53 PolarHBondContact O-N 3.4Š| ||
| 52 | G | 47.8 | Very low | 48.4 | Very low | 70 Ų | 70 | 148.5 Ų | 148.5 | 72% | 0.722 | 81% | 0.81 | S | S | * | * | trans | -69.6 | 121.3 | 170.2 | 0 | 0 | 0 | 0 | 0 | 109.9 | P50 | P50-G52 PolarHBondContact O-N 2.86Š| ||
| 53 | S | 50.9 | Low | 49.1 | Very low | 116 Ų | 116 | 147.1 Ų | 147.1 | 81% | 0.811 | 81% | 0.811 | S | S | * | * | trans | -5.1 | 114.5 | 165.3 | -163.6 | 0 | 0 | 0 | 0 | 116.5 | Y51 A55 | Y51-S53 PolarHBondContact O-N 3.4Å; S53-A55 PolarHBondContact O-N 2.92Å; S53-A55 VanDerWaalsContact O-N 3.11Å | ||
| 54 | L | 48.1 | Very low | 49 | Very low | 170 Ų | 170 | 151.4 Ų | 151.4 | 89% | 0.89 | 82% | 0.819 | S | S | * | * | trans | -72.1 | 99.1 | 167.5 | -64 | 176.6 | 0 | 0 | 0 | 109 | V56 | L54-V56 PolarHBondContact O-N 3.05Å; L54-V56 VanDerWaalsContact O-N 3.12Å | ||
| 55 | A | 51.5 | Low | 49.4 | Very low | 96 Ų | 96 | 144.5 Ų | 144.5 | 79% | 0.793 | 81% | 0.814 | S | S | * | * | trans | -71.6 | 98.8 | 161.1 | 0 | 0 | 0 | 0 | 0 | 107.8 | S53 S57 | S53-A55 PolarHBondContact O-N 2.92Å; S53-A55 VanDerWaalsContact O-N 3.11Å; A55-S57 PolarHBondContact O-N 2.9Å | ||
| 56 | V | 54.6 | Low | 49.5 | Very low | 135 Ų | 135 | 148.6 Ų | 148.6 | 82% | 0.818 | 82% | 0.821 | S | S | * | * | trans | -67.8 | 113 | 166.8 | 115.3 | 0 | 0 | 0 | 0 | 106.7 | L54 S58 | L54-V56 PolarHBondContact O-N 3.05Å; L54-V56 VanDerWaalsContact O-N 3.12Å; V56-S58 PolarHBondContact O-N 3.07Å | ||
| 57 | S | 49.3 | Very low | 49.5 | Very low | 99 Ų | 99 | 148.3 Ų | 148.3 | 69% | 0.692 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -70.3 | 120.3 | 167.7 | 43.1 | 0 | 0 | 0 | 0 | 108 | A55 F59 | A55-S57 PolarHBondContact O-N 2.9Å; S57-F59 PolarHBondContact O-N 3.36Å |
| 58 | S | 45.7 | Very low | 49.8 | Very low | 110 Ų | 110 | 153 Ų | 153 | 77% | 0.769 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 118.8 | 174 | -163.3 | 0 | 0 | 0 | 0 | 109 | V56 S60 | V56-S58 PolarHBondContact O-N 3.07Å; S58-S60 PolarHBondContact O-N 3.13Å; S58-S60 VanDerWaalsContact O-N 3.14Å |
| 59 | F | 54.6 | Low | 50.3 | Low | 200 Ų | 200 | 149.1 Ų | 149.1 | 88% | 0.877 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 117.5 | 175.7 | -81.7 | -91.5 | 0 | 0 | 0 | 108.6 | S57 D61 | S57-F59 PolarHBondContact O-N 3.36Å; F59-D61 PolarHBondContact O-N 3.41Å |
| 60 | S | 52.7 | Low | 50.6 | Low | 111 Ų | 111 | 146.9 Ų | 146.9 | 78% | 0.776 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -67.9 | 122.8 | 171.6 | -65.5 | 0 | 0 | 0 | 0 | 109.2 | S58 R62 | S58-S60 PolarHBondContact O-N 3.13Å; S58-S60 VanDerWaalsContact O-N 3.14Å; S60-R62 PolarHBondContact O-N 3.44Å |
| 61 | D | 45.1 | Very low | 51.5 | Low | 165 Ų | 165 | 150.5 Ų | 150.5 | 88% | 0.882 | 82% | 0.823 | S | S | * | * | trans | -52 | 112.2 | 177.9 | -152.5 | -4.7 | 0 | 0 | 0 | 110.9 | F59 | F59-D61 PolarHBondContact O-N 3.41Š| ||
| 62 | R | 54.5 | Low | 52.8 | Low | 239 Ų | 239 | 143.1 Ų | 143.1 | 90% | 0.902 | 81% | 0.805 | S | S | * | * | trans | -100.5 | 119.2 | 170.1 | -78.6 | -151.4 | 177.8 | -140.4 | 2.5 | 108.9 | S60 | S60-R62 PolarHBondContact O-N 3.44Š| ||
| 63 | K | 49.7 | Very low | 54.1 | Low | 209 Ų | 209 | 144.2 Ų | 144.2 | 91% | 0.909 | 79% | 0.794 | S | S | * | * | trans | -49.2 | 137.4 | 178.2 | -78.9 | -170.5 | 171.2 | -176.8 | 0 | 113.8 | ||||
| 64 | E | 42 | Very low | 55.4 | Low | 200 Ų | 200 | 142.8 Ų | 142.8 | 94% | 0.935 | 78% | 0.782 | S | S | * | * | trans | -24.3 | 128.2 | 172.4 | -62.8 | 171.7 | 165 | 0 | 0 | 118.3 | ||||
| 65 | G | 46.7 | Very low | 56.5 | Low | 74 Ų | 74 | 143.2 Ų | 143.2 | 76% | 0.763 | 78% | 0.777 | S | S | * | * | trans | -170.3 | 121 | 160.9 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 66 | E | 41 | Very low | 57.8 | Low | 194 Ų | 194 | 140.1 Ų | 140.1 | 91% | 0.907 | 75% | 0.749 | S | S | * | * | trans | -35.5 | 128.7 | -178 | -79 | 173.4 | 104.6 | 0 | 0 | 115.1 | ||||
| 67 | S | 51.5 | Low | 58.6 | Low | 97 Ų | 97 | 139.3 Ų | 139.3 | 68% | 0.678 | 75% | 0.747 | S | S | * | * | trans | 167.3 | 122.4 | 133.2 | -80.1 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 68 | K | 58.7 | Low | 59.7 | Low | 184 Ų | 184 | 142.9 Ų | 142.9 | 80% | 0.8 | 75% | 0.753 | S | S | * | * | trans | 37.4 | 118 | 145.1 | -57.9 | 176.7 | -176.1 | 173.4 | 0 | 117.7 | N70 | K68-N70 PolarHBondContact O-N 3.14Å; K68-N70 PolarHBondContact O-ND2 3.3Å; K68-N70 PolarHBondContact O-OD1 3.24Å | ||
| 69 | S | 56.9 | Low | 60.6 | Low | 118 Ų | 118 | 140.1 Ų | 140.1 | 83% | 0.825 | 73% | 0.733 | S | S | * | * | trans | -37.7 | 95.4 | -179.5 | 63.8 | 0 | 0 | 0 | 0 | 115.2 | K71 | S69-K71 VanDerWaalsContact C-N 3.33Å; S69-K71 PolarHBondContact O-N 3.14Å; S69-K71 VanDerWaalsContact O-N 3.08Å | ||
| 70 | N | 63.4 | Low | 61.3 | Low | 144 Ų | 144 | 135.1 Ų | 135.1 | 77% | 0.77 | 72% | 0.723 | S | S | * | * | trans | -85.1 | 73.5 | 176.6 | -67.9 | -50.3 | 0 | 0 | 0 | 109.9 | K68 P72 | K68-N70 PolarHBondContact O-N 3.14Å; K68-N70 PolarHBondContact O-ND2 3.3Å; K68-N70 PolarHBondContact O-OD1 3.24Å; N70-P72 VanDerWaalsContact O-CD 3.29Å; N70-P72 WeakPolarHBondContact O-CD 3.42Å | ||
| 71 | K | 71.4 | Confident | 62 | Low | 188 Ų | 188 | 135.4 Ų | 135.4 | 82% | 0.817 | 72% | 0.719 | S | S | * | * | trans | -70.6 | 112.5 | 156.5 | -70.2 | 178.2 | -176.4 | 177.6 | 0 | 105.3 | S69 N73 | S69-K71 VanDerWaalsContact C-N 3.33Å; S69-K71 PolarHBondContact O-N 3.14Å; S69-K71 VanDerWaalsContact O-N 3.08Å; K71-N73 PolarHBondContact O-N 3.43Å | ||
| 72 | P | 72.4 | Confident | 62.8 | Low | 86 Ų | 86 | 133.3 Ų | 133.3 | 56% | 0.558 | 72% | 0.715 | S | S | * | * | trans | -56.3 | 134.1 | -179.1 | 22.8 | -31.5 | 0 | 0 | 0 | 108.2 | N70 | N70-P72 VanDerWaalsContact O-CD 3.29Å; N70-P72 WeakPolarHBondContact O-CD 3.42Å | ||
| 73 | N | 76.4 | Confident | 63.2 | Low | 94 Ų | 94 | 125.7 Ų | 125.7 | 50% | 0.503 | 69% | 0.692 | S | S | . | * | trans | -52.2 | 126.9 | 177.5 | 175.8 | -8.1 | 0 | 0 | 0 | 107.9 | K71 F75 S76 C79 | K71-N73 PolarHBondContact O-N 3.43Å; N73-F75 PolarHBondContact O-N 3.03Å; N73-F75 WeakPolarHBondContact OD1-CB 3.22Å; N73-F75 WeakPolarHBondContact OD1-CD2 3.33Å; N73-F75 PolarHBondContact OD1-N 3.24Å; N73-S76 VanDerWaalsContact O-CB 3.29Å; N73-S76 WeakPolarHBondContact O-CB 3.32Å; N73-S76 PolarHBondContact O-N 3.07Å; N73-C79 WeakPolarHBondContact O-CB 3.33Å | ||
| 74 | P | 76.9 | Confident | 63.6 | Low | 86 Ų | 86 | 120.5 Ų | 120.5 | 56% | 0.558 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.5 | -12.9 | 180 | 25.4 | -35.8 | 0 | 0 | 0 | 113.2 | ||
| 75 | F | 71.6 | Confident | 64.2 | Low | 179 Ų | 179 | 120.9 Ų | 120.9 | 79% | 0.785 | 68% | 0.678 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.1 | 6 | 174.9 | -52.1 | -72 | 0 | 0 | 0 | 113.8 | N73 | N73-F75 PolarHBondContact O-N 3.03Å; N73-F75 WeakPolarHBondContact OD1-CB 3.22Å; N73-F75 WeakPolarHBondContact OD1-CD2 3.33Å; N73-F75 PolarHBondContact OD1-N 3.24Å |
| 76 | S | 77.8 | Confident | 64.5 | Low | 30 Ų | 30 | 125.4 Ų | 125.4 | 21% | 0.21 | 68% | 0.68 | C | S | . | * | S | Bend | trans | -64.2 | 142.2 | 172 | -178.6 | 0 | 0 | 0 | 0 | 109.7 | N73 E78 C79 | N73-S76 VanDerWaalsContact O-CB 3.29Å; N73-S76 WeakPolarHBondContact O-CB 3.32Å; N73-S76 PolarHBondContact O-N 3.07Å; S76-E78 PolarHBondContact O-N 2.93Å; S76-E78 VanDerWaalsContact O-N 3.11Å; S76-E78 PolarHBondContact OG-N 3.05Å; S76-C79 CarbonylContact O-C 3.55Å; S76-C79 WeakPolarHBondContact O-CA 3.47Å; S76-C79 PolarHBondContact O-N 3.09Å |
| 77 | P | 71.9 | Confident | 65.1 | Low | 118 Ų | 118 | 118.6 Ų | 118.6 | 77% | 0.766 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -53.3 | -30.5 | 171.4 | -23.4 | 32.8 | 0 | 0 | 0 | 112.9 | C79 S80 | P77-C79 VanDerWaalsContact C-N 3.28Å; P77-C79 PolarHBondContact O-N 3.01Å; P77-S80 PolarHBondContact O-OG 3.09Å |
| 78 | E | 72.1 | Confident | 65.1 | Low | 175 Ų | 175 | 116.1 Ų | 116.1 | 82% | 0.818 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.6 | -26.9 | 176.2 | -58.5 | 178.8 | 175.8 | 0 | 0 | 112.6 | S76 S80 | S76-E78 PolarHBondContact O-N 2.93Å; S76-E78 VanDerWaalsContact O-N 3.11Å; S76-E78 PolarHBondContact OG-N 3.05Å; E78-S80 VanDerWaalsContact C-N 3.31Å; E78-S80 PolarHBondContact O-N 3.31Å |
| 79 | C | 65.7 | Low | 65.1 | Low | 51 Ų | 51 | 114.9 Ų | 114.9 | 35% | 0.345 | 64% | 0.641 | S | S | . | * | S | Bend | trans | -91.8 | 65.5 | 176.1 | -161.5 | 0 | 0 | 0 | 0 | 109.6 | N73 S76 P77 V81 | N73-C79 WeakPolarHBondContact O-CB 3.33Å; S76-C79 CarbonylContact O-C 3.55Å; S76-C79 WeakPolarHBondContact O-CA 3.47Å; S76-C79 PolarHBondContact O-N 3.09Å; P77-C79 VanDerWaalsContact C-N 3.28Å; P77-C79 PolarHBondContact O-N 3.01Å; C79-V81 PolarHBondContact O-N 3.31Å |
| 80 | S | 68 | Low | 65.3 | Low | 96 Ų | 96 | 116.4 Ų | 116.4 | 67% | 0.671 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -72.3 | 118.2 | 173.7 | -73 | 0 | 0 | 0 | 0 | 109.8 | P77 E78 P82 | P77-S80 PolarHBondContact O-OG 3.09Å; E78-S80 VanDerWaalsContact C-N 3.31Å; E78-S80 PolarHBondContact O-N 3.31Å; S80-P82 WeakPolarHBondContact O-CD 3.38Å |
| 81 | V | 67.9 | Low | 65 | Low | 116 Ų | 116 | 118.1 Ų | 118.1 | 70% | 0.703 | 64% | 0.637 | S | S | * | * | P | Polyproline II helix | trans | -54 | 123 | 173 | 179.5 | 0 | 0 | 0 | 0 | 107.9 | C79 L83 | C79-V81 PolarHBondContact O-N 3.31Å; V81-L83 PolarHBondContact O-N 3.44Å |
| 82 | P | 62.6 | Low | 64.5 | Low | 122 Ų | 122 | 109.8 Ų | 109.8 | 79% | 0.792 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -55.1 | 116.3 | -177.6 | -23.1 | 30.8 | 0 | 0 | 0 | 109.4 | S80 | S80-P82 WeakPolarHBondContact O-CD 3.38Š|
| 83 | L | 62.4 | Low | 64 | Low | 78 Ų | 78 | 113 Ų | 113 | 41% | 0.408 | 61% | 0.61 | S | S | . | * | P | Polyproline II helix | trans | -76.6 | 148.3 | 171 | -66.3 | 174 | 0 | 0 | 0 | 108.5 | V81 F85 I96 | V81-L83 PolarHBondContact O-N 3.44Å; L83-F85 PolarHBondContact O-N 3.02Å; L83-I96 HydrophobicContact CD1-CD1 2.94Å; L83-I96 HydrophobicContact CD1-CG1 4.35Å; L83-I96 HydrophobicContact CG-CD1 4.41Å |
| 84 | P | 59.1 | Low | 63.6 | Low | 100 Ų | 100 | 116.2 Ų | 116.2 | 65% | 0.649 | 62% | 0.616 | S | S | * | * | P | Polyproline II helix | trans | -52 | 128.5 | 177.7 | 20 | -31 | 0 | 0 | 0 | 110 | Q86 | P84-Q86 PolarHBondContact O-N 2.64Š|
| 85 | F | 53.1 | Low | 63.2 | Low | 208 Ų | 208 | 113.3 Ų | 113.3 | 91% | 0.912 | 60% | 0.6 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.2 | 45.4 | -167.7 | 169.9 | -105.4 | 0 | 0 | 0 | 115.6 | L83 | L83-F85 PolarHBondContact O-N 3.02Š|
| 86 | Q | 53.8 | Low | 63.2 | Low | 170 Ų | 170 | 106.9 Ų | 106.9 | 79% | 0.794 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.9 | 8.6 | 175.8 | -71.7 | 176.6 | -38.8 | 0 | 0 | 113.5 | P84 G88 | P84-Q86 PolarHBondContact O-N 2.64Å; Q86-G88 VanDerWaalsContact C-N 3.32Å; Q86-G88 PolarHBondContact O-N 3.29Å |
| 87 | L | 53.9 | Low | 63.1 | Low | 50 Ų | 50 | 107.8 Ų | 107.8 | 26% | 0.262 | 58% | 0.576 | S | S | . | * | S | Bend | trans | -86 | 81.2 | 164.6 | -104.8 | 65.3 | 0 | 0 | 0 | 108.4 | D89 A95 I96 L99 | L87-D89 PolarHBondContact O-N 3.35Å; L87-A95 HydrophobicContact CD1-CB 3.66Å; L87-A95 HydrophobicContact CD2-CB 3.41Å; L87-A95 VanDerWaalsContact CD2-CB 3.41Å; L87-A95 HydrophobicContact CG-CB 3.3Å; L87-I96 HydrophobicContact CD2-CD1 3.44Å; L87-I96 VanDerWaalsContact CD2-CD1 3.44Å; L87-I96 HydrophobicContact CD2-CG1 3.99Å; L87-I96 VanDerWaalsContact CD2-N 3.34Å; L87-L99 HydrophobicContact CD1-CD1 4.24Å; L87-L99 HydrophobicContact CD2-CD1 4.16Å |
| 88 | G | 51.3 | Low | 63.6 | Low | 46 Ų | 46 | 105.6 Ų | 105.6 | 47% | 0.474 | 56% | 0.563 | S | S | . | * | trans | -51 | 139.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | Q86 D90 Y91 G92 | Q86-G88 VanDerWaalsContact C-N 3.32Å; Q86-G88 PolarHBondContact O-N 3.29Å; G88-D90 PolarHBondContact O-N 2.89Å; G88-Y91 PolarHBondContact O-N 3.31Å; G88-G92 PolarHBondContact O-N 2.99Å | ||
| 89 | D | 57.7 | Low | 63.9 | Low | 158 Ų | 158 | 100 Ų | 100 | 85% | 0.845 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -17.2 | -168.9 | -52.3 | -31.7 | 0 | 0 | 0 | 113.2 | L87 | L87-D89 PolarHBondContact O-N 3.35Š|
| 90 | D | 60.9 | Low | 64.8 | Low | 150 Ų | 150 | 105.7 Ų | 105.7 | 80% | 0.802 | 55% | 0.553 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.5 | -21.1 | -177.3 | -45 | -23.7 | 0 | 0 | 0 | 113.6 | G88 | G88-D90 PolarHBondContact O-N 2.89Š|
| 91 | Y | 59 | Low | 65.7 | Low | 179 Ų | 179 | 106.8 Ų | 106.8 | 70% | 0.702 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -124.5 | 8 | 174.5 | -76.2 | -89.6 | 0 | 0 | 0 | 112.4 | G88 F93 Y94 A95 | G88-Y91 PolarHBondContact O-N 3.31Å; Y91-F93 PolarHBondContact O-N 3.45Å; Y91-Y94 PolarHBondContact O-N 2.95Å; Y91-A95 WeakPolarHBondContact O-CB 3.11Å; Y91-A95 PolarHBondContact O-N 3.26Å |
| 92 | G | 59 | Low | 66.7 | Low | 14 Ų | 14 | 109.2 Ų | 109.2 | 14% | 0.144 | 54% | 0.542 | C | S | . | . | H | α-helix | trans | -47.6 | -61.1 | -173.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | G88 Y94 A95 I96 | G88-G92 PolarHBondContact O-N 2.99Å; G92-Y94 PolarHBondContact O-N 3.43Å; G92-A95 PolarHBondContact O-N 3.45Å; G92-I96 VanDerWaalsContact O-CG1 3.26Å; G92-I96 WeakPolarHBondContact O-CG1 3.21Å; G92-I96 PolarHBondContact O-N 3.49Å |
| 93 | F | 63.8 | Low | 68.2 | Low | 152 Ų | 152 | 107.8 Ų | 107.8 | 67% | 0.667 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -53.2 | -48.1 | -174.6 | -172.6 | -98.1 | 0 | 0 | 0 | 114.4 | Y91 A95 I96 D97 | Y91-F93 PolarHBondContact O-N 3.45Å; F93-A95 VanDerWaalsContact C-N 3.32Å; F93-A95 PolarHBondContact O-N 3.01Å; F93-I96 WeakPolarHBondContact O-CB 3.41Å; F93-I96 PolarHBondContact O-N 2.94Å; F93-D97 PolarHBondContact O-N 2.81Å; F93-D97 VanDerWaalsContact O-N 3.09Å |
| 94 | Y | 66.7 | Low | 69.8 | Low | 162 Ų | 162 | 108.1 Ų | 108.1 | 64% | 0.635 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -67.6 | -32.8 | -179.9 | -65.7 | -69.4 | 0 | 0 | 0 | 113.5 | Y91 G92 S98 | Y91-Y94 PolarHBondContact O-N 2.95Å; G92-Y94 PolarHBondContact O-N 3.43Å; Y94-S98 WeakPolarHBondContact O-CB 3.14Å; Y94-S98 PolarHBondContact O-N 2.72Å; Y94-S98 PolarHBondContact O-OG 3.36Å |
| 95 | A | 69.9 | Low | 71.6 | Confident | 26 Ų | 26 | 110.7 Ų | 110.7 | 22% | 0.215 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -77 | -33.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L87 Y91 G92 F93 S98 L99 | L87-A95 HydrophobicContact CD1-CB 3.66Å; L87-A95 HydrophobicContact CD2-CB 3.41Å; L87-A95 VanDerWaalsContact CD2-CB 3.41Å; L87-A95 HydrophobicContact CG-CB 3.3Å; Y91-A95 WeakPolarHBondContact O-CB 3.11Å; Y91-A95 PolarHBondContact O-N 3.26Å; G92-A95 PolarHBondContact O-N 3.45Å; F93-A95 VanDerWaalsContact C-N 3.32Å; F93-A95 PolarHBondContact O-N 3.01Å; A95-S98 PolarHBondContact O-N 3.28Å; A95-L99 WeakPolarHBondContact O-CG 3.47Å; A95-L99 PolarHBondContact O-N 2.88Å |
| 96 | I | 70.4 | Confident | 73.7 | Confident | 43 Ų | 43 | 104.8 Ų | 104.8 | 22% | 0.221 | 50% | 0.5 | C | S | . | . | H | α-helix | trans | -55.9 | -54.2 | 167.9 | -55.4 | -60.6 | 0 | 0 | 0 | 108.8 | L83 L87 G92 F93 S98 L99 W100 | L83-I96 HydrophobicContact CD1-CD1 2.94Å; L83-I96 HydrophobicContact CD1-CG1 4.35Å; L83-I96 HydrophobicContact CG-CD1 4.41Å; L87-I96 HydrophobicContact CD2-CD1 3.44Å; L87-I96 VanDerWaalsContact CD2-CD1 3.44Å; L87-I96 HydrophobicContact CD2-CG1 3.99Å; L87-I96 VanDerWaalsContact CD2-N 3.34Å; G92-I96 VanDerWaalsContact O-CG1 3.26Å; G92-I96 WeakPolarHBondContact O-CG1 3.21Å; G92-I96 PolarHBondContact O-N 3.49Å; F93-I96 WeakPolarHBondContact O-CB 3.41Å; F93-I96 PolarHBondContact O-N 2.94Å; I96-S98 VanDerWaalsContact C-N 3.26Å; I96-S98 PolarHBondContact O-N 3.33Å; I96-L99 WeakPolarHBondContact O-CB 3.25Å; I96-L99 PolarHBondContact O-N 3.26Å; I96-L99 VanDerWaalsContact O-N 3.13Å; I96-W100 HydrophobicContact CG2-CD2 4.34Å; I96-W100 HydrophobicContact CG2-CG 4.32Å; I96-W100 HydrophobicContact CG2-CZ2 4.16Å; I96-W100 PolarHBondContact O-N 2.96Å |
| 97 | D | 76.7 | Confident | 75.8 | Confident | 50 Ų | 50 | 104.7 Ų | 104.7 | 27% | 0.267 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -55.4 | -42.9 | 179.2 | -87.6 | 5.1 | 0 | 0 | 0 | 112 | F93 W100 K101 | F93-D97 PolarHBondContact O-N 2.81Å; F93-D97 VanDerWaalsContact O-N 3.09Å; D97-W100 PolarHBondContact O-N 3.1Å; D97-K101 VanDerWaalsContact O-CB 3.25Å; D97-K101 WeakPolarHBondContact O-CB 3.24Å; D97-K101 WeakPolarHBondContact O-CD 3.48Å; D97-K101 WeakPolarHBondContact O-CG 3.19Å; D97-K101 PolarHBondContact O-N 3.43Å |
| 98 | S | 81.8 | Confident | 77.9 | Confident | 72 Ų | 72 | 108 Ų | 108 | 50% | 0.503 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.6 | -41.2 | 180 | -63.2 | 0 | 0 | 0 | 0 | 112.2 | Y94 A95 I96 R102 | Y94-S98 WeakPolarHBondContact O-CB 3.14Å; Y94-S98 PolarHBondContact O-N 2.72Å; Y94-S98 PolarHBondContact O-OG 3.36Å; A95-S98 PolarHBondContact O-N 3.28Å; I96-S98 VanDerWaalsContact C-N 3.26Å; I96-S98 PolarHBondContact O-N 3.33Å; S98-R102 WeakPolarHBondContact O-CB 3.44Å; S98-R102 PolarHBondContact O-N 3.44Å |
| 99 | L | 79.3 | Confident | 80.1 | Confident | 58 Ų | 58 | 112.1 Ų | 112.1 | 30% | 0.304 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.5 | -44.6 | 174.2 | -71.3 | 172.1 | 0 | 0 | 0 | 111.4 | L87 A95 I96 R102 N103 | L87-L99 HydrophobicContact CD1-CD1 4.24Å; L87-L99 HydrophobicContact CD2-CD1 4.16Å; A95-L99 WeakPolarHBondContact O-CG 3.47Å; A95-L99 PolarHBondContact O-N 2.88Å; I96-L99 WeakPolarHBondContact O-CB 3.25Å; I96-L99 PolarHBondContact O-N 3.26Å; I96-L99 VanDerWaalsContact O-N 3.13Å; L99-R102 WeakPolarHBondContact O-CB 3.49Å; L99-R102 PolarHBondContact O-N 3.41Å; L99-R102 VanDerWaalsContact O-N 3.14Å; L99-N103 WeakPolarHBondContact O-CB 3.36Å; L99-N103 VanDerWaalsContact O-CG 3.31Å; L99-N103 PolarHBondContact O-N 2.73Å |
| 100 | W | 84.3 | Confident | 82.1 | Confident | 169 Ų | 169 | 107 Ų | 107 | 64% | 0.64 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -64.7 | -45.4 | 179.6 | -72.8 | 37.8 | 0 | 0 | 0 | 110.8 | I96 D97 R102 N103 E104 | I96-W100 HydrophobicContact CG2-CD2 4.34Å; I96-W100 HydrophobicContact CG2-CG 4.32Å; I96-W100 HydrophobicContact CG2-CZ2 4.16Å; I96-W100 PolarHBondContact O-N 2.96Å; D97-W100 PolarHBondContact O-N 3.1Å; W100-R102 VanDerWaalsContact C-N 3.27Å; W100-R102 PolarHBondContact O-N 3.23Å; W100-N103 PolarHBondContact O-N 3.01Å; W100-E104 WeakPolarHBondContact O-CB 3.36Å; W100-E104 PolarHBondContact O-N 2.98Å |
| 101 | K | 87.3 | Confident | 83.9 | Confident | 120 Ų | 120 | 105.7 Ų | 105.7 | 52% | 0.522 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.4 | -39.3 | 172.4 | -73 | 166.4 | -174.5 | 164.9 | 0 | 111.1 | D97 R105 | D97-K101 VanDerWaalsContact O-CB 3.25Å; D97-K101 WeakPolarHBondContact O-CB 3.24Å; D97-K101 WeakPolarHBondContact O-CD 3.48Å; D97-K101 WeakPolarHBondContact O-CG 3.19Å; D97-K101 PolarHBondContact O-N 3.43Å; K101-R105 VanDerWaalsContact C-NH1 3.33Å; K101-R105 WeakPolarHBondContact O-CG 3.32Å; K101-R105 PolarHBondContact O-N 3.47Å; K101-R105 VanDerWaalsContact O-N 3.13Å; K101-R105 PolarHBondContact O-NH1 3.29Å; K101-R105 VanDerWaalsContact O-NH1 3.14Å |
| 102 | R | 87.8 | Confident | 85.7 | Confident | 167 Ų | 167 | 100.6 Ų | 100.6 | 63% | 0.63 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -67 | -46.5 | 176.3 | -176.4 | -178.5 | 176 | 107.2 | 2.3 | 112 | S98 L99 W100 E104 R105 E106 | S98-R102 WeakPolarHBondContact O-CB 3.44Å; S98-R102 PolarHBondContact O-N 3.44Å; L99-R102 WeakPolarHBondContact O-CB 3.49Å; L99-R102 PolarHBondContact O-N 3.41Å; L99-R102 VanDerWaalsContact O-N 3.14Å; W100-R102 VanDerWaalsContact C-N 3.27Å; W100-R102 PolarHBondContact O-N 3.23Å; R102-E104 VanDerWaalsContact C-N 3.33Å; R102-E104 PolarHBondContact O-N 3.41Å; R102-R105 WeakPolarHBondContact O-CB 3.48Å; R102-R105 PolarHBondContact O-N 2.92Å; R102-E106 PolarHBondContact O-N 2.98Å |
| 103 | N | 93.6 | Very high | 87.5 | Confident | 92 Ų | 92 | 102.9 Ų | 102.9 | 49% | 0.492 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -64.3 | -38.6 | 178.6 | -72.1 | -13.5 | 0 | 0 | 0 | 111.7 | L99 W100 E106 R107 | L99-N103 WeakPolarHBondContact O-CB 3.36Å; L99-N103 VanDerWaalsContact O-CG 3.31Å; L99-N103 PolarHBondContact O-N 2.73Å; W100-N103 PolarHBondContact O-N 3.01Å; N103-E106 PolarHBondContact O-N 2.97Å; N103-R107 WeakPolarHBondContact O-CG 3.25Å; N103-R107 PolarHBondContact O-N 3.36Å |
| 104 | E | 95.6 | Very high | 89.2 | Confident | 85 Ų | 85 | 98.4 Ų | 98.4 | 40% | 0.397 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -66.2 | -40.9 | 176.4 | -174.1 | 51.9 | -143.3 | 0 | 0 | 111.6 | W100 R102 E106 R107 H108 R111 | W100-E104 WeakPolarHBondContact O-CB 3.36Å; W100-E104 PolarHBondContact O-N 2.98Å; R102-E104 VanDerWaalsContact C-N 3.33Å; R102-E104 PolarHBondContact O-N 3.41Å; E104-E106 VanDerWaalsContact C-N 3.3Å; E104-E106 PolarHBondContact O-N 3.31Å; E104-R107 PolarHBondContact O-N 3Å; E104-R107 IonicContact OE2-NH1 3.65Å; E104-H108 PolarHBondContact O-N 2.77Å; E104-R111 IonicContact OE1-NH2 3.97Å; E104-R111 PolarHBondContact OE1-NH2 3.43Å; E104-R111 VanDerWaalsContact OE1-NH2 3.14Å |
| 105 | R | 97 | Very high | 90.6 | Very high | 154 Ų | 154 | 95.7 Ų | 95.7 | 58% | 0.581 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -59 | -42.9 | 171 | -73.2 | -169.7 | -52.4 | -87.5 | 9.2 | 111.7 | K101 R102 H108 R109 | K101-R105 VanDerWaalsContact C-NH1 3.33Å; K101-R105 WeakPolarHBondContact O-CG 3.32Å; K101-R105 PolarHBondContact O-N 3.47Å; K101-R105 VanDerWaalsContact O-N 3.13Å; K101-R105 PolarHBondContact O-NH1 3.29Å; K101-R105 VanDerWaalsContact O-NH1 3.14Å; R102-R105 WeakPolarHBondContact O-CB 3.48Å; R102-R105 PolarHBondContact O-N 2.92Å; R105-H108 PolarHBondContact O-N 3.12Å; R105-R109 PolarHBondContact O-N 2.96Å |
| 106 | E | 97.5 | Very high | 92 | Very high | 84 Ų | 84 | 96.2 Ų | 96.2 | 39% | 0.393 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -65.4 | -41.3 | 178.6 | 178.9 | 55.1 | -162.8 | 0 | 0 | 112.2 | R102 N103 E104 H108 R109 V110 | R102-E106 PolarHBondContact O-N 2.98Å; N103-E106 PolarHBondContact O-N 2.97Å; E104-E106 VanDerWaalsContact C-N 3.3Å; E104-E106 PolarHBondContact O-N 3.31Å; E106-H108 VanDerWaalsContact C-N 3.32Å; E106-H108 PolarHBondContact O-N 3.35Å; E106-R109 WeakPolarHBondContact O-CB 3.41Å; E106-R109 PolarHBondContact O-N 3.26Å; E106-R109 IonicContact OE1-CZ 3.53Å; E106-R109 IonicContact OE1-NE 3.14Å; E106-R109 PolarHBondContact OE1-NE 3.48Å; E106-R109 IonicContact OE1-NH2 2.67Å; E106-R109 PolarHBondContact OE1-NH2 3.07Å; E106-R109 IonicContact OE2-CZ 3.41Å; E106-R109 IonicContact OE2-NE 3.34Å; E106-R109 PolarHBondContact OE2-NE 3.41Å; E106-R109 IonicContact OE2-NH2 2.78Å; E106-V110 WeakPolarHBondContact O-CG2 3.29Å; E106-V110 PolarHBondContact O-N 3.49Å; E106-V110 WeakPolarHBondContact OE1-CG2 3.13Å |
| 107 | R | 98.2 | Very high | 93.3 | Very high | 168 Ų | 168 | 96.6 Ų | 96.6 | 63% | 0.634 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -58.8 | -43.4 | 172 | -73.9 | 174.6 | 174.4 | 178.4 | -1.7 | 111.8 | N103 E104 V110 R111 | N103-R107 WeakPolarHBondContact O-CG 3.25Å; N103-R107 PolarHBondContact O-N 3.36Å; E104-R107 PolarHBondContact O-N 3Å; E104-R107 IonicContact OE2-NH1 3.65Å; R107-V110 PolarHBondContact O-N 3.03Å; R107-R111 WeakPolarHBondContact O-CG 3.39Å; R107-R111 PolarHBondContact O-N 3.09Å |
| 108 | H | 98.2 | Very high | 94.1 | Very high | 119 Ų | 119 | 98.7 Ų | 98.7 | 55% | 0.551 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -63.7 | -44.1 | 176.3 | -173.7 | 71.5 | 0 | 0 | 0 | 112.2 | E104 R105 E106 V110 R111 C112 | E104-H108 PolarHBondContact O-N 2.77Å; R105-H108 PolarHBondContact O-N 3.12Å; E106-H108 VanDerWaalsContact C-N 3.32Å; E106-H108 PolarHBondContact O-N 3.35Å; H108-V110 PolarHBondContact O-N 3.46Å; H108-R111 WeakPolarHBondContact O-CB 3.29Å; H108-R111 PolarHBondContact O-N 3.42Å; H108-C112 PolarHBondContact O-N 2.94Å |
| 109 | R | 98.4 | Very high | 94.8 | Very high | 132 Ų | 132 | 101.6 Ų | 101.6 | 50% | 0.498 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -57.8 | -47.1 | 175.4 | -169.1 | -163.8 | 68.5 | 75.7 | -0.1 | 111.6 | R105 E106 C112 V113 | R105-R109 PolarHBondContact O-N 2.96Å; E106-R109 WeakPolarHBondContact O-CB 3.41Å; E106-R109 PolarHBondContact O-N 3.26Å; E106-R109 IonicContact OE1-CZ 3.53Å; E106-R109 IonicContact OE1-NE 3.14Å; E106-R109 PolarHBondContact OE1-NE 3.48Å; E106-R109 IonicContact OE1-NH2 2.67Å; E106-R109 PolarHBondContact OE1-NH2 3.07Å; E106-R109 IonicContact OE2-CZ 3.41Å; E106-R109 IonicContact OE2-NE 3.34Å; E106-R109 PolarHBondContact OE2-NE 3.41Å; E106-R109 IonicContact OE2-NH2 2.78Å; R109-C112 PolarHBondContact O-N 2.85Å; R109-V113 WeakPolarHBondContact O-CG2 3.44Å; R109-V113 PolarHBondContact O-N 3.5Å; R109-V113 VanDerWaalsContact O-N 3.14Å |
| 110 | V | 98.3 | Very high | 95.6 | Very high | 51 Ų | 51 | 101.5 Ų | 101.5 | 31% | 0.309 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -65.7 | -38.5 | 178.5 | 173.3 | 0 | 0 | 0 | 0 | 111.8 | E106 R107 H108 V113 N114 | E106-V110 WeakPolarHBondContact O-CG2 3.29Å; E106-V110 PolarHBondContact O-N 3.49Å; E106-V110 WeakPolarHBondContact OE1-CG2 3.13Å; R107-V110 PolarHBondContact O-N 3.03Å; H108-V110 PolarHBondContact O-N 3.46Å; V110-V113 PolarHBondContact O-N 3.06Å; V110-N114 WeakPolarHBondContact O-CB 3.32Å; V110-N114 VanDerWaalsContact O-CG 3.29Å; V110-N114 PolarHBondContact O-N 3.35Å |
| 111 | R | 98.2 | Very high | 96.1 | Very high | 123 Ų | 123 | 95.9 Ų | 95.9 | 46% | 0.464 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -57.6 | -50.1 | 173.6 | -80 | -173.1 | -73.8 | -178.5 | -5.6 | 111.6 | E104 R107 H108 V113 N114 E115 | E104-R111 IonicContact OE1-NH2 3.97Å; E104-R111 PolarHBondContact OE1-NH2 3.43Å; E104-R111 VanDerWaalsContact OE1-NH2 3.14Å; R107-R111 WeakPolarHBondContact O-CG 3.39Å; R107-R111 PolarHBondContact O-N 3.09Å; H108-R111 WeakPolarHBondContact O-CB 3.29Å; H108-R111 PolarHBondContact O-N 3.42Å; R111-V113 VanDerWaalsContact C-N 3.32Å; R111-V113 PolarHBondContact O-N 3.21Å; R111-N114 PolarHBondContact O-N 3.15Å; R111-N114 VanDerWaalsContact O-N 3.08Å; R111-E115 WeakPolarHBondContact O-CG 3.31Å; R111-E115 PolarHBondContact O-N 2.92Å |
| 112 | C | 97.5 | Very high | 96.4 | Very high | 72 Ų | 72 | 96.1 Ų | 96.1 | 49% | 0.486 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -57.3 | -43.3 | 177.3 | 179.8 | 0 | 0 | 0 | 0 | 112.2 | H108 R109 N114 E115 G116 | H108-C112 PolarHBondContact O-N 2.94Å; R109-C112 PolarHBondContact O-N 2.85Å; C112-N114 PolarHBondContact O-N 3.1Å; C112-E115 PolarHBondContact O-N 3.03Å; C112-G116 PolarHBondContact O-N 3.38Å |
| 113 | V | 98 | Very high | 96.7 | Very high | 61 Ų | 61 | 94.7 Ų | 94.7 | 37% | 0.37 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.2 | -44.8 | 174.8 | 172.8 | 0 | 0 | 0 | 0 | 111.5 | R109 V110 R111 G116 Y117 | R109-V113 WeakPolarHBondContact O-CG2 3.44Å; R109-V113 PolarHBondContact O-N 3.5Å; R109-V113 VanDerWaalsContact O-N 3.14Å; V110-V113 PolarHBondContact O-N 3.06Å; R111-V113 VanDerWaalsContact C-N 3.32Å; R111-V113 PolarHBondContact O-N 3.21Å; V113-G116 WeakPolarHBondContact O-CA 3.48Å; V113-G116 PolarHBondContact O-N 2.91Å; V113-G116 VanDerWaalsContact O-N 3.14Å; V113-Y117 HydrophobicContact CG1-CD2 3.95Å; V113-Y117 HydrophobicContact CG1-CE2 3.81Å; V113-Y117 WeakPolarHBondContact O-CD2 3.39Å; V113-Y117 PolarHBondContact O-N 3.42Å |
| 114 | N | 97.8 | Very high | 96.7 | Very high | 59 Ų | 59 | 90.8 Ų | 90.8 | 32% | 0.316 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -66.3 | -38.7 | -180 | -70.3 | -16.7 | 0 | 0 | 0 | 111.9 | V110 R111 C112 G116 Y117 E118 K135 | V110-N114 WeakPolarHBondContact O-CB 3.32Å; V110-N114 VanDerWaalsContact O-CG 3.29Å; V110-N114 PolarHBondContact O-N 3.35Å; R111-N114 PolarHBondContact O-N 3.15Å; R111-N114 VanDerWaalsContact O-N 3.08Å; C112-N114 PolarHBondContact O-N 3.1Å; N114-G116 VanDerWaalsContact C-N 3.25Å; N114-G116 PolarHBondContact O-N 3.08Å; N114-Y117 WeakPolarHBondContact O-CB 3.38Å; N114-Y117 PolarHBondContact O-N 3.14Å; N114-Y117 VanDerWaalsContact O-N 3.1Å; N114-E118 PolarHBondContact O-N 3.28Å; N114-K135 PolarHBondContact OD1-NZ 2.97Å |
| 115 | E | 97.8 | Very high | 96.5 | Very high | 105 Ų | 105 | 88.9 Ų | 88.9 | 49% | 0.491 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -58.2 | -39.3 | 170.6 | -72.2 | 170.3 | -156.1 | 0 | 0 | 111.5 | R111 C112 E118 R119 | R111-E115 WeakPolarHBondContact O-CG 3.31Å; R111-E115 PolarHBondContact O-N 2.92Å; C112-E115 PolarHBondContact O-N 3.03Å; E115-E118 PolarHBondContact O-N 3.36Å; E115-R119 WeakPolarHBondContact O-CG 3.37Å; E115-R119 PolarHBondContact O-N 2.88Å |
| 116 | G | 97.4 | Very high | 96 | Very high | 37 Ų | 37 | 82.7 Ų | 82.7 | 38% | 0.381 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -60.3 | -42.7 | 171.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | C112 V113 N114 R119 L120 | C112-G116 PolarHBondContact O-N 3.38Å; V113-G116 WeakPolarHBondContact O-CA 3.48Å; V113-G116 PolarHBondContact O-N 2.91Å; V113-G116 VanDerWaalsContact O-N 3.14Å; N114-G116 VanDerWaalsContact C-N 3.25Å; N114-G116 PolarHBondContact O-N 3.08Å; G116-R119 PolarHBondContact O-N 3.08Å; G116-L120 PolarHBondContact O-N 3.08Å |
| 117 | Y | 97.6 | Very high | 95.2 | Very high | 50 Ų | 50 | 89.3 Ų | 89.3 | 20% | 0.196 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -62.8 | -41 | 174.3 | -87.1 | -82.3 | 0 | 0 | 0 | 112.4 | V113 N114 L120 R121 K135 T138 L139 | V113-Y117 HydrophobicContact CG1-CD2 3.95Å; V113-Y117 HydrophobicContact CG1-CE2 3.81Å; V113-Y117 WeakPolarHBondContact O-CD2 3.39Å; V113-Y117 PolarHBondContact O-N 3.42Å; N114-Y117 WeakPolarHBondContact O-CB 3.38Å; N114-Y117 PolarHBondContact O-N 3.14Å; N114-Y117 VanDerWaalsContact O-N 3.1Å; Y117-L120 PolarHBondContact O-N 3.14Å; Y117-R121 WeakPolarHBondContact O-CG 3.39Å; Y117-R121 PolarHBondContact O-N 3.44Å; Y117-K135 HydrophobicContact CD1-CB 4.46Å; Y117-K135 HydrophobicContact CD1-CG 4.34Å; Y117-K135 HydrophobicContact CE1-CB 3.81Å; Y117-K135 HydrophobicContact CE1-CG 4.06Å; Y117-K135 HydrophobicContact CE2-CD 4.05Å; Y117-K135 HydrophobicContact CE2-CG 4.4Å; Y117-T138 HydrophobicContact CD1-CG2 4.09Å; Y117-L139 HydrophobicContact CE1-CD2 4.15Å; Y117-L139 HydrophobicContact CE1-CG 4.17Å |
| 118 | E | 95.3 | Very high | 94.5 | Very high | 94 Ų | 94 | 83.7 Ų | 83.7 | 44% | 0.439 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -66.2 | -41.5 | 176.9 | -61.9 | -48 | 140.9 | 0 | 0 | 111.9 | N114 E115 L120 R121 N122 | N114-E118 PolarHBondContact O-N 3.28Å; E115-E118 PolarHBondContact O-N 3.36Å; E118-L120 VanDerWaalsContact C-N 3.33Å; E118-L120 PolarHBondContact O-N 3.25Å; E118-R121 PolarHBondContact O-N 3.05Å; E118-R121 IonicContact OE1-CZ 2.64Å; E118-R121 IonicContact OE1-NH1 3.02Å; E118-R121 PolarHBondContact OE1-NH1 2.96Å; E118-R121 IonicContact OE2-CZ 3.66Å; E118-R121 IonicContact OE2-NH1 2.8Å; E118-R121 PolarHBondContact OE2-NH1 3.32Å; E118-N122 PolarHBondContact O-N 3.14Å; E118-N122 VanDerWaalsContact O-N 3.14Å; E118-N122 PolarHBondContact O-ND2 3.46Å |
| 119 | R | 95.9 | Very high | 93.8 | Very high | 133 Ų | 133 | 86.8 Ų | 86.8 | 50% | 0.502 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -59 | -45.4 | 173.3 | -70.7 | 178.8 | -167.1 | -174.8 | 5.4 | 111.3 | E115 G116 R121 N122 H123 | E115-R119 WeakPolarHBondContact O-CG 3.37Å; E115-R119 PolarHBondContact O-N 2.88Å; G116-R119 PolarHBondContact O-N 3.08Å; R119-R121 VanDerWaalsContact C-N 3.33Å; R119-R121 PolarHBondContact O-N 3.26Å; R119-N122 WeakPolarHBondContact O-CB 3.31Å; R119-N122 PolarHBondContact O-N 3.39Å; R119-H123 PolarHBondContact O-CD2 3.11Å |
| 120 | L | 96.2 | Very high | 93.1 | Very high | 56 Ų | 56 | 86 Ų | 86 | 29% | 0.293 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -58 | -46.4 | 176.7 | 179.7 | 56.3 | 0 | 0 | 0 | 111.1 | G116 Y117 E118 N122 H123 L124 T138 A142 | G116-L120 PolarHBondContact O-N 3.08Å; Y117-L120 PolarHBondContact O-N 3.14Å; E118-L120 VanDerWaalsContact C-N 3.33Å; E118-L120 PolarHBondContact O-N 3.25Å; L120-N122 VanDerWaalsContact C-N 3.28Å; L120-N122 PolarHBondContact O-N 2.95Å; L120-H123 PolarHBondContact O-N 2.94Å; L120-L124 HydrophobicContact CD1-CD2 4.37Å; L120-L124 WeakPolarHBondContact O-CG 3.43Å; L120-L124 PolarHBondContact O-N 2.85Å; L120-T138 HydrophobicContact CB-CG2 4.44Å; L120-T138 HydrophobicContact CD2-CG2 3.79Å; L120-T138 HydrophobicContact CG-CG2 3.96Å; L120-A142 HydrophobicContact CD1-CB 3.97Å; L120-A142 HydrophobicContact CD2-CB 4.06Å; L120-A142 HydrophobicContact CG-CB 4.36Å |
| 121 | R | 94.5 | Very high | 92.6 | Very high | 51 Ų | 51 | 87.2 Ų | 87.2 | 19% | 0.192 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -59.7 | -34.7 | 178.9 | -72 | 173.5 | -175 | 161 | 7.3 | 113.7 | Y117 E118 R119 H123 L124 I133 T138 | Y117-R121 WeakPolarHBondContact O-CG 3.39Å; Y117-R121 PolarHBondContact O-N 3.44Å; E118-R121 PolarHBondContact O-N 3.05Å; E118-R121 IonicContact OE1-CZ 2.64Å; E118-R121 IonicContact OE1-NH1 3.02Å; E118-R121 PolarHBondContact OE1-NH1 2.96Å; E118-R121 IonicContact OE2-CZ 3.66Å; E118-R121 IonicContact OE2-NH1 2.8Å; E118-R121 PolarHBondContact OE2-NH1 3.32Å; R119-R121 VanDerWaalsContact C-N 3.33Å; R119-R121 PolarHBondContact O-N 3.26Å; R121-H123 PolarHBondContact O-N 3.37Å; R121-L124 PolarHBondContact O-N 2.85Å; R121-L124 VanDerWaalsContact O-N 3.14Å; R121-I133 VanDerWaalsContact CZ-O 3.31Å; R121-I133 PolarHBondContact NH2-O 2.84Å; R121-T138 HydrophobicContact CG-CG2 3.74Å; R121-T138 PolarHBondContact NE-OG1 3.43Å |
| 122 | N | 93.5 | Very high | 92.1 | Very high | 125 Ų | 125 | 92.8 Ų | 92.8 | 67% | 0.668 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -63.5 | -23.7 | 176.8 | -68.3 | -27.1 | 0 | 0 | 0 | 113.2 | E118 R119 L120 | E118-N122 PolarHBondContact O-N 3.14Å; E118-N122 VanDerWaalsContact O-N 3.14Å; E118-N122 PolarHBondContact O-ND2 3.46Å; R119-N122 WeakPolarHBondContact O-CB 3.31Å; R119-N122 PolarHBondContact O-N 3.39Å; L120-N122 VanDerWaalsContact C-N 3.28Å; L120-N122 PolarHBondContact O-N 2.95Å |
| 123 | H | 93.9 | Very high | 91.8 | Very high | 137 Ų | 137 | 90 Ų | 90 | 63% | 0.634 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.3 | -5.7 | 177.8 | -64.4 | -64.9 | 0 | 0 | 0 | 113.7 | R119 L120 R121 Y145 | R119-H123 PolarHBondContact O-CD2 3.11Å; L120-H123 PolarHBondContact O-N 2.94Å; R121-H123 PolarHBondContact O-N 3.37Å; H123-Y145 VanDerWaalsContact O-CE1 3.24Å; H123-Y145 WeakPolarHBondContact O-CE1 3.39Å |
| 124 | L | 93.3 | Very high | 91.6 | Very high | 11 Ų | 11 | 89.6 Ų | 89.6 | 6% | 0.058 | 43% | 0.428 | C | S | . | . | S | Bend | trans | -84.8 | 141.3 | -179.5 | -60.8 | 177.8 | 0 | 0 | 0 | 111.1 | L120 R121 L126 T138 L141 A142 Y145 | L120-L124 HydrophobicContact CD1-CD2 4.37Å; L120-L124 WeakPolarHBondContact O-CG 3.43Å; L120-L124 PolarHBondContact O-N 2.85Å; R121-L124 PolarHBondContact O-N 2.85Å; R121-L124 VanDerWaalsContact O-N 3.14Å; L124-L126 HydrophobicContact CB-CD1 4Å; L124-L126 HydrophobicContact CB-CG 4.04Å; L124-L126 PolarHBondContact O-N 2.96Å; L124-T138 HydrophobicContact CD1-CG2 3.84Å; L124-L141 HydrophobicContact CB-CD2 3.85Å; L124-L141 HydrophobicContact CB-CG 4.14Å; L124-L141 HydrophobicContact CD1-CB 4.06Å; L124-L141 HydrophobicContact CD1-CD2 3.74Å; L124-L141 HydrophobicContact CD1-CG 3.82Å; L124-L141 HydrophobicContact CD2-CG 4.18Å; L124-L141 HydrophobicContact CG-CD2 4.27Å; L124-L141 HydrophobicContact CG-CG 4.24Å; L124-A142 HydrophobicContact CD2-CB 3.97Å; L124-Y145 HydrophobicContact CD2-CD1 4.4Å |
| 125 | P | 91 | Very high | 91.5 | Very high | 44 Ų | 44 | 91.3 Ų | 91.3 | 29% | 0.286 | 43% | 0.432 | S | S | . | . | trans | -75.3 | 72.2 | 177.4 | 31.8 | -36.8 | 0 | 0 | 0 | 111.3 | Y145 F165 | P125-Y145 HydrophobicContact CG-CD1 4.48Å; P125-Y145 HydrophobicContact CG-CD2 3.68Å; P125-Y145 HydrophobicContact CG-CE2 3.91Å; P125-Y145 HydrophobicContact CG-CG 3.99Å; P125-F165 HydrophobicContact CB-CD2 3.81Å; P125-F165 HydrophobicContact CB-CE2 3.89Å; P125-F165 HydrophobicContact CB-CG 4.4Å; P125-F165 HydrophobicContact CG-CB 4.48Å; P125-F165 HydrophobicContact CG-CD1 3.89Å; P125-F165 HydrophobicContact CG-CD2 3.4Å; P125-F165 HydrophobicContact CG-CE1 3.8Å; P125-F165 HydrophobicContact CG-CE2 3.35Å; P125-F165 HydrophobicContact CG-CG 3.66Å; P125-F165 HydrophobicContact CG-CZ 3.53Å; P125-F165 WeakPolarHBondContact O-CB 3.37Å | ||
| 126 | L | 87.1 | Confident | 91.4 | Very high | 25 Ų | 25 | 90.1 Ų | 90.1 | 13% | 0.131 | 43% | 0.432 | C | S | . | . | trans | -91.5 | 129.5 | 179.3 | -67 | 155.4 | 0 | 0 | 0 | 110.2 | L124 N128 I133 L141 | L124-L126 HydrophobicContact CB-CD1 4Å; L124-L126 HydrophobicContact CB-CG 4.04Å; L124-L126 PolarHBondContact O-N 2.96Å; L126-N128 VanDerWaalsContact C-N 3.33Å; L126-I133 HydrophobicContact CD1-CD1 3.34Å; L126-I133 HydrophobicContact CD2-CD1 3.31Å; L126-I133 HydrophobicContact CD2-CG1 4.15Å; L126-I133 HydrophobicContact CG-CD1 3.93Å; L126-L141 HydrophobicContact CD2-CD2 3.45Å; L126-L141 VanDerWaalsContact CD2-CD2 3.45Å; L126-L141 HydrophobicContact CG-CD2 4.03Å | ||
| 127 | R | 81.9 | Confident | 91.2 | Very high | 222 Ų | 222 | 91 Ų | 91 | 84% | 0.838 | 43% | 0.426 | S | S | * | . | S | Bend | trans | -71.5 | -35.3 | 176.4 | -170 | 169.4 | 68.1 | 165 | 1.7 | 110.9 | E166 | R127-E166 HydrophobicContact CB-CG 4.43Å; R127-E166 WeakPolarHBondContact CB-OE1 3.44Å; R127-E166 PolarHBondContact N-OE1 3.2Å |
| 128 | N | 82.5 | Confident | 91 | Very high | 50 Ų | 50 | 88.6 Ų | 88.6 | 27% | 0.267 | 42% | 0.417 | S | S | . | . | trans | -116.1 | 84.7 | -179.3 | 50.1 | 21.9 | 0 | 0 | 0 | 110.9 | L126 S130 K131 E166 | L126-N128 VanDerWaalsContact C-N 3.33Å; N128-S130 PolarHBondContact O-N 3.42Å; N128-K131 HydrophobicContact CB-CB 4.13Å; N128-K131 VanDerWaalsContact CG-CB 3.44Å; N128-K131 VanDerWaalsContact ND2-CD 3.33Å; N128-K131 WeakPolarHBondContact ND2-CD 3.45Å; N128-K131 WeakPolarHBondContact O-CB 3.44Å; N128-K131 PolarHBondContact O-N 3.26Å; N128-K131 VanDerWaalsContact OD1-CB 3.22Å; N128-K131 WeakPolarHBondContact OD1-CB 3.5Å; N128-K131 WeakPolarHBondContact OD1-CD 3.38Å; N128-E166 PolarHBondContact ND2-OE1 3.3Å; N128-E166 PolarHBondContact ND2-OE2 3.13Å; N128-E166 PolarHBondContact OD1-OE1 3.3Å; N128-E166 PolarHBondContact OD1-OE2 3.32Å | ||
| 129 | K | 82.7 | Confident | 91.1 | Very high | 184 Ų | 184 | 87.9 Ų | 87.9 | 80% | 0.8 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.8 | -16.4 | 177.8 | -63.7 | -176.1 | 179.1 | -177.8 | 0 | 114.5 | ||
| 130 | S | 84.9 | Confident | 91 | Very high | 115 Ų | 115 | 88 Ų | 88 | 80% | 0.804 | 42% | 0.416 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -15.1 | 174.1 | 57.8 | 0 | 0 | 0 | 0 | 114.4 | N128 R132 | N128-S130 PolarHBondContact O-N 3.42Å; S130-R132 PolarHBondContact O-N 2.91Å |
| 131 | K | 86.8 | Confident | 90.8 | Very high | 78 Ų | 78 | 85.3 Ų | 85.3 | 34% | 0.339 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -67.3 | 128.7 | 179.2 | 178.4 | 172.8 | 166.8 | -176 | 0 | 109.4 | N128 I133 E166 | N128-K131 HydrophobicContact CB-CB 4.13Å; N128-K131 VanDerWaalsContact CG-CB 3.44Å; N128-K131 VanDerWaalsContact ND2-CD 3.33Å; N128-K131 WeakPolarHBondContact ND2-CD 3.45Å; N128-K131 WeakPolarHBondContact O-CB 3.44Å; N128-K131 PolarHBondContact O-N 3.26Å; N128-K131 VanDerWaalsContact OD1-CB 3.22Å; N128-K131 WeakPolarHBondContact OD1-CB 3.5Å; N128-K131 WeakPolarHBondContact OD1-CD 3.38Å; K131-I133 PolarHBondContact O-N 3.49Å; K131-E166 IonicContact NZ-OE2 3.9Å; K131-E166 PolarHBondContact NZ-OE2 2.91Å |
| 132 | R | 89.4 | Confident | 90.9 | Very high | 239 Ų | 239 | 83.5 Ų | 83.5 | 90% | 0.902 | 40% | 0.398 | S | S | * | . | trans | -72.9 | 118.7 | 172.4 | -62.1 | -175.2 | 70.4 | -171.7 | 1.9 | 108.6 | S130 | S130-R132 PolarHBondContact O-N 2.91Š| ||
| 133 | I | 90.8 | Very high | 91 | Very high | 13 Ų | 13 | 82.2 Ų | 82.2 | 7% | 0.067 | 39% | 0.39 | C | S | . | . | trans | -107.6 | 132.4 | -178.8 | -56.4 | 145.9 | 0 | 0 | 0 | 108.6 | R121 L126 K131 E137 | R121-I133 VanDerWaalsContact CZ-O 3.31Å; R121-I133 PolarHBondContact NH2-O 2.84Å; L126-I133 HydrophobicContact CD1-CD1 3.34Å; L126-I133 HydrophobicContact CD2-CD1 3.31Å; L126-I133 HydrophobicContact CD2-CG1 4.15Å; L126-I133 HydrophobicContact CG-CD1 3.93Å; K131-I133 PolarHBondContact O-N 3.49Å; I133-E137 HydrophobicContact CG2-CB 3.44Å; I133-E137 VanDerWaalsContact CG2-CB 3.44Å | ||
| 134 | S | 93.8 | Very high | 90.9 | Very high | 54 Ų | 54 | 78.2 Ų | 78.2 | 38% | 0.378 | 37% | 0.369 | S | S | . | . | trans | -67.6 | 165.4 | 176.9 | 68.8 | 0 | 0 | 0 | 0 | 112.3 | V136 E137 T138 | S134-V136 VanDerWaalsContact C-N 3.33Å; S134-V136 PolarHBondContact O-N 3.22Å; S134-E137 VanDerWaalsContact CB-OE2 3.29Å; S134-E137 WeakPolarHBondContact CB-OE2 3.4Å; S134-E137 PolarHBondContact N-OE2 2.88Å; S134-E137 PolarHBondContact O-N 2.78Å; S134-E137 VanDerWaalsContact OG-CB 3.29Å; S134-E137 WeakPolarHBondContact OG-CB 3.29Å; S134-E137 VanDerWaalsContact OG-CD 3.26Å; S134-E137 WeakPolarHBondContact OG-CG 3.49Å; S134-E137 PolarHBondContact OG-N 3.34Å; S134-E137 PolarHBondContact OG-OE2 3Å; S134-T138 WeakPolarHBondContact O-CB 3.37Å; S134-T138 PolarHBondContact O-N 2.99Å; S134-T138 PolarHBondContact O-OG1 3.14Å | ||
| 135 | K | 95.5 | Very high | 91 | Very high | 95 Ų | 95 | 80.9 Ų | 80.9 | 41% | 0.413 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -60.1 | -44.4 | 177 | -66.5 | -170.3 | 175.2 | -169.6 | 0 | 111.6 | N114 Y117 T138 L139 | N114-K135 PolarHBondContact OD1-NZ 2.97Å; Y117-K135 HydrophobicContact CD1-CB 4.46Å; Y117-K135 HydrophobicContact CD1-CG 4.34Å; Y117-K135 HydrophobicContact CE1-CB 3.81Å; Y117-K135 HydrophobicContact CE1-CG 4.06Å; Y117-K135 HydrophobicContact CE2-CD 4.05Å; Y117-K135 HydrophobicContact CE2-CG 4.4Å; K135-T138 PolarHBondContact O-N 3.46Å; K135-L139 WeakPolarHBondContact O-CG 3.45Å; K135-L139 PolarHBondContact O-N 3.22Å; K135-L139 VanDerWaalsContact O-N 3.12Å |
| 136 | V | 95.5 | Very high | 91.2 | Very high | 80 Ų | 80 | 83.3 Ų | 83.3 | 49% | 0.485 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -64.7 | -44.7 | 179.9 | 175.9 | 0 | 0 | 0 | 0 | 110.9 | S134 T138 L139 R140 | S134-V136 VanDerWaalsContact C-N 3.33Å; S134-V136 PolarHBondContact O-N 3.22Å; V136-T138 VanDerWaalsContact C-N 3.35Å; V136-T138 PolarHBondContact O-N 3.26Å; V136-L139 PolarHBondContact O-N 3.43Å; V136-R140 HydrophobicContact CG1-CG 4.45Å; V136-R140 WeakPolarHBondContact O-CG 3.5Å; V136-R140 PolarHBondContact O-N 3.14Å |
| 137 | E | 93 | Very high | 91.5 | Very high | 54 Ų | 54 | 88 Ų | 88 | 25% | 0.252 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62 | -42 | 176.1 | -74.9 | 171 | 136.4 | 0 | 0 | 112.3 | I133 S134 L139 R140 L141 I168 | I133-E137 HydrophobicContact CG2-CB 3.44Å; I133-E137 VanDerWaalsContact CG2-CB 3.44Å; S134-E137 VanDerWaalsContact CB-OE2 3.29Å; S134-E137 WeakPolarHBondContact CB-OE2 3.4Å; S134-E137 PolarHBondContact N-OE2 2.88Å; S134-E137 PolarHBondContact O-N 2.78Å; S134-E137 VanDerWaalsContact OG-CB 3.29Å; S134-E137 WeakPolarHBondContact OG-CB 3.29Å; S134-E137 VanDerWaalsContact OG-CD 3.26Å; S134-E137 WeakPolarHBondContact OG-CG 3.49Å; S134-E137 PolarHBondContact OG-N 3.34Å; S134-E137 PolarHBondContact OG-OE2 3Å; E137-L139 VanDerWaalsContact C-N 3.28Å; E137-L139 PolarHBondContact O-N 2.67Å; E137-R140 PolarHBondContact O-N 3.22Å; E137-L141 VanDerWaalsContact O-CB 3.25Å; E137-L141 WeakPolarHBondContact O-CB 3.43Å; E137-L141 PolarHBondContact O-N 3.34Å; E137-I168 HydrophobicContact CB-CD1 3.59Å; E137-I168 HydrophobicContact CB-CG2 4.33Å; E137-I168 HydrophobicContact CG-CB 4.19Å; E137-I168 HydrophobicContact CG-CD1 3.74Å; E137-I168 HydrophobicContact CG-CG2 3.79Å |
| 138 | T | 94 | Very high | 91.9 | Very high | 0 Ų | 0 | 79.3 Ų | 79.3 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -57.5 | -44.2 | 176.6 | -54.1 | 0 | 0 | 0 | 0 | 110.5 | Y117 L120 R121 L124 S134 K135 V136 A142 | Y117-T138 HydrophobicContact CD1-CG2 4.09Å; L120-T138 HydrophobicContact CB-CG2 4.44Å; L120-T138 HydrophobicContact CD2-CG2 3.79Å; L120-T138 HydrophobicContact CG-CG2 3.96Å; R121-T138 HydrophobicContact CG-CG2 3.74Å; R121-T138 PolarHBondContact NE-OG1 3.43Å; L124-T138 HydrophobicContact CD1-CG2 3.84Å; S134-T138 WeakPolarHBondContact O-CB 3.37Å; S134-T138 PolarHBondContact O-N 2.99Å; S134-T138 PolarHBondContact O-OG1 3.14Å; K135-T138 PolarHBondContact O-N 3.46Å; V136-T138 VanDerWaalsContact C-N 3.35Å; V136-T138 PolarHBondContact O-N 3.26Å; T138-A142 WeakPolarHBondContact O-CB 3.48Å; T138-A142 PolarHBondContact O-N 2.9Å |
| 139 | L | 96.2 | Very high | 92.4 | Very high | 80 Ų | 80 | 80 Ų | 80 | 42% | 0.419 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -67.3 | -45.4 | 178.1 | -65.3 | 177.2 | 0 | 0 | 0 | 112.4 | Y117 K135 V136 E137 L141 A142 I143 | Y117-L139 HydrophobicContact CE1-CD2 4.15Å; Y117-L139 HydrophobicContact CE1-CG 4.17Å; K135-L139 WeakPolarHBondContact O-CG 3.45Å; K135-L139 PolarHBondContact O-N 3.22Å; K135-L139 VanDerWaalsContact O-N 3.12Å; V136-L139 PolarHBondContact O-N 3.43Å; E137-L139 VanDerWaalsContact C-N 3.28Å; E137-L139 PolarHBondContact O-N 2.67Å; L139-L141 VanDerWaalsContact C-N 3.29Å; L139-L141 PolarHBondContact O-N 3.27Å; L139-A142 PolarHBondContact O-N 2.82Å; L139-I143 WeakPolarHBondContact O-CG1 3.29Å; L139-I143 PolarHBondContact O-N 3.26Å |
| 140 | R | 94.3 | Very high | 92.9 | Very high | 135 Ų | 135 | 76.8 Ų | 76.8 | 51% | 0.509 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -59.2 | -43.2 | 177.5 | -72.8 | 176.3 | 178.7 | 167.2 | 0.8 | 111.4 | V136 E137 I143 R144 I168 | V136-R140 HydrophobicContact CG1-CG 4.45Å; V136-R140 WeakPolarHBondContact O-CG 3.5Å; V136-R140 PolarHBondContact O-N 3.14Å; E137-R140 PolarHBondContact O-N 3.22Å; R140-I143 PolarHBondContact O-N 2.92Å; R140-R144 PolarHBondContact O-N 2.85Å; R140-R144 VanDerWaalsContact O-N 3.09Å; R140-I168 HydrophobicContact CB-CG2 4.22Å |
| 141 | L | 93.3 | Very high | 93.2 | Very high | 0 Ų | 0 | 75.1 Ų | 75.1 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -67.1 | -41.6 | 178.9 | -179.4 | 54.5 | 0 | 0 | 0 | 111.8 | L124 L126 E137 L139 R144 Y145 F165 | L124-L141 HydrophobicContact CB-CD2 3.85Å; L124-L141 HydrophobicContact CB-CG 4.14Å; L124-L141 HydrophobicContact CD1-CB 4.06Å; L124-L141 HydrophobicContact CD1-CD2 3.74Å; L124-L141 HydrophobicContact CD1-CG 3.82Å; L124-L141 HydrophobicContact CD2-CG 4.18Å; L124-L141 HydrophobicContact CG-CD2 4.27Å; L124-L141 HydrophobicContact CG-CG 4.24Å; L126-L141 HydrophobicContact CD2-CD2 3.45Å; L126-L141 VanDerWaalsContact CD2-CD2 3.45Å; L126-L141 HydrophobicContact CG-CD2 4.03Å; E137-L141 VanDerWaalsContact O-CB 3.25Å; E137-L141 WeakPolarHBondContact O-CB 3.43Å; E137-L141 PolarHBondContact O-N 3.34Å; L139-L141 VanDerWaalsContact C-N 3.29Å; L139-L141 PolarHBondContact O-N 3.27Å; L141-R144 PolarHBondContact O-N 3.36Å; L141-Y145 WeakPolarHBondContact O-CB 3.34Å; L141-Y145 PolarHBondContact O-N 3.39Å; L141-F165 HydrophobicContact CD1-CB 3.65Å; L141-F165 HydrophobicContact CD1-CD1 3.19Å; L141-F165 HydrophobicContact CD1-CE1 4.09Å; L141-F165 HydrophobicContact CD1-CG 3.78Å |
| 142 | A | 95.8 | Very high | 93.4 | Very high | 12 Ų | 12 | 74.5 Ų | 74.5 | 10% | 0.099 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -59.9 | -46.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L120 L124 T138 L139 R144 Y145 I146 | L120-A142 HydrophobicContact CD1-CB 3.97Å; L120-A142 HydrophobicContact CD2-CB 4.06Å; L120-A142 HydrophobicContact CG-CB 4.36Å; L124-A142 HydrophobicContact CD2-CB 3.97Å; T138-A142 WeakPolarHBondContact O-CB 3.48Å; T138-A142 PolarHBondContact O-N 2.9Å; L139-A142 PolarHBondContact O-N 2.82Å; A142-R144 PolarHBondContact O-N 3.14Å; A142-Y145 PolarHBondContact O-N 3.32Å; A142-I146 VanDerWaalsContact O-CG1 3.32Å; A142-I146 WeakPolarHBondContact O-CG1 3.43Å; A142-I146 PolarHBondContact O-N 3.13Å |
| 143 | I | 95.1 | Very high | 93.5 | Very high | 99 Ų | 99 | 69.8 Ų | 69.8 | 51% | 0.508 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -60.8 | -46.5 | 177.6 | -66.4 | 166.3 | 0 | 0 | 0 | 110.6 | L139 R140 Y145 I146 K147 | L139-I143 WeakPolarHBondContact O-CG1 3.29Å; L139-I143 PolarHBondContact O-N 3.26Å; R140-I143 PolarHBondContact O-N 2.92Å; I143-Y145 VanDerWaalsContact C-N 3.31Å; I143-Y145 PolarHBondContact O-N 3.21Å; I143-I146 PolarHBondContact O-N 3.12Å; I143-K147 HydrophobicContact CG2-CD 4.46Å; I143-K147 WeakPolarHBondContact O-CG 3.49Å; I143-K147 PolarHBondContact O-N 3.34Å |
| 144 | R | 92.7 | Very high | 93.4 | Very high | 53 Ų | 53 | 73.1 Ų | 73.1 | 20% | 0.2 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -60.3 | -42.2 | 177.6 | -172.1 | -175.3 | -62.2 | 162.5 | 0.3 | 111.6 | R140 L141 A142 K147 Y148 P163 N164 F165 D167 | R140-R144 PolarHBondContact O-N 2.85Å; R140-R144 VanDerWaalsContact O-N 3.09Å; L141-R144 PolarHBondContact O-N 3.36Å; A142-R144 PolarHBondContact O-N 3.14Å; R144-K147 PolarHBondContact O-N 3.18Å; R144-Y148 WeakPolarHBondContact O-CB 3.13Å; R144-Y148 PolarHBondContact O-N 3.09Å; R144-P163 HydrophobicContact CG-CB 4.5Å; R144-P163 HydrophobicContact CG-CG 4.21Å; R144-N164 PolarHBondContact NH1-O 3.02Å; R144-F165 HydrophobicContact CG-CD1 4.45Å; R144-F165 HydrophobicContact CG-CE1 4.12Å; R144-D167 PolarHBondContact NH1-O 3.14Å; R144-D167 VanDerWaalsContact NH1-O 3.07Å; R144-D167 PolarHBondContact NH2-O 3.19Å; R144-D167 VanDerWaalsContact NH2-O 3.13Å |
| 145 | Y | 95 | Very high | 92.5 | Very high | 67 Ų | 67 | 75.9 Ų | 75.9 | 26% | 0.263 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -68.4 | -42.5 | -179.4 | -173.9 | -138 | 0 | 0 | 0 | 112.1 | H123 L124 P125 L141 A142 I143 K147 Y148 L149 F165 | H123-Y145 VanDerWaalsContact O-CE1 3.24Å; H123-Y145 WeakPolarHBondContact O-CE1 3.39Å; L124-Y145 HydrophobicContact CD2-CD1 4.4Å; P125-Y145 HydrophobicContact CG-CD1 4.48Å; P125-Y145 HydrophobicContact CG-CD2 3.68Å; P125-Y145 HydrophobicContact CG-CE2 3.91Å; P125-Y145 HydrophobicContact CG-CG 3.99Å; L141-Y145 WeakPolarHBondContact O-CB 3.34Å; L141-Y145 PolarHBondContact O-N 3.39Å; A142-Y145 PolarHBondContact O-N 3.32Å; I143-Y145 VanDerWaalsContact C-N 3.31Å; I143-Y145 PolarHBondContact O-N 3.21Å; Y145-K147 VanDerWaalsContact C-N 3.34Å; Y145-K147 PolarHBondContact O-N 3.34Å; Y145-Y148 HydrophobicContact CD2-CD1 4.18Å; Y145-Y148 HydrophobicContact CE2-CD1 4.25Å; Y145-Y148 PolarHBondContact O-N 3.33Å; Y145-L149 HydrophobicContact CD1-CD1 4.22Å; Y145-L149 HydrophobicContact CD2-CD1 4.36Å; Y145-L149 HydrophobicContact CD2-CG 4.11Å; Y145-L149 HydrophobicContact CE1-CD1 3.87Å; Y145-L149 HydrophobicContact CE2-CD1 4.01Å; Y145-L149 HydrophobicContact CE2-CD2 3.8Å; Y145-L149 HydrophobicContact CE2-CG 3.82Å; Y145-L149 HydrophobicContact CG-CD1 4.46Å; Y145-L149 VanDerWaalsContact O-CG 3.32Å; Y145-L149 WeakPolarHBondContact O-CG 3.33Å; Y145-L149 PolarHBondContact O-N 3.24Å; Y145-F165 HydrophobicContact CD2-CE1 4.27Å; Y145-F165 AromaticContact CD2-CZ 3.85Å; Y145-F165 HydrophobicContact CD2-CZ 3.85Å |
| 146 | I | 95.1 | Very high | 91 | Very high | 95 Ų | 95 | 78.7 Ų | 78.7 | 49% | 0.487 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -58.5 | -46.8 | 174.3 | -68.3 | 165.2 | 0 | 0 | 0 | 110.7 | A142 I143 L149 Q150 | A142-I146 VanDerWaalsContact O-CG1 3.32Å; A142-I146 WeakPolarHBondContact O-CG1 3.43Å; A142-I146 PolarHBondContact O-N 3.13Å; I143-I146 PolarHBondContact O-N 3.12Å; I146-L149 PolarHBondContact O-N 2.91Å; I146-Q150 HydrophobicContact CG2-CG 4.41Å; I146-Q150 VanDerWaalsContact O-CG 3.31Å; I146-Q150 WeakPolarHBondContact O-CG 3.46Å; I146-Q150 PolarHBondContact O-N 3.07Å |
| 147 | K | 92.9 | Very high | 89.4 | Confident | 124 Ų | 124 | 79.3 Ų | 79.3 | 54% | 0.539 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -59.2 | -48.1 | 176.9 | -72.2 | -177.4 | 175.5 | -170.5 | 0 | 112.1 | I143 R144 Y145 L149 Q150 D151 | I143-K147 HydrophobicContact CG2-CD 4.46Å; I143-K147 WeakPolarHBondContact O-CG 3.49Å; I143-K147 PolarHBondContact O-N 3.34Å; R144-K147 PolarHBondContact O-N 3.18Å; Y145-K147 VanDerWaalsContact C-N 3.34Å; Y145-K147 PolarHBondContact O-N 3.34Å; K147-L149 VanDerWaalsContact C-N 3.3Å; K147-L149 PolarHBondContact O-N 3.4Å; K147-Q150 WeakPolarHBondContact O-CB 3.5Å; K147-Q150 PolarHBondContact O-N 3.36Å; K147-Q150 VanDerWaalsContact O-N 3.07Å; K147-D151 VanDerWaalsContact O-CG 3.29Å; K147-D151 PolarHBondContact O-N 3.27Å |
| 148 | Y | 91.8 | Very high | 88 | Confident | 38 Ų | 38 | 88.4 Ų | 88.4 | 15% | 0.149 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -57.2 | -42.8 | 176.5 | 171.5 | -110 | 0 | 0 | 0 | 112.7 | R144 Y145 D151 L152 I160 P162 P163 F165 | R144-Y148 WeakPolarHBondContact O-CB 3.13Å; R144-Y148 PolarHBondContact O-N 3.09Å; Y145-Y148 HydrophobicContact CD2-CD1 4.18Å; Y145-Y148 HydrophobicContact CE2-CD1 4.25Å; Y145-Y148 PolarHBondContact O-N 3.33Å; Y148-D151 PolarHBondContact O-N 3.36Å; Y148-L152 HydrophobicContact CE1-CD1 4.11Å; Y148-L152 HydrophobicContact CE2-CD1 4.47Å; Y148-L152 WeakPolarHBondContact O-CB 3.5Å; Y148-L152 PolarHBondContact O-N 2.96Å; Y148-I160 HydrophobicContact CD2-CG2 3.9Å; Y148-I160 HydrophobicContact CE2-CB 4.37Å; Y148-I160 HydrophobicContact CE2-CG2 3.74Å; Y148-P162 HydrophobicContact CE2-CB 4.44Å; Y148-P163 HydrophobicContact CD2-CG 4.21Å; Y148-P163 HydrophobicContact CG-CG 4.21Å; Y148-F165 HydrophobicContact CD1-CZ 4.25Å; Y148-F165 HydrophobicContact CG-CZ 4.47Å |
| 149 | L | 92.9 | Very high | 86.8 | Confident | 65 Ų | 65 | 94.8 Ų | 94.8 | 34% | 0.34 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -66.6 | -37.3 | 176.3 | -67.2 | 177.4 | 0 | 0 | 0 | 112 | Y145 I146 K147 L153 | Y145-L149 HydrophobicContact CD1-CD1 4.22Å; Y145-L149 HydrophobicContact CD2-CD1 4.36Å; Y145-L149 HydrophobicContact CD2-CG 4.11Å; Y145-L149 HydrophobicContact CE1-CD1 3.87Å; Y145-L149 HydrophobicContact CE2-CD1 4.01Å; Y145-L149 HydrophobicContact CE2-CD2 3.8Å; Y145-L149 HydrophobicContact CE2-CG 3.82Å; Y145-L149 HydrophobicContact CG-CD1 4.46Å; Y145-L149 VanDerWaalsContact O-CG 3.32Å; Y145-L149 WeakPolarHBondContact O-CG 3.33Å; Y145-L149 PolarHBondContact O-N 3.24Å; I146-L149 PolarHBondContact O-N 2.91Å; K147-L149 VanDerWaalsContact C-N 3.3Å; K147-L149 PolarHBondContact O-N 3.4Å; L149-L153 WeakPolarHBondContact O-CB 3.25Å; L149-L153 WeakPolarHBondContact O-CG 3.43Å; L149-L153 PolarHBondContact O-N 3.2Å; L149-L153 VanDerWaalsContact O-N 3.09Å |
| 150 | Q | 93.1 | Very high | 85.7 | Confident | 117 Ų | 117 | 92.5 Ų | 92.5 | 55% | 0.547 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.4 | -46.7 | 175.6 | -73.2 | 172.4 | -36.8 | 0 | 0 | 111.6 | I146 K147 L153 A154 | I146-Q150 HydrophobicContact CG2-CG 4.41Å; I146-Q150 VanDerWaalsContact O-CG 3.31Å; I146-Q150 WeakPolarHBondContact O-CG 3.46Å; I146-Q150 PolarHBondContact O-N 3.07Å; K147-Q150 WeakPolarHBondContact O-CB 3.5Å; K147-Q150 PolarHBondContact O-N 3.36Å; K147-Q150 VanDerWaalsContact O-N 3.07Å; Q150-L153 PolarHBondContact O-N 2.77Å; Q150-A154 WeakPolarHBondContact O-CB 3.48Å; Q150-A154 PolarHBondContact O-N 2.97Å |
| 151 | D | 90.3 | Very high | 84.9 | Confident | 79 Ų | 79 | 89.9 Ų | 89.9 | 42% | 0.422 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.9 | -44.6 | 178.6 | -59.7 | -23 | 0 | 0 | 0 | 110.5 | K147 Y148 L153 A154 E155 I160 | K147-D151 VanDerWaalsContact O-CG 3.29Å; K147-D151 PolarHBondContact O-N 3.27Å; Y148-D151 PolarHBondContact O-N 3.36Å; D151-L153 VanDerWaalsContact C-N 3.28Å; D151-L153 PolarHBondContact O-N 3.29Å; D151-A154 PolarHBondContact O-N 2.73Å; D151-A154 VanDerWaalsContact O-N 3.09Å; D151-E155 PolarHBondContact O-N 3.11Å; D151-I160 HydrophobicContact CB-CD1 3.73Å; D151-I160 WeakPolarHBondContact O-CD1 3.46Å |
| 152 | L | 90.9 | Very high | 84.2 | Confident | 66 Ų | 66 | 94.2 Ų | 94.2 | 35% | 0.346 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.9 | -37.6 | 178.4 | -169.1 | 153.3 | 0 | 0 | 0 | 112.4 | Y148 I160 | Y148-L152 HydrophobicContact CE1-CD1 4.11Å; Y148-L152 HydrophobicContact CE2-CD1 4.47Å; Y148-L152 WeakPolarHBondContact O-CB 3.5Å; Y148-L152 PolarHBondContact O-N 2.96Å; L152-I160 HydrophobicContact CB-CD1 4.48Å |
| 153 | L | 91.2 | Very high | 83.4 | Confident | 140 Ų | 140 | 95.7 Ų | 95.7 | 73% | 0.733 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -76.1 | -29.3 | 176.8 | -68.9 | 172.7 | 0 | 0 | 0 | 112.9 | L149 Q150 D151 | L149-L153 WeakPolarHBondContact O-CB 3.25Å; L149-L153 WeakPolarHBondContact O-CG 3.43Å; L149-L153 PolarHBondContact O-N 3.2Å; L149-L153 VanDerWaalsContact O-N 3.09Å; Q150-L153 PolarHBondContact O-N 2.77Å; D151-L153 VanDerWaalsContact C-N 3.28Å; D151-L153 PolarHBondContact O-N 3.29Å |
| 154 | A | 88.6 | Confident | 82.8 | Confident | 82 Ų | 82 | 95.3 Ų | 95.3 | 68% | 0.678 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -78.2 | -42.2 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | Q150 D151 N156 | Q150-A154 WeakPolarHBondContact O-CB 3.48Å; Q150-A154 PolarHBondContact O-N 2.97Å; D151-A154 PolarHBondContact O-N 2.73Å; D151-A154 VanDerWaalsContact O-N 3.09Å; A154-N156 VanDerWaalsContact C-N 3.33Å; A154-N156 PolarHBondContact O-N 3.41Å |
| 155 | E | 75.2 | Confident | 82.3 | Confident | 113 Ų | 113 | 93.9 Ų | 93.9 | 53% | 0.528 | 49% | 0.489 | S | S | . | . | S | Bend | trans | -81.6 | -11.7 | -171.1 | -66.3 | -175.9 | -178.8 | 0 | 0 | 113.2 | D151 D157 I160 | D151-E155 PolarHBondContact O-N 3.11Å; E155-D157 HydrophobicContact CB-CB 4.23Å; E155-D157 WeakPolarHBondContact O-CB 3.36Å; E155-D157 PolarHBondContact O-N 3.06Å; E155-I160 HydrophobicContact CB-CD1 4.06Å; E155-I160 HydrophobicContact CG-CD1 4.06Å; E155-I160 VanDerWaalsContact OE2-CD1 3.25Å; E155-I160 WeakPolarHBondContact OE2-CD1 3.38Å; E155-I160 WeakPolarHBondContact OE2-CG1 3.4Å |
| 156 | N | 64.2 | Low | 81.4 | Confident | 153 Ų | 153 | 92.2 Ų | 92.2 | 82% | 0.818 | 48% | 0.484 | S | S | * | . | trans | 48.6 | 4.4 | -167.6 | -155.7 | 51.9 | 0 | 0 | 0 | 114.2 | A154 | A154-N156 VanDerWaalsContact C-N 3.33Å; A154-N156 PolarHBondContact O-N 3.41Å | ||
| 157 | D | 61.5 | Low | 80 | Confident | 94 Ų | 94 | 92.1 Ų | 92.1 | 50% | 0.503 | 48% | 0.484 | S | S | . | . | trans | -109.1 | 118.8 | -172.1 | -105.1 | -16.5 | 0 | 0 | 0 | 108 | E155 N159 | E155-D157 HydrophobicContact CB-CB 4.23Å; E155-D157 WeakPolarHBondContact O-CB 3.36Å; E155-D157 PolarHBondContact O-N 3.06Å; D157-N159 PolarHBondContact O-N 2.9Å | ||
| 158 | R | 64.5 | Low | 78.6 | Confident | 245 Ų | 245 | 87.1 Ų | 87.1 | 93% | 0.925 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.1 | 12.2 | 176.9 | -58.4 | -179.9 | 179.1 | 177.2 | -0.1 | 112.9 | ||
| 159 | N | 68.9 | Low | 77 | Confident | 133 Ų | 133 | 90.2 Ų | 90.2 | 71% | 0.711 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -87.3 | -6 | -174.2 | -67.3 | -49 | 0 | 0 | 0 | 113.1 | D157 A161 | D157-N159 PolarHBondContact O-N 2.9Å; N159-A161 PolarHBondContact O-N 2.97Å |
| 160 | I | 73.2 | Confident | 75.1 | Confident | 33 Ų | 33 | 96.2 Ų | 96.2 | 17% | 0.169 | 51% | 0.514 | C | S | . | . | S | Bend | trans | -73.7 | 102.8 | 173.8 | -57.6 | 158.7 | 0 | 0 | 0 | 108.7 | Y148 D151 L152 E155 | Y148-I160 HydrophobicContact CD2-CG2 3.9Å; Y148-I160 HydrophobicContact CE2-CB 4.37Å; Y148-I160 HydrophobicContact CE2-CG2 3.74Å; D151-I160 HydrophobicContact CB-CD1 3.73Å; D151-I160 WeakPolarHBondContact O-CD1 3.46Å; L152-I160 HydrophobicContact CB-CD1 4.48Å; E155-I160 HydrophobicContact CB-CD1 4.06Å; E155-I160 HydrophobicContact CG-CD1 4.06Å; E155-I160 VanDerWaalsContact OE2-CD1 3.25Å; E155-I160 WeakPolarHBondContact OE2-CD1 3.38Å; E155-I160 WeakPolarHBondContact OE2-CG1 3.4Å |
| 161 | A | 77.2 | Confident | 73.1 | Confident | 79 Ų | 79 | 95.2 Ų | 95.2 | 65% | 0.653 | 52% | 0.52 | S | S | * | . | P | Polyproline II helix | trans | -57.5 | 133.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | N159 | N159-A161 PolarHBondContact O-N 2.97Š|
| 162 | P | 79.2 | Confident | 71.1 | Confident | 91 Ų | 91 | 95 Ų | 95 | 59% | 0.591 | 54% | 0.537 | S | S | * | . | P | Polyproline II helix | trans | -61.4 | 127.3 | 178.2 | 25 | -32.7 | 0 | 0 | 0 | 109.5 | Y148 | Y148-P162 HydrophobicContact CE2-CB 4.44Š|
| 163 | P | 78.8 | Confident | 68.5 | Low | 43 Ų | 43 | 103.4 Ų | 103.4 | 28% | 0.279 | 58% | 0.581 | S | S | . | * | P | Polyproline II helix | trans | -65.4 | 148.6 | 179.5 | 26.7 | -33.5 | 0 | 0 | 0 | 109.9 | R144 Y148 F165 | R144-P163 HydrophobicContact CG-CB 4.5Å; R144-P163 HydrophobicContact CG-CG 4.21Å; Y148-P163 HydrophobicContact CD2-CG 4.21Å; Y148-P163 HydrophobicContact CG-CG 4.21Å; P163-F165 HydrophobicContact CG-CD1 4.4Å; P163-F165 HydrophobicContact CG-CE1 3.71Å; P163-F165 HydrophobicContact CG-CE2 4.1Å; P163-F165 HydrophobicContact CG-CZ 3.52Å; P163-F165 WeakPolarHBondContact O-CD2 3.26Å; P163-F165 WeakPolarHBondContact O-CE2 3.48Å; P163-F165 WeakPolarHBondContact O-CG 3.33Å; P163-F165 PolarHBondContact O-N 3.21Å |
| 164 | N | 81.6 | Confident | 67.4 | Low | 91 Ų | 91 | 101.6 Ų | 101.6 | 49% | 0.487 | 57% | 0.574 | S | S | . | * | trans | -64.9 | 113.9 | 174.8 | -173.8 | 9.1 | 0 | 0 | 0 | 109.8 | R144 E166 D167 | R144-N164 PolarHBondContact NH1-O 3.02Å; N164-E166 PolarHBondContact OD1-N 3.48Å; N164-E166 VanDerWaalsContact OD1-N 3.13Å; N164-D167 PolarHBondContact ND2-OD2 3.46Å | ||
| 165 | F | 82.5 | Confident | 66.3 | Low | 23 Ų | 23 | 102.6 Ų | 102.6 | 10% | 0.101 | 57% | 0.568 | C | S | . | * | S | Bend | trans | -87.3 | -7 | -177.4 | -68.2 | -64.1 | 0 | 0 | 0 | 113.6 | P125 L141 R144 Y145 Y148 P163 | P125-F165 HydrophobicContact CB-CD2 3.81Å; P125-F165 HydrophobicContact CB-CE2 3.89Å; P125-F165 HydrophobicContact CB-CG 4.4Å; P125-F165 HydrophobicContact CG-CB 4.48Å; P125-F165 HydrophobicContact CG-CD1 3.89Å; P125-F165 HydrophobicContact CG-CD2 3.4Å; P125-F165 HydrophobicContact CG-CE1 3.8Å; P125-F165 HydrophobicContact CG-CE2 3.35Å; P125-F165 HydrophobicContact CG-CG 3.66Å; P125-F165 HydrophobicContact CG-CZ 3.53Å; P125-F165 WeakPolarHBondContact O-CB 3.37Å; L141-F165 HydrophobicContact CD1-CB 3.65Å; L141-F165 HydrophobicContact CD1-CD1 3.19Å; L141-F165 HydrophobicContact CD1-CE1 4.09Å; L141-F165 HydrophobicContact CD1-CG 3.78Å; R144-F165 HydrophobicContact CG-CD1 4.45Å; R144-F165 HydrophobicContact CG-CE1 4.12Å; Y145-F165 HydrophobicContact CD2-CE1 4.27Å; Y145-F165 AromaticContact CD2-CZ 3.85Å; Y145-F165 HydrophobicContact CD2-CZ 3.85Å; Y148-F165 HydrophobicContact CD1-CZ 4.25Å; Y148-F165 HydrophobicContact CG-CZ 4.47Å; P163-F165 HydrophobicContact CG-CD1 4.4Å; P163-F165 HydrophobicContact CG-CE1 3.71Å; P163-F165 HydrophobicContact CG-CE2 4.1Å; P163-F165 HydrophobicContact CG-CZ 3.52Å; P163-F165 WeakPolarHBondContact O-CD2 3.26Å; P163-F165 WeakPolarHBondContact O-CE2 3.48Å; P163-F165 WeakPolarHBondContact O-CG 3.33Å; P163-F165 PolarHBondContact O-N 3.21Å |
| 166 | E | 75.9 | Confident | 65.8 | Low | 32 Ų | 32 | 102 Ų | 102 | 15% | 0.15 | 57% | 0.571 | C | S | . | * | S | Bend | trans | -90.1 | -21.5 | 178.7 | -68.7 | -70.9 | 161.2 | 0 | 0 | 113.9 | R127 N128 K131 N164 I168 | R127-E166 HydrophobicContact CB-CG 4.43Å; R127-E166 WeakPolarHBondContact CB-OE1 3.44Å; R127-E166 PolarHBondContact N-OE1 3.2Å; N128-E166 PolarHBondContact ND2-OE1 3.3Å; N128-E166 PolarHBondContact ND2-OE2 3.13Å; N128-E166 PolarHBondContact OD1-OE1 3.3Å; N128-E166 PolarHBondContact OD1-OE2 3.32Å; K131-E166 IonicContact NZ-OE2 3.9Å; K131-E166 PolarHBondContact NZ-OE2 2.91Å; N164-E166 PolarHBondContact OD1-N 3.48Å; N164-E166 VanDerWaalsContact OD1-N 3.13Å; E166-I168 PolarHBondContact O-N 3.42Å |
| 167 | D | 65.8 | Low | 65.9 | Low | 93 Ų | 93 | 99 Ų | 99 | 50% | 0.497 | 56% | 0.556 | S | S | . | * | trans | -90.3 | 97 | 179.6 | -72.7 | -25 | 0 | 0 | 0 | 110.3 | R144 N164 | R144-D167 PolarHBondContact NH1-O 3.14Å; R144-D167 VanDerWaalsContact NH1-O 3.07Å; R144-D167 PolarHBondContact NH2-O 3.19Å; R144-D167 VanDerWaalsContact NH2-O 3.13Å; N164-D167 PolarHBondContact ND2-OD2 3.46Å | ||
| 168 | I | 63.3 | Low | 66.1 | Low | 19 Ų | 19 | 99.3 Ų | 99.3 | 10% | 0.097 | 56% | 0.559 | C | S | . | * | trans | -105.4 | 0.7 | 175.4 | -47.7 | 174.4 | 0 | 0 | 0 | 111.1 | E137 R140 E166 | E137-I168 HydrophobicContact CB-CD1 3.59Å; E137-I168 HydrophobicContact CB-CG2 4.33Å; E137-I168 HydrophobicContact CG-CB 4.19Å; E137-I168 HydrophobicContact CG-CD1 3.74Å; E137-I168 HydrophobicContact CG-CG2 3.79Å; R140-I168 HydrophobicContact CB-CG2 4.22Å; E166-I168 PolarHBondContact O-N 3.42Å | ||
| 169 | S | 58 | Low | 66.2 | Low | 103 Ų | 103 | 89.6 Ų | 89.6 | 72% | 0.72 | 54% | 0.535 | S | S | * | . | S | Bend | trans | -89.8 | 4.8 | -173.8 | 50.9 | 0 | 0 | 0 | 0 | 115.7 | ||
| 170 | K | 53.4 | Low | 66.1 | Low | 191 Ų | 191 | 86.5 Ų | 86.5 | 83% | 0.83 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -142.1 | 13.4 | -165.2 | -75.7 | -164 | 177.2 | -175.6 | 0 | 121 | ||
| 171 | S | 50.5 | Low | 65.5 | Low | 97 Ų | 97 | 90.6 Ų | 90.6 | 68% | 0.678 | 55% | 0.55 | S | S | * | . | trans | -119.2 | 81 | 173.2 | 63.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 172 | G | 48 | Very low | 64.5 | Low | 75 Ų | 75 | 91.6 Ų | 91.6 | 77% | 0.773 | 54% | 0.541 | S | S | * | . | trans | -119.6 | 77.2 | 164.7 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 173 | D | 37.4 | Very low | 63.2 | Low | 241 Ų | 241 | 91.6 Ų | 91.6 | 100% | 1.289 | 54% | 0.537 | S | S | * | . | trans | -120.5 | 0 | 159 | -75.7 | -44.5 | 0 | 0 | 0 | 106.8 |
Retrieved 173 of 173 residues in 60.9 ms
(Link to these results)