| 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 | 38.9 | Very low | 47.6 | Very low | 218 Ų | 218 | 157.5 Ų | 157.5 | 100% | 1.074 | 84% | 0.836 | S | S | * | * | 0 | 110.3 | 0 | -57.3 | 92.7 | 149.8 | 0 | 0 | 105.6 | |||||
| 2 | D | 45.2 | Very low | 48.8 | Very low | 143 Ų | 143 | 154.5 Ų | 154.5 | 77% | 0.765 | 83% | 0.832 | S | S | * | * | cis | -162 | 142.7 | 18.7 | -54 | -64.1 | 0 | 0 | 0 | 108.3 | ||||
| 3 | H | 42 | Very low | 48.1 | Very low | 186 Ų | 186 | 156.2 Ų | 156.2 | 86% | 0.861 | 83% | 0.831 | S | S | * | * | trans | -96.9 | 128.6 | 171.8 | -58.8 | -89.2 | 0 | 0 | 0 | 108.5 | ||||
| 4 | T | 56.4 | Low | 47.3 | Very low | 134 Ų | 134 | 151.4 Ų | 151.4 | 82% | 0.822 | 82% | 0.824 | S | S | * | * | trans | -116.9 | 99.1 | 169.7 | 22.1 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 5 | L | 51.4 | Low | 48 | Very low | 150 Ų | 150 | 148.8 Ų | 148.8 | 79% | 0.785 | 82% | 0.818 | S | S | * | * | 51.2 | 97.8 | 82.9 | -74.6 | 169.6 | 0 | 0 | 0 | 113.5 | |||||
| 6 | F | 50.6 | Low | 47.5 | Very low | 205 Ų | 205 | 144.9 Ų | 144.9 | 90% | 0.899 | 81% | 0.812 | S | S | * | * | trans | -143 | 96.6 | 138.7 | -110.8 | -82.8 | 0 | 0 | 0 | 109.1 | ||||
| 7 | G | 41.3 | Very low | 47.1 | Very low | 64 Ų | 64 | 147.4 Ų | 147.4 | 66% | 0.66 | 82% | 0.815 | S | S | * | * | trans | -88 | 136.1 | 164.8 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 8 | C | 52.8 | Low | 47 | Very low | 125 Ų | 125 | 143.7 Ų | 143.7 | 85% | 0.845 | 81% | 0.807 | S | S | * | * | trans | -117.6 | 97.5 | 160.7 | -74.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 9 | L | 47 | Very low | 46.7 | Very low | 160 Ų | 160 | 145.3 Ų | 145.3 | 84% | 0.838 | 81% | 0.813 | S | S | * | * | trans | -59.3 | 130.8 | 163.3 | -105.6 | 62.4 | 0 | 0 | 0 | 109.8 | ||||
| 10 | R | 51 | Low | 47 | Very low | 243 Ų | 243 | 146.8 Ų | 146.8 | 92% | 0.917 | 81% | 0.812 | S | S | * | * | trans | -138.5 | 116.4 | 149.8 | -161.7 | 69.6 | 66.2 | -178.3 | 2.1 | 109.8 | ||||
| 11 | S | 46.5 | Very low | 47.2 | Very low | 104 Ų | 104 | 145.7 Ų | 145.7 | 73% | 0.727 | 81% | 0.812 | S | S | * | * | trans | -63.2 | 159.2 | -178.7 | -86.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 12 | P | 62.9 | Low | 47.2 | Very low | 122 Ų | 122 | 139.1 Ų | 139.1 | 79% | 0.792 | 79% | 0.792 | S | S | * | * | trans | -91.9 | 160.1 | 175.7 | 38.4 | -32.7 | 0 | 0 | 0 | 112.1 | ||||
| 13 | H | 39 | Very low | 47.1 | Very low | 176 Ų | 176 | 141.4 Ų | 141.4 | 82% | 0.815 | 80% | 0.796 | S | S | * | * | trans | 155.1 | 114.4 | 139.7 | -173.5 | -96 | 0 | 0 | 0 | 112.7 | ||||
| 14 | A | 37.7 | Very low | 46.9 | Very low | 89 Ų | 89 | 139.1 Ų | 139.1 | 74% | 0.736 | 80% | 0.795 | S | S | * | * | 173.9 | 135.6 | 127.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 15 | P | 56.8 | Low | 46.3 | Very low | 113 Ų | 113 | 141.3 Ų | 141.3 | 73% | 0.734 | 80% | 0.796 | S | S | * | * | trans | -110.3 | 171.8 | -176 | 40.3 | -32.8 | 0 | 0 | 0 | 115.7 | ||||
| 16 | A | 40.7 | Very low | 45.6 | Very low | 87 Ų | 87 | 139.5 Ų | 139.5 | 72% | 0.719 | 80% | 0.796 | S | S | * | * | trans | 76.4 | 124.5 | 152.8 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 17 | Q | 40.8 | Very low | 45.7 | Very low | 187 Ų | 187 | 135.2 Ų | 135.2 | 87% | 0.874 | 79% | 0.789 | S | S | * | * | -161.9 | 129.5 | 109.2 | -85.1 | -60 | -22.5 | 0 | 0 | 108.9 | |||||
| 18 | A | 45.1 | Very low | 45.9 | Very low | 80 Ų | 80 | 140.3 Ų | 140.3 | 66% | 0.661 | 80% | 0.8 | S | S | * | * | trans | -76.2 | 161.6 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 19 | L | 41.5 | Very low | 45.8 | Very low | 175 Ų | 175 | 140 Ų | 140 | 92% | 0.916 | 79% | 0.794 | S | S | * | * | trans | 177.9 | 118.1 | 135.4 | -91 | 168.9 | 0 | 0 | 0 | 109.4 | ||||
| 20 | H | 51.6 | Low | 45.7 | Very low | 175 Ų | 175 | 140.6 Ų | 140.6 | 81% | 0.81 | 80% | 0.797 | S | S | * | * | trans | -78.2 | 160.9 | 162.7 | -73 | -99.8 | 0 | 0 | 0 | 109.7 | ||||
| 21 | P | 51.1 | Low | 45.4 | Very low | 123 Ų | 123 | 137.2 Ų | 137.2 | 80% | 0.799 | 79% | 0.792 | S | S | * | * | -138.1 | 138.2 | 81.2 | 19 | 4.7 | 0 | 0 | 0 | 113.1 | |||||
| 22 | A | 39.3 | Very low | 45 | Very low | 80 Ų | 80 | 135.7 Ų | 135.7 | 66% | 0.661 | 79% | 0.792 | S | S | * | * | 65.7 | 114.3 | 90.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | |||||
| 23 | F | 43.4 | Very low | 44 | Very low | 191 Ų | 191 | 140.1 Ų | 140.1 | 84% | 0.838 | 79% | 0.793 | S | S | * | * | trans | 42.3 | 126.1 | 144.2 | -87.5 | -97.7 | 0 | 0 | 0 | 120.8 | ||||
| 24 | T | 38.8 | Very low | 44 | Very low | 139 Ų | 139 | 137.8 Ų | 137.8 | 85% | 0.853 | 80% | 0.797 | S | S | * | * | -174.1 | 151.8 | 110.4 | 44.9 | 0 | 0 | 0 | 0 | 110.8 | |||||
| 25 | Q | 44.1 | Very low | 44.7 | Very low | 180 Ų | 180 | 140 Ų | 140 | 84% | 0.841 | 80% | 0.796 | S | S | * | * | trans | -74.6 | 142.4 | -177.5 | -61.7 | 171.6 | 37.1 | 0 | 0 | 111.2 | ||||
| 26 | S | 36.3 | Very low | 44 | Very low | 111 Ų | 111 | 142.7 Ų | 142.7 | 78% | 0.776 | 80% | 0.798 | S | S | * | * | trans | -107.2 | 122.4 | 168.8 | -57.5 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 27 | P | 53.2 | Low | 44.3 | Very low | 116 Ų | 116 | 145.2 Ų | 145.2 | 75% | 0.753 | 80% | 0.799 | S | S | * | * | trans | -90.6 | 123.9 | 159.1 | 32.7 | -24.1 | 0 | 0 | 0 | 108.2 | ||||
| 28 | L | 44.7 | Very low | 44.4 | Very low | 170 Ų | 170 | 140.9 Ų | 140.9 | 89% | 0.89 | 79% | 0.789 | S | S | * | * | trans | -116.5 | 121.7 | 170.9 | -74.4 | -177.8 | 0 | 0 | 0 | 111.7 | ||||
| 29 | T | 50.9 | Low | 44.1 | Very low | 119 Ų | 119 | 146.8 Ų | 146.8 | 73% | 0.73 | 80% | 0.796 | S | S | * | * | trans | -72.6 | 136 | -175.4 | -15.1 | 0 | 0 | 0 | 0 | 111.5 | H31 | T29-H31 PolarHBondContact O-N 3.27Š| ||
| 30 | L | 44.1 | Very low | 44.7 | Very low | 172 Ų | 172 | 144.3 Ų | 144.3 | 90% | 0.901 | 79% | 0.79 | S | S | * | * | trans | -56.2 | 113.2 | 171 | -166.9 | 88.7 | 0 | 0 | 0 | 110.7 | ||||
| 31 | H | 45.8 | Very low | 44.2 | Very low | 173 Ų | 173 | 142.8 Ų | 142.8 | 80% | 0.801 | 79% | 0.787 | S | S | * | * | trans | -95.3 | 108.9 | 166 | -89 | 72.6 | 0 | 0 | 0 | 109.4 | T29 | T29-H31 PolarHBondContact O-N 3.27Š| ||
| 32 | G | 38.1 | Very low | 43.9 | Very low | 72 Ų | 72 | 145.1 Ų | 145.1 | 74% | 0.742 | 79% | 0.793 | S | S | * | * | trans | -71.2 | 127.6 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 33 | R | 40.4 | Very low | 43.9 | Very low | 215 Ų | 215 | 145.7 Ų | 145.7 | 81% | 0.811 | 80% | 0.797 | S | S | * | * | trans | -98.8 | 111 | 167.1 | -66.7 | 179.4 | 66.5 | 174.1 | 0.5 | 107.3 | ||||
| 34 | S | 40.3 | Very low | 43.7 | Very low | 127 Ų | 127 | 142.1 Ų | 142.1 | 89% | 0.888 | 80% | 0.796 | S | S | * | * | trans | -86.7 | 112.2 | 164.5 | -75.6 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 35 | D | 51.4 | Low | 43.7 | Very low | 134 Ų | 134 | 141.2 Ų | 141.2 | 72% | 0.717 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -97.8 | 121 | 166.2 | -74.9 | -64 | 0 | 0 | 0 | 108.7 | ||
| 36 | H | 42.1 | Very low | 43.5 | Very low | 170 Ų | 170 | 137.9 Ų | 137.9 | 79% | 0.787 | 79% | 0.792 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 118.8 | -178.9 | 179.1 | -87.5 | 0 | 0 | 0 | 110.5 | S38 | H36-S38 PolarHBondContact CE1-OG 3.3Å; H36-S38 VanDerWaalsContact CE1-OG 3.27Å; H36-S38 PolarHBondContact ND1-OG 3.41Å |
| 37 | I | 47.2 | Very low | 43.6 | Very low | 141 Ų | 141 | 137.2 Ų | 137.2 | 72% | 0.723 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -97.2 | 117.7 | 176.4 | -128.1 | 144.1 | 0 | 0 | 0 | 108.6 | Y39 | I37-Y39 HydrophobicContact CG2-CD2 3.97Å; I37-Y39 HydrophobicContact CG2-CE2 3.96Å |
| 38 | S | 43.4 | Very low | 42.9 | Very low | 95 Ų | 95 | 136.7 Ų | 136.7 | 66% | 0.664 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -100.9 | 118.9 | 171.3 | -63.3 | 0 | 0 | 0 | 0 | 108.7 | H36 | H36-S38 PolarHBondContact CE1-OG 3.3Å; H36-S38 VanDerWaalsContact CE1-OG 3.27Å; H36-S38 PolarHBondContact ND1-OG 3.41Å |
| 39 | Y | 39.1 | Very low | 42.6 | Very low | 205 Ų | 205 | 133.5 Ų | 133.5 | 80% | 0.804 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -94.6 | 142.4 | 168.7 | -89.9 | -91.6 | 0 | 0 | 0 | 110 | I37 | I37-Y39 HydrophobicContact CG2-CD2 3.97Å; I37-Y39 HydrophobicContact CG2-CE2 3.96Å |
| 40 | P | 53.5 | Low | 42 | Very low | 122 Ų | 122 | 132.5 Ų | 132.5 | 79% | 0.792 | 78% | 0.776 | S | S | * | * | P | Polyproline II helix | trans | -85.5 | 135 | 160.5 | 31.3 | -27.4 | 0 | 0 | 0 | 111.2 | ||
| 41 | D | 41.5 | Very low | 41.9 | Very low | 143 Ų | 143 | 130.2 Ų | 130.2 | 77% | 0.765 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 131.9 | 171.6 | -171.6 | -81.3 | 0 | 0 | 0 | 110.6 | ||
| 42 | L | 44.7 | Very low | 41.7 | Very low | 173 Ų | 173 | 127.3 Ų | 127.3 | 91% | 0.906 | 77% | 0.768 | S | S | * | * | trans | -139.3 | 123.9 | 155.3 | -75 | -179.7 | 0 | 0 | 0 | 109.8 | ||||
| 43 | A | 38.8 | Very low | 41.9 | Very low | 91 Ų | 91 | 129.3 Ų | 129.3 | 75% | 0.752 | 77% | 0.771 | S | S | * | * | trans | -61.7 | 154 | -171.4 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 44 | S | 39.8 | Very low | 42.5 | Very low | 117 Ų | 117 | 124.8 Ų | 124.8 | 82% | 0.818 | 77% | 0.769 | S | S | * | * | trans | -63.3 | 144.4 | 170.7 | -67.1 | 0 | 0 | 0 | 0 | 113 | ||||
| 45 | S | 37.9 | Very low | 42.6 | Very low | 120 Ų | 120 | 124.1 Ų | 124.1 | 84% | 0.839 | 77% | 0.765 | S | S | * | * | trans | -152.4 | 119 | 139.6 | -76.1 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 46 | S | 40.9 | Very low | 42.8 | Very low | 109 Ų | 109 | 123.6 Ų | 123.6 | 76% | 0.762 | 77% | 0.769 | S | S | * | * | trans | -38.1 | 150.9 | 162.8 | 38 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 47 | S | 37.2 | Very low | 43.1 | Very low | 98 Ų | 98 | 121.3 Ų | 121.3 | 69% | 0.685 | 77% | 0.77 | S | S | * | * | -177.4 | 151.2 | 62.3 | -42.5 | 0 | 0 | 0 | 0 | 110 | |||||
| 48 | S | 39.8 | Very low | 43 | Very low | 104 Ų | 104 | 121.5 Ų | 121.5 | 73% | 0.727 | 78% | 0.778 | S | S | * | * | trans | 26.9 | 130.1 | 144.4 | 57.4 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 49 | S | 37.8 | Very low | 43 | Very low | 104 Ų | 104 | 124.8 Ų | 124.8 | 73% | 0.727 | 79% | 0.786 | S | S | * | * | cis | 167.6 | 142.7 | 42.6 | 25.8 | 0 | 0 | 0 | 0 | 103.7 | ||||
| 50 | S | 38.9 | Very low | 43 | Very low | 97 Ų | 97 | 120.4 Ų | 120.4 | 68% | 0.678 | 79% | 0.785 | S | S | * | * | 167.8 | 131.7 | 81.7 | -46.8 | 0 | 0 | 0 | 0 | 108.5 | |||||
| 51 | T | 41.5 | Very low | 42.5 | Very low | 125 Ų | 125 | 119.5 Ų | 119.5 | 77% | 0.767 | 78% | 0.782 | S | S | * | * | trans | 57.7 | 108.9 | 133.6 | 61.1 | 0 | 0 | 0 | 0 | 122.3 | ||||
| 52 | S | 40.7 | Very low | 42.7 | Very low | 111 Ų | 111 | 123.5 Ų | 123.5 | 78% | 0.776 | 79% | 0.788 | S | S | * | * | 66.4 | 105.6 | 124 | 66.9 | 0 | 0 | 0 | 0 | 121.3 | |||||
| 53 | S | 42.1 | Very low | 42.6 | Very low | 115 Ų | 115 | 120.6 Ų | 120.6 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -46.4 | 153.7 | 132.8 | -84.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 54 | P | 53 | Low | 42.7 | Very low | 119 Ų | 119 | 119.7 Ų | 119.7 | 77% | 0.773 | 78% | 0.782 | S | S | * | * | cis | -144.4 | 174.1 | 48.5 | 35.9 | -14 | 0 | 0 | 0 | 116.5 | ||||
| 55 | S | 43.7 | Very low | 42.8 | Very low | 114 Ų | 114 | 121.6 Ų | 121.6 | 80% | 0.797 | 78% | 0.783 | S | S | * | * | trans | -44.5 | 157.3 | 167.4 | -43.5 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 56 | P | 54.2 | Low | 43 | Very low | 122 Ų | 122 | 123.2 Ų | 123.2 | 79% | 0.792 | 78% | 0.782 | S | S | * | * | -143.1 | 156.2 | 114.3 | 34.5 | -19.3 | 0 | 0 | 0 | 115.2 | |||||
| 57 | C | 49.5 | Very low | 43 | Very low | 122 Ų | 122 | 121.1 Ų | 121.1 | 82% | 0.824 | 78% | 0.778 | S | S | * | * | trans | -63.5 | 145.6 | 169.7 | -37.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 58 | V | 45.7 | Very low | 43.2 | Very low | 146 Ų | 146 | 124.9 Ų | 124.9 | 89% | 0.885 | 79% | 0.789 | S | S | * | * | trans | -153.4 | 123.6 | 146.8 | -98 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 59 | I | 42.8 | Very low | 43.3 | Very low | 164 Ų | 164 | 129 Ų | 129 | 84% | 0.841 | 79% | 0.794 | S | S | * | * | trans | -72.3 | 135.5 | 158.3 | -69.8 | 160.8 | 0 | 0 | 0 | 107.1 | ||||
| 60 | S | 38.3 | Very low | 43.8 | Very low | 112 Ų | 112 | 130.3 Ų | 130.3 | 78% | 0.783 | 80% | 0.8 | S | S | * | * | trans | -159 | 127.5 | 141.4 | -147.6 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 61 | S | 44.3 | Very low | 43.7 | Very low | 104 Ų | 104 | 128.6 Ų | 128.6 | 73% | 0.727 | 80% | 0.798 | S | S | * | * | trans | -54.7 | 143.6 | 167.6 | 36.3 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 62 | Y | 45.3 | Very low | 43.9 | Very low | 226 Ų | 226 | 131.1 Ų | 131.1 | 89% | 0.886 | 80% | 0.801 | S | S | * | * | trans | -145.7 | 136.6 | 136.6 | 74.9 | -87.5 | 0 | 0 | 0 | 110.7 | ||||
| 63 | S | 42.5 | Very low | 44 | Very low | 113 Ų | 113 | 134.1 Ų | 134.1 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -84.1 | 146.4 | 176.9 | -62.1 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 64 | G | 40.2 | Very low | 44 | Very low | 71 Ų | 71 | 136.4 Ų | 136.4 | 73% | 0.732 | 80% | 0.8 | S | S | * | * | trans | 62.8 | 120.4 | 132.8 | 0 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 65 | D | 43.3 | Very low | 43.6 | Very low | 157 Ų | 157 | 138.9 Ų | 138.9 | 84% | 0.84 | 80% | 0.801 | S | S | * | * | -160.4 | 155.3 | 120.7 | 67.5 | -84.3 | 0 | 0 | 0 | 111.5 | |||||
| 66 | D | 41.3 | Very low | 43.5 | Very low | 155 Ų | 155 | 142 Ų | 142 | 83% | 0.829 | 80% | 0.803 | S | S | * | * | trans | -76.8 | 148.3 | -165.2 | -68.5 | -90.3 | 0 | 0 | 0 | 115 | ||||
| 67 | G | 40.5 | Very low | 42.9 | Very low | 65 Ų | 65 | 147.3 Ų | 147.3 | 67% | 0.67 | 81% | 0.807 | S | S | * | * | trans | 60.3 | 117 | 131.1 | 0 | 0 | 0 | 0 | 0 | 119.6 | ||||
| 68 | L | 41.4 | Very low | 42.3 | Very low | 177 Ų | 177 | 146.5 Ų | 146.5 | 93% | 0.927 | 80% | 0.803 | S | S | * | * | 180 | 111.1 | 120 | -112.2 | 66.6 | 0 | 0 | 0 | 110 | |||||
| 69 | F | 42.9 | Very low | 42.4 | Very low | 190 Ų | 190 | 148.4 Ų | 148.4 | 83% | 0.833 | 80% | 0.802 | S | S | * | * | trans | -77.1 | 154.8 | 155.3 | -103.2 | -90.8 | 0 | 0 | 0 | 107.9 | ||||
| 70 | P | 47.6 | Very low | 42.6 | Very low | 131 Ų | 131 | 148.1 Ų | 148.1 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | -148.2 | 160.4 | 60.3 | 36.5 | -15 | 0 | 0 | 0 | 116.8 | |||||
| 71 | G | 37.5 | Very low | 43 | Very low | 61 Ų | 61 | 148.7 Ų | 148.7 | 63% | 0.629 | 80% | 0.802 | S | S | * | * | trans | -176.5 | 87.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 72 | Q | 44.9 | Very low | 42.8 | Very low | 178 Ų | 178 | 149.1 Ų | 149.1 | 83% | 0.832 | 81% | 0.805 | S | S | * | * | trans | -57.1 | 133 | 169.2 | -68.4 | 178.6 | 33.2 | 0 | 0 | 110.8 | ||||
| 73 | H | 42.1 | Very low | 42.8 | Very low | 174 Ų | 174 | 145.6 Ų | 145.6 | 81% | 0.806 | 80% | 0.797 | S | S | * | * | trans | -149.9 | 107.8 | 141.9 | -86.5 | -73.7 | 0 | 0 | 0 | 109.5 | ||||
| 74 | H | 43.8 | Very low | 43 | Very low | 164 Ų | 164 | 147.5 Ų | 147.5 | 76% | 0.759 | 79% | 0.793 | S | S | * | * | trans | -70 | 121.3 | 163.7 | -90 | 41.7 | 0 | 0 | 0 | 109.3 | ||||
| 75 | H | 44.3 | Very low | 43.1 | Very low | 170 Ų | 170 | 150.4 Ų | 150.4 | 79% | 0.787 | 79% | 0.787 | S | S | * | * | trans | -132 | 115.7 | 154.4 | -74.8 | -69.4 | 0 | 0 | 0 | 110.1 | R77 | H75-R77 PolarHBondContact O-N 2.99Š| ||
| 76 | H | 40.9 | Very low | 43.3 | Very low | 181 Ų | 181 | 151 Ų | 151 | 84% | 0.838 | 79% | 0.785 | S | S | * | * | trans | -52.1 | 115 | 175.9 | -74.1 | -99 | 0 | 0 | 0 | 111.6 | S78 | H76-S78 PolarHBondContact O-N 3.4Š| ||
| 77 | R | 40.8 | Very low | 43.4 | Very low | 232 Ų | 232 | 151 Ų | 151 | 88% | 0.875 | 78% | 0.779 | S | S | * | * | trans | -81.9 | 103.7 | 163.5 | -169.8 | 73.1 | 168.3 | -99 | 0.2 | 107.4 | H75 H79 | H75-R77 PolarHBondContact O-N 2.99Å; R77-H79 PolarHBondContact O-N 2.81Å | ||
| 78 | S | 37.4 | Very low | 43.6 | Very low | 106 Ų | 106 | 155.1 Ų | 155.1 | 74% | 0.741 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 119.1 | 175.1 | 40.2 | 0 | 0 | 0 | 0 | 111.5 | H76 | H76-S78 PolarHBondContact O-N 3.4Š|
| 79 | H | 47.6 | Very low | 43.7 | Very low | 186 Ų | 186 | 151.7 Ų | 151.7 | 86% | 0.861 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 122.5 | 168.8 | -106.9 | -98.4 | 0 | 0 | 0 | 109.9 | R77 | R77-H79 PolarHBondContact O-N 2.81Š|
| 80 | L | 47.4 | Very low | 44.1 | Very low | 158 Ų | 158 | 149.8 Ų | 149.8 | 83% | 0.827 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -92.1 | 121.6 | 167.5 | -138.6 | 78 | 0 | 0 | 0 | 107.8 | S82 | L80-S82 PolarHBondContact O-N 3.32Š|
| 81 | P | 47.6 | Very low | 43.7 | Very low | 124 Ų | 124 | 150.9 Ų | 150.9 | 81% | 0.805 | 76% | 0.757 | S | S | * | * | trans | -80.3 | 107.2 | 170.8 | 29 | -28.9 | 0 | 0 | 0 | 109.7 | Q83 | P81-Q83 PolarHBondContact O-N 3.19Š| ||
| 82 | S | 40 | Very low | 44.1 | Very low | 113 Ų | 113 | 155.3 Ų | 155.3 | 79% | 0.79 | 76% | 0.761 | S | S | * | * | trans | -75.6 | 100 | 166.2 | -175.6 | 0 | 0 | 0 | 0 | 108.7 | L80 Q84 | L80-S82 PolarHBondContact O-N 3.32Å; S82-Q84 PolarHBondContact O-N 3.26Å | ||
| 83 | Q | 45.6 | Very low | 43.8 | Very low | 151 Ų | 151 | 150.4 Ų | 150.4 | 71% | 0.706 | 76% | 0.758 | S | S | * | * | trans | -59.4 | 117.5 | 168.2 | -99.8 | -127.7 | 79.7 | 0 | 0 | 110.1 | P81 H85 | P81-Q83 PolarHBondContact O-N 3.19Å; Q83-H85 PolarHBondContact O-N 3.01Å | ||
| 84 | Q | 46.1 | Very low | 44.1 | Very low | 154 Ų | 154 | 146.1 Ų | 146.1 | 72% | 0.72 | 75% | 0.748 | S | S | * | * | trans | -79.8 | 105.6 | 162.8 | -77.8 | -177.6 | 6.6 | 0 | 0 | 108.6 | S82 H86 | S82-Q84 PolarHBondContact O-N 3.26Å; Q84-H86 PolarHBondContact O-N 3.07Å | ||
| 85 | H | 43.1 | Very low | 44 | Very low | 131 Ų | 131 | 149.9 Ų | 149.9 | 61% | 0.606 | 76% | 0.755 | S | S | * | * | trans | -79.1 | 104.3 | 157 | -82.6 | -87.5 | 0 | 0 | 0 | 108.5 | Q83 H87 | Q83-H85 PolarHBondContact O-N 3.01Å; H85-H87 VanDerWaalsContact CB-CE1 3.42Å; H85-H87 WeakPolarHBondContact CB-CE1 3.19Å; H85-H87 PolarHBondContact O-CE1 3.39Å; H85-H87 VanDerWaalsContact O-CE1 3.31Å; H85-H87 PolarHBondContact O-N 3.42Å | ||
| 86 | H | 45.5 | Very low | 44.2 | Very low | 171 Ų | 171 | 149.8 Ų | 149.8 | 79% | 0.792 | 76% | 0.755 | S | S | * | * | trans | -74.3 | 100.1 | 159.7 | -95.1 | 63.3 | 0 | 0 | 0 | 108.2 | Q84 | Q84-H86 PolarHBondContact O-N 3.07Š| ||
| 87 | H | 44.9 | Very low | 45.2 | Very low | 154 Ų | 154 | 148.3 Ų | 148.3 | 71% | 0.713 | 75% | 0.751 | S | S | * | * | trans | -96.2 | 112.4 | 162.9 | 6.4 | -85.8 | 0 | 0 | 0 | 108.3 | H85 P89 | H85-H87 VanDerWaalsContact CB-CE1 3.42Å; H85-H87 WeakPolarHBondContact CB-CE1 3.19Å; H85-H87 PolarHBondContact O-CE1 3.39Å; H85-H87 VanDerWaalsContact O-CE1 3.31Å; H85-H87 PolarHBondContact O-N 3.42Å; H87-P89 WeakPolarHBondContact O-CD 3.38Å | ||
| 88 | Q | 43.8 | Very low | 45.5 | Very low | 152 Ų | 152 | 142.9 Ų | 142.9 | 71% | 0.71 | 75% | 0.746 | S | S | * | * | trans | -79.4 | 118.3 | 168.2 | -179.6 | -167.4 | 86.6 | 0 | 0 | 108.1 | Q90 | Q88-Q90 VanDerWaalsContact OE1-NE2 3.08Š| ||
| 89 | P | 43 | Very low | 46 | Very low | 104 Ų | 104 | 147 Ų | 147 | 68% | 0.675 | 75% | 0.754 | S | S | * | * | trans | -90.8 | 111.7 | 167.4 | 24 | -11 | 0 | 0 | 0 | 109.3 | H87 H91 | H87-P89 WeakPolarHBondContact O-CD 3.38Å; P89-H91 PolarHBondContact O-N 3.16Å | ||
| 90 | Q | 51.8 | Low | 46.4 | Very low | 150 Ų | 150 | 146.5 Ų | 146.5 | 70% | 0.701 | 75% | 0.754 | S | S | * | * | trans | -70.1 | 99.7 | 159.2 | -68.5 | -75.6 | -7.1 | 0 | 0 | 107.8 | Q88 | Q88-Q90 VanDerWaalsContact OE1-NE2 3.08Š| ||
| 91 | H | 39.1 | Very low | 46.6 | Very low | 155 Ų | 155 | 144.8 Ų | 144.8 | 72% | 0.718 | 75% | 0.752 | S | S | * | * | trans | -119.5 | 106.3 | 164.8 | -83 | -66.8 | 0 | 0 | 0 | 110 | P89 G93 | P89-H91 PolarHBondContact O-N 3.16Å; H91-G93 PolarHBondContact O-N 3.02Å | ||
| 92 | H | 46.9 | Very low | 46.7 | Very low | 154 Ų | 154 | 144.2 Ų | 144.2 | 71% | 0.713 | 75% | 0.751 | S | S | * | * | trans | -45.2 | 116.9 | 157.5 | 45.7 | 69.1 | 0 | 0 | 0 | 110.4 | S94 | H92-S94 VanDerWaalsContact C-N 3.34Å; H92-S94 PolarHBondContact O-N 3.37Å | ||
| 93 | G | 39.2 | Very low | 47.1 | Very low | 75 Ų | 75 | 145.1 Ų | 145.1 | 77% | 0.773 | 75% | 0.754 | S | S | * | * | trans | -72.6 | 85.3 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | H91 | H91-G93 PolarHBondContact O-N 3.02Š| ||
| 94 | S | 47.9 | Very low | 46.7 | Very low | 84 Ų | 84 | 141.6 Ų | 141.6 | 59% | 0.587 | 76% | 0.758 | S | S | * | * | trans | -100.8 | 105.5 | 164.6 | -169.3 | 0 | 0 | 0 | 0 | 108.3 | H92 H96 | H92-S94 VanDerWaalsContact C-N 3.34Å; H92-S94 PolarHBondContact O-N 3.37Å; S94-H96 VanDerWaalsContact C-N 3.26Å; S94-H96 PolarHBondContact O-N 3.34Å; S94-H96 PolarHBondContact OG-CD2 3.23Å | ||
| 95 | W | 42.1 | Very low | 46.9 | Very low | 243 Ų | 243 | 138.6 Ų | 138.6 | 92% | 0.92 | 77% | 0.769 | S | S | * | * | trans | -75 | 77.1 | 176 | -68.1 | 98.3 | 0 | 0 | 0 | 110 | ||||
| 96 | H | 48.1 | Very low | 46.5 | Very low | 168 Ų | 168 | 135.8 Ų | 135.8 | 78% | 0.778 | 78% | 0.776 | S | S | * | * | trans | -83.8 | 115 | 165.5 | -97.8 | -90.8 | 0 | 0 | 0 | 109.7 | S94 P98 | S94-H96 VanDerWaalsContact C-N 3.26Å; S94-H96 PolarHBondContact O-N 3.34Å; S94-H96 PolarHBondContact OG-CD2 3.23Å; H96-P98 WeakPolarHBondContact O-CD 3.41Å | ||
| 97 | I | 60.3 | Low | 46 | Very low | 149 Ų | 149 | 132.8 Ų | 132.8 | 76% | 0.764 | 77% | 0.774 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 120.1 | 167.6 | -69.3 | 125.6 | 0 | 0 | 0 | 108.1 | Q99 | I97-Q99 PolarHBondContact O-N 3.19Š|
| 98 | P | 48.3 | Very low | 45.8 | Very low | 118 Ų | 118 | 135.7 Ų | 135.7 | 77% | 0.766 | 78% | 0.779 | S | S | * | * | P | Polyproline II helix | trans | -74 | 124.9 | 173.7 | -9.6 | 25.6 | 0 | 0 | 0 | 110 | H96 | H96-P98 WeakPolarHBondContact O-CD 3.41Š|
| 99 | Q | 48.8 | Very low | 45.4 | Very low | 192 Ų | 192 | 137.4 Ų | 137.4 | 90% | 0.897 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 132.2 | 167.3 | -76.5 | -176.9 | 41.4 | 0 | 0 | 109.8 | I97 | I97-Q99 PolarHBondContact O-N 3.19Š|
| 100 | M | 55.9 | Low | 44.8 | Very low | 177 Ų | 177 | 135 Ų | 135 | 87% | 0.872 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -82.1 | 139.8 | 169.5 | -67.7 | -71.7 | -137.8 | 0 | 0 | 110 | ||
| 101 | P | 51.4 | Low | 44.2 | Very low | 122 Ų | 122 | 136.1 Ų | 136.1 | 79% | 0.792 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -79.3 | 133 | 174.7 | 29.4 | -29.8 | 0 | 0 | 0 | 111.7 | ||
| 102 | S | 48.3 | Very low | 43.9 | Very low | 112 Ų | 112 | 134.4 Ų | 134.4 | 78% | 0.783 | 79% | 0.794 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 142.6 | 171.5 | -73.2 | 0 | 0 | 0 | 0 | 111.9 | G104 | S102-G104 PolarHBondContact O-N 2.64Š|
| 103 | P | 49.2 | Very low | 43.5 | Very low | 131 Ų | 131 | 135.8 Ų | 135.8 | 85% | 0.851 | 80% | 0.801 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 124.2 | 171.6 | 28.8 | -29.6 | 0 | 0 | 0 | 110.2 | ||
| 104 | G | 36.3 | Very low | 44.1 | Very low | 77 Ų | 77 | 136.7 Ų | 136.7 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | P | Polyproline II helix | trans | -67 | 147.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | S102 | S102-G104 PolarHBondContact O-N 2.64Š|
| 105 | G | 50.6 | Low | 43.4 | Very low | 91 Ų | 91 | 140.9 Ų | 140.9 | 94% | 0.938 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 146.6 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 106 | G | 34.5 | Very low | 43.2 | Very low | 73 Ų | 73 | 134.5 Ų | 134.5 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | trans | -162.2 | 90.6 | 165 | 0 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 107 | S | 35.3 | Very low | 42.6 | Very low | 107 Ų | 107 | 135 Ų | 135 | 75% | 0.748 | 80% | 0.802 | S | S | * | * | 60.3 | 103.4 | 94.4 | -95.1 | 0 | 0 | 0 | 0 | 116.2 | |||||
| 108 | R | 40.9 | Very low | 41.4 | Very low | 216 Ų | 216 | 132.8 Ų | 132.8 | 82% | 0.815 | 80% | 0.8 | S | S | * | * | 72.2 | 115 | 123.9 | -56.7 | 174.3 | 105.1 | -96.5 | -4.7 | 118.7 | |||||
| 109 | H | 35.5 | Very low | 40.7 | Very low | 188 Ų | 188 | 132.7 Ų | 132.7 | 87% | 0.87 | 80% | 0.803 | S | S | * | * | 168.6 | 148 | 112 | 60.8 | -82.9 | 0 | 0 | 0 | 106.6 | |||||
| 110 | G | 31.1 | Very low | 40.2 | Very low | 53 Ų | 53 | 132 Ų | 132 | 55% | 0.546 | 80% | 0.799 | S | S | . | * | cis | 155.6 | 132.2 | 7.2 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 111 | L | 39.1 | Very low | 39.2 | Very low | 173 Ų | 173 | 130.8 Ų | 130.8 | 91% | 0.906 | 79% | 0.791 | S | S | * | * | trans | 63.1 | 137.2 | 160.4 | -66.1 | 72.4 | 0 | 0 | 0 | 115 | ||||
| 112 | C | 31.6 | Very low | 38.4 | Very low | 120 Ų | 120 | 131.4 Ų | 131.4 | 81% | 0.811 | 79% | 0.788 | S | S | * | * | cis | -164.5 | 139.2 | 37.5 | 36.3 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 113 | H | 40.2 | Very low | 37.8 | Very low | 183 Ų | 183 | 129.5 Ų | 129.5 | 85% | 0.847 | 79% | 0.786 | S | S | * | * | trans | -75.1 | 157.8 | 147.2 | -76.6 | 82.5 | 0 | 0 | 0 | 107 | ||||
| 114 | P | 51.8 | Low | 37.9 | Very low | 94 Ų | 94 | 129.3 Ų | 129.3 | 61% | 0.61 | 79% | 0.785 | S | S | * | * | -136.9 | -178.9 | 50.9 | 17.5 | 11.7 | 0 | 0 | 0 | 111.9 | |||||
| 115 | H | 32.8 | Very low | 38.3 | Very low | 172 Ų | 172 | 131.8 Ų | 131.8 | 80% | 0.796 | 78% | 0.784 | S | S | * | * | -163.8 | 147.3 | 50.8 | -57.3 | -96.2 | 0 | 0 | 0 | 111 | |||||
| 116 | S | 36.2 | Very low | 38.6 | Very low | 109 Ų | 109 | 133 Ų | 133 | 76% | 0.762 | 78% | 0.776 | S | S | * | * | trans | -80.8 | 136.2 | 171.3 | -171.8 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 117 | L | 35.9 | Very low | 39.8 | Very low | 177 Ų | 177 | 135.3 Ų | 135.3 | 93% | 0.927 | 78% | 0.778 | S | S | * | * | trans | -144.3 | 116.5 | 151.9 | -82.5 | 178.2 | 0 | 0 | 0 | 109.9 | ||||
| 118 | S | 36 | Very low | 40 | Very low | 103 Ų | 103 | 136.8 Ų | 136.8 | 72% | 0.72 | 78% | 0.777 | S | S | * | * | trans | -81.9 | 143.8 | 168.5 | 55.4 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 119 | S | 33.4 | Very low | 40.2 | Very low | 117 Ų | 117 | 134.7 Ų | 134.7 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -165 | 104 | 150.2 | -73.3 | 0 | 0 | 0 | 0 | 105.8 | ||||
| 120 | H | 37.3 | Very low | 40.3 | Very low | 178 Ų | 178 | 128.9 Ų | 128.9 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | 50.4 | 103 | 83.6 | -126.3 | -105.5 | 0 | 0 | 0 | 112.9 | |||||
| 121 | E | 35 | Very low | 40.8 | Very low | 151 Ų | 151 | 135.3 Ų | 135.3 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | 159.4 | 131.5 | 112.3 | -86.1 | -148.8 | 104.8 | 0 | 0 | 114.6 | |||||
| 122 | N | 35.8 | Very low | 41.5 | Very low | 134 Ų | 134 | 133.2 Ų | 133.2 | 72% | 0.717 | 78% | 0.784 | S | S | * | * | trans | 70 | 120.3 | 143.4 | -57.9 | -38.6 | 0 | 0 | 0 | 122.1 | ||||
| 123 | G | 34.7 | Very low | 42 | Very low | 72 Ų | 72 | 131 Ų | 131 | 74% | 0.742 | 78% | 0.781 | S | S | * | * | trans | -72.1 | -167.2 | 160.4 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 124 | P | 52.2 | Low | 42.8 | Very low | 128 Ų | 128 | 128.4 Ų | 128.4 | 83% | 0.831 | 78% | 0.781 | S | S | * | * | cis | -142.5 | -178.7 | 44.1 | 35.3 | -12.3 | 0 | 0 | 0 | 116.8 | ||||
| 125 | T | 44.8 | Very low | 43.2 | Very low | 128 Ų | 128 | 130.2 Ų | 130.2 | 79% | 0.785 | 79% | 0.792 | S | S | * | * | trans | -59.3 | 167.6 | 172 | 56.5 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 126 | P | 57.3 | Low | 43.8 | Very low | 117 Ų | 117 | 126.7 Ų | 126.7 | 76% | 0.76 | 79% | 0.787 | S | S | * | * | -156.2 | -158.7 | 70.6 | 40.9 | -15.4 | 0 | 0 | 0 | 114.3 | |||||
| 127 | P | 58.2 | Low | 44.2 | Very low | 121 Ų | 121 | 130 Ų | 130 | 79% | 0.786 | 79% | 0.793 | S | S | * | * | -124.7 | 169.7 | -77.9 | 38.6 | -21.9 | 0 | 0 | 0 | 115.3 | |||||
| 128 | D | 41.3 | Very low | 44.4 | Very low | 139 Ų | 139 | 127.9 Ų | 127.9 | 74% | 0.743 | 79% | 0.791 | S | S | * | * | trans | -57.5 | 145.8 | 167.4 | 176.9 | 60.4 | 0 | 0 | 0 | 115.2 | ||||
| 129 | L | 45 | Very low | 44.6 | Very low | 172 Ų | 172 | 127.5 Ų | 127.5 | 90% | 0.901 | 80% | 0.795 | S | S | * | * | trans | -159.4 | 101.8 | 148.5 | -79.8 | -169.5 | 0 | 0 | 0 | 112.4 | ||||
| 130 | G | 36 | Very low | 45.2 | Very low | 65 Ų | 65 | 127.8 Ų | 127.8 | 67% | 0.67 | 80% | 0.797 | S | S | * | * | 73.2 | 104.8 | 116 | 0 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 131 | H | 42.6 | Very low | 45.5 | Very low | 189 Ų | 189 | 125.7 Ų | 125.7 | 88% | 0.875 | 80% | 0.796 | S | S | * | * | trans | -93 | 152.5 | 143.3 | -74.4 | 78.3 | 0 | 0 | 0 | 108.3 | ||||
| 132 | P | 54.1 | Low | 46.6 | Very low | 129 Ų | 129 | 124.8 Ų | 124.8 | 84% | 0.838 | 80% | 0.803 | S | S | * | * | -157 | 160.3 | 81 | 37.9 | -16.5 | 0 | 0 | 0 | 118.1 | |||||
| 133 | G | 40.7 | Very low | 47 | Very low | 73 Ų | 73 | 124.3 Ų | 124.3 | 75% | 0.753 | 81% | 0.805 | S | S | * | * | trans | 90 | 139.9 | 136.1 | 0 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 134 | P | 58.3 | Low | 47.6 | Very low | 128 Ų | 128 | 128.8 Ų | 128.8 | 83% | 0.831 | 81% | 0.811 | S | S | * | * | trans | -100.1 | 172.9 | -176.8 | 40.5 | -33.8 | 0 | 0 | 0 | 113.5 | ||||
| 135 | P | 58.9 | Low | 46.7 | Very low | 132 Ų | 132 | 126 Ų | 126 | 86% | 0.857 | 81% | 0.806 | S | S | * | * | trans | -125.5 | 148.1 | 151.5 | 35.1 | -23 | 0 | 0 | 0 | 114.6 | ||||
| 136 | S | 46.6 | Very low | 46.5 | Very low | 98 Ų | 98 | 126.3 Ų | 126.3 | 69% | 0.685 | 81% | 0.813 | S | S | * | * | trans | -106.2 | 167.5 | 169.7 | -178.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 137 | M | 45 | Very low | 45.4 | Very low | 180 Ų | 180 | 123.6 Ų | 123.6 | 89% | 0.887 | 81% | 0.807 | S | S | * | * | trans | 85.7 | 114.2 | 164.7 | -33.4 | -76.2 | -169.4 | 0 | 0 | 118.3 | ||||
| 138 | C | 40.1 | Very low | 44.7 | Very low | 132 Ų | 132 | 123 Ų | 123 | 89% | 0.892 | 81% | 0.806 | S | S | * | * | -153.1 | 135.3 | 126.6 | 63 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 139 | A | 40.1 | Very low | 45.2 | Very low | 95 Ų | 95 | 123 Ų | 123 | 79% | 0.785 | 81% | 0.811 | S | S | * | * | trans | -81.8 | 161.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 140 | S | 45.3 | Very low | 46.4 | Very low | 123 Ų | 123 | 120.4 Ų | 120.4 | 86% | 0.86 | 81% | 0.805 | S | S | * | * | trans | -166.8 | 117.5 | 142.5 | -76.9 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 141 | T | 43.8 | Very low | 46.6 | Very low | 134 Ų | 134 | 124.5 Ų | 124.5 | 82% | 0.822 | 82% | 0.816 | S | S | * | * | trans | -84.3 | 160.3 | 149.8 | 46.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 142 | P | 57.6 | Low | 46.4 | Very low | 131 Ų | 131 | 118.6 Ų | 118.6 | 85% | 0.851 | 81% | 0.807 | S | S | * | * | -140.3 | 174.5 | 100.9 | 34.8 | -18.9 | 0 | 0 | 0 | 114.3 | |||||
| 143 | T | 45.3 | Very low | 45.8 | Very low | 124 Ų | 124 | 117.1 Ų | 117.1 | 76% | 0.761 | 81% | 0.806 | S | S | * | * | trans | -109.6 | 169.7 | -166 | -173.6 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 144 | L | 45.8 | Very low | 45.9 | Very low | 166 Ų | 166 | 119.1 Ų | 119.1 | 87% | 0.869 | 81% | 0.808 | S | S | * | * | trans | 107.4 | 126.6 | 150.3 | -76.2 | 157.5 | 0 | 0 | 0 | 121.4 | ||||
| 145 | G | 34.6 | Very low | 45 | Very low | 69 Ų | 69 | 117.8 Ų | 117.8 | 71% | 0.711 | 80% | 0.8 | S | S | * | * | trans | 137.1 | 80.2 | 157.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 146 | S | 40.1 | Very low | 44.4 | Very low | 135 Ų | 135 | 118 Ų | 118 | 94% | 0.944 | 80% | 0.799 | S | S | * | * | 58.8 | 127.5 | 89.1 | -151.8 | 0 | 0 | 0 | 0 | 113.5 | |||||
| 147 | G | 34.6 | Very low | 45 | Very low | 61 Ų | 61 | 119.1 Ų | 119.1 | 63% | 0.629 | 80% | 0.804 | S | S | * | * | cis | 175.4 | -173.4 | 9 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 148 | S | 43.9 | Very low | 44.9 | Very low | 109 Ų | 109 | 115.1 Ų | 115.1 | 76% | 0.762 | 80% | 0.799 | S | S | * | * | trans | 64 | 100.5 | 165.5 | 52.8 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 149 | T | 51.8 | Low | 45 | Very low | 138 Ų | 138 | 115.1 Ų | 115.1 | 85% | 0.847 | 79% | 0.791 | S | S | * | * | 88 | 148.9 | 76.1 | 56.5 | 0 | 0 | 0 | 0 | 115.8 | |||||
| 150 | P | 69 | Low | 45.3 | Very low | 118 Ų | 118 | 120.7 Ų | 120.7 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | trans | -109.7 | 174.6 | -153.9 | 40.7 | -29.2 | 0 | 0 | 0 | 113.5 | ||||
| 151 | T | 40.8 | Very low | 45.2 | Very low | 150 Ų | 150 | 117.8 Ų | 117.8 | 92% | 0.92 | 79% | 0.787 | S | S | * | * | trans | 151 | 138.3 | 158.5 | -69.1 | 0 | 0 | 0 | 0 | 107.4 | ||||
| 152 | G | 38.2 | Very low | 45.2 | Very low | 65 Ų | 65 | 121.4 Ų | 121.4 | 67% | 0.67 | 79% | 0.786 | S | S | * | * | cis | 175.1 | 154.2 | 2.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 153 | A | 42.3 | Very low | 44.4 | Very low | 99 Ų | 99 | 121.9 Ų | 121.9 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | 44.8 | 134.5 | 144.7 | 0 | 0 | 0 | 0 | 0 | 124.4 | ||||
| 154 | S | 41 | Very low | 44.2 | Very low | 114 Ų | 114 | 121.6 Ų | 121.6 | 80% | 0.797 | 78% | 0.775 | S | S | * | * | trans | 78.4 | 147.4 | 134.8 | -106.3 | 0 | 0 | 0 | 0 | 118.1 | ||||
| 155 | C | 39.5 | Very low | 44.1 | Very low | 100 Ų | 100 | 121.3 Ų | 121.3 | 68% | 0.676 | 77% | 0.774 | S | S | * | * | cis | -170.5 | 125 | 14 | 26.2 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 156 | V | 47 | Very low | 44.5 | Very low | 138 Ų | 138 | 123 Ų | 123 | 84% | 0.836 | 78% | 0.775 | S | S | * | * | 69.9 | 171.7 | 107.5 | -52.5 | 0 | 0 | 0 | 0 | 117.4 | |||||
| 157 | P | 59.8 | Low | 45.1 | Very low | 121 Ų | 121 | 122.3 Ų | 122.3 | 79% | 0.786 | 77% | 0.767 | S | S | * | * | -136.3 | -178.6 | -99.5 | 38.9 | -16.1 | 0 | 0 | 0 | 115.1 | |||||
| 158 | A | 41.5 | Very low | 45.4 | Very low | 95 Ų | 95 | 122.8 Ų | 122.8 | 79% | 0.785 | 77% | 0.765 | S | S | * | * | trans | -161.7 | 114.9 | 155.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 159 | D | 42.9 | Very low | 45.1 | Very low | 133 Ų | 133 | 126.4 Ų | 126.4 | 71% | 0.711 | 77% | 0.77 | S | S | * | * | 79.8 | 111.4 | 76.3 | -155.3 | -77.1 | 0 | 0 | 0 | 113.4 | |||||
| 160 | F | 45.7 | Very low | 44.8 | Very low | 211 Ų | 211 | 124.9 Ų | 124.9 | 93% | 0.925 | 77% | 0.771 | S | S | * | * | -162.7 | 105.9 | 129.3 | -94.3 | -69.2 | 0 | 0 | 0 | 107.9 | |||||
| 161 | G | 43.5 | Very low | 43.5 | Very low | 63 Ų | 63 | 127.2 Ų | 127.2 | 65% | 0.649 | 77% | 0.772 | S | S | * | * | trans | -78 | 175.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 162 | R | 44.1 | Very low | 43.7 | Very low | 209 Ų | 209 | 128.1 Ų | 128.1 | 79% | 0.789 | 76% | 0.763 | S | S | * | * | -169.8 | 105.6 | 125.6 | -98.3 | -174.5 | 123 | -89.6 | -3.4 | 111.4 | |||||
| 163 | Q | 41.1 | Very low | 44.1 | Very low | 142 Ų | 142 | 136.5 Ų | 136.5 | 66% | 0.664 | 77% | 0.774 | S | S | * | * | 41 | 142.9 | 128.2 | 6.2 | -174.5 | -1.3 | 0 | 0 | 119.8 | |||||
| 164 | T | 41 | Very low | 44.1 | Very low | 118 Ų | 118 | 138.5 Ų | 138.5 | 72% | 0.724 | 77% | 0.771 | S | S | * | * | cis | 176.5 | 155.9 | -0.5 | -96.3 | 0 | 0 | 0 | 0 | 106.5 | ||||
| 165 | L | 44.1 | Very low | 44.2 | Very low | 160 Ų | 160 | 136.7 Ų | 136.7 | 84% | 0.838 | 77% | 0.771 | S | S | * | * | trans | 99.1 | 93.9 | 166.3 | -49.4 | -179.2 | 0 | 0 | 0 | 119.2 | ||||
| 166 | S | 42.9 | Very low | 44.3 | Very low | 105 Ų | 105 | 140.4 Ų | 140.4 | 73% | 0.734 | 78% | 0.775 | S | S | * | * | trans | -77 | 154.1 | 139 | -163.7 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 167 | P | 51.5 | Low | 44.6 | Very low | 119 Ų | 119 | 145.7 Ų | 145.7 | 77% | 0.773 | 78% | 0.78 | S | S | * | * | -142.2 | 134.2 | 97 | 28.8 | -9.3 | 0 | 0 | 0 | 112.6 | |||||
| 168 | A | 41.1 | Very low | 44.1 | Very low | 71 Ų | 71 | 148.5 Ų | 148.5 | 59% | 0.587 | 78% | 0.78 | S | S | * | * | 88.3 | 135.3 | 82.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | |||||
| 169 | E | 38.3 | Very low | 44.4 | Very low | 185 Ų | 185 | 149.5 Ų | 149.5 | 86% | 0.864 | 78% | 0.781 | S | S | * | * | trans | 58.3 | 113.7 | 157.4 | -30.5 | -63.4 | 92.2 | 0 | 0 | 121.5 | ||||
| 170 | A | 46 | Very low | 44.2 | Very low | 106 Ų | 106 | 149 Ų | 149 | 88% | 0.876 | 78% | 0.779 | S | S | * | * | trans | -158.3 | 101.5 | 134.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 171 | E | 40.1 | Very low | 44.2 | Very low | 168 Ų | 168 | 143.5 Ų | 143.5 | 79% | 0.785 | 77% | 0.766 | S | S | * | * | trans | -65.6 | 146.8 | 170.4 | -105.8 | -152.8 | 98.8 | 0 | 0 | 113.8 | ||||
| 172 | K | 46 | Very low | 44.3 | Very low | 168 Ų | 168 | 146.6 Ų | 146.6 | 73% | 0.73 | 78% | 0.778 | S | S | * | * | trans | 73.4 | 116.4 | 130.2 | -161.6 | 177.1 | -165.1 | 169.8 | 0 | 120.9 | ||||
| 173 | R | 47.3 | Very low | 44.2 | Very low | 242 Ų | 242 | 145.1 Ų | 145.1 | 91% | 0.913 | 78% | 0.78 | S | S | * | * | -175.7 | 99 | 124.9 | -103.6 | 172.8 | 172.2 | -134 | -1.3 | 109.5 | |||||
| 174 | N | 41.7 | Very low | 44.5 | Very low | 141 Ų | 141 | 143.9 Ų | 143.9 | 75% | 0.754 | 79% | 0.787 | S | S | * | * | 45.4 | 102.5 | 93.6 | -161.1 | 63.4 | 0 | 0 | 0 | 115.2 | |||||
| 175 | G | 43.1 | Very low | 45 | Very low | 76 Ų | 76 | 147.3 Ų | 147.3 | 78% | 0.784 | 80% | 0.795 | S | S | * | * | trans | -137.4 | 45.4 | 168.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | R177 | G175-R177 PolarHBondContact O-N 3.44Š| ||
| 176 | K | 42.1 | Very low | 45.2 | Very low | 177 Ų | 177 | 147.4 Ų | 147.4 | 77% | 0.77 | 80% | 0.796 | S | S | * | * | trans | -70.8 | 104.9 | 167.3 | -172.6 | 123.1 | 164.7 | 177.2 | 0 | 108.1 | ||||
| 177 | R | 53.8 | Low | 45.5 | Very low | 249 Ų | 249 | 144 Ų | 144 | 94% | 0.94 | 78% | 0.777 | S | S | * | * | trans | -105.7 | 110.1 | 160.6 | -69.5 | -165.8 | 175.3 | -159.5 | -0.8 | 108.5 | G175 | G175-R177 PolarHBondContact O-N 3.44Š| ||
| 178 | K | 48.7 | Very low | 45.6 | Very low | 181 Ų | 181 | 144.8 Ų | 144.8 | 79% | 0.787 | 78% | 0.775 | S | S | * | * | trans | -102.4 | 127 | 166.1 | 173.6 | 163.4 | 166.4 | 175.9 | 0 | 105.9 | ||||
| 179 | S | 48.4 | Very low | 45.8 | Very low | 116 Ų | 116 | 150.9 Ų | 150.9 | 81% | 0.811 | 78% | 0.784 | S | S | * | * | trans | -156.1 | 89.2 | 162.8 | -169.7 | 0 | 0 | 0 | 0 | 103.5 | ||||
| 180 | D | 37.5 | Very low | 46.4 | Very low | 122 Ų | 122 | 150.4 Ų | 150.4 | 65% | 0.652 | 78% | 0.779 | S | S | * | * | 56.5 | 99.5 | 87.3 | -152.6 | -106.2 | 0 | 0 | 0 | 112.4 | |||||
| 181 | S | 46 | Very low | 46.6 | Very low | 96 Ų | 96 | 150.5 Ų | 150.5 | 67% | 0.671 | 77% | 0.771 | S | S | * | * | trans | 27.7 | 121.4 | 134.1 | -50.2 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 182 | S | 46.3 | Very low | 47 | Very low | 127 Ų | 127 | 148.8 Ų | 148.8 | 89% | 0.888 | 77% | 0.767 | S | S | * | * | trans | -142.6 | 137.8 | 140 | -75.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 183 | E | 41.3 | Very low | 47.6 | Very low | 178 Ų | 178 | 147.4 Ų | 147.4 | 83% | 0.832 | 77% | 0.773 | S | S | * | * | trans | -66.6 | 146.2 | -163.2 | -65.9 | 178.4 | 73.7 | 0 | 0 | 114.6 | ||||
| 184 | S | 47.7 | Very low | 48.1 | Very low | 117 Ų | 117 | 139.3 Ų | 139.3 | 82% | 0.818 | 75% | 0.753 | S | S | * | * | 28 | 100.9 | 127.9 | -41.3 | 0 | 0 | 0 | 0 | 117.1 | |||||
| 185 | Q | 51.6 | Low | 48.8 | Very low | 189 Ų | 189 | 137.5 Ų | 137.5 | 88% | 0.883 | 75% | 0.752 | S | S | * | * | trans | -126.7 | 116.7 | 151.1 | -162.9 | 154.4 | -6.1 | 0 | 0 | 110.1 | G187 | Q185-G187 PolarHBondContact O-N 2.92Š| ||
| 186 | D | 48.5 | Very low | 49.7 | Very low | 163 Ų | 163 | 142 Ų | 142 | 87% | 0.872 | 75% | 0.75 | S | S | * | * | trans | -52.7 | 98.5 | 175.8 | -151.1 | -94.8 | 0 | 0 | 0 | 109.9 | ||||
| 187 | G | 49.5 | Very low | 50.7 | Low | 32 Ų | 32 | 139.3 Ų | 139.3 | 33% | 0.33 | 75% | 0.75 | S | S | . | * | trans | -114.4 | 95.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 108.1 | Q185 Y189 | Q185-G187 PolarHBondContact O-N 2.92Å; G187-Y189 WeakPolarHBondContact O-CD2 3.46Å; G187-Y189 VanDerWaalsContact O-CE2 3.27Å; G187-Y189 WeakPolarHBondContact O-CE2 3.47Å; G187-Y189 PolarHBondContact O-N 3.36Å | ||
| 188 | N | 52.7 | Low | 51.5 | Low | 136 Ų | 136 | 139 Ų | 139 | 73% | 0.727 | 75% | 0.749 | S | S | * | * | trans | -62.2 | 76 | 168.9 | 174.4 | 42.5 | 0 | 0 | 0 | 110.3 | K190 | N188-K190 PolarHBondContact O-N 2.68Š| ||
| 189 | Y | 46 | Very low | 52.7 | Low | 199 Ų | 199 | 140 Ų | 140 | 78% | 0.78 | 75% | 0.753 | S | S | * | * | trans | -84.4 | 98.5 | 167.5 | -48.5 | -73.3 | 0 | 0 | 0 | 106.8 | G187 P191 | G187-Y189 WeakPolarHBondContact O-CD2 3.46Å; G187-Y189 VanDerWaalsContact O-CE2 3.27Å; G187-Y189 WeakPolarHBondContact O-CE2 3.47Å; G187-Y189 PolarHBondContact O-N 3.36Å; Y189-P191 WeakPolarHBondContact O-CD 3.34Å; Y189-P191 VanDerWaalsContact O-N 3.11Å | ||
| 190 | K | 50.3 | Low | 54.3 | Low | 175 Ų | 175 | 143 Ų | 143 | 76% | 0.761 | 75% | 0.754 | S | S | * | * | trans | -53.6 | 117.8 | 163.2 | -72 | -163.6 | 161.8 | -170.6 | 0 | 107.7 | N188 D192 | N188-K190 PolarHBondContact O-N 2.68Å; K190-D192 PolarHBondContact O-N 3.48Å | ||
| 191 | P | 50 | Low | 56.6 | Low | 108 Ų | 108 | 148.4 Ų | 148.4 | 70% | 0.701 | 77% | 0.766 | S | S | * | * | trans | -68.1 | 106.3 | 172.9 | 26.7 | -30.6 | 0 | 0 | 0 | 107.1 | Y189 V193 | Y189-P191 WeakPolarHBondContact O-CD 3.34Å; Y189-P191 VanDerWaalsContact O-N 3.11Å; P191-V193 VanDerWaalsContact C-N 3.32Å; P191-V193 PolarHBondContact O-N 3.09Å | ||
| 192 | D | 49.4 | Very low | 58.5 | Low | 133 Ų | 133 | 149.1 Ų | 149.1 | 71% | 0.711 | 77% | 0.766 | S | S | * | * | trans | -61.1 | 99.2 | 166.5 | -173.7 | -93.1 | 0 | 0 | 0 | 107.8 | K190 S194 | K190-D192 PolarHBondContact O-N 3.48Å; D192-S194 PolarHBondContact O-N 3.45Å; D192-S194 PolarHBondContact OD1-N 3.13Å | ||
| 193 | V | 57.7 | Low | 60.8 | Low | 139 Ų | 139 | 147.3 Ų | 147.3 | 84% | 0.842 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.7 | 56.8 | 176.7 | -72.3 | 0 | 0 | 0 | 0 | 110.4 | P191 | P191-V193 VanDerWaalsContact C-N 3.32Å; P191-V193 PolarHBondContact O-N 3.09Å |
| 194 | S | 57 | Low | 63.5 | Low | 72 Ų | 72 | 141.7 Ų | 141.7 | 50% | 0.503 | 73% | 0.732 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -145.1 | 23.9 | 164.2 | -169.5 | 0 | 0 | 0 | 0 | 114.2 | D192 K196 | D192-S194 PolarHBondContact O-N 3.45Å; D192-S194 PolarHBondContact OD1-N 3.13Å; S194-K196 PolarHBondContact O-N 3.49Å |
| 195 | S | 57.2 | Low | 65.9 | Low | 103 Ų | 103 | 139.7 Ų | 139.7 | 72% | 0.72 | 72% | 0.715 | S | S | * | * | trans | -86.9 | 92.5 | 157.4 | -68.3 | 0 | 0 | 0 | 0 | 108.5 | P197 | S195-P197 WeakPolarHBondContact O-CD 3.29Š| ||
| 196 | K | 62.7 | Low | 68.1 | Low | 171 Ų | 171 | 139.8 Ų | 139.8 | 74% | 0.743 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -51.4 | 119.1 | 165.5 | -78.7 | 78.7 | 175.5 | 176.1 | 0 | 106 | S194 R198 | S194-K196 PolarHBondContact O-N 3.49Å; K196-R198 PolarHBondContact O-N 3.1Å |
| 197 | P | 61.6 | Low | 70.5 | Confident | 120 Ų | 120 | 138.3 Ų | 138.3 | 78% | 0.779 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 117.6 | -174.8 | 20.2 | -30.7 | 0 | 0 | 0 | 108 | S195 K199 | S195-P197 WeakPolarHBondContact O-CD 3.29Å; P197-K199 PolarHBondContact O-N 3.47Å |
| 198 | R | 70.6 | Confident | 72.8 | Confident | 243 Ų | 243 | 138.1 Ų | 138.1 | 92% | 0.917 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 117.2 | 175.3 | -157.4 | -179.9 | -156.9 | -155.7 | 6.9 | 105.4 | K196 E200 | K196-R198 PolarHBondContact O-N 3.1Å; R198-E200 PolarHBondContact O-N 2.96Å |
| 199 | K | 75.6 | Confident | 75 | Confident | 202 Ų | 202 | 134.6 Ų | 134.6 | 88% | 0.878 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -46.6 | 116.1 | -178.2 | -77.9 | 157.4 | 176.4 | 164.6 | 0 | 108.9 | P197 R201 | P197-K199 PolarHBondContact O-N 3.47Å; K199-R201 PolarHBondContact O-N 2.92Å |
| 200 | E | 81.5 | Confident | 77.4 | Confident | 177 Ų | 177 | 131.7 Ų | 131.7 | 83% | 0.827 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -46.2 | 131.3 | 177 | -166.6 | 81.2 | -142.9 | 0 | 0 | 108.4 | R198 T202 | R198-E200 PolarHBondContact O-N 2.96Å; E200-T202 PolarHBondContact O-N 3.24Å; E200-T202 VanDerWaalsContact O-N 3.08Å |
| 201 | R | 86.3 | Confident | 79.7 | Confident | 237 Ų | 237 | 126.5 Ų | 126.5 | 89% | 0.894 | 64% | 0.637 | S | S | * | * | trans | -74.1 | 108.3 | -177.1 | -165.6 | 178.2 | -174.8 | -178.9 | 1.2 | 108.2 | K199 A203 | K199-R201 PolarHBondContact O-N 2.92Å; R201-A203 PolarHBondContact O-N 3.45Å | ||
| 202 | T | 85.7 | Confident | 82.1 | Confident | 110 Ų | 110 | 121.3 Ų | 121.3 | 68% | 0.675 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -71.6 | 124.5 | 177.2 | -9.3 | 0 | 0 | 0 | 0 | 109.9 | E200 | E200-T202 PolarHBondContact O-N 3.24Å; E200-T202 VanDerWaalsContact O-N 3.08Å |
| 203 | A | 94.1 | Very high | 84.4 | Confident | 90 Ų | 90 | 119 Ų | 119 | 74% | 0.744 | 59% | 0.588 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 142.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | R201 | R201-A203 PolarHBondContact O-N 3.45Š|
| 204 | F | 97.6 | Very high | 86.3 | Confident | 60 Ų | 60 | 114.2 Ų | 114.2 | 26% | 0.263 | 56% | 0.564 | S | S | . | * | P | Polyproline II helix | trans | -80.2 | 146.8 | 172.4 | -58.3 | -49.9 | 0 | 0 | 0 | 110.3 | Q208 I209 L236 Q240 W244 | F204-Q208 HydrophobicContact CB-CB 4.28Å; F204-I209 HydrophobicContact CB-CD1 4.42Å; F204-I209 HydrophobicContact CB-CG1 4.01Å; F204-L236 HydrophobicContact CD1-CD1 4.15Å; F204-L236 HydrophobicContact CD1-CD2 3.75Å; F204-L236 HydrophobicContact CE1-CD1 4.12Å; F204-L236 HydrophobicContact CE1-CD2 3.7Å; F204-Q240 HydrophobicContact CE1-CB 4.17Å; F204-Q240 HydrophobicContact CE1-CG 4.27Å; F204-Q240 HydrophobicContact CZ-CB 4.03Å; F204-Q240 HydrophobicContact CZ-CG 4.28Å; F204-W244 AromaticContact CD2-CD1 3.7Å; F204-W244 HydrophobicContact CE2-CB 4.38Å; F204-W244 AromaticContact CE2-CD1 3.61Å; F204-W244 HydrophobicContact CE2-CG 4.38Å |
| 205 | T | 98.2 | Very high | 88.3 | Confident | 74 Ų | 74 | 111.8 Ų | 111.8 | 45% | 0.454 | 55% | 0.545 | S | S | . | . | P | Polyproline II helix | trans | -67.8 | 160.5 | 175 | 74 | 0 | 0 | 0 | 0 | 110.5 | E207 Q208 I209 | T205-E207 PolarHBondContact O-N 2.82Å; T205-Q208 PolarHBondContact O-N 3.32Å; T205-Q208 VanDerWaalsContact OG1-CG 3.27Å; T205-Q208 WeakPolarHBondContact OG1-CG 3.38Å; T205-Q208 PolarHBondContact OG1-N 3.02Å; T205-Q208 VanDerWaalsContact OG1-N 3.17Å; T205-I209 WeakPolarHBondContact O-CG1 3.27Å; T205-I209 PolarHBondContact O-N 2.92Å |
| 206 | K | 97.9 | Very high | 90.2 | Very high | 192 Ų | 192 | 107.3 Ų | 107.3 | 84% | 0.835 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -59.9 | -37.8 | 177.3 | -173 | -179.9 | 178.5 | -174.6 | 0 | 111.8 | I209 R210 | K206-I209 PolarHBondContact O-N 3.34Å; K206-R210 PolarHBondContact O-N 3.19Å |
| 207 | E | 98 | Very high | 91.9 | Very high | 131 Ų | 131 | 103.1 Ų | 103.1 | 61% | 0.612 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.6 | -47.4 | 177.7 | -177.8 | 167.8 | -154.3 | 0 | 0 | 111.9 | T205 I209 R210 E211 | T205-E207 PolarHBondContact O-N 2.82Å; E207-I209 VanDerWaalsContact C-N 3.27Å; E207-I209 PolarHBondContact O-N 2.92Å; E207-R210 WeakPolarHBondContact O-CB 3.23Å; E207-R210 PolarHBondContact O-N 2.91Å; E207-R210 VanDerWaalsContact O-N 3.08Å; E207-E211 PolarHBondContact O-N 2.79Å; E207-E211 VanDerWaalsContact O-N 3.09Å |
| 208 | Q | 98.4 | Very high | 93.6 | Very high | 29 Ų | 29 | 104 Ų | 104 | 14% | 0.136 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -56.3 | -43.2 | 174.5 | -73 | 171.7 | -24.7 | 0 | 0 | 111.5 | F204 T205 E211 L212 L234 | F204-Q208 HydrophobicContact CB-CB 4.28Å; T205-Q208 PolarHBondContact O-N 3.32Å; T205-Q208 VanDerWaalsContact OG1-CG 3.27Å; T205-Q208 WeakPolarHBondContact OG1-CG 3.38Å; T205-Q208 PolarHBondContact OG1-N 3.02Å; T205-Q208 VanDerWaalsContact OG1-N 3.17Å; Q208-E211 PolarHBondContact O-N 3.12Å; Q208-L212 WeakPolarHBondContact O-CB 3.39Å; Q208-L212 WeakPolarHBondContact O-CD1 3.35Å; Q208-L212 WeakPolarHBondContact O-CG 3.29Å; Q208-L212 PolarHBondContact O-N 3.17Å; Q208-L234 HydrophobicContact CG-CB 4.33Å; Q208-L234 PolarHBondContact NE2-O 3.07Å |
| 209 | I | 98.3 | Very high | 94.8 | Very high | 61 Ų | 61 | 97.6 Ų | 97.6 | 31% | 0.313 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63 | -44.5 | 177.4 | -65.6 | 165.4 | 0 | 0 | 0 | 110.8 | F204 T205 K206 E207 E211 L212 E213 | F204-I209 HydrophobicContact CB-CD1 4.42Å; F204-I209 HydrophobicContact CB-CG1 4.01Å; T205-I209 WeakPolarHBondContact O-CG1 3.27Å; T205-I209 PolarHBondContact O-N 2.92Å; K206-I209 PolarHBondContact O-N 3.34Å; E207-I209 VanDerWaalsContact C-N 3.27Å; E207-I209 PolarHBondContact O-N 2.92Å; I209-E211 VanDerWaalsContact C-N 3.33Å; I209-E211 PolarHBondContact O-N 3.21Å; I209-L212 PolarHBondContact O-N 2.95Å; I209-E213 HydrophobicContact CG2-CG 4.22Å; I209-E213 WeakPolarHBondContact O-CB 3.36Å; I209-E213 WeakPolarHBondContact O-CG 3.45Å; I209-E213 PolarHBondContact O-N 3.29Å |
| 210 | R | 98.4 | Very high | 95.8 | Very high | 139 Ų | 139 | 90.4 Ų | 90.4 | 53% | 0.525 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -57.9 | -45.5 | -179.8 | -173.3 | -163.3 | 66.4 | 76.1 | 1.2 | 111.4 | K206 E207 E213 A214 | K206-R210 PolarHBondContact O-N 3.19Å; E207-R210 WeakPolarHBondContact O-CB 3.23Å; E207-R210 PolarHBondContact O-N 2.91Å; E207-R210 VanDerWaalsContact O-N 3.08Å; R210-E213 PolarHBondContact O-N 3.02Å; R210-A214 WeakPolarHBondContact O-CB 3.46Å; R210-A214 PolarHBondContact O-N 3.26Å |
| 211 | E | 98.4 | Very high | 96.6 | Very high | 65 Ų | 65 | 89.8 Ų | 89.8 | 30% | 0.304 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -70.2 | -41.5 | 179.6 | -68.8 | -157.8 | -159.3 | 0 | 0 | 112.9 | E207 Q208 I209 E213 A214 E215 L234 | E207-E211 PolarHBondContact O-N 2.79Å; E207-E211 VanDerWaalsContact O-N 3.09Å; Q208-E211 PolarHBondContact O-N 3.12Å; I209-E211 VanDerWaalsContact C-N 3.33Å; I209-E211 PolarHBondContact O-N 3.21Å; E211-E213 VanDerWaalsContact C-N 3.28Å; E211-E213 PolarHBondContact O-N 3.42Å; E211-A214 PolarHBondContact O-N 3.05Å; E211-E215 PolarHBondContact O-N 3.08Å; E211-L234 HydrophobicContact CB-CD1 4.09Å; E211-L234 HydrophobicContact CB-CD2 3.71Å; E211-L234 HydrophobicContact CB-CG 4.48Å; E211-L234 HydrophobicContact CG-CD2 4.03Å; E211-L234 WeakPolarHBondContact OE2-CD2 3.25Å |
| 212 | L | 98.6 | Very high | 97.2 | Very high | 0 Ų | 0 | 79.9 Ų | 79.9 | 0% | 0 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -61 | -38.3 | 174.1 | -70.3 | 167 | 0 | 0 | 0 | 111.9 | Q208 I209 F216 I230 L234 L236 V241 W244 F245 | Q208-L212 WeakPolarHBondContact O-CB 3.39Å; Q208-L212 WeakPolarHBondContact O-CD1 3.35Å; Q208-L212 WeakPolarHBondContact O-CG 3.29Å; Q208-L212 PolarHBondContact O-N 3.17Å; I209-L212 PolarHBondContact O-N 2.95Å; L212-F216 VanDerWaalsContact O-CB 3.29Å; L212-F216 WeakPolarHBondContact O-CB 3.38Å; L212-F216 PolarHBondContact O-N 2.98Å; L212-I230 HydrophobicContact CD2-CG2 3.89Å; L212-L234 HydrophobicContact CD1-CD1 4.43Å; L212-L234 HydrophobicContact CD2-CD1 3.86Å; L212-L234 HydrophobicContact CG-CD1 3.7Å; L212-L236 HydrophobicContact CD1-CD1 4.15Å; L212-V241 HydrophobicContact CD2-CG1 4.2Å; L212-W244 VanDerWaalsContact C-CH2 3.44Å; L212-W244 HydrophobicContact CB-CD2 3.91Å; L212-W244 HydrophobicContact CB-CE3 3.86Å; L212-W244 HydrophobicContact CB-CH2 3.59Å; L212-W244 HydrophobicContact CB-CZ2 3.62Å; L212-W244 HydrophobicContact CB-CZ3 3.71Å; L212-W244 HydrophobicContact CD1-CB 4.5Å; L212-W244 HydrophobicContact CD1-CD2 3.85Å; L212-W244 HydrophobicContact CD1-CE3 4.46Å; L212-W244 HydrophobicContact CD1-CG 3.83Å; L212-W244 HydrophobicContact CD2-CD2 4.49Å; L212-W244 HydrophobicContact CD2-CE3 4.33Å; L212-W244 HydrophobicContact CG-CD2 4.31Å; L212-W244 HydrophobicContact CG-CE3 4.45Å; L212-W244 WeakPolarHBondContact O-CH2 3.31Å; L212-W244 WeakPolarHBondContact O-CZ3 3.3Å; L212-F245 HydrophobicContact CD2-CE2 3.95Å |
| 213 | E | 98.4 | Very high | 97.8 | Very high | 83 Ų | 83 | 79 Ų | 79 | 39% | 0.388 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -70.3 | -41.6 | 175.4 | -73.6 | -170.3 | 150.1 | 0 | 0 | 112.7 | I209 R210 E211 F216 A217 W244 R248 | I209-E213 HydrophobicContact CG2-CG 4.22Å; I209-E213 WeakPolarHBondContact O-CB 3.36Å; I209-E213 WeakPolarHBondContact O-CG 3.45Å; I209-E213 PolarHBondContact O-N 3.29Å; R210-E213 PolarHBondContact O-N 3.02Å; E211-E213 VanDerWaalsContact C-N 3.28Å; E211-E213 PolarHBondContact O-N 3.42Å; E213-F216 PolarHBondContact O-N 3.06Å; E213-A217 PolarHBondContact O-N 2.98Å; E213-W244 HydrophobicContact CB-CH2 4.49Å; E213-W244 HydrophobicContact CG-CH2 3.78Å; E213-W244 HydrophobicContact CG-CZ2 3.8Å; E213-R248 IonicContact OE1-NH1 3.59Å; E213-R248 PolarHBondContact OE1-NH1 2.84Å |
| 214 | A | 98.2 | Very high | 98 | Very high | 40 Ų | 40 | 82.3 Ų | 82.3 | 33% | 0.331 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -58.4 | -49.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.2 | R210 E211 F216 A217 H218 | R210-A214 WeakPolarHBondContact O-CB 3.46Å; R210-A214 PolarHBondContact O-N 3.26Å; E211-A214 PolarHBondContact O-N 3.05Å; A214-F216 VanDerWaalsContact C-N 3.34Å; A214-F216 PolarHBondContact O-N 3.49Å; A214-A217 WeakPolarHBondContact O-CB 3.37Å; A214-A217 PolarHBondContact O-N 3.45Å; A214-H218 PolarHBondContact O-CE1 3.45Å; A214-H218 PolarHBondContact O-N 3.46Å; A214-H218 PolarHBondContact O-ND1 2.97Å |
| 215 | E | 98.3 | Very high | 98.1 | Very high | 21 Ų | 21 | 85 Ų | 85 | 10% | 0.098 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -61.2 | -43.2 | 177.6 | -170.5 | 69.6 | -148.9 | 0 | 0 | 112 | E211 A217 H218 H219 L222 R226 I230 F245 | E211-E215 PolarHBondContact O-N 3.08Å; E215-A217 PolarHBondContact O-N 3.36Å; E215-H218 PolarHBondContact O-N 2.87Å; E215-H219 PolarHBondContact O-N 3.41Å; E215-H219 IonicContact OE1-ND1 2.92Å; E215-L222 HydrophobicContact CG-CD2 3.97Å; E215-R226 VanDerWaalsContact CD-NE 3.33Å; E215-R226 IonicContact OE1-CZ 2.64Å; E215-R226 IonicContact OE1-NE 3.93Å; E215-R226 PolarHBondContact OE1-NE 3.41Å; E215-R226 IonicContact OE1-NH2 3.44Å; E215-R226 PolarHBondContact OE1-NH2 3.09Å; E215-R226 IonicContact OE2-CZ 3.49Å; E215-R226 IonicContact OE2-NE 3.63Å; E215-R226 PolarHBondContact OE2-NE 3.49Å; E215-R226 IonicContact OE2-NH2 3.65Å; E215-R226 PolarHBondContact OE2-NH2 3.44Å; E215-I230 HydrophobicContact CB-CD1 4.42Å; E215-I230 HydrophobicContact CG-CD1 3.61Å; E215-I230 HydrophobicContact CG-CG1 4.5Å; E215-F245 HydrophobicContact CB-CZ 4.21Å; E215-F245 HydrophobicContact CG-CZ 4.06Å |
| 216 | F | 98.3 | Very high | 98.1 | Very high | 9 Ų | 9 | 85.7 Ų | 85.7 | 4% | 0.039 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -60.6 | -33.2 | 179.5 | -174.7 | -95.9 | 0 | 0 | 0 | 113 | L212 E213 A214 H218 H219 N220 W244 F245 R248 R249 W252 | L212-F216 VanDerWaalsContact O-CB 3.29Å; L212-F216 WeakPolarHBondContact O-CB 3.38Å; L212-F216 PolarHBondContact O-N 2.98Å; E213-F216 PolarHBondContact O-N 3.06Å; A214-F216 VanDerWaalsContact C-N 3.34Å; A214-F216 PolarHBondContact O-N 3.49Å; F216-H218 VanDerWaalsContact C-N 3.29Å; F216-H218 PolarHBondContact O-N 2.9Å; F216-H219 CarbonylContact O-C 3.47Å; F216-N220 WeakPolarHBondContact CE1-OD1 3.27Å; F216-N220 HydrophobicContact CE2-CB 4.05Å; F216-N220 HydrophobicContact CZ-CB 4.2Å; F216-N220 WeakPolarHBondContact CZ-OD1 3.42Å; F216-W244 HydrophobicContact CB-CH2 4.4Å; F216-W244 HydrophobicContact CB-CZ3 4.15Å; F216-F245 HydrophobicContact CB-CE1 4.24Å; F216-F245 HydrophobicContact CB-CZ 4.34Å; F216-F245 AromaticContact CD2-CD1 3.88Å; F216-F245 HydrophobicContact CD2-CD1 3.88Å; F216-F245 AromaticContact CD2-CE1 3.81Å; F216-F245 HydrophobicContact CD2-CE1 3.81Å; F216-R248 HydrophobicContact CB-CG 4.4Å; F216-R248 HydrophobicContact CD1-CG 3.69Å; F216-R248 HydrophobicContact CD2-CB 4.22Å; F216-R248 HydrophobicContact CD2-CG 3.52Å; F216-R248 HydrophobicContact CE1-CG 3.74Å; F216-R248 HydrophobicContact CE2-CB 4.16Å; F216-R248 HydrophobicContact CE2-CG 3.59Å; F216-R248 HydrophobicContact CG-CG 3.57Å; F216-R248 HydrophobicContact CZ-CG 3.69Å; F216-R249 HydrophobicContact CE2-CG 3.7Å; F216-R249 HydrophobicContact CZ-CG 4.1Å; F216-W252 HydrophobicContact CE1-CB 4.31Å; F216-W252 HydrophobicContact CE1-CG 4.35Å; F216-W252 HydrophobicContact CZ-CB 4.17Å; F216-W252 HydrophobicContact CZ-CG 4.38Å |
| 217 | A | 97.3 | Very high | 98.1 | Very high | 82 Ų | 82 | 79 Ų | 79 | 68% | 0.678 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -65.2 | -33.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | E213 A214 E215 | E213-A217 PolarHBondContact O-N 2.98Å; A214-A217 WeakPolarHBondContact O-CB 3.37Å; A214-A217 PolarHBondContact O-N 3.45Å; E215-A217 PolarHBondContact O-N 3.36Å |
| 218 | H | 97 | Very high | 98.1 | Very high | 138 Ų | 138 | 79.2 Ų | 79.2 | 64% | 0.639 | 37% | 0.374 | S | S | * | . | H | α-helix | trans | -79.2 | -48.7 | 175.1 | -58.7 | 92.1 | 0 | 0 | 0 | 111.3 | A214 E215 F216 | A214-H218 PolarHBondContact O-CE1 3.45Å; A214-H218 PolarHBondContact O-N 3.46Å; A214-H218 PolarHBondContact O-ND1 2.97Å; E215-H218 PolarHBondContact O-N 2.87Å; F216-H218 VanDerWaalsContact C-N 3.29Å; F216-H218 PolarHBondContact O-N 2.9Å |
| 219 | H | 96.8 | Very high | 98.1 | Very high | 109 Ų | 109 | 81.1 Ų | 81.1 | 51% | 0.505 | 38% | 0.383 | S | S | . | . | trans | -136.9 | 113.5 | -175.2 | -56.9 | 95 | 0 | 0 | 0 | 110.9 | E215 F216 Y221 F245 | E215-H219 PolarHBondContact O-N 3.41Å; E215-H219 IonicContact OE1-ND1 2.92Å; F216-H219 CarbonylContact O-C 3.47Å; H219-Y221 PolarHBondContact O-N 2.71Å; H219-F245 WeakPolarHBondContact O-CE1 3.46Å | ||
| 220 | N | 97.1 | Very high | 98.2 | Very high | 52 Ų | 52 | 78.8 Ų | 78.8 | 28% | 0.278 | 37% | 0.371 | S | S | . | . | S | Bend | trans | -70.7 | -14.6 | 179.6 | -70.4 | -92.3 | 0 | 0 | 0 | 113.1 | F216 R249 | F216-N220 WeakPolarHBondContact CE1-OD1 3.27Å; F216-N220 HydrophobicContact CE2-CB 4.05Å; F216-N220 HydrophobicContact CZ-CB 4.2Å; F216-N220 WeakPolarHBondContact CZ-OD1 3.42Å; N220-R249 WeakPolarHBondContact O-CD 3.17Å |
| 221 | Y | 98.2 | Very high | 98.2 | Very high | 163 Ų | 163 | 72.5 Ų | 72.5 | 64% | 0.639 | 35% | 0.349 | S | S | * | . | S | Bend | trans | -135.2 | 138.2 | -178.2 | -66.3 | -110.5 | 0 | 0 | 0 | 108.8 | H219 | H219-Y221 PolarHBondContact O-N 2.71Š|
| 222 | L | 98.2 | Very high | 98.2 | Very high | 29 Ų | 29 | 73 Ų | 73 | 15% | 0.152 | 36% | 0.356 | C | S | . | . | trans | -102.8 | 137.9 | -179.1 | -61.2 | 178.4 | 0 | 0 | 0 | 111.6 | E215 R226 R227 I230 V241 F245 | E215-L222 HydrophobicContact CG-CD2 3.97Å; L222-R226 HydrophobicContact CD2-CG 3.93Å; L222-R227 HydrophobicContact CB-CB 4.29Å; L222-R227 HydrophobicContact CD1-CB 4.25Å; L222-R227 HydrophobicContact CD1-CG 4.43Å; L222-I230 HydrophobicContact CD1-CD1 3.78Å; L222-I230 HydrophobicContact CD2-CD1 3.69Å; L222-I230 HydrophobicContact CG-CD1 4.39Å; L222-V241 HydrophobicContact CD1-CG1 3.59Å; L222-F245 HydrophobicContact CD1-CD1 4.07Å; L222-F245 HydrophobicContact CD1-CD2 3.6Å; L222-F245 HydrophobicContact CD1-CE1 3.92Å; L222-F245 HydrophobicContact CD1-CE2 3.47Å; L222-F245 VanDerWaalsContact CD1-CE2 3.47Å; L222-F245 HydrophobicContact CD1-CG 3.92Å; L222-F245 HydrophobicContact CD1-CZ 3.64Å; L222-F245 HydrophobicContact CD2-CD1 4.4Å; L222-F245 HydrophobicContact CD2-CE1 3.67Å; L222-F245 HydrophobicContact CD2-CE2 4.37Å; L222-F245 HydrophobicContact CD2-CZ 3.67Å; L222-F245 HydrophobicContact CG-CD1 3.76Å; L222-F245 HydrophobicContact CG-CD2 4.24Å; L222-F245 HydrophobicContact CG-CE1 3.53Å; L222-F245 HydrophobicContact CG-CE2 4.06Å; L222-F245 HydrophobicContact CG-CG 4.12Å; L222-F245 HydrophobicContact CG-CZ 3.7Å | ||
| 223 | T | 98.4 | Very high | 98.1 | Very high | 93 Ų | 93 | 78.5 Ų | 78.5 | 57% | 0.571 | 39% | 0.386 | S | S | * | . | trans | -69.7 | 168.6 | 163.4 | 67.3 | 0 | 0 | 0 | 0 | 110.5 | R226 R227 | T223-R226 WeakPolarHBondContact OG1-CB 3.44Å; T223-R226 PolarHBondContact OG1-N 3.27Å; T223-R227 WeakPolarHBondContact O-CB 3.21Å; T223-R227 PolarHBondContact O-N 2.85Å; T223-R227 VanDerWaalsContact O-N 3.09Å | ||
| 224 | R | 98.4 | Very high | 98.1 | Very high | 159 Ų | 159 | 75 Ų | 75 | 60% | 0.6 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -62.5 | -46.6 | 177.4 | -179.7 | 141.4 | -171.8 | 65.4 | 7.3 | 111.4 | R227 Y228 E238 | R224-R227 PolarHBondContact O-N 3.27Å; R224-Y228 PolarHBondContact O-N 3.5Å; R224-E238 IonicContact CZ-OE1 3.77Å; R224-E238 IonicContact CZ-OE2 3.37Å; R224-E238 IonicContact NH1-OE1 2.81Å; R224-E238 PolarHBondContact NH1-OE1 3.03Å; R224-E238 IonicContact NH1-OE2 3.23Å; R224-E238 PolarHBondContact NH1-OE2 2.93Å; R224-E238 IonicContact NH2-OE1 2.99Å; R224-E238 PolarHBondContact NH2-OE1 3.47Å; R224-E238 IonicContact NH2-OE2 3.42Å |
| 225 | L | 98.4 | Very high | 98.1 | Very high | 115 Ų | 115 | 80.3 Ų | 80.3 | 60% | 0.602 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -62 | -50.2 | 178.8 | -178.4 | 60.9 | 0 | 0 | 0 | 111.4 | R227 Y228 E229 | L225-R227 VanDerWaalsContact C-N 3.28Å; L225-R227 PolarHBondContact O-N 2.89Å; L225-Y228 WeakPolarHBondContact O-CB 3.46Å; L225-Y228 PolarHBondContact O-N 3.41Å; L225-E229 PolarHBondContact O-N 3.23Å |
| 226 | R | 98.4 | Very high | 98.1 | Very high | 90 Ų | 90 | 80.2 Ų | 80.2 | 34% | 0.34 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -61.6 | -37.1 | -178.5 | -171 | 56.7 | 175.4 | 172.1 | 2.3 | 112.6 | E215 L222 T223 Y228 E229 I230 | E215-R226 VanDerWaalsContact CD-NE 3.33Å; E215-R226 IonicContact OE1-CZ 2.64Å; E215-R226 IonicContact OE1-NE 3.93Å; E215-R226 PolarHBondContact OE1-NE 3.41Å; E215-R226 IonicContact OE1-NH2 3.44Å; E215-R226 PolarHBondContact OE1-NH2 3.09Å; E215-R226 IonicContact OE2-CZ 3.49Å; E215-R226 IonicContact OE2-NE 3.63Å; E215-R226 PolarHBondContact OE2-NE 3.49Å; E215-R226 IonicContact OE2-NH2 3.65Å; E215-R226 PolarHBondContact OE2-NH2 3.44Å; L222-R226 HydrophobicContact CD2-CG 3.93Å; T223-R226 WeakPolarHBondContact OG1-CB 3.44Å; T223-R226 PolarHBondContact OG1-N 3.27Å; R226-Y228 VanDerWaalsContact C-N 3.33Å; R226-Y228 PolarHBondContact O-N 2.91Å; R226-E229 WeakPolarHBondContact CD-OE2 3.29Å; R226-E229 IonicContact CZ-OE2 2.68Å; R226-E229 IonicContact NE-OE2 3.65Å; R226-E229 IonicContact NH1-OE2 3.48Å; R226-E229 PolarHBondContact NH1-OE2 2.88Å; R226-E229 PolarHBondContact O-N 3.38Å; R226-I230 HydrophobicContact CG-CD1 3.95Å; R226-I230 VanDerWaalsContact O-CD1 3.29Å; R226-I230 WeakPolarHBondContact O-CD1 3.41Å; R226-I230 VanDerWaalsContact O-CG1 3.27Å; R226-I230 WeakPolarHBondContact O-CG1 3.42Å; R226-I230 PolarHBondContact O-N 3.35Å; R226-I230 VanDerWaalsContact O-N 3.13Å |
| 227 | R | 98.8 | Very high | 98.1 | Very high | 52 Ų | 52 | 83.4 Ų | 83.4 | 20% | 0.196 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -61.9 | -40.9 | 174.2 | -173.9 | -166.5 | -54 | 161 | 8.7 | 112.3 | L222 T223 R224 L225 A231 E238 V241 | L222-R227 HydrophobicContact CB-CB 4.29Å; L222-R227 HydrophobicContact CD1-CB 4.25Å; L222-R227 HydrophobicContact CD1-CG 4.43Å; T223-R227 WeakPolarHBondContact O-CB 3.21Å; T223-R227 PolarHBondContact O-N 2.85Å; T223-R227 VanDerWaalsContact O-N 3.09Å; R224-R227 PolarHBondContact O-N 3.27Å; L225-R227 VanDerWaalsContact C-N 3.28Å; L225-R227 PolarHBondContact O-N 2.89Å; R227-A231 VanDerWaalsContact O-CB 3.23Å; R227-A231 WeakPolarHBondContact O-CB 3.4Å; R227-A231 PolarHBondContact O-N 3.04Å; R227-E238 WeakPolarHBondContact CD-O 3.38Å; R227-E238 HydrophobicContact CG-CB 4.37Å; R227-V241 HydrophobicContact CG-CB 4.22Å; R227-V241 HydrophobicContact CG-CG1 4.08Å |
| 228 | Y | 98.7 | Very high | 98.2 | Very high | 134 Ų | 134 | 82.1 Ų | 82.1 | 53% | 0.525 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -64.1 | -46.9 | 177.6 | 170.7 | -97.1 | 0 | 0 | 0 | 111.1 | R224 L225 R226 I230 A231 V232 | R224-Y228 PolarHBondContact O-N 3.5Å; L225-Y228 WeakPolarHBondContact O-CB 3.46Å; L225-Y228 PolarHBondContact O-N 3.41Å; R226-Y228 VanDerWaalsContact C-N 3.33Å; R226-Y228 PolarHBondContact O-N 2.91Å; Y228-I230 PolarHBondContact O-N 3.04Å; Y228-A231 WeakPolarHBondContact O-CB 3.17Å; Y228-A231 PolarHBondContact O-N 3.3Å; Y228-A231 VanDerWaalsContact O-N 3.16Å; Y228-V232 HydrophobicContact CD2-CG2 4.36Å; Y228-V232 HydrophobicContact CE1-CG2 4.11Å; Y228-V232 HydrophobicContact CE2-CG2 3.89Å; Y228-V232 WeakPolarHBondContact O-CG2 2.96Å; Y228-V232 PolarHBondContact O-N 3Å |
| 229 | E | 98.6 | Very high | 98.2 | Very high | 70 Ų | 70 | 85.1 Ų | 85.1 | 33% | 0.327 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -56.5 | -48 | 177.6 | -66.3 | 171.4 | 171.1 | 0 | 0 | 112.2 | L225 R226 A231 V232 N233 | L225-E229 PolarHBondContact O-N 3.23Å; R226-E229 WeakPolarHBondContact CD-OE2 3.29Å; R226-E229 IonicContact CZ-OE2 2.68Å; R226-E229 IonicContact NE-OE2 3.65Å; R226-E229 IonicContact NH1-OE2 3.48Å; R226-E229 PolarHBondContact NH1-OE2 2.88Å; R226-E229 PolarHBondContact O-N 3.38Å; E229-A231 VanDerWaalsContact C-N 3.33Å; E229-A231 PolarHBondContact O-N 3.08Å; E229-V232 PolarHBondContact O-N 3.43Å; E229-N233 WeakPolarHBondContact O-CB 3.33Å; E229-N233 VanDerWaalsContact O-CG 3.23Å; E229-N233 PolarHBondContact O-N 3.34Å; E229-N233 PolarHBondContact O-OD1 3.38Å |
| 230 | I | 98.4 | Very high | 98.3 | Very high | 12 Ų | 12 | 82.6 Ų | 82.6 | 6% | 0.062 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -65.2 | -38.7 | 179 | -64.1 | 158.6 | 0 | 0 | 0 | 111.4 | L212 E215 L222 R226 Y228 V232 N233 L234 V241 | L212-I230 HydrophobicContact CD2-CG2 3.89Å; E215-I230 HydrophobicContact CB-CD1 4.42Å; E215-I230 HydrophobicContact CG-CD1 3.61Å; E215-I230 HydrophobicContact CG-CG1 4.5Å; L222-I230 HydrophobicContact CD1-CD1 3.78Å; L222-I230 HydrophobicContact CD2-CD1 3.69Å; L222-I230 HydrophobicContact CG-CD1 4.39Å; R226-I230 HydrophobicContact CG-CD1 3.95Å; R226-I230 VanDerWaalsContact O-CD1 3.29Å; R226-I230 WeakPolarHBondContact O-CD1 3.41Å; R226-I230 VanDerWaalsContact O-CG1 3.27Å; R226-I230 WeakPolarHBondContact O-CG1 3.42Å; R226-I230 PolarHBondContact O-N 3.35Å; R226-I230 VanDerWaalsContact O-N 3.13Å; Y228-I230 PolarHBondContact O-N 3.04Å; I230-V232 VanDerWaalsContact C-N 3.34Å; I230-N233 PolarHBondContact O-N 3.24Å; I230-L234 HydrophobicContact CG2-CD1 3.68Å; I230-L234 HydrophobicContact CG2-CG 4.28Å; I230-L234 WeakPolarHBondContact O-CB 3.41Å; I230-L234 WeakPolarHBondContact O-CG 3.4Å; I230-L234 PolarHBondContact O-N 3.05Å; I230-L234 VanDerWaalsContact O-N 3.1Å; I230-V241 HydrophobicContact CG2-CG1 4.08Å; I230-V241 HydrophobicContact CG2-CG2 4.24Å |
| 231 | A | 98.6 | Very high | 98.4 | Very high | 6 Ų | 6 | 80.1 Ų | 80.1 | 5% | 0.05 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61 | -45.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111 | R227 Y228 E229 D235 L236 E238 V241 | R227-A231 VanDerWaalsContact O-CB 3.23Å; R227-A231 WeakPolarHBondContact O-CB 3.4Å; R227-A231 PolarHBondContact O-N 3.04Å; Y228-A231 WeakPolarHBondContact O-CB 3.17Å; Y228-A231 PolarHBondContact O-N 3.3Å; Y228-A231 VanDerWaalsContact O-N 3.16Å; E229-A231 VanDerWaalsContact C-N 3.33Å; E229-A231 PolarHBondContact O-N 3.08Å; A231-D235 PolarHBondContact O-N 3.01Å; A231-L236 CarbonylContact C-O 3.37Å; A231-L236 WeakPolarHBondContact CA-O 3.39Å; A231-L236 VanDerWaalsContact CB-O 3.25Å; A231-L236 WeakPolarHBondContact CB-O 3.33Å; A231-L236 PolarHBondContact O-N 3.3Å; A231-E238 HydrophobicContact CB-CG 4.22Å; A231-V241 HydrophobicContact CB-CG2 4.14Å |
| 232 | V | 98.5 | Very high | 98.4 | Very high | 76 Ų | 76 | 78 Ų | 78 | 46% | 0.461 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -64.9 | -48.8 | 176.6 | 174.6 | 0 | 0 | 0 | 0 | 111.1 | Y228 E229 I230 L234 D235 | Y228-V232 HydrophobicContact CD2-CG2 4.36Å; Y228-V232 HydrophobicContact CE1-CG2 4.11Å; Y228-V232 HydrophobicContact CE2-CG2 3.89Å; Y228-V232 WeakPolarHBondContact O-CG2 2.96Å; Y228-V232 PolarHBondContact O-N 3Å; E229-V232 PolarHBondContact O-N 3.43Å; I230-V232 VanDerWaalsContact C-N 3.34Å; V232-L234 PolarHBondContact O-N 3.06Å; V232-D235 PolarHBondContact O-N 3.32Å |
| 233 | N | 98.2 | Very high | 98.4 | Very high | 116 Ų | 116 | 79.5 Ų | 79.5 | 62% | 0.62 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -65 | -26.9 | -175.4 | -69.6 | 2.3 | 0 | 0 | 0 | 113.8 | E229 I230 | E229-N233 WeakPolarHBondContact O-CB 3.33Å; E229-N233 VanDerWaalsContact O-CG 3.23Å; E229-N233 PolarHBondContact O-N 3.34Å; E229-N233 PolarHBondContact O-OD1 3.38Å; I230-N233 PolarHBondContact O-N 3.24Å |
| 234 | L | 98.1 | Very high | 98.3 | Very high | 10 Ų | 10 | 76.6 Ų | 76.6 | 5% | 0.052 | 36% | 0.356 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -104.7 | 4 | -176.4 | -62.1 | -175.5 | 0 | 0 | 0 | 114 | Q208 E211 L212 I230 V232 L236 | Q208-L234 HydrophobicContact CG-CB 4.33Å; Q208-L234 PolarHBondContact NE2-O 3.07Å; E211-L234 HydrophobicContact CB-CD1 4.09Å; E211-L234 HydrophobicContact CB-CD2 3.71Å; E211-L234 HydrophobicContact CB-CG 4.48Å; E211-L234 HydrophobicContact CG-CD2 4.03Å; E211-L234 WeakPolarHBondContact OE2-CD2 3.25Å; L212-L234 HydrophobicContact CD1-CD1 4.43Å; L212-L234 HydrophobicContact CD2-CD1 3.86Å; L212-L234 HydrophobicContact CG-CD1 3.7Å; I230-L234 HydrophobicContact CG2-CD1 3.68Å; I230-L234 HydrophobicContact CG2-CG 4.28Å; I230-L234 WeakPolarHBondContact O-CB 3.41Å; I230-L234 WeakPolarHBondContact O-CG 3.4Å; I230-L234 PolarHBondContact O-N 3.05Å; I230-L234 VanDerWaalsContact O-N 3.1Å; V232-L234 PolarHBondContact O-N 3.06Å; L234-L236 HydrophobicContact CB-CD1 4.14Å; L234-L236 HydrophobicContact CB-CG 4.05Å; L234-L236 HydrophobicContact CD1-CD1 4.48Å; L234-L236 PolarHBondContact O-N 3.43Å |
| 235 | D | 98.3 | Very high | 98.4 | Very high | 150 Ų | 150 | 69.3 Ų | 69.3 | 80% | 0.802 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.1 | 42.9 | -172.2 | -63 | -53.5 | 0 | 0 | 0 | 112.8 | A231 V232 | A231-D235 PolarHBondContact O-N 3.01Å; V232-D235 PolarHBondContact O-N 3.32Å |
| 236 | L | 97.9 | Very high | 98.4 | Very high | 19 Ų | 19 | 68.5 Ų | 68.5 | 10% | 0.099 | 32% | 0.322 | C | S | . | . | trans | -116.1 | 155.2 | 177.5 | -64.8 | -178 | 0 | 0 | 0 | 110.7 | F204 L212 A231 L234 Q240 V241 | F204-L236 HydrophobicContact CD1-CD1 4.15Å; F204-L236 HydrophobicContact CD1-CD2 3.75Å; F204-L236 HydrophobicContact CE1-CD1 4.12Å; F204-L236 HydrophobicContact CE1-CD2 3.7Å; L212-L236 HydrophobicContact CD1-CD1 4.15Å; A231-L236 CarbonylContact C-O 3.37Å; A231-L236 WeakPolarHBondContact CA-O 3.39Å; A231-L236 VanDerWaalsContact CB-O 3.25Å; A231-L236 WeakPolarHBondContact CB-O 3.33Å; A231-L236 PolarHBondContact O-N 3.3Å; L234-L236 HydrophobicContact CB-CD1 4.14Å; L234-L236 HydrophobicContact CB-CG 4.05Å; L234-L236 HydrophobicContact CD1-CD1 4.48Å; L234-L236 PolarHBondContact O-N 3.43Å; L236-Q240 HydrophobicContact CB-CB 4.44Å; L236-V241 HydrophobicContact CB-CG2 4.07Å; L236-V241 HydrophobicContact CD1-CG2 4.41Å | ||
| 237 | T | 98.4 | Very high | 98.3 | Very high | 77 Ų | 77 | 68.8 Ų | 68.8 | 47% | 0.472 | 33% | 0.331 | S | S | . | . | trans | -74.6 | 148.3 | 169.2 | 63.2 | 0 | 0 | 0 | 0 | 110.9 | R239 Q240 V241 | T237-R239 PolarHBondContact O-N 3.35Å; T237-Q240 WeakPolarHBondContact O-CB 3.33Å; T237-Q240 PolarHBondContact O-N 3.33Å; T237-Q240 VanDerWaalsContact OG1-CG 3.29Å; T237-Q240 WeakPolarHBondContact OG1-CG 3.35Å; T237-Q240 PolarHBondContact OG1-N 3.35Å; T237-Q240 PolarHBondContact OG1-OE1 3.39Å; T237-V241 PolarHBondContact O-N 2.79Å; T237-V241 VanDerWaalsContact O-N 3.12Å | ||
| 238 | E | 98.5 | Very high | 98.3 | Very high | 55 Ų | 55 | 69.2 Ų | 69.2 | 26% | 0.257 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -50.6 | -34.4 | 172 | -68.8 | -162.9 | -99.3 | 0 | 0 | 112.3 | R224 R227 A231 K242 | R224-E238 IonicContact CZ-OE1 3.77Å; R224-E238 IonicContact CZ-OE2 3.37Å; R224-E238 IonicContact NH1-OE1 2.81Å; R224-E238 PolarHBondContact NH1-OE1 3.03Å; R224-E238 IonicContact NH1-OE2 3.23Å; R224-E238 PolarHBondContact NH1-OE2 2.93Å; R224-E238 IonicContact NH2-OE1 2.99Å; R224-E238 PolarHBondContact NH2-OE1 3.47Å; R224-E238 IonicContact NH2-OE2 3.42Å; R227-E238 WeakPolarHBondContact CD-O 3.38Å; R227-E238 HydrophobicContact CG-CB 4.37Å; A231-E238 HydrophobicContact CB-CG 4.22Å; E238-K242 VanDerWaalsContact O-CB 3.31Å; E238-K242 WeakPolarHBondContact O-CB 3.39Å; E238-K242 PolarHBondContact O-N 3.19Å |
| 239 | R | 97.9 | Very high | 98.2 | Very high | 200 Ų | 200 | 66.3 Ų | 66.3 | 76% | 0.755 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -65.7 | -44.4 | 177.3 | -173.2 | 176.6 | -171 | -121 | 2.3 | 111.7 | T237 K242 V243 | T237-R239 PolarHBondContact O-N 3.35Å; R239-K242 PolarHBondContact O-N 3.27Å; R239-V243 VanDerWaalsContact O-CG2 3.3Å; R239-V243 WeakPolarHBondContact O-CG2 3.29Å; R239-V243 PolarHBondContact O-N 3.4Å |
| 240 | Q | 98.1 | Very high | 98.1 | Very high | 56 Ų | 56 | 66.8 Ų | 66.8 | 26% | 0.262 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -62.3 | -45.8 | 177.1 | -78.1 | 162.2 | -52.4 | 0 | 0 | 111 | F204 L236 T237 K242 V243 W244 | F204-Q240 HydrophobicContact CE1-CB 4.17Å; F204-Q240 HydrophobicContact CE1-CG 4.27Å; F204-Q240 HydrophobicContact CZ-CB 4.03Å; F204-Q240 HydrophobicContact CZ-CG 4.28Å; L236-Q240 HydrophobicContact CB-CB 4.44Å; T237-Q240 WeakPolarHBondContact O-CB 3.33Å; T237-Q240 PolarHBondContact O-N 3.33Å; T237-Q240 VanDerWaalsContact OG1-CG 3.29Å; T237-Q240 WeakPolarHBondContact OG1-CG 3.35Å; T237-Q240 PolarHBondContact OG1-N 3.35Å; T237-Q240 PolarHBondContact OG1-OE1 3.39Å; Q240-K242 VanDerWaalsContact C-N 3.34Å; Q240-K242 PolarHBondContact O-N 3.34Å; Q240-V243 PolarHBondContact O-N 2.89Å; Q240-W244 WeakPolarHBondContact O-CB 3.38Å; Q240-W244 PolarHBondContact O-N 3.41Å |
| 241 | V | 98.4 | Very high | 97.9 | Very high | 0 Ų | 0 | 71.9 Ų | 71.9 | 0% | 0 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -59.7 | -45.9 | 175.8 | -178.8 | 0 | 0 | 0 | 0 | 110.5 | L212 L222 R227 I230 A231 L236 T237 V243 W244 F245 | L212-V241 HydrophobicContact CD2-CG1 4.2Å; L222-V241 HydrophobicContact CD1-CG1 3.59Å; R227-V241 HydrophobicContact CG-CB 4.22Å; R227-V241 HydrophobicContact CG-CG1 4.08Å; I230-V241 HydrophobicContact CG2-CG1 4.08Å; I230-V241 HydrophobicContact CG2-CG2 4.24Å; A231-V241 HydrophobicContact CB-CG2 4.14Å; L236-V241 HydrophobicContact CB-CG2 4.07Å; L236-V241 HydrophobicContact CD1-CG2 4.41Å; T237-V241 PolarHBondContact O-N 2.79Å; T237-V241 VanDerWaalsContact O-N 3.12Å; V241-V243 PolarHBondContact O-N 2.77Å; V241-W244 PolarHBondContact O-N 3.42Å; V241-F245 HydrophobicContact CG1-CD2 3.99Å; V241-F245 HydrophobicContact CG1-CE2 4.14Å; V241-F245 WeakPolarHBondContact O-CD2 3.45Å; V241-F245 PolarHBondContact O-N 2.86Å |
| 242 | K | 98.2 | Very high | 97.7 | Very high | 119 Ų | 119 | 76.7 Ų | 76.7 | 52% | 0.517 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -57.6 | -47.4 | 176.3 | -178.5 | -177.8 | 178.5 | -178.1 | 0 | 112.3 | E238 R239 Q240 F245 Q246 | E238-K242 VanDerWaalsContact O-CB 3.31Å; E238-K242 WeakPolarHBondContact O-CB 3.39Å; E238-K242 PolarHBondContact O-N 3.19Å; R239-K242 PolarHBondContact O-N 3.27Å; Q240-K242 VanDerWaalsContact C-N 3.34Å; Q240-K242 PolarHBondContact O-N 3.34Å; K242-F245 PolarHBondContact O-N 3.21Å; K242-Q246 PolarHBondContact O-N 3.44Å |
| 243 | V | 98.3 | Very high | 97.4 | Very high | 60 Ų | 60 | 79.3 Ų | 79.3 | 36% | 0.364 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -66.3 | -41.3 | 179.7 | 170.4 | 0 | 0 | 0 | 0 | 110.8 | R239 Q240 V241 Q246 N247 | R239-V243 VanDerWaalsContact O-CG2 3.3Å; R239-V243 WeakPolarHBondContact O-CG2 3.29Å; R239-V243 PolarHBondContact O-N 3.4Å; Q240-V243 PolarHBondContact O-N 2.89Å; V241-V243 PolarHBondContact O-N 2.77Å; V243-Q246 PolarHBondContact O-N 3.49Å; V243-N247 PolarHBondContact O-N 3.27Å; V243-N247 PolarHBondContact O-ND2 2.94Å |
| 244 | W | 98.3 | Very high | 97.1 | Very high | 32 Ų | 32 | 81.8 Ų | 81.8 | 12% | 0.121 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -60.7 | -47.9 | 176.8 | -170.8 | 101.4 | 0 | 0 | 0 | 111.2 | F204 L212 E213 F216 Q240 V241 Q246 N247 R248 | F204-W244 AromaticContact CD2-CD1 3.7Å; F204-W244 HydrophobicContact CE2-CB 4.38Å; F204-W244 AromaticContact CE2-CD1 3.61Å; F204-W244 HydrophobicContact CE2-CG 4.38Å; L212-W244 VanDerWaalsContact C-CH2 3.44Å; L212-W244 HydrophobicContact CB-CD2 3.91Å; L212-W244 HydrophobicContact CB-CE3 3.86Å; L212-W244 HydrophobicContact CB-CH2 3.59Å; L212-W244 HydrophobicContact CB-CZ2 3.62Å; L212-W244 HydrophobicContact CB-CZ3 3.71Å; L212-W244 HydrophobicContact CD1-CB 4.5Å; L212-W244 HydrophobicContact CD1-CD2 3.85Å; L212-W244 HydrophobicContact CD1-CE3 4.46Å; L212-W244 HydrophobicContact CD1-CG 3.83Å; L212-W244 HydrophobicContact CD2-CD2 4.49Å; L212-W244 HydrophobicContact CD2-CE3 4.33Å; L212-W244 HydrophobicContact CG-CD2 4.31Å; L212-W244 HydrophobicContact CG-CE3 4.45Å; L212-W244 WeakPolarHBondContact O-CH2 3.31Å; L212-W244 WeakPolarHBondContact O-CZ3 3.3Å; E213-W244 HydrophobicContact CB-CH2 4.49Å; E213-W244 HydrophobicContact CG-CH2 3.78Å; E213-W244 HydrophobicContact CG-CZ2 3.8Å; F216-W244 HydrophobicContact CB-CH2 4.4Å; F216-W244 HydrophobicContact CB-CZ3 4.15Å; Q240-W244 WeakPolarHBondContact O-CB 3.38Å; Q240-W244 PolarHBondContact O-N 3.41Å; V241-W244 PolarHBondContact O-N 3.42Å; W244-Q246 VanDerWaalsContact C-N 3.3Å; W244-Q246 PolarHBondContact O-N 2.96Å; W244-N247 PolarHBondContact O-N 3.01Å; W244-R248 HydrophobicContact CD2-CB 4.47Å; W244-R248 HydrophobicContact CE3-CB 3.91Å; W244-R248 HydrophobicContact CE3-CG 4.41Å; W244-R248 HydrophobicContact CH2-CB 4.07Å; W244-R248 HydrophobicContact CH2-CG 3.75Å; W244-R248 HydrophobicContact CZ3-CB 3.69Å; W244-R248 HydrophobicContact CZ3-CG 3.68Å; W244-R248 VanDerWaalsContact O-CB 3.29Å; W244-R248 WeakPolarHBondContact O-CB 3.44Å; W244-R248 PolarHBondContact O-N 3.48Å |
| 245 | F | 98.6 | Very high | 96.5 | Very high | 6 Ų | 6 | 85.5 Ų | 85.5 | 3% | 0.026 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -63.5 | -33.8 | 177.1 | -92.3 | -103.9 | 0 | 0 | 0 | 112.9 | L212 E215 F216 H219 L222 V241 K242 R249 | L212-F245 HydrophobicContact CD2-CE2 3.95Å; E215-F245 HydrophobicContact CB-CZ 4.21Å; E215-F245 HydrophobicContact CG-CZ 4.06Å; F216-F245 HydrophobicContact CB-CE1 4.24Å; F216-F245 HydrophobicContact CB-CZ 4.34Å; F216-F245 AromaticContact CD2-CD1 3.88Å; F216-F245 HydrophobicContact CD2-CD1 3.88Å; F216-F245 AromaticContact CD2-CE1 3.81Å; F216-F245 HydrophobicContact CD2-CE1 3.81Å; H219-F245 WeakPolarHBondContact O-CE1 3.46Å; L222-F245 HydrophobicContact CD1-CD1 4.07Å; L222-F245 HydrophobicContact CD1-CD2 3.6Å; L222-F245 HydrophobicContact CD1-CE1 3.92Å; L222-F245 HydrophobicContact CD1-CE2 3.47Å; L222-F245 VanDerWaalsContact CD1-CE2 3.47Å; L222-F245 HydrophobicContact CD1-CG 3.92Å; L222-F245 HydrophobicContact CD1-CZ 3.64Å; L222-F245 HydrophobicContact CD2-CD1 4.4Å; L222-F245 HydrophobicContact CD2-CE1 3.67Å; L222-F245 HydrophobicContact CD2-CE2 4.37Å; L222-F245 HydrophobicContact CD2-CZ 3.67Å; L222-F245 HydrophobicContact CG-CD1 3.76Å; L222-F245 HydrophobicContact CG-CD2 4.24Å; L222-F245 HydrophobicContact CG-CE1 3.53Å; L222-F245 HydrophobicContact CG-CE2 4.06Å; L222-F245 HydrophobicContact CG-CG 4.12Å; L222-F245 HydrophobicContact CG-CZ 3.7Å; V241-F245 HydrophobicContact CG1-CD2 3.99Å; V241-F245 HydrophobicContact CG1-CE2 4.14Å; V241-F245 WeakPolarHBondContact O-CD2 3.45Å; V241-F245 PolarHBondContact O-N 2.86Å; K242-F245 PolarHBondContact O-N 3.21Å; F245-R249 WeakPolarHBondContact O-CG 3.27Å; F245-R249 PolarHBondContact O-N 3.42Å; F245-R249 PolarHBondContact O-NE 3.49Å |
| 246 | Q | 98.4 | Very high | 95.5 | Very high | 98 Ų | 98 | 85.5 Ų | 85.5 | 46% | 0.458 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -65.3 | -49 | 173 | -170 | 175.7 | 37.4 | 0 | 0 | 111.2 | K242 V243 W244 R248 R249 M250 | K242-Q246 PolarHBondContact O-N 3.44Å; V243-Q246 PolarHBondContact O-N 3.49Å; W244-Q246 VanDerWaalsContact C-N 3.3Å; W244-Q246 PolarHBondContact O-N 2.96Å; Q246-R248 VanDerWaalsContact C-N 3.31Å; Q246-R248 PolarHBondContact O-N 3.11Å; Q246-R249 PolarHBondContact O-N 2.86Å; Q246-M250 WeakPolarHBondContact O-CG 3.44Å; Q246-M250 PolarHBondContact O-N 3.33Å; Q246-M250 VanDerWaalsContact O-N 3.07Å |
| 247 | N | 97.6 | Very high | 93.8 | Very high | 96 Ų | 96 | 87 Ų | 87 | 51% | 0.513 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62 | -40.7 | 177.5 | -71.1 | -22.9 | 0 | 0 | 0 | 111.8 | V243 W244 M250 K251 | V243-N247 PolarHBondContact O-N 3.27Å; V243-N247 PolarHBondContact O-ND2 2.94Å; W244-N247 PolarHBondContact O-N 3.01Å; N247-M250 PolarHBondContact O-N 2.97Å; N247-K251 PolarHBondContact O-N 3.26Å |
| 248 | R | 97.8 | Very high | 91.6 | Very high | 61 Ų | 61 | 83.9 Ų | 83.9 | 23% | 0.23 | 39% | 0.387 | C | S | . | . | H | α-helix | trans | -62.9 | -46.1 | 178.7 | -177 | 64.4 | -165.3 | 176.1 | 3.3 | 111.6 | E213 F216 W244 Q246 M250 K251 W252 | E213-R248 IonicContact OE1-NH1 3.59Å; E213-R248 PolarHBondContact OE1-NH1 2.84Å; F216-R248 HydrophobicContact CB-CG 4.4Å; F216-R248 HydrophobicContact CD1-CG 3.69Å; F216-R248 HydrophobicContact CD2-CB 4.22Å; F216-R248 HydrophobicContact CD2-CG 3.52Å; F216-R248 HydrophobicContact CE1-CG 3.74Å; F216-R248 HydrophobicContact CE2-CB 4.16Å; F216-R248 HydrophobicContact CE2-CG 3.59Å; F216-R248 HydrophobicContact CG-CG 3.57Å; F216-R248 HydrophobicContact CZ-CG 3.69Å; W244-R248 HydrophobicContact CD2-CB 4.47Å; W244-R248 HydrophobicContact CE3-CB 3.91Å; W244-R248 HydrophobicContact CE3-CG 4.41Å; W244-R248 HydrophobicContact CH2-CB 4.07Å; W244-R248 HydrophobicContact CH2-CG 3.75Å; W244-R248 HydrophobicContact CZ3-CB 3.69Å; W244-R248 HydrophobicContact CZ3-CG 3.68Å; W244-R248 VanDerWaalsContact O-CB 3.29Å; W244-R248 WeakPolarHBondContact O-CB 3.44Å; W244-R248 PolarHBondContact O-N 3.48Å; Q246-R248 VanDerWaalsContact C-N 3.31Å; Q246-R248 PolarHBondContact O-N 3.11Å; R248-M250 VanDerWaalsContact C-N 3.34Å; R248-M250 PolarHBondContact O-N 2.86Å; R248-K251 PolarHBondContact O-N 3.18Å; R248-W252 WeakPolarHBondContact O-CB 3.38Å; R248-W252 PolarHBondContact O-N 2.94Å |
| 249 | R | 97.3 | Very high | 89.4 | Confident | 73 Ų | 73 | 89 Ų | 89 | 28% | 0.275 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60.6 | -40.6 | 173.7 | -74.2 | -178.7 | -71.1 | 155.6 | -2.4 | 112.6 | F216 N220 F245 Q246 K251 W252 K253 | F216-R249 HydrophobicContact CE2-CG 3.7Å; F216-R249 HydrophobicContact CZ-CG 4.1Å; N220-R249 WeakPolarHBondContact O-CD 3.17Å; F245-R249 WeakPolarHBondContact O-CG 3.27Å; F245-R249 PolarHBondContact O-N 3.42Å; F245-R249 PolarHBondContact O-NE 3.49Å; Q246-R249 PolarHBondContact O-N 2.86Å; R249-K251 PolarHBondContact O-N 3.34Å; R249-W252 PolarHBondContact O-N 2.71Å; R249-K253 WeakPolarHBondContact O-CB 3.41Å; R249-K253 PolarHBondContact O-N 3.31Å |
| 250 | M | 96.6 | Very high | 87.1 | Confident | 81 Ų | 81 | 88 Ų | 88 | 40% | 0.399 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.8 | -43.7 | 175.4 | -67.7 | -59.5 | -164.8 | 0 | 0 | 111.8 | Q246 N247 R248 R254 | Q246-M250 WeakPolarHBondContact O-CG 3.44Å; Q246-M250 PolarHBondContact O-N 3.33Å; Q246-M250 VanDerWaalsContact O-N 3.07Å; N247-M250 PolarHBondContact O-N 2.97Å; R248-M250 VanDerWaalsContact C-N 3.34Å; R248-M250 PolarHBondContact O-N 2.86Å; M250-R254 WeakPolarHBondContact O-CG 2.94Å; M250-R254 PolarHBondContact O-N 3.14Å; M250-R254 VanDerWaalsContact O-N 3.11Å; M250-R254 PolarHBondContact O-NH1 2.93Å |
| 251 | K | 94.6 | Very high | 84.7 | Confident | 119 Ų | 119 | 87.3 Ų | 87.3 | 52% | 0.517 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -62.5 | -47.2 | 174.9 | -175.4 | 177.7 | 177.2 | -179.3 | 0 | 111.2 | N247 R248 R249 K253 R254 V255 | N247-K251 PolarHBondContact O-N 3.26Å; R248-K251 PolarHBondContact O-N 3.18Å; R249-K251 PolarHBondContact O-N 3.34Å; K251-K253 VanDerWaalsContact C-N 3.34Å; K251-K253 PolarHBondContact O-N 3.31Å; K251-R254 PolarHBondContact O-N 3.27Å; K251-R254 VanDerWaalsContact O-N 3.14Å; K251-V255 WeakPolarHBondContact O-CG2 3Å; K251-V255 PolarHBondContact O-N 3.3Å |
| 252 | W | 93.3 | Very high | 82.3 | Confident | 106 Ų | 106 | 90.2 Ų | 90.2 | 40% | 0.402 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -58 | -45 | 178.2 | 178.2 | 76.2 | 0 | 0 | 0 | 112.3 | F216 R248 R249 R254 V255 K256 | F216-W252 HydrophobicContact CE1-CB 4.31Å; F216-W252 HydrophobicContact CE1-CG 4.35Å; F216-W252 HydrophobicContact CZ-CB 4.17Å; F216-W252 HydrophobicContact CZ-CG 4.38Å; R248-W252 WeakPolarHBondContact O-CB 3.38Å; R248-W252 PolarHBondContact O-N 2.94Å; R249-W252 PolarHBondContact O-N 2.71Å; W252-R254 VanDerWaalsContact C-N 3.35Å; W252-R254 PolarHBondContact O-N 3.2Å; W252-V255 PolarHBondContact O-N 3.36Å; W252-K256 HydrophobicContact CH2-CD 4.1Å; W252-K256 HydrophobicContact CZ2-CD 3.5Å; W252-K256 WeakPolarHBondContact O-CB 3.1Å; W252-K256 PolarHBondContact O-N 2.96Å |
| 253 | K | 93.5 | Very high | 80 | Confident | 132 Ų | 132 | 86.8 Ų | 86.8 | 57% | 0.574 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -60 | -42.4 | 175.1 | -173.8 | 175.7 | 66.2 | 174 | 0 | 112.2 | R249 K251 V255 G257 | R249-K253 WeakPolarHBondContact O-CB 3.41Å; R249-K253 PolarHBondContact O-N 3.31Å; K251-K253 VanDerWaalsContact C-N 3.34Å; K251-K253 PolarHBondContact O-N 3.31Å; K253-V255 VanDerWaalsContact C-N 3.33Å; K253-V255 PolarHBondContact O-N 3.22Å; K253-G257 WeakPolarHBondContact O-CA 3.49Å; K253-G257 PolarHBondContact O-N 3.38Å |
| 254 | R | 90.6 | Very high | 77.8 | Confident | 167 Ų | 167 | 86.9 Ų | 86.9 | 63% | 0.63 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -66.1 | -33.9 | 176.5 | -70.5 | -169.8 | -151.3 | 89.4 | -5.4 | 112.8 | M250 K251 W252 G258 | M250-R254 WeakPolarHBondContact O-CG 2.94Å; M250-R254 PolarHBondContact O-N 3.14Å; M250-R254 VanDerWaalsContact O-N 3.11Å; M250-R254 PolarHBondContact O-NH1 2.93Å; K251-R254 PolarHBondContact O-N 3.27Å; K251-R254 VanDerWaalsContact O-N 3.14Å; W252-R254 VanDerWaalsContact C-N 3.35Å; W252-R254 PolarHBondContact O-N 3.2Å; R254-G258 WeakPolarHBondContact O-CA 3.43Å; R254-G258 PolarHBondContact O-N 3.38Å |
| 255 | V | 85.3 | Confident | 75.6 | Confident | 89 Ų | 89 | 93.9 Ų | 93.9 | 54% | 0.539 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -77 | -43.8 | 178.5 | 176.3 | 0 | 0 | 0 | 0 | 110.8 | K251 W252 K253 Q259 | K251-V255 WeakPolarHBondContact O-CG2 3Å; K251-V255 PolarHBondContact O-N 3.3Å; W252-V255 PolarHBondContact O-N 3.36Å; K253-V255 VanDerWaalsContact C-N 3.33Å; K253-V255 PolarHBondContact O-N 3.22Å; V255-Q259 PolarHBondContact O-N 3.16Å |
| 256 | K | 77.7 | Confident | 73.4 | Confident | 150 Ų | 150 | 100.5 Ų | 100.5 | 65% | 0.652 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -76.5 | -37.2 | -176.7 | -165.9 | 169.2 | -180 | 175.8 | 0 | 113.3 | W252 | W252-K256 HydrophobicContact CH2-CD 4.1Å; W252-K256 HydrophobicContact CZ2-CD 3.5Å; W252-K256 WeakPolarHBondContact O-CB 3.1Å; W252-K256 PolarHBondContact O-N 2.96Å |
| 257 | G | 63.2 | Low | 71.1 | Confident | 50 Ų | 50 | 102.9 Ų | 102.9 | 52% | 0.515 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -89.9 | -13.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | K253 | K253-G257 WeakPolarHBondContact O-CA 3.49Å; K253-G257 PolarHBondContact O-N 3.38Å |
| 258 | G | 52.3 | Low | 68.8 | Low | 12 Ų | 12 | 105 Ų | 105 | 12% | 0.124 | 52% | 0.521 | C | S | . | . | trans | -109 | 12.4 | -174.7 | 0 | 0 | 0 | 0 | 0 | 115.2 | R254 Q260 G261 A262 | R254-G258 WeakPolarHBondContact O-CA 3.43Å; R254-G258 PolarHBondContact O-N 3.38Å; G258-Q260 PolarHBondContact O-N 3.31Å; G258-G261 PolarHBondContact O-N 3.22Å; G258-A262 WeakPolarHBondContact O-CA 3.42Å; G258-A262 WeakPolarHBondContact O-CB 3.43Å; G258-A262 PolarHBondContact O-N 3.26Å | ||
| 259 | Q | 52 | Low | 66.6 | Low | 163 Ų | 163 | 106.8 Ų | 106.8 | 76% | 0.762 | 54% | 0.535 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.4 | -21.5 | 150.3 | -78.6 | -170.8 | 25.3 | 0 | 0 | 111.1 | V255 A263 | V255-Q259 PolarHBondContact O-N 3.16Å; Q259-A263 WeakPolarHBondContact O-CB 3.48Å |
| 260 | Q | 48.7 | Very low | 64.4 | Low | 178 Ų | 178 | 107.9 Ų | 107.9 | 83% | 0.832 | 55% | 0.549 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.4 | -14.2 | 171.6 | -59.6 | 178.4 | 26.5 | 0 | 0 | 113.7 | G258 | G258-Q260 PolarHBondContact O-N 3.31Š|
| 261 | G | 47.2 | Very low | 62.1 | Low | 41 Ų | 41 | 110.4 Ų | 110.4 | 42% | 0.423 | 56% | 0.564 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -123.8 | -27.4 | -174.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | G258 A264 R265 | G258-G261 PolarHBondContact O-N 3.22Å; G261-A264 WeakPolarHBondContact O-CB 3.23Å; G261-A264 PolarHBondContact O-N 3.38Å; G261-R265 PolarHBondContact O-N 3.29Å |
| 262 | A | 48.9 | Very low | 60.3 | Low | 61 Ų | 61 | 110.5 Ų | 110.5 | 50% | 0.504 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -77.7 | -32.2 | 173 | 0 | 0 | 0 | 0 | 0 | 111.5 | G258 A264 R265 E266 | G258-A262 WeakPolarHBondContact O-CA 3.42Å; G258-A262 WeakPolarHBondContact O-CB 3.43Å; G258-A262 PolarHBondContact O-N 3.26Å; A262-A264 PolarHBondContact O-N 3.47Å; A262-R265 PolarHBondContact O-N 3.33Å; A262-R265 VanDerWaalsContact O-N 3.16Å; A262-E266 PolarHBondContact O-N 3.3Å |
| 263 | A | 50.8 | Low | 58.4 | Low | 47 Ų | 47 | 114.2 Ų | 114.2 | 39% | 0.388 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -63.2 | -23.3 | 168 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q259 K267 | Q259-A263 WeakPolarHBondContact O-CB 3.48Å; A263-K267 WeakPolarHBondContact O-CD 3.41Å; A263-K267 VanDerWaalsContact O-CG 3.23Å; A263-K267 WeakPolarHBondContact O-CG 3.46Å |
| 264 | A | 51.9 | Low | 56.4 | Low | 63 Ų | 63 | 116 Ų | 116 | 52% | 0.521 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -77.4 | -37.2 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | G261 A262 | G261-A264 WeakPolarHBondContact O-CB 3.23Å; G261-A264 PolarHBondContact O-N 3.38Å; A262-A264 PolarHBondContact O-N 3.47Å |
| 265 | R | 51.9 | Low | 54.7 | Low | 179 Ų | 179 | 111.7 Ų | 111.7 | 68% | 0.675 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -79.7 | -27.1 | -179.9 | -158.8 | -172.2 | 177.8 | -121.6 | -1.5 | 113.8 | G261 A262 | G261-R265 PolarHBondContact O-N 3.29Å; A262-R265 PolarHBondContact O-N 3.33Å; A262-R265 VanDerWaalsContact O-N 3.16Å |
| 266 | E | 51.8 | Low | 53 | Low | 144 Ų | 144 | 112.8 Ų | 112.8 | 67% | 0.673 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -73.9 | -30 | 175 | -168.5 | 169.8 | -178.9 | 0 | 0 | 112 | A262 E268 L269 V270 | A262-E266 PolarHBondContact O-N 3.3Å; E266-E268 VanDerWaalsContact C-N 3.28Å; E266-E268 PolarHBondContact O-N 3.39Å; E266-L269 PolarHBondContact O-N 3.38Å; E266-V270 WeakPolarHBondContact O-CG2 3.45Å |
| 267 | K | 49.3 | Very low | 51.7 | Low | 149 Ų | 149 | 113.5 Ų | 113.5 | 65% | 0.648 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -66.9 | -25.8 | 173.7 | -71.7 | 176.7 | -176 | -172 | 0 | 113.4 | A263 N271 | A263-K267 WeakPolarHBondContact O-CD 3.41Å; A263-K267 VanDerWaalsContact O-CG 3.23Å; A263-K267 WeakPolarHBondContact O-CG 3.46Å; K267-N271 PolarHBondContact O-OD1 2.88Å |
| 268 | E | 49.4 | Very low | 50.9 | Low | 139 Ų | 139 | 118.6 Ų | 118.6 | 65% | 0.65 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -75.6 | -27.2 | 178.7 | -162.8 | -179.6 | 164.7 | 0 | 0 | 113 | E266 | E266-E268 VanDerWaalsContact C-N 3.28Å; E266-E268 PolarHBondContact O-N 3.39Å |
| 269 | L | 51.7 | Low | 51.2 | Low | 100 Ų | 100 | 123.4 Ų | 123.4 | 52% | 0.524 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -93.3 | -11.6 | -177.2 | -64.8 | 171.4 | 0 | 0 | 0 | 114.1 | E266 | E266-L269 PolarHBondContact O-N 3.38Å |
| 270 | V | 51.8 | Low | 50.8 | Low | 96 Ų | 96 | 120 Ų | 120 | 58% | 0.582 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -84 | -27.5 | 173.2 | -177.9 | 0 | 0 | 0 | 0 | 111.2 | E266 V272 K273 | E266-V270 WeakPolarHBondContact O-CG2 3.45Å; V270-V272 VanDerWaalsContact C-N 3.27Å; V270-V272 PolarHBondContact O-N 3.37Å; V270-K273 PolarHBondContact O-N 3.23Å |
| 271 | N | 49.3 | Very low | 50.4 | Low | 134 Ų | 134 | 120.3 Ų | 120.3 | 72% | 0.717 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.2 | -14.9 | 175.9 | -77.6 | 87.7 | 0 | 0 | 0 | 114.6 | K267 | K267-N271 PolarHBondContact O-OD1 2.88Š|
| 272 | V | 55.3 | Low | 50.4 | Low | 121 Ų | 121 | 127.3 Ų | 127.3 | 73% | 0.733 | 68% | 0.684 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | -20.7 | 177.5 | -179.7 | 0 | 0 | 0 | 0 | 112.4 | V270 | V270-V272 VanDerWaalsContact C-N 3.27Å; V270-V272 PolarHBondContact O-N 3.37Å |
| 273 | K | 54.4 | Low | 50.1 | Low | 183 Ų | 183 | 130.3 Ų | 130.3 | 80% | 0.796 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.4 | -12.2 | -172.9 | -66.7 | 180 | -179.7 | -178.9 | 0 | 114.6 | V270 | V270-K273 PolarHBondContact O-N 3.23Š|
| 274 | K | 51.9 | Low | 49.3 | Very low | 171 Ų | 171 | 131.8 Ų | 131.8 | 74% | 0.743 | 72% | 0.721 | S | S | * | * | S | Bend | trans | -105.7 | 95.1 | 172 | -162.3 | 162.6 | -175.9 | 173.3 | 0 | 107.9 | T276 | K274-T276 PolarHBondContact O-N 3.42Š|
| 275 | G | 53.3 | Low | 49.1 | Very low | 76 Ų | 76 | 136.9 Ų | 136.9 | 78% | 0.784 | 74% | 0.738 | S | S | * | * | trans | -48.1 | 114.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 276 | T | 49.8 | Very low | 48.5 | Very low | 111 Ų | 111 | 133.3 Ų | 133.3 | 68% | 0.681 | 75% | 0.747 | S | S | * | * | trans | -142 | 74.3 | 158 | -46.1 | 0 | 0 | 0 | 0 | 105.6 | K274 L278 | K274-T276 PolarHBondContact O-N 3.42Å; T276-L278 HydrophobicContact CG2-CG 4.13Å; T276-L278 PolarHBondContact O-N 3.35Å | ||
| 277 | L | 51.1 | Low | 47.8 | Very low | 166 Ų | 166 | 130.5 Ų | 130.5 | 87% | 0.869 | 75% | 0.748 | S | S | * | * | trans | -66 | 116.5 | 146.5 | -62.9 | 179 | 0 | 0 | 0 | 104.8 | ||||
| 278 | L | 47.3 | Very low | 47.3 | Very low | 157 Ų | 157 | 131.2 Ų | 131.2 | 82% | 0.822 | 76% | 0.758 | S | S | * | * | trans | -121.6 | 124.3 | 148.4 | -73 | -172.7 | 0 | 0 | 0 | 109.1 | T276 | T276-L278 HydrophobicContact CG2-CG 4.13Å; T276-L278 PolarHBondContact O-N 3.35Å | ||
| 279 | P | 57.5 | Low | 46.9 | Very low | 112 Ų | 112 | 131.3 Ų | 131.3 | 73% | 0.727 | 76% | 0.758 | S | S | * | * | trans | -87.8 | 169.9 | 171.9 | 36.3 | -31.9 | 0 | 0 | 0 | 111.3 | ||||
| 280 | S | 44.1 | Very low | 46.4 | Very low | 91 Ų | 91 | 133.6 Ų | 133.6 | 64% | 0.636 | 77% | 0.766 | S | S | * | * | trans | 85.7 | 115.4 | 167.7 | -163.8 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 281 | E | 41 | Very low | 45.7 | Very low | 185 Ų | 185 | 134 Ų | 134 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | -147 | 88.9 | 103.6 | -73 | -56.9 | 77.7 | 0 | 0 | 108.5 | |||||
| 282 | F | 45.4 | Very low | 45.2 | Very low | 188 Ų | 188 | 134.2 Ų | 134.2 | 83% | 0.825 | 78% | 0.78 | S | S | * | * | trans | -108.3 | 102.7 | 157.7 | -170.8 | -85.2 | 0 | 0 | 0 | 106.6 | ||||
| 283 | S | 42.6 | Very low | 44.2 | Very low | 124 Ų | 124 | 135 Ų | 135 | 87% | 0.867 | 78% | 0.78 | S | S | * | * | trans | -171.3 | 121.6 | 151.4 | -87.4 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 284 | G | 34.2 | Very low | 43.6 | Very low | 79 Ų | 79 | 130.4 Ų | 130.4 | 81% | 0.814 | 77% | 0.771 | S | S | * | * | trans | 170.4 | 45.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 285 | I | 47.4 | Very low | 43.4 | Very low | 170 Ų | 170 | 129.4 Ų | 129.4 | 87% | 0.872 | 77% | 0.772 | S | S | * | * | trans | -76.3 | 118 | 162.1 | 38.6 | 164 | 0 | 0 | 0 | 109.1 | ||||
| 286 | A | 39.9 | Very low | 43.1 | Very low | 104 Ų | 104 | 129.7 Ų | 129.7 | 86% | 0.86 | 77% | 0.767 | S | S | * | * | trans | -153.4 | 137.7 | 154.5 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 287 | A | 37.3 | Very low | 42.6 | Very low | 85 Ų | 85 | 131 Ų | 131 | 70% | 0.702 | 77% | 0.77 | S | S | * | * | trans | -87 | -176.9 | -162 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 288 | L | 39.3 | Very low | 42.3 | Very low | 164 Ų | 164 | 130.8 Ų | 130.8 | 86% | 0.859 | 77% | 0.765 | S | S | * | * | trans | 79.8 | 131.4 | 160.1 | -68.8 | 149.8 | 0 | 0 | 0 | 114.4 | ||||
| 289 | H | 40.2 | Very low | 42.1 | Very low | 140 Ų | 140 | 129 Ų | 129 | 65% | 0.648 | 76% | 0.756 | S | S | * | * | cis | -177.4 | 170.8 | 15.7 | -175.6 | -153 | 0 | 0 | 0 | 107.3 | ||||
| 290 | H | 41 | Very low | 41.8 | Very low | 149 Ų | 149 | 128.5 Ų | 128.5 | 69% | 0.69 | 76% | 0.755 | S | S | * | * | trans | 81.2 | 104.6 | 166.3 | -22.2 | 128.7 | 0 | 0 | 0 | 117.5 | ||||
| 291 | S | 36.8 | Very low | 42.4 | Very low | 105 Ų | 105 | 131.2 Ų | 131.2 | 73% | 0.734 | 76% | 0.758 | S | S | * | * | 76.8 | 132 | 60.4 | -69.3 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 292 | T | 39.7 | Very low | 42.7 | Very low | 138 Ų | 138 | 128.5 Ų | 128.5 | 85% | 0.847 | 75% | 0.749 | S | S | * | * | trans | 76.1 | 145.8 | 163.2 | 77.9 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 293 | D | 34.2 | Very low | 43.4 | Very low | 137 Ų | 137 | 125.2 Ų | 125.2 | 73% | 0.733 | 75% | 0.749 | S | S | * | * | cis | -169.5 | 127.6 | 6.7 | -156.6 | -124.1 | 0 | 0 | 0 | 103.3 | ||||
| 294 | S | 42.3 | Very low | 43.8 | Very low | 87 Ų | 87 | 125.3 Ų | 125.3 | 61% | 0.608 | 74% | 0.74 | S | S | * | * | 81.7 | 149.5 | 94.6 | -145.6 | 0 | 0 | 0 | 0 | 116.8 | |||||
| 295 | L | 46.2 | Very low | 44.8 | Very low | 149 Ų | 149 | 130.6 Ų | 130.6 | 78% | 0.78 | 74% | 0.744 | S | S | * | * | trans | 82.3 | 107.2 | 165.3 | -44.3 | -178.9 | 0 | 0 | 0 | 116.6 | ||||
| 296 | A | 47 | Very low | 44.9 | Very low | 82 Ų | 82 | 127.3 Ų | 127.3 | 68% | 0.678 | 74% | 0.736 | S | S | * | * | 76.1 | 129.8 | 54.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | |||||
| 297 | N | 39.8 | Very low | 45.8 | Very low | 138 Ų | 138 | 126.8 Ų | 126.8 | 74% | 0.738 | 73% | 0.726 | S | S | * | * | trans | 73.6 | 155.5 | 158.3 | -70.2 | 33.9 | 0 | 0 | 0 | 119 | ||||
| 298 | E | 46.1 | Very low | 46.8 | Very low | 162 Ų | 162 | 130 Ų | 130 | 76% | 0.757 | 73% | 0.727 | S | S | * | * | cis | -177 | 163.9 | -24.2 | -98.1 | -164.4 | 130 | 0 | 0 | 103.4 | ||||
| 299 | D | 41.3 | Very low | 47.6 | Very low | 121 Ų | 121 | 130.4 Ų | 130.4 | 65% | 0.647 | 72% | 0.723 | S | S | * | * | trans | 69.5 | 119.3 | 150.9 | -160.1 | -103.1 | 0 | 0 | 0 | 119.4 | H301 | D299-H301 IonicContact OD1-ND1 3.63Å; D299-H301 IonicContact OD2-CE1 3.36Å; D299-H301 PolarHBondContact OD2-CE1 3.45Å; D299-H301 IonicContact OD2-ND1 3.41Å; D299-H301 PolarHBondContact OD2-ND1 3.03Å | ||
| 300 | S | 52.3 | Low | 48.6 | Very low | 101 Ų | 101 | 127.7 Ų | 127.7 | 71% | 0.706 | 73% | 0.726 | S | S | * | * | -177.1 | 112.4 | 100.8 | -135.5 | 0 | 0 | 0 | 0 | 113.3 | |||||
| 301 | H | 56 | Low | 49.4 | Very low | 147 Ų | 147 | 128 Ų | 128 | 68% | 0.681 | 73% | 0.727 | S | S | * | * | trans | 37.1 | 105.2 | 134.1 | -70.5 | 91.8 | 0 | 0 | 0 | 121.1 | D299 | D299-H301 IonicContact OD1-ND1 3.63Å; D299-H301 IonicContact OD2-CE1 3.36Å; D299-H301 PolarHBondContact OD2-CE1 3.45Å; D299-H301 IonicContact OD2-ND1 3.41Å; D299-H301 PolarHBondContact OD2-ND1 3.03Å | ||
| 302 | D | 48.4 | Very low | 50.4 | Low | 128 Ų | 128 | 134.4 Ų | 134.4 | 68% | 0.684 | 75% | 0.752 | S | S | * | * | 18.9 | 120.3 | 112.2 | -150.6 | -89.1 | 0 | 0 | 0 | 118.1 | |||||
| 303 | S | 59.2 | Low | 50.9 | Low | 119 Ų | 119 | 134.3 Ų | 134.3 | 83% | 0.832 | 75% | 0.747 | S | S | * | * | trans | -142.4 | 93.8 | 154.7 | -74 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 304 | D | 52 | Low | 51.8 | Low | 126 Ų | 126 | 134.1 Ų | 134.1 | 67% | 0.674 | 75% | 0.748 | S | S | * | * | trans | -42 | 130.4 | 152.6 | -114.9 | -61.6 | 0 | 0 | 0 | 111.9 | ||||
| 305 | Q | 54.1 | Low | 52.3 | Low | 191 Ų | 191 | 136.7 Ų | 136.7 | 89% | 0.893 | 76% | 0.756 | S | S | * | * | trans | -150.8 | 83.1 | 151.1 | -120.3 | 168.6 | 96.1 | 0 | 0 | 109.5 | ||||
| 306 | S | 50.9 | Low | 52.7 | Low | 101 Ų | 101 | 136 Ų | 136 | 71% | 0.706 | 75% | 0.754 | S | S | * | * | trans | -63.8 | 124 | 149.6 | 177.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 307 | S | 57.2 | Low | 53 | Low | 93 Ų | 93 | 139.4 Ų | 139.4 | 65% | 0.65 | 76% | 0.759 | S | S | * | * | trans | -159.3 | 128.3 | 138.7 | -163.3 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 308 | E | 60 | Low | 53.9 | Low | 153 Ų | 153 | 139.5 Ų | 139.5 | 72% | 0.715 | 76% | 0.76 | S | S | * | * | trans | -28.2 | 143.5 | 163.9 | 56.5 | -107.8 | 62.1 | 0 | 0 | 117.7 | ||||
| 309 | H | 54.6 | Low | 54.5 | Low | 171 Ų | 171 | 137.9 Ų | 137.9 | 79% | 0.792 | 76% | 0.761 | S | S | * | * | -167.6 | 98.8 | 120.7 | -154.4 | -106.9 | 0 | 0 | 0 | 110.5 | |||||
| 310 | A | 61.1 | Low | 55.5 | Low | 84 Ų | 84 | 139.2 Ų | 139.2 | 69% | 0.694 | 77% | 0.769 | S | S | * | * | trans | -95.9 | 126.5 | 153.6 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 311 | H | 58.8 | Low | 55.8 | Low | 155 Ų | 155 | 142.3 Ų | 142.3 | 72% | 0.718 | 78% | 0.775 | S | S | * | * | trans | 172 | 135.2 | 132 | -108.6 | -100.2 | 0 | 0 | 0 | 111.9 | ||||
| 312 | L | 56.9 | Low | 55.7 | Low | 240 Ų | 240 | 141.9 Ų | 141.9 | 100% | 1.257 | 78% | 0.783 | S | S | * | * | trans | 86.4 | 0 | 165.4 | -54.3 | 175.4 | 0 | 0 | 0 | 117.5 |
Retrieved 312 of 312 residues in 52.7 ms
(Link to these results)