| 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 | 36.9 | Very low | 35 | Very low | 230 Ų | 230 | 149.2 Ų | 149.2 | 100% | 1.133 | 82% | 0.816 | S | S | * | * | 0 | 94.3 | 0 | -73.5 | 169 | 176.7 | 0 | 0 | 106.4 | |||||
| 2 | T | 35.8 | Very low | 34.9 | Very low | 120 Ų | 120 | 144.1 Ų | 144.1 | 74% | 0.736 | 81% | 0.809 | S | S | * | * | 79.4 | 103.8 | 91.1 | 47.3 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 3 | Q | 29.9 | Very low | 34.6 | Very low | 184 Ų | 184 | 139.6 Ų | 139.6 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | 77.5 | 136.5 | 94.3 | -70 | -75 | 8.9 | 0 | 0 | 112.1 | |||||
| 4 | G | 32.9 | Very low | 34.5 | Very low | 65 Ų | 65 | 143.4 Ų | 143.4 | 67% | 0.67 | 81% | 0.808 | S | S | * | * | cis | -176.3 | 175.6 | 1.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 5 | K | 39.8 | Very low | 34.3 | Very low | 201 Ų | 201 | 140.3 Ų | 140.3 | 87% | 0.874 | 81% | 0.808 | S | S | * | * | trans | -70.6 | 151.2 | 163.2 | -69.2 | 179.3 | 175.3 | -179.2 | 0 | 109.4 | ||||
| 6 | L | 36.8 | Very low | 34 | Very low | 175 Ų | 175 | 136.3 Ų | 136.3 | 92% | 0.916 | 81% | 0.807 | S | S | * | * | trans | -133.7 | 144.6 | 163.5 | -112.1 | 157.4 | 0 | 0 | 0 | 110.1 | ||||
| 7 | T | 33.7 | Very low | 33.6 | Very low | 113 Ų | 113 | 138.7 Ų | 138.7 | 69% | 0.693 | 81% | 0.808 | S | S | * | * | trans | -149.7 | 156.5 | -166.4 | -12 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 8 | V | 37 | Very low | 33.4 | Very low | 134 Ų | 134 | 142.3 Ų | 142.3 | 81% | 0.812 | 81% | 0.812 | S | S | * | * | trans | 81 | 154.6 | 154.2 | 173.4 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 9 | A | 35.1 | Very low | 33 | Very low | 80 Ų | 80 | 144.3 Ų | 144.3 | 66% | 0.661 | 81% | 0.814 | S | S | * | * | trans | 88.4 | 148.2 | 167.1 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 10 | N | 34.7 | Very low | 32.6 | Very low | 151 Ų | 151 | 149.2 Ų | 149.2 | 81% | 0.807 | 82% | 0.821 | S | S | * | * | cis | -169.5 | 169.9 | -9.2 | -106.2 | -13.1 | 0 | 0 | 0 | 108.3 | ||||
| 11 | K | 32.7 | Very low | 32.5 | Very low | 188 Ų | 188 | 145.1 Ų | 145.1 | 82% | 0.817 | 81% | 0.813 | S | S | * | * | cis | -162.9 | 161.5 | -12.1 | 164.3 | 176.9 | 170 | -172 | 0 | 109.1 | ||||
| 12 | A | 33.1 | Very low | 32.1 | Very low | 88 Ų | 88 | 141.2 Ų | 141.2 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | trans | -69.1 | 164.8 | 173.5 | 0 | 0 | 0 | 0 | 0 | 119.3 | ||||
| 13 | A | 31.5 | Very low | 31.7 | Very low | 86 Ų | 86 | 141.3 Ų | 141.3 | 71% | 0.711 | 81% | 0.807 | S | S | * | * | trans | -175.2 | 124.5 | 149 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 14 | E | 33.6 | Very low | 31.9 | Very low | 192 Ų | 192 | 138.3 Ų | 138.3 | 90% | 0.897 | 81% | 0.807 | S | S | * | * | 71.5 | 141.9 | 70.9 | -69.7 | -176.6 | 147.5 | 0 | 0 | 115 | |||||
| 15 | A | 31.4 | Very low | 31.7 | Very low | 98 Ų | 98 | 139 Ų | 139 | 81% | 0.81 | 81% | 0.814 | S | S | * | * | cis | -171.2 | 164.7 | -15.9 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 16 | G | 29 | Very low | 31.4 | Very low | 76 Ų | 76 | 138.7 Ų | 138.7 | 78% | 0.784 | 82% | 0.815 | S | S | * | * | trans | 89.5 | 157 | 158.8 | 0 | 0 | 0 | 0 | 0 | 119.4 | ||||
| 17 | E | 28.1 | Very low | 31.3 | Very low | 177 Ų | 177 | 135.3 Ų | 135.3 | 83% | 0.827 | 81% | 0.813 | S | S | * | * | cis | -173 | 141.8 | -19.9 | -158.5 | -169.2 | 140.4 | 0 | 0 | 110.4 | ||||
| 18 | K | 28.5 | Very low | 31.2 | Very low | 204 Ų | 204 | 133.9 Ų | 133.9 | 89% | 0.887 | 82% | 0.821 | S | S | * | * | trans | 163.3 | 154.3 | 140.4 | -92.5 | 171.7 | -178.1 | 179.2 | 0 | 116 | ||||
| 19 | Q | 25.8 | Very low | 31.5 | Very low | 179 Ų | 179 | 131 Ų | 131 | 84% | 0.836 | 82% | 0.818 | S | S | * | * | trans | -105.2 | 154.3 | -169.8 | -55.1 | 163.5 | -76.7 | 0 | 0 | 115.4 | ||||
| 20 | Y | 26.1 | Very low | 32.1 | Very low | 243 Ų | 243 | 133.1 Ų | 133.1 | 95% | 0.953 | 83% | 0.825 | S | S | * | * | trans | -178.2 | 145.3 | 132.3 | -123.3 | -100.1 | 0 | 0 | 0 | 106.5 | ||||
| 21 | G | 29.4 | Very low | 33.1 | Very low | 64 Ų | 64 | 132 Ų | 132 | 66% | 0.66 | 83% | 0.826 | S | S | * | * | cis | -175.3 | 175 | 4.4 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 22 | T | 28.4 | Very low | 34.1 | Very low | 148 Ų | 148 | 127.4 Ų | 127.4 | 91% | 0.908 | 82% | 0.823 | S | S | * | * | trans | -91.6 | 138.9 | -162.7 | -51.4 | 0 | 0 | 0 | 0 | 116 | ||||
| 23 | S | 28.8 | Very low | 34.9 | Very low | 121 Ų | 121 | 128.8 Ų | 128.8 | 85% | 0.846 | 82% | 0.824 | S | S | * | * | trans | -158.4 | 161.9 | 138.3 | 81.3 | 0 | 0 | 0 | 0 | 112 | ||||
| 24 | S | 33.7 | Very low | 35.6 | Very low | 121 Ų | 121 | 130.1 Ų | 130.1 | 85% | 0.846 | 83% | 0.826 | S | S | * | * | trans | -119.4 | 145.9 | -169.6 | 48.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 25 | G | 29.3 | Very low | 36.1 | Very low | 79 Ų | 79 | 125.9 Ų | 125.9 | 81% | 0.814 | 81% | 0.813 | S | S | * | * | trans | -167.5 | 155.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 26 | E | 31.9 | Very low | 36.8 | Very low | 195 Ų | 195 | 130.3 Ų | 130.3 | 91% | 0.911 | 81% | 0.81 | S | S | * | * | trans | -90.1 | 157.2 | -160.8 | -70.4 | 164.9 | 88.3 | 0 | 0 | 117.3 | ||||
| 27 | A | 35.4 | Very low | 37.6 | Very low | 105 Ų | 105 | 133.7 Ų | 133.7 | 87% | 0.868 | 81% | 0.806 | S | S | * | * | trans | 28.1 | 132.6 | 145.4 | 0 | 0 | 0 | 0 | 0 | 122.7 | ||||
| 28 | G | 32.4 | Very low | 38.3 | Very low | 83 Ų | 83 | 133.5 Ų | 133.5 | 86% | 0.856 | 81% | 0.805 | S | S | * | * | trans | 161.3 | 93.3 | 157.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 29 | G | 42.5 | Very low | 38.9 | Very low | 72 Ų | 72 | 128 Ų | 128 | 74% | 0.742 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -92.3 | 155.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 30 | P | 48.3 | Very low | 39.7 | Very low | 126 Ų | 126 | 125.9 Ų | 125.9 | 82% | 0.818 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -71.7 | 149.5 | -179 | 30 | -35 | 0 | 0 | 0 | 112.7 | ||
| 31 | P | 54.7 | Low | 40.1 | Very low | 127 Ų | 127 | 118 Ų | 118 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 149.7 | -178.7 | 30.4 | -35.2 | 0 | 0 | 0 | 112.9 | ||
| 32 | A | 54.7 | Low | 40.4 | Very low | 92 Ų | 92 | 119.9 Ų | 119.9 | 76% | 0.76 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -79.5 | 153 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||
| 33 | P | 48.8 | Very low | 40.7 | Very low | 116 Ų | 116 | 117 Ų | 117 | 75% | 0.753 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 154 | 178.8 | 30.4 | -35.3 | 0 | 0 | 0 | 113.1 | ||
| 34 | P | 47.3 | Very low | 40.9 | Very low | 115 Ų | 115 | 120.1 Ų | 120.1 | 75% | 0.747 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -72 | 159.6 | -177.4 | 29.7 | -35.5 | 0 | 0 | 0 | 113.7 | ||
| 35 | T | 44.2 | Very low | 41.1 | Very low | 102 Ų | 102 | 124.2 Ų | 124.2 | 63% | 0.626 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -93 | 151.3 | -173.1 | -48.7 | 0 | 0 | 0 | 0 | 111.8 | E37 | T35-E37 PolarHBondContact O-N 2.93Š|
| 36 | Y | 44.8 | Very low | 41.4 | Very low | 192 Ų | 192 | 125.2 Ų | 125.2 | 75% | 0.753 | 80% | 0.803 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.7 | -1.1 | -164.6 | 67.5 | -86.5 | 0 | 0 | 0 | 117.3 | ||
| 37 | E | 45.6 | Very low | 41.4 | Very low | 146 Ų | 146 | 119.7 Ų | 119.7 | 68% | 0.682 | 80% | 0.798 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.6 | -14 | -176.7 | -63.4 | -174 | 144.2 | 0 | 0 | 113.6 | T35 A39 | T35-E37 PolarHBondContact O-N 2.93Å; E37-A39 VanDerWaalsContact C-N 3.29Å; E37-A39 PolarHBondContact O-N 3.44Å |
| 38 | E | 44.3 | Very low | 41.5 | Very low | 174 Ų | 174 | 123.1 Ų | 123.1 | 81% | 0.813 | 80% | 0.8 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | -2.3 | -177 | -151.4 | 173 | 172.3 | 0 | 0 | 113.7 | ||
| 39 | A | 40.5 | Very low | 41.5 | Very low | 89 Ų | 89 | 124.8 Ų | 124.8 | 74% | 0.736 | 80% | 0.799 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.7 | -1.5 | -169.8 | 0 | 0 | 0 | 0 | 0 | 116 | E37 | E37-A39 VanDerWaalsContact C-N 3.29Å; E37-A39 PolarHBondContact O-N 3.44Å |
| 40 | T | 42.6 | Very low | 41 | Very low | 133 Ų | 133 | 124.9 Ų | 124.9 | 82% | 0.816 | 80% | 0.799 | S | S | * | * | S | Bend | trans | -135.3 | 14.2 | -169.1 | 52.6 | 0 | 0 | 0 | 0 | 115.8 | ||
| 41 | G | 35.2 | Very low | 40.3 | Very low | 78 Ų | 78 | 123.6 Ų | 123.6 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | trans | -116.6 | 77.8 | -173.4 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 42 | A | 34.9 | Very low | 39.5 | Very low | 104 Ų | 104 | 123.6 Ų | 123.6 | 86% | 0.86 | 79% | 0.794 | S | S | * | * | trans | -148.3 | 97.1 | 165.5 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 43 | G | 34.7 | Very low | 38.9 | Very low | 86 Ų | 86 | 124.9 Ų | 124.9 | 89% | 0.887 | 80% | 0.796 | S | S | * | * | trans | -94.2 | 130.8 | 165.8 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 44 | E | 33.8 | Very low | 38.3 | Very low | 187 Ų | 187 | 130 Ų | 130 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | trans | -112.4 | 130.1 | -172.6 | -164.5 | -178.8 | 135.8 | 0 | 0 | 112.8 | ||||
| 45 | K | 37.4 | Very low | 38 | Very low | 207 Ų | 207 | 129.9 Ų | 129.9 | 90% | 0.9 | 80% | 0.803 | S | S | * | * | trans | -145.6 | 116.6 | 155.2 | -92.5 | -160.1 | 176.2 | -177.1 | 0 | 112.8 | ||||
| 46 | A | 36.5 | Very low | 38.2 | Very low | 101 Ų | 101 | 127.2 Ų | 127.2 | 84% | 0.835 | 80% | 0.797 | S | S | * | * | trans | 75.7 | 120.1 | 145.3 | 0 | 0 | 0 | 0 | 0 | 120.6 | ||||
| 47 | G | 31 | Very low | 38.4 | Very low | 79 Ų | 79 | 121.8 Ų | 121.8 | 81% | 0.814 | 79% | 0.791 | S | S | * | * | trans | 178.6 | 110.3 | 162.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 48 | I | 36.9 | Very low | 38.8 | Very low | 176 Ų | 176 | 125.1 Ų | 125.1 | 90% | 0.903 | 80% | 0.799 | S | S | * | * | trans | -84.9 | 134.3 | -171.5 | -64.1 | 160.4 | 0 | 0 | 0 | 112.1 | ||||
| 49 | S | 32.3 | Very low | 39.5 | Very low | 119 Ų | 119 | 119.9 Ų | 119.9 | 83% | 0.832 | 78% | 0.78 | S | S | * | * | 164 | 136.4 | 128.7 | -175.6 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 50 | G | 32.8 | Very low | 40.8 | Very low | 73 Ų | 73 | 119.3 Ų | 119.3 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | trans | 104.9 | 97.8 | 159.3 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 51 | S | 33 | Very low | 42 | Very low | 100 Ų | 100 | 118.8 Ų | 118.8 | 70% | 0.699 | 76% | 0.763 | S | S | * | * | trans | -94.7 | 141.2 | 162.8 | -167.1 | 0 | 0 | 0 | 0 | 109.4 | C53 | S51-C53 PolarHBondContact OG-N 3.23Š| ||
| 52 | P | 38.7 | Very low | 43.6 | Very low | 127 Ų | 127 | 117 Ų | 117 | 83% | 0.825 | 75% | 0.745 | S | S | * | * | -111.5 | 142.8 | 106.4 | -11.8 | 29 | 0 | 0 | 0 | 111.7 | Y54 | P52-Y54 PolarHBondContact O-N 3.15Š| |||
| 53 | C | 40.7 | Very low | 45.4 | Very low | 118 Ų | 118 | 117.8 Ų | 117.8 | 80% | 0.797 | 73% | 0.731 | S | S | * | * | trans | -61.5 | 98.9 | 178.3 | -70.8 | 0 | 0 | 0 | 0 | 112.1 | S51 | S51-C53 PolarHBondContact OG-N 3.23Š| ||
| 54 | Y | 37.1 | Very low | 47.3 | Very low | 224 Ų | 224 | 117.4 Ų | 117.4 | 88% | 0.878 | 71% | 0.707 | S | S | * | * | trans | -87.2 | 91.5 | 145 | -134.5 | -93.7 | 0 | 0 | 0 | 107.1 | P52 G56 | P52-Y54 PolarHBondContact O-N 3.15Å; Y54-G56 PolarHBondContact O-N 3.32Å | ||
| 55 | S | 41.6 | Very low | 49.2 | Very low | 112 Ų | 112 | 114.2 Ų | 114.2 | 78% | 0.783 | 70% | 0.695 | S | S | * | * | trans | -74.3 | 59.9 | 170.8 | -174.8 | 0 | 0 | 0 | 0 | 109.8 | A57 | S55-A57 PolarHBondContact O-N 3.41Š| ||
| 56 | G | 47.2 | Very low | 50.9 | Low | 47 Ų | 47 | 107.9 Ų | 107.9 | 49% | 0.485 | 67% | 0.674 | S | S | . | * | trans | -71 | 67.7 | 164 | 0 | 0 | 0 | 0 | 0 | 108.9 | Y54 Y58 | Y54-G56 PolarHBondContact O-N 3.32Å; G56-Y58 PolarHBondContact O-N 3.2Å | ||
| 57 | A | 50.3 | Low | 52.5 | Low | 78 Ų | 78 | 109.7 Ų | 109.7 | 65% | 0.645 | 67% | 0.665 | S | S | * | * | trans | -63.2 | 96.1 | 161.3 | 0 | 0 | 0 | 0 | 0 | 106.1 | S55 P59 | S55-A57 PolarHBondContact O-N 3.41Å; A57-P59 WeakPolarHBondContact O-CD 3.34Å; A57-P59 VanDerWaalsContact O-N 3.12Å | ||
| 58 | Y | 53.6 | Low | 54.4 | Low | 215 Ų | 215 | 112 Ų | 112 | 84% | 0.843 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 118.6 | 157.5 | -71.7 | -88.4 | 0 | 0 | 0 | 105.4 | G56 S60 | G56-Y58 PolarHBondContact O-N 3.2Å; Y58-S60 PolarHBondContact O-N 3.26Å; Y58-S60 VanDerWaalsContact O-N 3.13Å |
| 59 | P | 59.6 | Low | 56.1 | Low | 64 Ų | 64 | 105.8 Ų | 105.8 | 42% | 0.416 | 63% | 0.626 | S | S | . | * | P | Polyproline II helix | trans | -55.2 | 127.4 | -179.6 | 22.6 | -32.1 | 0 | 0 | 0 | 106.7 | A57 D61 E63 | A57-P59 WeakPolarHBondContact O-CD 3.34Å; A57-P59 VanDerWaalsContact O-N 3.12Å; P59-D61 PolarHBondContact O-N 3.42Å; P59-E63 HydrophobicContact CB-CB 4.33Å |
| 60 | S | 66.9 | Low | 57.6 | Low | 77 Ų | 77 | 107.1 Ų | 107.1 | 54% | 0.538 | 61% | 0.612 | S | S | . | * | P | Polyproline II helix | trans | -53.8 | 145.1 | -176 | -178.4 | 0 | 0 | 0 | 0 | 108.6 | Y58 G62 E63 M64 | Y58-S60 PolarHBondContact O-N 3.26Å; Y58-S60 VanDerWaalsContact O-N 3.13Å; S60-G62 CarbonylContact O-C 3.52Å; S60-G62 PolarHBondContact O-N 2.9Å; S60-E63 PolarHBondContact N-OE2 3.49Å; S60-E63 VanDerWaalsContact N-OE2 3.12Å; S60-E63 WeakPolarHBondContact O-CA 3.36Å; S60-E63 WeakPolarHBondContact O-CB 3.45Å; S60-E63 PolarHBondContact O-N 2.97Å; S60-M64 PolarHBondContact O-N 3.35Å |
| 61 | D | 68.4 | Low | 59.6 | Low | 122 Ų | 122 | 106.3 Ų | 106.3 | 65% | 0.652 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -51.4 | -32.4 | -177.1 | -62.7 | -45.6 | 0 | 0 | 0 | 111.9 | P59 L65 | P59-D61 PolarHBondContact O-N 3.42Å; D61-L65 VanDerWaalsContact O-CB 3.22Å; D61-L65 WeakPolarHBondContact O-CB 3.4Å; D61-L65 WeakPolarHBondContact O-CD1 3.36Å; D61-L65 WeakPolarHBondContact O-CG 3.23Å; D61-L65 PolarHBondContact O-N 3.22Å |
| 62 | G | 69 | Low | 61.7 | Low | 42 Ų | 42 | 106.2 Ų | 106.2 | 43% | 0.433 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.6 | -43.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | S60 T66 | S60-G62 CarbonylContact O-C 3.52Å; S60-G62 PolarHBondContact O-N 2.9Å; G62-T66 WeakPolarHBondContact O-CB 3.47Å; G62-T66 VanDerWaalsContact O-CG2 3.24Å; G62-T66 WeakPolarHBondContact O-CG2 3.45Å; G62-T66 PolarHBondContact O-N 3.46Å; G62-T66 PolarHBondContact O-OG1 3.44Å |
| 63 | E | 73.1 | Confident | 63.6 | Low | 119 Ų | 119 | 104 Ų | 104 | 56% | 0.556 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -63.6 | -49.9 | 176.2 | -66 | -179.6 | 139.1 | 0 | 0 | 110.5 | P59 S60 L65 T66 E67 | P59-E63 HydrophobicContact CB-CB 4.33Å; S60-E63 PolarHBondContact N-OE2 3.49Å; S60-E63 VanDerWaalsContact N-OE2 3.12Å; S60-E63 WeakPolarHBondContact O-CA 3.36Å; S60-E63 WeakPolarHBondContact O-CB 3.45Å; S60-E63 PolarHBondContact O-N 2.97Å; E63-L65 PolarHBondContact O-N 2.89Å; E63-T66 WeakPolarHBondContact CA-OG1 3.35Å; E63-T66 PolarHBondContact O-N 2.99Å; E63-T66 VanDerWaalsContact O-N 3.14Å; E63-T66 PolarHBondContact O-OG1 3.35Å; E63-E67 PolarHBondContact O-N 3.44Å |
| 64 | M | 73.1 | Confident | 65.7 | Low | 79 Ų | 79 | 102.2 Ų | 102.2 | 39% | 0.389 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -58.5 | -48.6 | 177.6 | -165.8 | -153.7 | -59.9 | 0 | 0 | 111.6 | S60 T66 E67 F68 | S60-M64 PolarHBondContact O-N 3.35Å; M64-T66 VanDerWaalsContact C-N 3.31Å; M64-T66 PolarHBondContact O-N 3.49Å; M64-E67 PolarHBondContact O-N 2.86Å; M64-F68 HydrophobicContact CG-CD2 3.88Å; M64-F68 HydrophobicContact CG-CE2 3.68Å; M64-F68 VanDerWaalsContact O-CD2 3.27Å; M64-F68 WeakPolarHBondContact O-CD2 3.24Å; M64-F68 PolarHBondContact O-N 3.23Å; M64-F68 HydrophobicContact SD-CD2 4.37Å; M64-F68 HydrophobicContact SD-CE2 3.85Å |
| 65 | L | 74.6 | Confident | 67.8 | Low | 120 Ų | 120 | 95.4 Ų | 95.4 | 63% | 0.628 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.7 | -36.2 | 176.8 | -73.4 | 171.4 | 0 | 0 | 0 | 112.4 | D61 E63 S69 | D61-L65 VanDerWaalsContact O-CB 3.22Å; D61-L65 WeakPolarHBondContact O-CB 3.4Å; D61-L65 WeakPolarHBondContact O-CD1 3.36Å; D61-L65 WeakPolarHBondContact O-CG 3.23Å; D61-L65 PolarHBondContact O-N 3.22Å; E63-L65 PolarHBondContact O-N 2.89Å; L65-S69 VanDerWaalsContact O-CB 3.26Å; L65-S69 WeakPolarHBondContact O-CB 3.45Å; L65-S69 PolarHBondContact O-N 3.37Å |
| 66 | T | 72.1 | Confident | 69.8 | Low | 74 Ų | 74 | 93.7 Ų | 93.7 | 45% | 0.454 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.9 | -44 | 173.3 | 59.4 | 0 | 0 | 0 | 0 | 111.8 | G62 E63 M64 S69 W70 | G62-T66 WeakPolarHBondContact O-CB 3.47Å; G62-T66 VanDerWaalsContact O-CG2 3.24Å; G62-T66 WeakPolarHBondContact O-CG2 3.45Å; G62-T66 PolarHBondContact O-N 3.46Å; G62-T66 PolarHBondContact O-OG1 3.44Å; E63-T66 WeakPolarHBondContact CA-OG1 3.35Å; E63-T66 PolarHBondContact O-N 2.99Å; E63-T66 VanDerWaalsContact O-N 3.14Å; E63-T66 PolarHBondContact O-OG1 3.35Å; M64-T66 VanDerWaalsContact C-N 3.31Å; M64-T66 PolarHBondContact O-N 3.49Å; T66-S69 CarbonylContact O-C 3.55Å; T66-S69 WeakPolarHBondContact O-CA 3.42Å; T66-S69 WeakPolarHBondContact O-CB 3.35Å; T66-S69 PolarHBondContact O-N 2.9Å; T66-S69 VanDerWaalsContact O-N 3.11Å; T66-W70 PolarHBondContact O-N 3.31Å |
| 67 | E | 70.4 | Confident | 71.5 | Confident | 139 Ų | 139 | 99 Ų | 99 | 65% | 0.65 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.3 | -46.7 | -179.7 | -170.9 | 173.6 | -168.9 | 0 | 0 | 111.6 | E63 M64 S69 W70 S71 | E63-E67 PolarHBondContact O-N 3.44Å; M64-E67 PolarHBondContact O-N 2.86Å; E67-S69 PolarHBondContact O-N 3.09Å; E67-W70 PolarHBondContact O-N 3.39Å; E67-S71 WeakPolarHBondContact O-CB 3.45Å; E67-S71 PolarHBondContact O-N 2.97Å |
| 68 | F | 70.6 | Confident | 73.3 | Confident | 126 Ų | 126 | 100.6 Ų | 100.6 | 55% | 0.553 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -56.7 | -47.4 | 170.3 | -81.2 | -66.6 | 0 | 0 | 0 | 111.6 | M64 W70 S71 D72 | M64-F68 HydrophobicContact CG-CD2 3.88Å; M64-F68 HydrophobicContact CG-CE2 3.68Å; M64-F68 VanDerWaalsContact O-CD2 3.27Å; M64-F68 WeakPolarHBondContact O-CD2 3.24Å; M64-F68 PolarHBondContact O-N 3.23Å; M64-F68 HydrophobicContact SD-CD2 4.37Å; M64-F68 HydrophobicContact SD-CE2 3.85Å; F68-W70 VanDerWaalsContact C-N 3.32Å; F68-W70 PolarHBondContact O-N 3.12Å; F68-S71 WeakPolarHBondContact O-CB 3.37Å; F68-S71 PolarHBondContact O-N 3.02Å; F68-D72 PolarHBondContact O-N 3.09Å |
| 69 | S | 73.9 | Confident | 74.9 | Confident | 47 Ų | 47 | 91.1 Ų | 91.1 | 33% | 0.329 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -61.9 | -35.2 | 178.6 | -165.2 | 0 | 0 | 0 | 0 | 113.7 | L65 T66 E67 K73 | L65-S69 VanDerWaalsContact O-CB 3.26Å; L65-S69 WeakPolarHBondContact O-CB 3.45Å; L65-S69 PolarHBondContact O-N 3.37Å; T66-S69 CarbonylContact O-C 3.55Å; T66-S69 WeakPolarHBondContact O-CA 3.42Å; T66-S69 WeakPolarHBondContact O-CB 3.35Å; T66-S69 PolarHBondContact O-N 2.9Å; T66-S69 VanDerWaalsContact O-N 3.11Å; E67-S69 PolarHBondContact O-N 3.09Å; S69-K73 WeakPolarHBondContact O-CB 3.44Å; S69-K73 WeakPolarHBondContact O-CD 3.31Å; S69-K73 WeakPolarHBondContact O-CG 3.06Å; S69-K73 PolarHBondContact O-N 3.04Å; S69-K73 PolarHBondContact OG-NZ 3.28Å |
| 70 | W | 64.1 | Low | 76.2 | Confident | 147 Ų | 147 | 89.5 Ų | 89.5 | 56% | 0.557 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -72.7 | -42.4 | 174.8 | -73.7 | 114.1 | 0 | 0 | 0 | 111.3 | T66 E67 F68 K73 N74 | T66-W70 PolarHBondContact O-N 3.31Å; E67-W70 PolarHBondContact O-N 3.39Å; F68-W70 VanDerWaalsContact C-N 3.32Å; F68-W70 PolarHBondContact O-N 3.12Å; W70-K73 PolarHBondContact O-N 3.35Å; W70-N74 WeakPolarHBondContact O-CB 3.48Å; W70-N74 PolarHBondContact O-N 3.31Å; W70-N74 PolarHBondContact O-ND2 2.87Å |
| 71 | S | 73.5 | Confident | 77.3 | Confident | 56 Ų | 56 | 95 Ų | 95 | 39% | 0.392 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -57.5 | -52.6 | 175.4 | -168.2 | 0 | 0 | 0 | 0 | 111.2 | E67 F68 K73 N74 I75 | E67-S71 WeakPolarHBondContact O-CB 3.45Å; E67-S71 PolarHBondContact O-N 2.97Å; F68-S71 WeakPolarHBondContact O-CB 3.37Å; F68-S71 PolarHBondContact O-N 3.02Å; S71-K73 VanDerWaalsContact C-N 3.34Å; S71-K73 PolarHBondContact O-N 3.01Å; S71-N74 PolarHBondContact O-N 2.95Å; S71-I75 VanDerWaalsContact O-CG1 3.29Å; S71-I75 WeakPolarHBondContact O-CG1 3.42Å; S71-I75 PolarHBondContact O-N 3.02Å |
| 72 | D | 77.5 | Confident | 78.3 | Confident | 98 Ų | 98 | 93.5 Ų | 93.5 | 52% | 0.524 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -56.5 | -45.1 | 177.6 | -73.9 | -23.9 | 0 | 0 | 0 | 112.4 | F68 N74 R76 | F68-D72 PolarHBondContact O-N 3.09Å; D72-N74 VanDerWaalsContact C-N 3.33Å; D72-N74 PolarHBondContact O-N 2.92Å; D72-R76 VanDerWaalsContact O-CB 3.24Å; D72-R76 WeakPolarHBondContact O-CB 3.37Å; D72-R76 PolarHBondContact O-N 3.34Å |
| 73 | K | 79.4 | Confident | 79.5 | Confident | 81 Ų | 81 | 91.5 Ų | 91.5 | 35% | 0.352 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.3 | -38.3 | 176.7 | -73.9 | 164.8 | -171.6 | 145.7 | 0 | 111.8 | S69 W70 S71 R77 | S69-K73 WeakPolarHBondContact O-CB 3.44Å; S69-K73 WeakPolarHBondContact O-CD 3.31Å; S69-K73 WeakPolarHBondContact O-CG 3.06Å; S69-K73 PolarHBondContact O-N 3.04Å; S69-K73 PolarHBondContact OG-NZ 3.28Å; W70-K73 PolarHBondContact O-N 3.35Å; S71-K73 VanDerWaalsContact C-N 3.34Å; S71-K73 PolarHBondContact O-N 3.01Å; K73-R77 VanDerWaalsContact O-CG 3.25Å; K73-R77 WeakPolarHBondContact O-CG 3.48Å; K73-R77 PolarHBondContact O-N 3.49Å |
| 74 | N | 83.6 | Confident | 80.4 | Confident | 79 Ų | 79 | 88 Ų | 88 | 42% | 0.422 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -72.7 | -46.5 | -179.8 | -72.9 | -25.6 | 0 | 0 | 0 | 111.6 | W70 S71 D72 R76 R77 I78 | W70-N74 WeakPolarHBondContact O-CB 3.48Å; W70-N74 PolarHBondContact O-N 3.31Å; W70-N74 PolarHBondContact O-ND2 2.87Å; S71-N74 PolarHBondContact O-N 2.95Å; D72-N74 VanDerWaalsContact C-N 3.33Å; D72-N74 PolarHBondContact O-N 2.92Å; N74-R76 VanDerWaalsContact C-N 3.28Å; N74-R76 PolarHBondContact O-N 3.4Å; N74-R77 PolarHBondContact O-N 2.87Å; N74-I78 WeakPolarHBondContact O-CG1 3.47Å; N74-I78 PolarHBondContact O-N 3.26Å |
| 75 | I | 82.5 | Confident | 81.4 | Confident | 81 Ų | 81 | 86.7 Ų | 86.7 | 42% | 0.415 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -53.6 | -47.9 | 172.4 | -67.5 | 163.4 | 0 | 0 | 0 | 109.8 | S71 R77 I78 F79 P263 | S71-I75 VanDerWaalsContact O-CG1 3.29Å; S71-I75 WeakPolarHBondContact O-CG1 3.42Å; S71-I75 PolarHBondContact O-N 3.02Å; I75-R77 PolarHBondContact O-N 2.99Å; I75-I78 PolarHBondContact O-N 3.12Å; I75-F79 WeakPolarHBondContact O-CB 3.43Å; I75-F79 PolarHBondContact O-N 2.89Å; I75-P263 HydrophobicContact CG2-CG 4.34Å |
| 76 | R | 82.4 | Confident | 82.4 | Confident | 77 Ų | 77 | 82.3 Ų | 82.3 | 29% | 0.291 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 179 | -167.7 | 161.1 | 76 | -165.2 | 16.4 | 113.2 | D72 N74 I78 F79 I80 M254 G255 N256 | D72-R76 VanDerWaalsContact O-CB 3.24Å; D72-R76 WeakPolarHBondContact O-CB 3.37Å; D72-R76 PolarHBondContact O-N 3.34Å; N74-R76 VanDerWaalsContact C-N 3.28Å; N74-R76 PolarHBondContact O-N 3.4Å; R76-I78 VanDerWaalsContact C-N 3.35Å; R76-I78 PolarHBondContact O-N 3.22Å; R76-F79 PolarHBondContact O-N 3.01Å; R76-I80 HydrophobicContact CG-CD1 3.91Å; R76-I80 HydrophobicContact CG-CG1 4.43Å; R76-I80 WeakPolarHBondContact O-CB 3.26Å; R76-I80 WeakPolarHBondContact O-CD1 3.41Å; R76-I80 WeakPolarHBondContact O-CG1 3.43Å; R76-I80 PolarHBondContact O-N 2.73Å; R76-M254 WeakPolarHBondContact CD-O 3.26Å; R76-M254 PolarHBondContact NE-O 3.2Å; R76-G255 PolarHBondContact NH1-O 2.81Å; R76-N256 PolarHBondContact NH2-OD1 3.29Å; R76-N256 VanDerWaalsContact NH2-OD1 3.16Å |
| 77 | R | 83.8 | Confident | 83.5 | Confident | 157 Ų | 157 | 79 Ų | 79 | 59% | 0.592 | 37% | 0.37 | S | S | * | . | H | α-helix | trans | -62.9 | -39.9 | 174 | -73.9 | 172.2 | -162.3 | -148.2 | 7.7 | 112.2 | K73 N74 I75 R81 | K73-R77 VanDerWaalsContact O-CG 3.25Å; K73-R77 WeakPolarHBondContact O-CG 3.48Å; K73-R77 PolarHBondContact O-N 3.49Å; N74-R77 PolarHBondContact O-N 2.87Å; I75-R77 PolarHBondContact O-N 2.99Å; R77-R81 VanDerWaalsContact O-CB 3.31Å; R77-R81 WeakPolarHBondContact O-CB 3.34Å; R77-R81 PolarHBondContact O-N 3.29Å |
| 78 | I | 86.8 | Confident | 84.7 | Confident | 112 Ų | 112 | 77.4 Ų | 77.4 | 57% | 0.574 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -65.9 | -45.2 | 177 | -67.8 | 163.1 | 0 | 0 | 0 | 110.3 | N74 I75 R76 R81 K82 | N74-I78 WeakPolarHBondContact O-CG1 3.47Å; N74-I78 PolarHBondContact O-N 3.26Å; I75-I78 PolarHBondContact O-N 3.12Å; R76-I78 VanDerWaalsContact C-N 3.35Å; R76-I78 PolarHBondContact O-N 3.22Å; I78-R81 PolarHBondContact O-N 2.97Å; I78-K82 WeakPolarHBondContact O-CB 3.35Å; I78-K82 PolarHBondContact O-N 2.86Å |
| 79 | F | 86.8 | Confident | 86 | Confident | 16 Ų | 16 | 76.7 Ų | 76.7 | 7% | 0.07 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -59.8 | -49.6 | 175 | 167.2 | -101.8 | 0 | 0 | 0 | 112.6 | I75 R76 R81 K82 V83 L253 I261 P263 | I75-F79 WeakPolarHBondContact O-CB 3.43Å; I75-F79 PolarHBondContact O-N 2.89Å; R76-F79 PolarHBondContact O-N 3.01Å; F79-R81 PolarHBondContact O-N 3.49Å; F79-K82 WeakPolarHBondContact O-CB 3.37Å; F79-K82 PolarHBondContact O-N 3.44Å; F79-K82 VanDerWaalsContact O-N 3.15Å; F79-V83 HydrophobicContact CE2-CG2 4.19Å; F79-V83 HydrophobicContact CZ-CG2 4.18Å; F79-V83 PolarHBondContact O-N 2.99Å; F79-L253 HydrophobicContact CD1-CD1 4.23Å; F79-L253 HydrophobicContact CE1-CD1 3.37Å; F79-L253 HydrophobicContact CE1-CG 4.31Å; F79-L253 HydrophobicContact CZ-CD1 3.72Å; F79-I261 HydrophobicContact CE1-CG2 4.39Å; F79-I261 HydrophobicContact CE2-CG2 4.34Å; F79-I261 HydrophobicContact CZ-CG2 3.61Å; F79-P263 HydrophobicContact CD2-CB 4.07Å |
| 80 | I | 88.1 | Confident | 87.1 | Confident | 30 Ų | 30 | 74.7 Ų | 74.7 | 15% | 0.154 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -58.3 | -47.5 | 175.8 | -69.7 | 165.8 | 0 | 0 | 0 | 110.4 | R76 K82 V83 Y84 L253 | R76-I80 HydrophobicContact CG-CD1 3.91Å; R76-I80 HydrophobicContact CG-CG1 4.43Å; R76-I80 WeakPolarHBondContact O-CB 3.26Å; R76-I80 WeakPolarHBondContact O-CD1 3.41Å; R76-I80 WeakPolarHBondContact O-CG1 3.43Å; R76-I80 PolarHBondContact O-N 2.73Å; I80-K82 VanDerWaalsContact C-N 3.29Å; I80-K82 PolarHBondContact O-N 3.12Å; I80-V83 PolarHBondContact O-N 2.95Å; I80-Y84 HydrophobicContact CG2-CD2 3.68Å; I80-Y84 HydrophobicContact CG2-CE2 3.86Å; I80-Y84 WeakPolarHBondContact O-CD2 3.41Å; I80-Y84 PolarHBondContact O-N 3.36Å; I80-L253 HydrophobicContact CG1-CG 4.3Å |
| 81 | R | 89.6 | Confident | 88.6 | Confident | 192 Ų | 192 | 69.6 Ų | 69.6 | 73% | 0.725 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -58.8 | -40.5 | 176.8 | -177.4 | -177 | -70.3 | 164.9 | -3.4 | 111.6 | R77 I78 F79 A85 | R77-R81 VanDerWaalsContact O-CB 3.31Å; R77-R81 WeakPolarHBondContact O-CB 3.34Å; R77-R81 PolarHBondContact O-N 3.29Å; I78-R81 PolarHBondContact O-N 2.97Å; F79-R81 PolarHBondContact O-N 3.49Å; R81-A85 WeakPolarHBondContact O-CB 3.39Å; R81-A85 PolarHBondContact O-N 3.44Å |
| 82 | K | 90.6 | Very high | 89.8 | Confident | 92 Ų | 92 | 71.6 Ų | 71.6 | 40% | 0.4 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.9 | -46.7 | 177 | -174.3 | -176.5 | -179.9 | -172.2 | 0 | 111.7 | I78 F79 I80 A85 I86 Y266 | I78-K82 WeakPolarHBondContact O-CB 3.35Å; I78-K82 PolarHBondContact O-N 2.86Å; F79-K82 WeakPolarHBondContact O-CB 3.37Å; F79-K82 PolarHBondContact O-N 3.44Å; F79-K82 VanDerWaalsContact O-N 3.15Å; I80-K82 VanDerWaalsContact C-N 3.29Å; I80-K82 PolarHBondContact O-N 3.12Å; K82-A85 PolarHBondContact O-N 3.44Å; K82-I86 HydrophobicContact CG-CD1 4.14Å; K82-I86 VanDerWaalsContact O-CG1 3.32Å; K82-I86 WeakPolarHBondContact O-CG1 3.36Å; K82-I86 PolarHBondContact O-N 3.28Å; K82-I86 VanDerWaalsContact O-N 3.12Å; K82-Y266 HydrophobicContact CD-CD2 4.22Å; K82-Y266 HydrophobicContact CD-CE2 4.45Å; K82-Y266 HydrophobicContact CD-CG 4.29Å |
| 83 | V | 92.6 | Very high | 90.8 | Very high | 0 Ų | 0 | 69.2 Ų | 69.2 | 0% | 0 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -61.1 | -52.6 | 177.3 | 168.1 | 0 | 0 | 0 | 0 | 111 | F79 I80 A85 I86 L87 L253 T270 | F79-V83 HydrophobicContact CE2-CG2 4.19Å; F79-V83 HydrophobicContact CZ-CG2 4.18Å; F79-V83 PolarHBondContact O-N 2.99Å; I80-V83 PolarHBondContact O-N 2.95Å; V83-A85 VanDerWaalsContact C-N 3.31Å; V83-A85 PolarHBondContact O-N 3.32Å; V83-I86 PolarHBondContact O-N 2.88Å; V83-L87 WeakPolarHBondContact O-CB 3.37Å; V83-L87 PolarHBondContact O-N 3.35Å; V83-L253 HydrophobicContact CB-CD1 3.9Å; V83-L253 HydrophobicContact CB-CD2 4.31Å; V83-L253 HydrophobicContact CG1-CD1 3.82Å; V83-L253 HydrophobicContact CG1-CD2 3.85Å; V83-L253 HydrophobicContact CG2-CD1 3.71Å; V83-T270 HydrophobicContact CG1-CG2 4.5Å |
| 84 | Y | 92.9 | Very high | 91.6 | Very high | 44 Ų | 44 | 65.6 Ų | 65.6 | 17% | 0.173 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -64.5 | -33.2 | 179.3 | -81.2 | -76.3 | 0 | 0 | 0 | 113 | I80 L87 M88 T187 F191 T250 L253 | I80-Y84 HydrophobicContact CG2-CD2 3.68Å; I80-Y84 HydrophobicContact CG2-CE2 3.86Å; I80-Y84 WeakPolarHBondContact O-CD2 3.41Å; I80-Y84 PolarHBondContact O-N 3.36Å; Y84-L87 HydrophobicContact CD1-CD2 3.84Å; Y84-L87 HydrophobicContact CE1-CD2 4Å; Y84-L87 PolarHBondContact O-N 2.9Å; Y84-M88 WeakPolarHBondContact O-CB 3.36Å; Y84-M88 VanDerWaalsContact O-CG 3.24Å; Y84-M88 WeakPolarHBondContact O-CG 3.41Å; Y84-M88 PolarHBondContact O-N 3.07Å; Y84-T187 HydrophobicContact CE1-CG2 4.38Å; Y84-F191 AromaticContact CE2-CZ 3.86Å; Y84-F191 HydrophobicContact CE2-CZ 3.86Å; Y84-T250 WeakPolarHBondContact OH-CG2 3.4Å; Y84-L253 HydrophobicContact CD2-CD2 4.08Å; Y84-L253 HydrophobicContact CE2-CD2 3.5Å; Y84-L253 VanDerWaalsContact CE2-CD2 3.5Å |
| 85 | A | 94.6 | Very high | 92.2 | Very high | 52 Ų | 52 | 65.8 Ų | 65.8 | 43% | 0.43 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -63.4 | -43.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | R81 K82 V83 I89 | R81-A85 WeakPolarHBondContact O-CB 3.39Å; R81-A85 PolarHBondContact O-N 3.44Å; K82-A85 PolarHBondContact O-N 3.44Å; V83-A85 VanDerWaalsContact C-N 3.31Å; V83-A85 PolarHBondContact O-N 3.32Å; A85-I89 WeakPolarHBondContact O-CG1 3.41Å; A85-I89 PolarHBondContact O-N 3.03Å |
| 86 | I | 94.7 | Very high | 92.9 | Very high | 29 Ų | 29 | 65.5 Ų | 65.5 | 15% | 0.149 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -67.2 | -45.5 | 176.3 | -61.4 | 164.5 | 0 | 0 | 0 | 110.1 | K82 V83 M88 I89 Q90 L149 Y266 T270 | K82-I86 HydrophobicContact CG-CD1 4.14Å; K82-I86 VanDerWaalsContact O-CG1 3.32Å; K82-I86 WeakPolarHBondContact O-CG1 3.36Å; K82-I86 PolarHBondContact O-N 3.28Å; K82-I86 VanDerWaalsContact O-N 3.12Å; V83-I86 PolarHBondContact O-N 2.88Å; I86-M88 VanDerWaalsContact C-N 3.34Å; I86-M88 PolarHBondContact O-N 3Å; I86-I89 WeakPolarHBondContact O-CB 3.37Å; I86-I89 PolarHBondContact O-N 2.92Å; I86-I89 VanDerWaalsContact O-N 3.09Å; I86-Q90 HydrophobicContact CG2-CG 4.49Å; I86-Q90 WeakPolarHBondContact O-CG 3.44Å; I86-Q90 PolarHBondContact O-N 3.46Å; I86-L149 HydrophobicContact CG2-CD2 3.6Å; I86-Y266 HydrophobicContact CD1-CD2 3.65Å; I86-Y266 HydrophobicContact CD1-CE2 3.59Å; I86-T270 HydrophobicContact CB-CG2 4.01Å; I86-T270 HydrophobicContact CG2-CG2 3.83Å |
| 87 | L | 95.9 | Very high | 93.6 | Very high | 4 Ų | 4 | 63.5 Ų | 63.5 | 2% | 0.021 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -56.1 | -45.3 | 176.9 | -179.1 | 68.3 | 0 | 0 | 0 | 112.1 | V83 Y84 I89 Q90 L91 T270 I273 Y274 I277 | V83-L87 WeakPolarHBondContact O-CB 3.37Å; V83-L87 PolarHBondContact O-N 3.35Å; Y84-L87 HydrophobicContact CD1-CD2 3.84Å; Y84-L87 HydrophobicContact CE1-CD2 4Å; Y84-L87 PolarHBondContact O-N 2.9Å; L87-I89 VanDerWaalsContact C-N 3.3Å; L87-I89 PolarHBondContact O-N 3.29Å; L87-Q90 WeakPolarHBondContact O-CB 3.41Å; L87-Q90 PolarHBondContact O-N 3.45Å; L87-Q90 VanDerWaalsContact O-N 3.16Å; L87-L91 HydrophobicContact CD1-CD1 4.34Å; L87-L91 HydrophobicContact CD1-CG 4.38Å; L87-L91 HydrophobicContact CG-CD1 4.03Å; L87-L91 HydrophobicContact CG-CG 4.43Å; L87-L91 WeakPolarHBondContact O-CG 3.48Å; L87-L91 PolarHBondContact O-N 3.37Å; L87-T270 HydrophobicContact CB-CG2 4.02Å; L87-I273 HydrophobicContact CD1-CG2 4.08Å; L87-I273 HydrophobicContact CD2-CG2 3.49Å; L87-I273 VanDerWaalsContact CD2-CG2 3.49Å; L87-I273 HydrophobicContact CG-CG2 4.44Å; L87-Y274 HydrophobicContact CD1-CD2 4.44Å; L87-I277 HydrophobicContact CD1-CD1 4.32Å; L87-I277 HydrophobicContact CD2-CD1 4.22Å |
| 88 | M | 95.9 | Very high | 94.2 | Very high | 106 Ų | 106 | 56.1 Ų | 56.1 | 52% | 0.522 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.1 | -37.8 | 177.3 | -73.3 | -57.1 | -59 | 0 | 0 | 112 | Y84 I86 L92 | Y84-M88 WeakPolarHBondContact O-CB 3.36Å; Y84-M88 VanDerWaalsContact O-CG 3.24Å; Y84-M88 WeakPolarHBondContact O-CG 3.41Å; Y84-M88 PolarHBondContact O-N 3.07Å; I86-M88 VanDerWaalsContact C-N 3.34Å; I86-M88 PolarHBondContact O-N 3Å; M88-L92 WeakPolarHBondContact O-CB 3.42Å; M88-L92 VanDerWaalsContact O-CG 3.22Å; M88-L92 WeakPolarHBondContact O-CG 3.24Å; M88-L92 PolarHBondContact O-N 3.16Å |
| 89 | I | 96.9 | Very high | 94.6 | Very high | 110 Ų | 110 | 52.2 Ų | 52.2 | 56% | 0.564 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -64.8 | -44.1 | 173.5 | -66 | 165.3 | 0 | 0 | 0 | 110.5 | A85 I86 L87 L92 V93 | A85-I89 WeakPolarHBondContact O-CG1 3.41Å; A85-I89 PolarHBondContact O-N 3.03Å; I86-I89 WeakPolarHBondContact O-CB 3.37Å; I86-I89 PolarHBondContact O-N 2.92Å; I86-I89 VanDerWaalsContact O-N 3.09Å; L87-I89 VanDerWaalsContact C-N 3.3Å; L87-I89 PolarHBondContact O-N 3.29Å; I89-L92 PolarHBondContact O-N 3.11Å; I89-V93 WeakPolarHBondContact O-CG2 3.35Å; I89-V93 PolarHBondContact O-N 3.29Å |
| 90 | Q | 97.1 | Very high | 95 | Very high | 6 Ų | 6 | 55.7 Ų | 55.7 | 3% | 0.028 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -59.4 | -49.9 | 177.2 | -66.3 | -178.3 | -66.2 | 0 | 0 | 111.6 | I86 L87 L92 V93 T94 T153 Y274 | I86-Q90 HydrophobicContact CG2-CG 4.49Å; I86-Q90 WeakPolarHBondContact O-CG 3.44Å; I86-Q90 PolarHBondContact O-N 3.46Å; L87-Q90 WeakPolarHBondContact O-CB 3.41Å; L87-Q90 PolarHBondContact O-N 3.45Å; L87-Q90 VanDerWaalsContact O-N 3.16Å; Q90-L92 VanDerWaalsContact C-N 3.32Å; Q90-L92 PolarHBondContact O-N 3.47Å; Q90-V93 WeakPolarHBondContact O-CB 3.46Å; Q90-V93 PolarHBondContact O-N 2.89Å; Q90-V93 VanDerWaalsContact O-N 3.14Å; Q90-T94 PolarHBondContact O-N 2.93Å; Q90-T94 PolarHBondContact O-OG1 2.87Å; Q90-T153 HydrophobicContact CB-CG2 3.75Å; Q90-T153 HydrophobicContact CG-CG2 3.81Å; Q90-T153 WeakPolarHBondContact CG-OG1 3.43Å; Q90-T153 PolarHBondContact NE2-OG1 3.45Å; Q90-Y274 HydrophobicContact CB-CD2 3.66Å; Q90-Y274 HydrophobicContact CB-CE2 3.73Å; Q90-Y274 HydrophobicContact CB-CG 4.36Å |
| 91 | L | 96.4 | Very high | 95.3 | Very high | 40 Ų | 40 | 55.1 Ų | 55.1 | 21% | 0.209 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.1 | -35.6 | 179.3 | -65.9 | 173.4 | 0 | 0 | 0 | 112.5 | L87 T94 L95 Y274 I277 I278 | L87-L91 HydrophobicContact CD1-CD1 4.34Å; L87-L91 HydrophobicContact CD1-CG 4.38Å; L87-L91 HydrophobicContact CG-CD1 4.03Å; L87-L91 HydrophobicContact CG-CG 4.43Å; L87-L91 WeakPolarHBondContact O-CG 3.48Å; L87-L91 PolarHBondContact O-N 3.37Å; L91-T94 PolarHBondContact O-N 3.02Å; L91-L95 VanDerWaalsContact O-CB 3.22Å; L91-L95 WeakPolarHBondContact O-CB 3.3Å; L91-L95 PolarHBondContact O-N 3.01Å; L91-Y274 HydrophobicContact CD2-CD2 4.03Å; L91-Y274 HydrophobicContact CD2-CE2 4.32Å; L91-I277 HydrophobicContact CD1-CD1 3.92Å; L91-I277 HydrophobicContact CD2-CB 4.21Å; L91-I277 HydrophobicContact CD2-CD1 4.37Å; L91-I277 HydrophobicContact CD2-CG2 3.63Å; L91-I278 HydrophobicContact CD2-CD1 4.4Å |
| 92 | L | 97.5 | Very high | 95.4 | Very high | 98 Ų | 98 | 46.2 Ų | 46.2 | 51% | 0.513 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -66.3 | -39.9 | 173.2 | -75.7 | 170.4 | 0 | 0 | 0 | 112.2 | M88 I89 Q90 S96 | M88-L92 WeakPolarHBondContact O-CB 3.42Å; M88-L92 VanDerWaalsContact O-CG 3.22Å; M88-L92 WeakPolarHBondContact O-CG 3.24Å; M88-L92 PolarHBondContact O-N 3.16Å; I89-L92 PolarHBondContact O-N 3.11Å; Q90-L92 VanDerWaalsContact C-N 3.32Å; Q90-L92 PolarHBondContact O-N 3.47Å; L92-S96 WeakPolarHBondContact O-CB 3.44Å; L92-S96 PolarHBondContact O-N 3.39Å; L92-S96 PolarHBondContact O-OG 3.43Å |
| 93 | V | 97.8 | Very high | 95.4 | Very high | 47 Ų | 47 | 48 Ų | 48 | 29% | 0.285 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -62.9 | -46 | 173.5 | 169 | 0 | 0 | 0 | 0 | 110.5 | I89 Q90 S96 I97 T153 L154 | I89-V93 WeakPolarHBondContact O-CG2 3.35Å; I89-V93 PolarHBondContact O-N 3.29Å; Q90-V93 WeakPolarHBondContact O-CB 3.46Å; Q90-V93 PolarHBondContact O-N 2.89Å; Q90-V93 VanDerWaalsContact O-N 3.14Å; V93-S96 PolarHBondContact O-N 2.65Å; V93-I97 HydrophobicContact CG1-CD1 3.93Å; V93-I97 WeakPolarHBondContact O-CG1 3.1Å; V93-I97 PolarHBondContact O-N 2.8Å; V93-T153 HydrophobicContact CB-CG2 4.41Å; V93-T153 HydrophobicContact CG1-CG2 4.27Å; V93-L154 HydrophobicContact CG1-CD2 3.88Å |
| 94 | T | 97.3 | Very high | 95.5 | Very high | 6 Ų | 6 | 50.3 Ų | 50.3 | 4% | 0.037 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63 | -47.2 | 177.4 | -45.1 | 0 | 0 | 0 | 0 | 112.2 | Q90 L91 S96 I97 V98 S157 T160 Y274 I278 | Q90-T94 PolarHBondContact O-N 2.93Å; Q90-T94 PolarHBondContact O-OG1 2.87Å; L91-T94 PolarHBondContact O-N 3.02Å; T94-S96 VanDerWaalsContact C-N 3.26Å; T94-S96 PolarHBondContact O-N 3.49Å; T94-I97 PolarHBondContact O-N 2.96Å; T94-V98 HydrophobicContact CG2-CG2 4.16Å; T94-V98 WeakPolarHBondContact O-CB 3.4Å; T94-V98 VanDerWaalsContact O-CG2 3.29Å; T94-V98 WeakPolarHBondContact O-CG2 3.38Å; T94-V98 PolarHBondContact O-N 3.26Å; T94-S157 VanDerWaalsContact CA-OG 3.3Å; T94-S157 WeakPolarHBondContact CA-OG 3.34Å; T94-S157 WeakPolarHBondContact CB-OG 3.4Å; T94-S157 PolarHBondContact OG1-OG 3.47Å; T94-T160 HydrophobicContact CG2-CG2 4.25Å; T94-Y274 WeakPolarHBondContact OG1-CE2 3.45Å; T94-Y274 PolarHBondContact OG1-OH 3.29Å; T94-I278 HydrophobicContact CG2-CD1 3.63Å |
| 95 | L | 96.7 | Very high | 95.4 | Very high | 82 Ų | 82 | 53.6 Ų | 53.6 | 43% | 0.429 | 29% | 0.293 | S | S | . | . | H | α-helix | trans | -58.6 | -40.1 | 176.8 | -179.3 | 63.3 | 0 | 0 | 0 | 111.3 | L91 A99 L176 | L91-L95 VanDerWaalsContact O-CB 3.22Å; L91-L95 WeakPolarHBondContact O-CB 3.3Å; L91-L95 PolarHBondContact O-N 3.01Å; L95-A99 WeakPolarHBondContact O-CB 3.25Å; L95-A99 PolarHBondContact O-N 3.41Å; L95-L176 HydrophobicContact CD1-CD1 3.82Å; L95-L176 HydrophobicContact CD1-CD2 4.25Å |
| 96 | S | 97.1 | Very high | 95.3 | Very high | 75 Ų | 75 | 55.6 Ų | 55.6 | 52% | 0.524 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -64.5 | -43.4 | 177.5 | -58.8 | 0 | 0 | 0 | 0 | 112 | L92 V93 T94 L100 | L92-S96 WeakPolarHBondContact O-CB 3.44Å; L92-S96 PolarHBondContact O-N 3.39Å; L92-S96 PolarHBondContact O-OG 3.43Å; V93-S96 PolarHBondContact O-N 2.65Å; T94-S96 VanDerWaalsContact C-N 3.26Å; T94-S96 PolarHBondContact O-N 3.49Å; S96-L100 VanDerWaalsContact O-CB 3.26Å; S96-L100 WeakPolarHBondContact O-CB 3.43Å; S96-L100 PolarHBondContact O-N 2.68Å |
| 97 | I | 96.9 | Very high | 95.3 | Very high | 36 Ų | 36 | 56.5 Ų | 56.5 | 19% | 0.185 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -69.6 | -45 | 178.4 | -69.8 | 165.3 | 0 | 0 | 0 | 111.2 | V93 T94 A99 L100 F101 L154 S157 | V93-I97 HydrophobicContact CG1-CD1 3.93Å; V93-I97 WeakPolarHBondContact O-CG1 3.1Å; V93-I97 PolarHBondContact O-N 2.8Å; T94-I97 PolarHBondContact O-N 2.96Å; I97-A99 PolarHBondContact O-N 3.28Å; I97-L100 PolarHBondContact O-N 3.05Å; I97-F101 HydrophobicContact CG2-CD2 4.36Å; I97-F101 HydrophobicContact CG2-CE1 4.33Å; I97-F101 HydrophobicContact CG2-CE2 4.07Å; I97-F101 HydrophobicContact CG2-CZ 4.04Å; I97-F101 WeakPolarHBondContact O-CG 3.41Å; I97-F101 PolarHBondContact O-N 3.5Å; I97-L154 HydrophobicContact CD1-CD2 4.14Å; I97-S157 WeakPolarHBondContact CG2-O 3.39Å |
| 98 | V | 96.2 | Very high | 95 | Very high | 2 Ų | 2 | 56.9 Ų | 56.9 | 1% | 0.012 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -58.6 | -46.6 | 174.3 | 168 | 0 | 0 | 0 | 0 | 110.7 | T94 F101 T102 T160 V172 L176 F281 | T94-V98 HydrophobicContact CG2-CG2 4.16Å; T94-V98 WeakPolarHBondContact O-CB 3.4Å; T94-V98 VanDerWaalsContact O-CG2 3.29Å; T94-V98 WeakPolarHBondContact O-CG2 3.38Å; T94-V98 PolarHBondContact O-N 3.26Å; V98-F101 PolarHBondContact O-N 3Å; V98-T102 WeakPolarHBondContact O-CB 3.39Å; V98-T102 PolarHBondContact O-N 2.93Å; V98-T102 PolarHBondContact O-OG1 3.25Å; V98-T160 HydrophobicContact CG2-CG2 3.99Å; V98-V172 HydrophobicContact CG1-CG1 4.05Å; V98-L176 HydrophobicContact CG1-CD1 4.24Å; V98-F281 HydrophobicContact CG1-CZ 4.42Å |
| 99 | A | 94.8 | Very high | 94.8 | Very high | 30 Ų | 30 | 56.5 Ų | 56.5 | 25% | 0.248 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -62.1 | -46.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | L95 I97 F101 T102 F103 | L95-A99 WeakPolarHBondContact O-CB 3.25Å; L95-A99 PolarHBondContact O-N 3.41Å; I97-A99 PolarHBondContact O-N 3.28Å; A99-F101 PolarHBondContact O-N 2.98Å; A99-T102 PolarHBondContact O-N 3Å; A99-F103 HydrophobicContact CB-CD2 3.99Å; A99-F103 HydrophobicContact CB-CE2 4.15Å; A99-F103 WeakPolarHBondContact O-CB 3.2Å; A99-F103 WeakPolarHBondContact O-CD2 3.3Å; A99-F103 PolarHBondContact O-N 2.89Å |
| 100 | L | 95.6 | Very high | 94.7 | Very high | 88 Ų | 88 | 57.1 Ų | 57.1 | 46% | 0.461 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.1 | -44.5 | 179.3 | -167.1 | 154.6 | 0 | 0 | 0 | 111.3 | S96 I97 C104 V107 | S96-L100 VanDerWaalsContact O-CB 3.26Å; S96-L100 WeakPolarHBondContact O-CB 3.43Å; S96-L100 PolarHBondContact O-N 2.68Å; I97-L100 PolarHBondContact O-N 3.05Å; L100-C104 WeakPolarHBondContact O-CA 3.27Å; L100-C104 WeakPolarHBondContact O-CB 3.4Å; L100-C104 PolarHBondContact O-N 3.36Å; L100-V107 HydrophobicContact CD2-CB 3.99Å; L100-V107 HydrophobicContact CD2-CG1 3.63Å; L100-V107 HydrophobicContact CD2-CG2 3.95Å |
| 101 | F | 94 | Very high | 94.5 | Very high | 18 Ų | 18 | 57 Ų | 57 | 8% | 0.079 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -74.5 | -26.8 | 178.6 | -67.1 | 6.1 | 0 | 0 | 0 | 112.8 | I97 V98 A99 V107 K108 I111 Y158 G161 | I97-F101 HydrophobicContact CG2-CD2 4.36Å; I97-F101 HydrophobicContact CG2-CE1 4.33Å; I97-F101 HydrophobicContact CG2-CE2 4.07Å; I97-F101 HydrophobicContact CG2-CZ 4.04Å; I97-F101 WeakPolarHBondContact O-CG 3.41Å; I97-F101 PolarHBondContact O-N 3.5Å; V98-F101 PolarHBondContact O-N 3Å; A99-F101 PolarHBondContact O-N 2.98Å; F101-V107 HydrophobicContact CD1-CG1 3.75Å; F101-V107 HydrophobicContact CE1-CG1 3.81Å; F101-K108 WeakPolarHBondContact O-CE 3.34Å; F101-I111 HydrophobicContact CB-CD1 3.85Å; F101-I111 HydrophobicContact CD1-CD1 4.13Å; F101-I111 HydrophobicContact CD2-CD1 3.18Å; F101-I111 HydrophobicContact CE1-CG2 4.49Å; F101-I111 HydrophobicContact CE2-CD1 3.68Å; F101-I111 HydrophobicContact CE2-CG2 4.32Å; F101-I111 HydrophobicContact CG-CD1 3.47Å; F101-I111 VanDerWaalsContact CG-CD1 3.47Å; F101-I111 HydrophobicContact CZ-CD1 4.33Å; F101-I111 HydrophobicContact CZ-CG2 4.18Å; F101-Y158 AromaticContact CE2-CD2 3.82Å; F101-Y158 HydrophobicContact CE2-CD2 3.82Å; F101-Y158 AromaticContact CE2-CE2 3.8Å; F101-Y158 HydrophobicContact CE2-CE2 3.8Å; F101-Y158 HydrophobicContact CE2-CG 4.36Å; F101-Y158 AromaticContact CZ-CD2 3.65Å; F101-Y158 HydrophobicContact CZ-CD2 3.65Å; F101-Y158 AromaticContact CZ-CE2 3.58Å; F101-Y158 HydrophobicContact CZ-CE2 3.58Å; F101-G161 VanDerWaalsContact CD2-C 3.44Å |
| 102 | T | 91.6 | Very high | 94.2 | Very high | 5 Ų | 5 | 57.7 Ų | 57.7 | 3% | 0.031 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -79.3 | -42.8 | 178.7 | -62.1 | 0 | 0 | 0 | 0 | 112.5 | V98 A99 K108 T169 V172 | V98-T102 WeakPolarHBondContact O-CB 3.39Å; V98-T102 PolarHBondContact O-N 2.93Å; V98-T102 PolarHBondContact O-OG1 3.25Å; A99-T102 PolarHBondContact O-N 3Å; T102-K108 VanDerWaalsContact O-CE 3.23Å; T102-K108 WeakPolarHBondContact O-CE 3.28Å; T102-K108 PolarHBondContact O-NZ 3.44Å; T102-T169 HydrophobicContact CG2-CG2 3.59Å; T102-V172 HydrophobicContact CG2-CB 4.42Å; T102-V172 HydrophobicContact CG2-CG1 4.36Å |
| 103 | F | 91.6 | Very high | 94 | Very high | 131 Ų | 131 | 56.9 Ų | 56.9 | 58% | 0.575 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -96.8 | -27.3 | -173.6 | -63.3 | -66.8 | 0 | 0 | 0 | 114 | A99 E105 T169 V173 | A99-F103 HydrophobicContact CB-CD2 3.99Å; A99-F103 HydrophobicContact CB-CE2 4.15Å; A99-F103 WeakPolarHBondContact O-CB 3.2Å; A99-F103 WeakPolarHBondContact O-CD2 3.3Å; A99-F103 PolarHBondContact O-N 2.89Å; F103-E105 PolarHBondContact O-N 3.36Å; F103-T169 HydrophobicContact CD1-CG2 3.95Å; F103-T169 HydrophobicContact CE1-CG2 3.43Å; F103-T169 VanDerWaalsContact CE1-CG2 3.43Å; F103-T169 HydrophobicContact CZ-CG2 4.11Å; F103-V173 HydrophobicContact CZ-CG2 4.01Å |
| 104 | C | 93.9 | Very high | 93.8 | Very high | 47 Ų | 47 | 57.7 Ų | 57.7 | 32% | 0.318 | 31% | 0.313 | S | S | . | . | trans | -92.8 | 95 | -179.6 | -162.9 | 0 | 0 | 0 | 0 | 111.5 | L100 V107 K108 | L100-C104 WeakPolarHBondContact O-CA 3.27Å; L100-C104 WeakPolarHBondContact O-CB 3.4Å; L100-C104 PolarHBondContact O-N 3.36Å; C104-V107 HydrophobicContact CB-CB 4.26Å; C104-V107 HydrophobicContact CB-CG2 4.22Å; C104-V107 PolarHBondContact O-N 3.48Å; C104-K108 WeakPolarHBondContact O-CB 3.18Å; C104-K108 PolarHBondContact O-N 2.93Å | ||
| 105 | E | 91.4 | Very high | 93.4 | Very high | 113 Ų | 113 | 60.5 Ų | 60.5 | 53% | 0.528 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -52.6 | -44.3 | 179.1 | -60.5 | -171.5 | 159.5 | 0 | 0 | 115.5 | F103 V107 K108 N109 | F103-E105 PolarHBondContact O-N 3.36Å; E105-V107 VanDerWaalsContact C-N 3.33Å; E105-V107 PolarHBondContact O-N 3.47Å; E105-K108 WeakPolarHBondContact O-CB 3.15Å; E105-K108 PolarHBondContact O-N 2.86Å; E105-N109 WeakPolarHBondContact O-CB 3.34Å; E105-N109 PolarHBondContact O-N 2.93Å; E105-N109 PolarHBondContact O-ND2 3.39Å; E105-N109 PolarHBondContact O-OD1 3.2Å |
| 106 | P | 93.1 | Very high | 93.2 | Very high | 95 Ų | 95 | 59 Ų | 59 | 62% | 0.617 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -65.4 | -35 | 178.7 | 23.9 | -33.5 | 0 | 0 | 0 | 112.9 | Y110 | P106-Y110 WeakPolarHBondContact O-CB 3.21Å; P106-Y110 PolarHBondContact O-N 2.86Å; P106-Y110 VanDerWaalsContact O-N 3.1Å |
| 107 | V | 92.8 | Very high | 92.9 | Very high | 47 Ų | 47 | 62.2 Ų | 62.2 | 29% | 0.285 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -71.1 | -42.5 | 176.1 | -179.8 | 0 | 0 | 0 | 0 | 110.6 | L100 F101 C104 E105 N109 Y110 I111 | L100-V107 HydrophobicContact CD2-CB 3.99Å; L100-V107 HydrophobicContact CD2-CG1 3.63Å; L100-V107 HydrophobicContact CD2-CG2 3.95Å; F101-V107 HydrophobicContact CD1-CG1 3.75Å; F101-V107 HydrophobicContact CE1-CG1 3.81Å; C104-V107 HydrophobicContact CB-CB 4.26Å; C104-V107 HydrophobicContact CB-CG2 4.22Å; C104-V107 PolarHBondContact O-N 3.48Å; E105-V107 VanDerWaalsContact C-N 3.33Å; E105-V107 PolarHBondContact O-N 3.47Å; V107-N109 PolarHBondContact O-N 3.18Å; V107-Y110 WeakPolarHBondContact O-CB 3.11Å; V107-Y110 PolarHBondContact O-N 3.13Å; V107-I111 HydrophobicContact CG1-CG2 4.39Å; V107-I111 WeakPolarHBondContact O-CG1 3.36Å; V107-I111 PolarHBondContact O-N 3.5Å |
| 108 | K | 90.7 | Very high | 92.7 | Very high | 13 Ų | 13 | 63.9 Ų | 63.9 | 6% | 0.057 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -54.3 | -48.5 | 174.4 | -172.5 | -173.2 | -58.2 | 175.3 | 0 | 112.2 | F101 T102 C104 E105 Y110 I111 Q112 | F101-K108 WeakPolarHBondContact O-CE 3.34Å; T102-K108 VanDerWaalsContact O-CE 3.23Å; T102-K108 WeakPolarHBondContact O-CE 3.28Å; T102-K108 PolarHBondContact O-NZ 3.44Å; C104-K108 WeakPolarHBondContact O-CB 3.18Å; C104-K108 PolarHBondContact O-N 2.93Å; E105-K108 WeakPolarHBondContact O-CB 3.15Å; E105-K108 PolarHBondContact O-N 2.86Å; K108-Y110 VanDerWaalsContact C-N 3.34Å; K108-Y110 PolarHBondContact O-N 3.03Å; K108-I111 WeakPolarHBondContact O-CG1 3.43Å; K108-I111 PolarHBondContact O-N 3.25Å; K108-Q112 WeakPolarHBondContact O-CB 3.49Å; K108-Q112 VanDerWaalsContact O-CG 3.32Å; K108-Q112 WeakPolarHBondContact O-CG 3.48Å; K108-Q112 PolarHBondContact O-N 2.92Å; K108-Q112 VanDerWaalsContact O-N 3.07Å |
| 109 | N | 92.3 | Very high | 92.6 | Very high | 97 Ų | 97 | 71.9 Ų | 71.9 | 52% | 0.519 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -67.2 | -36.1 | 179 | -64 | -9.4 | 0 | 0 | 0 | 111.5 | E105 V107 S113 | E105-N109 WeakPolarHBondContact O-CB 3.34Å; E105-N109 PolarHBondContact O-N 2.93Å; E105-N109 PolarHBondContact O-ND2 3.39Å; E105-N109 PolarHBondContact O-OD1 3.2Å; V107-N109 PolarHBondContact O-N 3.18Å; N109-S113 WeakPolarHBondContact O-CB 3.41Å; N109-S113 PolarHBondContact O-N 3.3Å; N109-S113 VanDerWaalsContact O-N 3.1Å; N109-S113 PolarHBondContact O-OG 3.34Å |
| 110 | Y | 93.4 | Very high | 92.5 | Very high | 124 Ų | 124 | 72.7 Ų | 72.7 | 49% | 0.486 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -65.4 | -46.4 | 175.9 | 178.6 | -96.8 | 0 | 0 | 0 | 112.9 | P106 V107 K108 S113 N114 W117 | P106-Y110 WeakPolarHBondContact O-CB 3.21Å; P106-Y110 PolarHBondContact O-N 2.86Å; P106-Y110 VanDerWaalsContact O-N 3.1Å; V107-Y110 WeakPolarHBondContact O-CB 3.11Å; V107-Y110 PolarHBondContact O-N 3.13Å; K108-Y110 VanDerWaalsContact C-N 3.34Å; K108-Y110 PolarHBondContact O-N 3.03Å; Y110-S113 PolarHBondContact O-OG 3.41Å; Y110-N114 WeakPolarHBondContact O-CB 3.18Å; Y110-N114 PolarHBondContact O-N 3.49Å; Y110-N114 PolarHBondContact O-ND2 3.35Å; Y110-W117 PolarHBondContact OH-NE1 3.49Å |
| 111 | I | 92.7 | Very high | 92.5 | Very high | 4 Ų | 4 | 69.1 Ų | 69.1 | 2% | 0.021 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -68.8 | -38.5 | 179.5 | 63.5 | -178.9 | 0 | 0 | 0 | 111.9 | F101 V107 K108 S113 N114 Y158 M162 | F101-I111 HydrophobicContact CB-CD1 3.85Å; F101-I111 HydrophobicContact CD1-CD1 4.13Å; F101-I111 HydrophobicContact CD2-CD1 3.18Å; F101-I111 HydrophobicContact CE1-CG2 4.49Å; F101-I111 HydrophobicContact CE2-CD1 3.68Å; F101-I111 HydrophobicContact CE2-CG2 4.32Å; F101-I111 HydrophobicContact CG-CD1 3.47Å; F101-I111 VanDerWaalsContact CG-CD1 3.47Å; F101-I111 HydrophobicContact CZ-CD1 4.33Å; F101-I111 HydrophobicContact CZ-CG2 4.18Å; V107-I111 HydrophobicContact CG1-CG2 4.39Å; V107-I111 WeakPolarHBondContact O-CG1 3.36Å; V107-I111 PolarHBondContact O-N 3.5Å; K108-I111 WeakPolarHBondContact O-CG1 3.43Å; K108-I111 PolarHBondContact O-N 3.25Å; I111-S113 PolarHBondContact O-N 2.88Å; I111-N114 CarbonylContact O-C 3.44Å; I111-N114 PolarHBondContact O-N 3.45Å; I111-Y158 HydrophobicContact CG2-CE2 4.47Å; I111-M162 HydrophobicContact CB-SD 3.73Å; I111-M162 HydrophobicContact CD1-SD 3.67Å; I111-M162 HydrophobicContact CG1-SD 3.57Å; I111-M162 VanDerWaalsContact CG1-SD 3.57Å; I111-M162 WeakPolarHBondContact O-CE 3.11Å |
| 112 | Q | 91.5 | Very high | 92.5 | Very high | 53 Ų | 53 | 72.9 Ų | 72.9 | 25% | 0.248 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -68.6 | -32.8 | 178.7 | -72.1 | 178.2 | -2.3 | 0 | 0 | 113.1 | K108 N114 M162 S165 Y166 | K108-Q112 WeakPolarHBondContact O-CB 3.49Å; K108-Q112 VanDerWaalsContact O-CG 3.32Å; K108-Q112 WeakPolarHBondContact O-CG 3.48Å; K108-Q112 PolarHBondContact O-N 2.92Å; K108-Q112 VanDerWaalsContact O-N 3.07Å; Q112-N114 VanDerWaalsContact C-N 3.33Å; Q112-M162 HydrophobicContact CG-CE 4.13Å; Q112-S165 PolarHBondContact NE2-O 3.4Å; Q112-S165 PolarHBondContact NE2-OG 2.96Å; Q112-Y166 HydrophobicContact CG-CE1 4.12Å |
| 113 | S | 92.9 | Very high | 92.7 | Very high | 81 Ų | 81 | 75.3 Ų | 75.3 | 57% | 0.566 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -77.2 | -15.1 | 173.7 | 51.1 | 0 | 0 | 0 | 0 | 114 | N109 Y110 I111 P115 | N109-S113 WeakPolarHBondContact O-CB 3.41Å; N109-S113 PolarHBondContact O-N 3.3Å; N109-S113 VanDerWaalsContact O-N 3.1Å; N109-S113 PolarHBondContact O-OG 3.34Å; Y110-S113 PolarHBondContact O-OG 3.41Å; I111-S113 PolarHBondContact O-N 2.88Å; S113-P115 VanDerWaalsContact C-CD 3.43Å; S113-P115 WeakPolarHBondContact O-CD 3.44Å |
| 114 | N | 92.5 | Very high | 93 | Very high | 64 Ų | 64 | 72.2 Ų | 72.2 | 34% | 0.342 | 39% | 0.387 | S | S | . | . | trans | -123.3 | 65.3 | -176.5 | -67.2 | -88.5 | 0 | 0 | 0 | 112.3 | Y110 I111 Q112 G116 W117 | Y110-N114 WeakPolarHBondContact O-CB 3.18Å; Y110-N114 PolarHBondContact O-N 3.49Å; Y110-N114 PolarHBondContact O-ND2 3.35Å; I111-N114 CarbonylContact O-C 3.44Å; I111-N114 PolarHBondContact O-N 3.45Å; Q112-N114 VanDerWaalsContact C-N 3.33Å; N114-G116 PolarHBondContact O-N 3.12Å; N114-W117 PolarHBondContact O-N 3.29Å; N114-W117 VanDerWaalsContact O-N 3.16Å | ||
| 115 | P | 89 | Confident | 93.1 | Very high | 66 Ų | 66 | 70.2 Ų | 70.2 | 43% | 0.429 | 37% | 0.373 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.5 | -14.3 | -177 | 26.7 | -36.1 | 0 | 0 | 0 | 114.2 | S113 W117 Y118 W119 | S113-P115 VanDerWaalsContact C-CD 3.43Å; S113-P115 WeakPolarHBondContact O-CD 3.44Å; P115-W117 PolarHBondContact O-N 2.98Å; P115-Y118 WeakPolarHBondContact O-CB 3.43Å; P115-Y118 PolarHBondContact O-N 3.28Å; P115-Y118 VanDerWaalsContact O-N 3.08Å; P115-W119 VanDerWaalsContact O-CD1 3.26Å; P115-W119 PolarHBondContact O-N 2.84Å |
| 116 | G | 92.8 | Very high | 93.2 | Very high | 50 Ų | 50 | 68.8 Ų | 68.8 | 52% | 0.515 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -56.2 | -34.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | N114 Y118 W119 A120 | N114-G116 PolarHBondContact O-N 3.12Å; G116-Y118 VanDerWaalsContact C-N 3.34Å; G116-Y118 PolarHBondContact O-N 2.97Å; G116-W119 PolarHBondContact O-N 3.4Å; G116-A120 WeakPolarHBondContact O-CB 3.44Å; G116-A120 PolarHBondContact O-N 3.38Å |
| 117 | W | 91.3 | Very high | 93.3 | Very high | 143 Ų | 143 | 68.7 Ų | 68.7 | 54% | 0.542 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -67.2 | -33.5 | 175.7 | -71.3 | 115.5 | 0 | 0 | 0 | 113 | Y110 N114 P115 A120 S121 Y158 | Y110-W117 PolarHBondContact OH-NE1 3.49Å; N114-W117 PolarHBondContact O-N 3.29Å; N114-W117 VanDerWaalsContact O-N 3.16Å; P115-W117 PolarHBondContact O-N 2.98Å; W117-A120 PolarHBondContact O-N 3.02Å; W117-S121 WeakPolarHBondContact O-CB 3.25Å; W117-S121 PolarHBondContact O-N 3.47Å; W117-Y158 HydrophobicContact CB-CE1 4.19Å; W117-Y158 WeakPolarHBondContact CB-OH 3.3Å |
| 118 | Y | 92.4 | Very high | 93.4 | Very high | 70 Ų | 70 | 66.9 Ų | 66.9 | 28% | 0.275 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -65.4 | -47.4 | 175.2 | 179.6 | -106.3 | 0 | 0 | 0 | 111.3 | P115 G116 A120 S121 Y122 M159 M162 | P115-Y118 WeakPolarHBondContact O-CB 3.43Å; P115-Y118 PolarHBondContact O-N 3.28Å; P115-Y118 VanDerWaalsContact O-N 3.08Å; G116-Y118 VanDerWaalsContact C-N 3.34Å; G116-Y118 PolarHBondContact O-N 2.97Å; Y118-A120 PolarHBondContact O-N 3.38Å; Y118-S121 PolarHBondContact O-N 2.93Å; Y118-Y122 WeakPolarHBondContact O-CB 3.15Å; Y118-Y122 PolarHBondContact O-N 3Å; Y118-M159 HydrophobicContact CD2-CG 4.37Å; Y118-M159 HydrophobicContact CE2-CB 4.1Å; Y118-M159 HydrophobicContact CE2-CG 4.09Å; Y118-M162 HydrophobicContact CD2-CB 3.86Å; Y118-M162 HydrophobicContact CD2-CG 3.63Å; Y118-M162 HydrophobicContact CE2-CB 4.36Å; Y118-M162 HydrophobicContact CE2-CG 4.31Å; Y118-M162 HydrophobicContact CG-CG 4.18Å |
| 119 | W | 93.6 | Very high | 93.6 | Very high | 170 Ų | 170 | 70 Ų | 70 | 64% | 0.644 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -63.8 | -38.9 | 175.3 | -67.1 | 111.3 | 0 | 0 | 0 | 112.9 | P115 G116 Y122 A123 | P115-W119 VanDerWaalsContact O-CD1 3.26Å; P115-W119 PolarHBondContact O-N 2.84Å; G116-W119 PolarHBondContact O-N 3.4Å; W119-Y122 WeakPolarHBondContact O-CB 3.23Å; W119-Y122 PolarHBondContact O-N 3.02Å; W119-A123 PolarHBondContact O-N 2.85Å |
| 120 | A | 94.8 | Very high | 93.6 | Very high | 47 Ų | 47 | 69.8 Ų | 69.8 | 39% | 0.388 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -62.5 | -44.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | G116 W117 Y118 Y122 A123 V124 | G116-A120 WeakPolarHBondContact O-CB 3.44Å; G116-A120 PolarHBondContact O-N 3.38Å; W117-A120 PolarHBondContact O-N 3.02Å; Y118-A120 PolarHBondContact O-N 3.38Å; A120-Y122 VanDerWaalsContact C-N 3.31Å; A120-Y122 PolarHBondContact O-N 3.48Å; A120-A123 PolarHBondContact O-N 3.28Å; A120-V124 WeakPolarHBondContact O-CG2 3.38Å; A120-V124 PolarHBondContact O-N 2.78Å |
| 121 | S | 95.1 | Very high | 93.6 | Very high | 14 Ų | 14 | 65.7 Ų | 65.7 | 10% | 0.098 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -62.5 | -38.6 | 175.9 | -158.3 | 0 | 0 | 0 | 0 | 112.1 | W117 Y118 V124 F125 S155 | W117-S121 WeakPolarHBondContact O-CB 3.25Å; W117-S121 PolarHBondContact O-N 3.47Å; Y118-S121 PolarHBondContact O-N 2.93Å; S121-V124 PolarHBondContact O-N 3.05Å; S121-F125 WeakPolarHBondContact O-CB 3.17Å; S121-F125 PolarHBondContact O-N 3.36Å; S121-S155 VanDerWaalsContact OG-CA 3.29Å; S121-S155 WeakPolarHBondContact OG-CA 3.28Å; S121-S155 PolarHBondContact OG-O 2.69Å |
| 122 | Y | 93.9 | Very high | 93.4 | Very high | 96 Ų | 96 | 65.5 Ų | 65.5 | 38% | 0.376 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -60.4 | -47.4 | 174.1 | -160.2 | -89 | 0 | 0 | 0 | 111.7 | Y118 W119 A120 V124 F125 F126 M159 | Y118-Y122 WeakPolarHBondContact O-CB 3.15Å; Y118-Y122 PolarHBondContact O-N 3Å; W119-Y122 WeakPolarHBondContact O-CB 3.23Å; W119-Y122 PolarHBondContact O-N 3.02Å; A120-Y122 VanDerWaalsContact C-N 3.31Å; A120-Y122 PolarHBondContact O-N 3.48Å; Y122-V124 PolarHBondContact O-N 2.84Å; Y122-F125 WeakPolarHBondContact O-CB 3.41Å; Y122-F125 PolarHBondContact O-N 2.89Å; Y122-F126 AromaticContact CD1-CD2 3.72Å; Y122-F126 HydrophobicContact CD1-CD2 3.72Å; Y122-F126 AromaticContact CD1-CE2 3.81Å; Y122-F126 HydrophobicContact CD1-CE2 3.81Å; Y122-F126 AromaticContact CE1-CD2 3.55Å; Y122-F126 HydrophobicContact CE1-CD2 3.55Å; Y122-F126 AromaticContact CE1-CE2 3.19Å; Y122-F126 HydrophobicContact CE1-CE2 3.19Å; Y122-F126 HydrophobicContact CE1-CZ 4Å; Y122-F126 HydrophobicContact CE2-CE2 4.02Å; Y122-F126 HydrophobicContact CG-CD2 4.41Å; Y122-F126 HydrophobicContact CG-CE2 4.45Å; Y122-F126 AromaticContact CZ-CE2 3.31Å; Y122-F126 WeakPolarHBondContact O-CD2 3.44Å; Y122-F126 PolarHBondContact O-N 3.48Å; Y122-F126 WeakPolarHBondContact OH-CE2 3.49Å; Y122-M159 HydrophobicContact CD2-CE 3.49Å; Y122-M159 VanDerWaalsContact CD2-CE 3.49Å; Y122-M159 HydrophobicContact CD2-SD 4.09Å; Y122-M159 HydrophobicContact CE2-CE 3.91Å; Y122-M159 HydrophobicContact CG-CE 4.44Å |
| 123 | A | 96 | Very high | 93.3 | Very high | 57 Ų | 57 | 65.2 Ų | 65.2 | 47% | 0.471 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | W119 A120 F126 V127 | W119-A123 PolarHBondContact O-N 2.85Å; A120-A123 PolarHBondContact O-N 3.28Å; A123-F126 PolarHBondContact O-N 3.29Å; A123-V127 WeakPolarHBondContact O-CG2 3.45Å; A123-V127 PolarHBondContact O-N 3.45Å |
| 124 | V | 96.8 | Very high | 93.2 | Very high | 65 Ų | 65 | 65.6 Ų | 65.6 | 39% | 0.394 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -63 | -42 | 176.7 | 173.2 | 0 | 0 | 0 | 0 | 111.5 | A120 S121 Y122 T128 I151 | A120-V124 WeakPolarHBondContact O-CG2 3.38Å; A120-V124 PolarHBondContact O-N 2.78Å; S121-V124 PolarHBondContact O-N 3.05Å; Y122-V124 PolarHBondContact O-N 2.84Å; V124-T128 HydrophobicContact CG1-CG2 4.39Å; V124-T128 WeakPolarHBondContact O-CB 3.49Å; V124-T128 WeakPolarHBondContact O-CG2 3.45Å; V124-T128 PolarHBondContact O-N 3.45Å; V124-T128 PolarHBondContact O-OG1 3.22Å; V124-I151 HydrophobicContact CG1-CG2 3.55Å |
| 125 | F | 95.8 | Very high | 93 | Very high | 6 Ų | 6 | 65 Ų | 65 | 3% | 0.026 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -57.9 | -51.3 | 174.6 | 170.9 | -99.9 | 0 | 0 | 0 | 111.6 | S121 Y122 V127 T128 Y129 F152 S155 L156 M159 L275 | S121-F125 WeakPolarHBondContact O-CB 3.17Å; S121-F125 PolarHBondContact O-N 3.36Å; Y122-F125 WeakPolarHBondContact O-CB 3.41Å; Y122-F125 PolarHBondContact O-N 2.89Å; F125-V127 PolarHBondContact O-N 3.27Å; F125-T128 PolarHBondContact O-N 2.89Å; F125-T128 PolarHBondContact O-OG1 3.35Å; F125-Y129 WeakPolarHBondContact O-CB 3.45Å; F125-Y129 PolarHBondContact O-N 2.74Å; F125-F152 AromaticContact CD2-CD2 3.91Å; F125-F152 HydrophobicContact CD2-CD2 3.91Å; F125-F152 AromaticContact CD2-CE2 3.77Å; F125-F152 HydrophobicContact CD2-CE2 3.77Å; F125-F152 AromaticContact CE2-CD2 3.96Å; F125-F152 HydrophobicContact CE2-CD2 3.96Å; F125-F152 AromaticContact CE2-CE2 3.32Å; F125-F152 HydrophobicContact CE2-CE2 3.32Å; F125-F152 HydrophobicContact CE2-CZ 4.03Å; F125-F152 HydrophobicContact CZ-CE2 4.2Å; F125-S155 WeakPolarHBondContact CA-OG 3.38Å; F125-L156 HydrophobicContact CD2-CB 3.87Å; F125-L156 HydrophobicContact CD2-CD1 4.1Å; F125-L156 HydrophobicContact CD2-CG 4.44Å; F125-L156 HydrophobicContact CE2-CB 4.01Å; F125-L156 HydrophobicContact CE2-CD1 3.77Å; F125-L156 HydrophobicContact CE2-CD2 4.08Å; F125-L156 HydrophobicContact CE2-CG 4.16Å; F125-L156 HydrophobicContact CZ-CD1 4.25Å; F125-M159 HydrophobicContact CB-SD 3.79Å; F125-M159 HydrophobicContact CD1-CE 4.43Å; F125-M159 HydrophobicContact CD1-SD 4.37Å; F125-M159 HydrophobicContact CG-SD 4.05Å; F125-L275 HydrophobicContact CE2-CD2 3.91Å; F125-L275 HydrophobicContact CZ-CD2 3.91Å |
| 126 | F | 94.6 | Very high | 92.7 | Very high | 82 Ų | 82 | 64.9 Ų | 64.9 | 36% | 0.36 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -62.8 | -45.4 | 180 | -90 | -95 | 0 | 0 | 0 | 112.8 | Y122 A123 Y129 I130 | Y122-F126 AromaticContact CD1-CD2 3.72Å; Y122-F126 HydrophobicContact CD1-CD2 3.72Å; Y122-F126 AromaticContact CD1-CE2 3.81Å; Y122-F126 HydrophobicContact CD1-CE2 3.81Å; Y122-F126 AromaticContact CE1-CD2 3.55Å; Y122-F126 HydrophobicContact CE1-CD2 3.55Å; Y122-F126 AromaticContact CE1-CE2 3.19Å; Y122-F126 HydrophobicContact CE1-CE2 3.19Å; Y122-F126 HydrophobicContact CE1-CZ 4Å; Y122-F126 HydrophobicContact CE2-CE2 4.02Å; Y122-F126 HydrophobicContact CG-CD2 4.41Å; Y122-F126 HydrophobicContact CG-CE2 4.45Å; Y122-F126 AromaticContact CZ-CE2 3.31Å; Y122-F126 WeakPolarHBondContact O-CD2 3.44Å; Y122-F126 PolarHBondContact O-N 3.48Å; Y122-F126 WeakPolarHBondContact OH-CE2 3.49Å; A123-F126 PolarHBondContact O-N 3.29Å; F126-Y129 PolarHBondContact O-N 2.85Å; F126-I130 WeakPolarHBondContact O-CB 3.48Å; F126-I130 WeakPolarHBondContact O-CD1 3.09Å; F126-I130 VanDerWaalsContact O-CG1 3.23Å; F126-I130 WeakPolarHBondContact O-CG1 3.3Å; F126-I130 PolarHBondContact O-N 3.26Å |
| 127 | V | 95.7 | Very high | 92.3 | Very high | 93 Ų | 93 | 64 Ų | 64 | 56% | 0.564 | 34% | 0.342 | S | S | * | . | H | α-helix | trans | -62.9 | -45.4 | 179.5 | 172.4 | 0 | 0 | 0 | 0 | 111.4 | A123 F125 T131 | A123-V127 WeakPolarHBondContact O-CG2 3.45Å; A123-V127 PolarHBondContact O-N 3.45Å; F125-V127 PolarHBondContact O-N 3.27Å; V127-T131 WeakPolarHBondContact O-CB 3.4Å; V127-T131 PolarHBondContact O-N 3.48Å; V127-T131 PolarHBondContact O-OG1 3.4Å |
| 128 | T | 94.8 | Very high | 91.9 | Very high | 10 Ų | 10 | 59.4 Ų | 59.4 | 6% | 0.061 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -69.7 | -39.1 | 178.8 | 51.9 | 0 | 0 | 0 | 0 | 113 | V124 F125 T131 L132 I151 | V124-T128 HydrophobicContact CG1-CG2 4.39Å; V124-T128 WeakPolarHBondContact O-CB 3.49Å; V124-T128 WeakPolarHBondContact O-CG2 3.45Å; V124-T128 PolarHBondContact O-N 3.45Å; V124-T128 PolarHBondContact O-OG1 3.22Å; F125-T128 PolarHBondContact O-N 2.89Å; F125-T128 PolarHBondContact O-OG1 3.35Å; T128-T131 PolarHBondContact O-N 2.96Å; T128-L132 WeakPolarHBondContact O-CB 3.18Å; T128-L132 WeakPolarHBondContact O-CG 3.45Å; T128-L132 PolarHBondContact O-N 2.97Å; T128-I151 HydrophobicContact CG2-CB 4.2Å; T128-I151 HydrophobicContact CG2-CG2 3.73Å |
| 129 | Y | 93.8 | Very high | 91.5 | Very high | 79 Ų | 79 | 57 Ų | 57 | 31% | 0.31 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -60.8 | -51.4 | 173.7 | 177.1 | -107.9 | 0 | 0 | 0 | 111.5 | F125 F126 T131 L132 V133 F152 L271 L275 | F125-Y129 WeakPolarHBondContact O-CB 3.45Å; F125-Y129 PolarHBondContact O-N 2.74Å; F126-Y129 PolarHBondContact O-N 2.85Å; Y129-T131 VanDerWaalsContact C-N 3.29Å; Y129-T131 PolarHBondContact O-N 2.87Å; Y129-L132 PolarHBondContact O-N 2.7Å; Y129-L132 VanDerWaalsContact O-N 3.14Å; Y129-V133 HydrophobicContact CD1-CG2 4.48Å; Y129-V133 HydrophobicContact CD2-CG2 3.98Å; Y129-V133 HydrophobicContact CE1-CG2 4.16Å; Y129-V133 HydrophobicContact CE2-CG2 3.61Å; Y129-V133 HydrophobicContact CG-CG2 4.4Å; Y129-V133 WeakPolarHBondContact O-CG2 3.31Å; Y129-V133 PolarHBondContact O-N 2.85Å; Y129-F152 AromaticContact CD2-CE2 3.93Å; Y129-F152 HydrophobicContact CD2-CE2 3.93Å; Y129-F152 HydrophobicContact CD2-CZ 4.48Å; Y129-F152 HydrophobicContact CG-CE2 4.44Å; Y129-L271 HydrophobicContact CD2-CD1 4.49Å; Y129-L271 HydrophobicContact CD2-CD2 4.04Å; Y129-L271 HydrophobicContact CE2-CD2 3.83Å; Y129-L275 HydrophobicContact CD2-CD1 4Å; Y129-L275 HydrophobicContact CE2-CD1 3.51Å |
| 130 | I | 93.1 | Very high | 91.1 | Very high | 92 Ų | 92 | 54.4 Ų | 54.4 | 47% | 0.472 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -59.1 | -41.8 | 177.5 | -68 | 165.9 | 0 | 0 | 0 | 110.8 | F126 V133 C134 | F126-I130 WeakPolarHBondContact O-CB 3.48Å; F126-I130 WeakPolarHBondContact O-CD1 3.09Å; F126-I130 VanDerWaalsContact O-CG1 3.23Å; F126-I130 WeakPolarHBondContact O-CG1 3.3Å; F126-I130 PolarHBondContact O-N 3.26Å; I130-V133 PolarHBondContact O-N 3.39Å; I130-C134 HydrophobicContact CG2-CB 4.49Å; I130-C134 WeakPolarHBondContact O-CB 3.43Å; I130-C134 PolarHBondContact O-N 3.18Å |
| 131 | T | 92.1 | Very high | 90.6 | Very high | 37 Ų | 37 | 57.9 Ų | 57.9 | 23% | 0.227 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -61.9 | -45.1 | 176.4 | -56.8 | 0 | 0 | 0 | 0 | 111.5 | V127 T128 Y129 C135 P138 L148 | V127-T131 WeakPolarHBondContact O-CB 3.4Å; V127-T131 PolarHBondContact O-N 3.48Å; V127-T131 PolarHBondContact O-OG1 3.4Å; T128-T131 PolarHBondContact O-N 2.96Å; Y129-T131 VanDerWaalsContact C-N 3.29Å; Y129-T131 PolarHBondContact O-N 2.87Å; T131-C135 HydrophobicContact CG2-CB 4.44Å; T131-C135 WeakPolarHBondContact O-CA 3.5Å; T131-C135 WeakPolarHBondContact O-CB 3.45Å; T131-C135 PolarHBondContact O-N 3.42Å; T131-P138 HydrophobicContact CG2-CB 4.44Å; T131-L148 HydrophobicContact CG2-CD1 3.91Å; T131-L148 HydrophobicContact CG2-CD2 4.41Å |
| 132 | L | 90.1 | Very high | 90 | Very high | 1 Ų | 1 | 64.7 Ų | 64.7 | 1% | 0.005 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -70.6 | -33.7 | -179.4 | -74.7 | 170.4 | 0 | 0 | 0 | 113 | T128 Y129 R139 L148 F152 V267 L271 | T128-L132 WeakPolarHBondContact O-CB 3.18Å; T128-L132 WeakPolarHBondContact O-CG 3.45Å; T128-L132 PolarHBondContact O-N 2.97Å; Y129-L132 PolarHBondContact O-N 2.7Å; Y129-L132 VanDerWaalsContact O-N 3.14Å; L132-R139 WeakPolarHBondContact O-CD 3.41Å; L132-R139 PolarHBondContact O-NH1 3.38Å; L132-L148 HydrophobicContact CD1-CB 4.21Å; L132-L148 HydrophobicContact CD2-CB 3.74Å; L132-L148 HydrophobicContact CD2-CD1 4.16Å; L132-L148 HydrophobicContact CG-CB 4.06Å; L132-F152 HydrophobicContact CD1-CB 4.12Å; L132-F152 HydrophobicContact CD1-CG 4.3Å; L132-V267 HydrophobicContact CD2-CG1 4.01Å; L132-L271 HydrophobicContact CB-CD1 3.76Å; L132-L271 HydrophobicContact CD1-CD1 3.51Å; L132-L271 HydrophobicContact CG-CD1 4.25Å |
| 133 | V | 89.4 | Confident | 89.8 | Confident | 47 Ų | 47 | 63 Ų | 63 | 29% | 0.285 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -78 | -52.6 | 177.5 | 176.5 | 0 | 0 | 0 | 0 | 111.2 | Y129 I130 R139 F268 | Y129-V133 HydrophobicContact CD1-CG2 4.48Å; Y129-V133 HydrophobicContact CD2-CG2 3.98Å; Y129-V133 HydrophobicContact CE1-CG2 4.16Å; Y129-V133 HydrophobicContact CE2-CG2 3.61Å; Y129-V133 HydrophobicContact CG-CG2 4.4Å; Y129-V133 WeakPolarHBondContact O-CG2 3.31Å; Y129-V133 PolarHBondContact O-N 2.85Å; I130-V133 PolarHBondContact O-N 3.39Å; V133-R139 PolarHBondContact O-NH1 3.46Å; V133-F268 HydrophobicContact CG1-CE2 4.49Å; V133-F268 HydrophobicContact CG2-CE2 4.27Å |
| 134 | C | 89.1 | Confident | 89.4 | Confident | 89 Ų | 89 | 67.3 Ų | 67.3 | 60% | 0.601 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -89.7 | -15.6 | -167.3 | -59 | 0 | 0 | 0 | 0 | 114.7 | I130 P136 | I130-C134 HydrophobicContact CG2-CB 4.49Å; I130-C134 WeakPolarHBondContact O-CB 3.43Å; I130-C134 PolarHBondContact O-N 3.18Å; C134-P136 WeakPolarHBondContact O-CD 3.14Å |
| 135 | C | 88.6 | Confident | 89.1 | Confident | 51 Ų | 51 | 64.4 Ų | 64.4 | 35% | 0.345 | 34% | 0.335 | S | S | . | . | trans | -116.5 | 95.4 | -176.5 | -52.4 | 0 | 0 | 0 | 0 | 111.9 | T131 G137 P138 R139 | T131-C135 HydrophobicContact CG2-CB 4.44Å; T131-C135 WeakPolarHBondContact O-CA 3.5Å; T131-C135 WeakPolarHBondContact O-CB 3.45Å; T131-C135 PolarHBondContact O-N 3.42Å; C135-G137 VanDerWaalsContact C-N 3.28Å; C135-G137 PolarHBondContact O-N 2.94Å; C135-P138 HydrophobicContact CB-CG 4.23Å; C135-R139 PolarHBondContact O-N 3.38Å | ||
| 136 | P | 82.4 | Confident | 88.8 | Confident | 63 Ų | 63 | 67.3 Ų | 67.3 | 41% | 0.409 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -61.3 | -31 | 179.8 | -25.1 | 34.7 | 0 | 0 | 0 | 114.3 | C134 R139 R140 | C134-P136 WeakPolarHBondContact O-CD 3.14Å; P136-R139 PolarHBondContact O-N 3.41Å; P136-R140 WeakPolarHBondContact O-CB 3.2Å; P136-R140 VanDerWaalsContact O-CG 3.3Å; P136-R140 WeakPolarHBondContact O-CG 3.4Å; P136-R140 PolarHBondContact O-N 2.95Å |
| 137 | G | 85.6 | Confident | 88.8 | Confident | 32 Ų | 32 | 67 Ų | 67 | 33% | 0.33 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -58.5 | -65 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | C135 R139 R140 Q141 | C135-G137 VanDerWaalsContact C-N 3.28Å; C135-G137 PolarHBondContact O-N 2.94Å; G137-R139 PolarHBondContact O-N 2.7Å; G137-R140 PolarHBondContact O-N 3.29Å; G137-R140 VanDerWaalsContact O-N 3.14Å; G137-Q141 WeakPolarHBondContact O-CB 3.39Å; G137-Q141 WeakPolarHBondContact O-CG 3.34Å; G137-Q141 PolarHBondContact O-N 3.19Å |
| 138 | P | 83.2 | Confident | 88.7 | Confident | 46 Ų | 46 | 63.7 Ų | 63.7 | 30% | 0.299 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -59.3 | -30.2 | 176.4 | -24.7 | 34.3 | 0 | 0 | 0 | 113.9 | T131 C135 N145 L148 | T131-P138 HydrophobicContact CG2-CB 4.44Å; C135-P138 HydrophobicContact CB-CG 4.23Å; P138-N145 WeakPolarHBondContact O-CA 3.12Å; P138-N145 WeakPolarHBondContact O-CB 3.11Å; P138-N145 PolarHBondContact O-N 3.38Å; P138-L148 HydrophobicContact CB-CD1 3.55Å |
| 139 | R | 84.1 | Confident | 88.6 | Confident | 19 Ų | 19 | 63.4 Ų | 63.4 | 7% | 0.072 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -69.5 | -34.4 | 175.7 | 178.2 | 172.3 | 72.9 | -130.9 | 12.3 | 113.5 | L132 V133 C135 P136 G137 N145 E265 V267 | L132-R139 WeakPolarHBondContact O-CD 3.41Å; L132-R139 PolarHBondContact O-NH1 3.38Å; V133-R139 PolarHBondContact O-NH1 3.46Å; C135-R139 PolarHBondContact O-N 3.38Å; P136-R139 PolarHBondContact O-N 3.41Å; G137-R139 PolarHBondContact O-N 2.7Å; R139-N145 WeakPolarHBondContact O-CB 3.32Å; R139-E265 IonicContact CZ-OE1 3.58Å; R139-E265 IonicContact NE-OE1 3.58Å; R139-E265 IonicContact NH2-OE1 2.74Å; R139-E265 PolarHBondContact NH2-OE1 2.93Å; R139-V267 HydrophobicContact CG-CB 4.31Å; R139-V267 HydrophobicContact CG-CG1 4.4Å |
| 140 | R | 84.1 | Confident | 88.7 | Confident | 117 Ų | 117 | 62 Ų | 62 | 44% | 0.442 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -95.7 | -22.1 | -175.4 | -66.7 | -179 | -173.7 | -175 | 6.5 | 113.2 | P136 G137 E264 E265 | P136-R140 WeakPolarHBondContact O-CB 3.2Å; P136-R140 VanDerWaalsContact O-CG 3.3Å; P136-R140 WeakPolarHBondContact O-CG 3.4Å; P136-R140 PolarHBondContact O-N 2.95Å; G137-R140 PolarHBondContact O-N 3.29Å; G137-R140 VanDerWaalsContact O-N 3.14Å; R140-E264 IonicContact NH1-OE2 3.6Å; R140-E265 IonicContact CZ-OE1 3.42Å; R140-E265 IonicContact NE-OE1 3.29Å; R140-E265 PolarHBondContact NE-OE1 2.91Å; R140-E265 IonicContact NH2-OE1 2.74Å; R140-E265 PolarHBondContact NH2-OE1 3.49Å |
| 141 | Q | 83.9 | Confident | 88.9 | Confident | 119 Ų | 119 | 60.9 Ų | 60.9 | 56% | 0.556 | 33% | 0.328 | S | S | * | . | S | Bend | trans | -84.8 | 129.5 | 179.6 | -68.2 | 177.7 | 7.2 | 0 | 0 | 112.9 | G137 W144 N145 | G137-Q141 WeakPolarHBondContact O-CB 3.39Å; G137-Q141 WeakPolarHBondContact O-CG 3.34Å; G137-Q141 PolarHBondContact O-N 3.19Å; Q141-W144 PolarHBondContact O-N 3.29Å; Q141-N145 WeakPolarHBondContact O-CB 3.42Å; Q141-N145 VanDerWaalsContact O-CG 3.28Å; Q141-N145 PolarHBondContact O-N 3.06Å; Q141-N145 PolarHBondContact O-OD1 3.45Å |
| 142 | F | 83.4 | Confident | 89.1 | Confident | 157 Ų | 157 | 59.1 Ų | 59.1 | 69% | 0.689 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.7 | 141.9 | 165.6 | -179 | -91 | 0 | 0 | 0 | 109.9 | L146 | F142-L146 HydrophobicContact CD2-CD1 4.33Å; F142-L146 HydrophobicContact CE2-CD1 3.93Å |
| 143 | P | 88.5 | Confident | 89.4 | Confident | 62 Ų | 62 | 59.4 Ų | 59.4 | 40% | 0.403 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -89.8 | -3.3 | -0.4 | 36.5 | -36.1 | 0 | 0 | 0 | 114.4 | N145 L146 I147 | P143-N145 PolarHBondContact O-N 2.71Å; P143-N145 VanDerWaalsContact O-N 3.14Å; P143-L146 PolarHBondContact O-N 2.88Å; P143-L146 VanDerWaalsContact O-N 3.09Å; P143-I147 HydrophobicContact CB-CD1 4.17Å; P143-I147 HydrophobicContact CG-CD1 4.09Å; P143-I147 PolarHBondContact O-N 3.22Å; P143-I147 VanDerWaalsContact O-N 3.16Å |
| 144 | W | 88.2 | Confident | 89.8 | Confident | 146 Ų | 146 | 61.7 Ų | 61.7 | 55% | 0.553 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -51.7 | -39.4 | -174.3 | -76.2 | 114.2 | 0 | 0 | 0 | 113.6 | Q141 L146 I147 L148 | Q141-W144 PolarHBondContact O-N 3.29Å; W144-L146 PolarHBondContact O-N 2.99Å; W144-I147 PolarHBondContact O-N 3.42Å; W144-L148 WeakPolarHBondContact O-CB 3.22Å; W144-L148 WeakPolarHBondContact O-CG 3.49Å; W144-L148 PolarHBondContact O-N 3.4Å |
| 145 | N | 90.6 | Very high | 90.2 | Very high | 4 Ų | 4 | 57.8 Ų | 57.8 | 2% | 0.021 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -61.6 | -38.2 | -179.2 | 65.3 | -2.7 | 0 | 0 | 0 | 114 | P138 R139 Q141 P143 L149 Y266 V267 | P138-N145 WeakPolarHBondContact O-CA 3.12Å; P138-N145 WeakPolarHBondContact O-CB 3.11Å; P138-N145 PolarHBondContact O-N 3.38Å; R139-N145 WeakPolarHBondContact O-CB 3.32Å; Q141-N145 WeakPolarHBondContact O-CB 3.42Å; Q141-N145 VanDerWaalsContact O-CG 3.28Å; Q141-N145 PolarHBondContact O-N 3.06Å; Q141-N145 PolarHBondContact O-OD1 3.45Å; P143-N145 PolarHBondContact O-N 2.71Å; P143-N145 VanDerWaalsContact O-N 3.14Å; N145-L149 VanDerWaalsContact O-CB 3.26Å; N145-L149 WeakPolarHBondContact O-CB 3.13Å; N145-L149 PolarHBondContact O-N 2.98Å; N145-Y266 PolarHBondContact ND2-OH 2.95Å; N145-Y266 VanDerWaalsContact ND2-OH 3.1Å; N145-V267 HydrophobicContact CB-CG2 4.08Å |
| 146 | L | 90.2 | Very high | 90.6 | Very high | 68 Ų | 68 | 55.5 Ų | 55.5 | 36% | 0.356 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -78.6 | -35.4 | 174.8 | -63.6 | -174.7 | 0 | 0 | 0 | 112.1 | F142 P143 W144 L149 A150 Y266 | F142-L146 HydrophobicContact CD2-CD1 4.33Å; F142-L146 HydrophobicContact CE2-CD1 3.93Å; P143-L146 PolarHBondContact O-N 2.88Å; P143-L146 VanDerWaalsContact O-N 3.09Å; W144-L146 PolarHBondContact O-N 2.99Å; L146-L149 PolarHBondContact O-N 2.84Å; L146-A150 VanDerWaalsContact O-CB 3.32Å; L146-A150 WeakPolarHBondContact O-CB 3.13Å; L146-A150 PolarHBondContact O-N 3.38Å; L146-Y266 HydrophobicContact CD2-CE2 4.24Å |
| 147 | I | 93.5 | Very high | 91.3 | Very high | 76 Ų | 76 | 52.5 Ų | 52.5 | 39% | 0.39 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.3 | -49.7 | 177.7 | -65.7 | 169.3 | 0 | 0 | 0 | 110.2 | P143 W144 L149 A150 I151 | P143-I147 HydrophobicContact CB-CD1 4.17Å; P143-I147 HydrophobicContact CG-CD1 4.09Å; P143-I147 PolarHBondContact O-N 3.22Å; P143-I147 VanDerWaalsContact O-N 3.16Å; W144-I147 PolarHBondContact O-N 3.42Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 3.17Å; I147-A150 PolarHBondContact O-N 3.37Å; I147-I151 HydrophobicContact CG2-CD1 3.92Å; I147-I151 WeakPolarHBondContact O-CG1 3.36Å; I147-I151 PolarHBondContact O-N 3.32Å |
| 148 | L | 93.3 | Very high | 91.9 | Very high | 22 Ų | 22 | 53.1 Ų | 53.1 | 12% | 0.115 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.3 | -42.6 | 176.8 | -71.6 | 172.3 | 0 | 0 | 0 | 111.6 | T131 L132 P138 W144 A150 I151 F152 | T131-L148 HydrophobicContact CG2-CD1 3.91Å; T131-L148 HydrophobicContact CG2-CD2 4.41Å; L132-L148 HydrophobicContact CD1-CB 4.21Å; L132-L148 HydrophobicContact CD2-CB 3.74Å; L132-L148 HydrophobicContact CD2-CD1 4.16Å; L132-L148 HydrophobicContact CG-CB 4.06Å; P138-L148 HydrophobicContact CB-CD1 3.55Å; W144-L148 WeakPolarHBondContact O-CB 3.22Å; W144-L148 WeakPolarHBondContact O-CG 3.49Å; W144-L148 PolarHBondContact O-N 3.4Å; L148-A150 VanDerWaalsContact C-N 3.34Å; L148-A150 PolarHBondContact O-N 2.89Å; L148-I151 PolarHBondContact O-N 3.21Å; L148-F152 VanDerWaalsContact O-CB 3.25Å; L148-F152 WeakPolarHBondContact O-CB 3.31Å; L148-F152 PolarHBondContact O-N 2.83Å |
| 149 | L | 94 | Very high | 92.5 | Very high | 5 Ų | 5 | 51.8 Ų | 51.8 | 3% | 0.026 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -63.1 | -39.1 | 176.2 | -171.6 | 66.9 | 0 | 0 | 0 | 111.9 | I86 N145 L146 I147 F152 T153 V267 L271 | I86-L149 HydrophobicContact CG2-CD2 3.6Å; N145-L149 VanDerWaalsContact O-CB 3.26Å; N145-L149 WeakPolarHBondContact O-CB 3.13Å; N145-L149 PolarHBondContact O-N 2.98Å; L146-L149 PolarHBondContact O-N 2.84Å; I147-L149 VanDerWaalsContact C-N 3.34Å; I147-L149 PolarHBondContact O-N 3.17Å; L149-F152 HydrophobicContact CD1-CD1 4.19Å; L149-T153 WeakPolarHBondContact O-CB 3.39Å; L149-T153 PolarHBondContact O-N 3.03Å; L149-T153 PolarHBondContact O-OG1 3.46Å; L149-V267 HydrophobicContact CB-CG1 4.29Å; L149-V267 HydrophobicContact CD1-CG1 4.17Å; L149-V267 HydrophobicContact CD2-CG1 4.3Å; L149-V267 HydrophobicContact CG-CG1 4.5Å; L149-L271 HydrophobicContact CD1-CB 4.27Å |
| 150 | A | 95.5 | Very high | 93 | Very high | 49 Ų | 49 | 51 Ų | 51 | 41% | 0.405 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -66.3 | -45.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L146 I147 L148 F152 T153 L154 | L146-A150 VanDerWaalsContact O-CB 3.32Å; L146-A150 WeakPolarHBondContact O-CB 3.13Å; L146-A150 PolarHBondContact O-N 3.38Å; I147-A150 PolarHBondContact O-N 3.37Å; L148-A150 VanDerWaalsContact C-N 3.34Å; L148-A150 PolarHBondContact O-N 2.89Å; A150-F152 PolarHBondContact O-N 3Å; A150-T153 WeakPolarHBondContact O-CB 3.21Å; A150-T153 PolarHBondContact O-N 2.84Å; A150-L154 WeakPolarHBondContact O-CG 3.12Å; A150-L154 PolarHBondContact O-N 2.92Å |
| 151 | I | 96.8 | Very high | 93.6 | Very high | 69 Ų | 69 | 45.5 Ų | 45.5 | 35% | 0.354 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -61.2 | -45.9 | 176.7 | -62.3 | 164.1 | 0 | 0 | 0 | 110.4 | V124 T128 I147 L148 T153 L154 S155 | V124-I151 HydrophobicContact CG1-CG2 3.55Å; T128-I151 HydrophobicContact CG2-CB 4.2Å; T128-I151 HydrophobicContact CG2-CG2 3.73Å; I147-I151 HydrophobicContact CG2-CD1 3.92Å; I147-I151 WeakPolarHBondContact O-CG1 3.36Å; I147-I151 PolarHBondContact O-N 3.32Å; L148-I151 PolarHBondContact O-N 3.21Å; I151-T153 VanDerWaalsContact C-N 3.35Å; I151-T153 PolarHBondContact O-N 3.49Å; I151-L154 PolarHBondContact O-N 3.03Å; I151-S155 PolarHBondContact O-N 3.19Å; I151-S155 PolarHBondContact O-OG 3.21Å |
| 152 | F | 96.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -59.8 | -41 | 174.6 | 167.2 | -97.2 | 0 | 0 | 0 | 112.9 | F125 Y129 L132 L148 L149 A150 S155 L156 L271 Y274 L275 | F125-F152 AromaticContact CD2-CD2 3.91Å; F125-F152 HydrophobicContact CD2-CD2 3.91Å; F125-F152 AromaticContact CD2-CE2 3.77Å; F125-F152 HydrophobicContact CD2-CE2 3.77Å; F125-F152 AromaticContact CE2-CD2 3.96Å; F125-F152 HydrophobicContact CE2-CD2 3.96Å; F125-F152 AromaticContact CE2-CE2 3.32Å; F125-F152 HydrophobicContact CE2-CE2 3.32Å; F125-F152 HydrophobicContact CE2-CZ 4.03Å; F125-F152 HydrophobicContact CZ-CE2 4.2Å; Y129-F152 AromaticContact CD2-CE2 3.93Å; Y129-F152 HydrophobicContact CD2-CE2 3.93Å; Y129-F152 HydrophobicContact CD2-CZ 4.48Å; Y129-F152 HydrophobicContact CG-CE2 4.44Å; L132-F152 HydrophobicContact CD1-CB 4.12Å; L132-F152 HydrophobicContact CD1-CG 4.3Å; L148-F152 VanDerWaalsContact O-CB 3.25Å; L148-F152 WeakPolarHBondContact O-CB 3.31Å; L148-F152 PolarHBondContact O-N 2.83Å; L149-F152 HydrophobicContact CD1-CD1 4.19Å; A150-F152 PolarHBondContact O-N 3Å; F152-S155 PolarHBondContact O-OG 3.42Å; F152-S155 VanDerWaalsContact O-OG 3.12Å; F152-L156 WeakPolarHBondContact O-CB 3.34Å; F152-L156 PolarHBondContact O-N 2.76Å; F152-L156 VanDerWaalsContact O-N 3.08Å; F152-L271 HydrophobicContact CD1-CD1 4.1Å; F152-L271 HydrophobicContact CD1-CG 4.41Å; F152-L271 HydrophobicContact CD2-CD1 4.4Å; F152-L271 HydrophobicContact CE1-CB 4.41Å; F152-L271 HydrophobicContact CE1-CD1 3.77Å; F152-L271 HydrophobicContact CE1-CG 3.64Å; F152-L271 HydrophobicContact CE2-CD1 4.1Å; F152-L271 HydrophobicContact CE2-CG 4.38Å; F152-L271 HydrophobicContact CG-CD1 4.39Å; F152-L271 HydrophobicContact CZ-CD1 3.77Å; F152-L271 HydrophobicContact CZ-CD2 4.31Å; F152-L271 HydrophobicContact CZ-CG 3.62Å; F152-Y274 HydrophobicContact CD1-CD1 4.48Å; F152-Y274 HydrophobicContact CD1-CE1 4.42Å; F152-Y274 AromaticContact CE1-CD1 3.68Å; F152-Y274 HydrophobicContact CE1-CD1 3.68Å; F152-Y274 AromaticContact CE1-CE1 3.92Å; F152-Y274 HydrophobicContact CE1-CE1 3.92Å; F152-Y274 HydrophobicContact CZ-CD1 4.38Å; F152-L275 HydrophobicContact CE2-CD2 4.23Å; F152-L275 HydrophobicContact CZ-CD1 4.16Å; F152-L275 HydrophobicContact CZ-CD2 3.65Å; F152-L275 HydrophobicContact CZ-CG 3.82Å |
| 153 | T | 97.2 | Very high | 94.5 | Very high | 6 Ų | 6 | 35.1 Ų | 35.1 | 4% | 0.037 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -63.3 | -47.4 | 176.3 | -55.9 | 0 | 0 | 0 | 0 | 110.7 | Q90 V93 L149 A150 I151 S157 Y274 | Q90-T153 HydrophobicContact CB-CG2 3.75Å; Q90-T153 HydrophobicContact CG-CG2 3.81Å; Q90-T153 WeakPolarHBondContact CG-OG1 3.43Å; Q90-T153 PolarHBondContact NE2-OG1 3.45Å; V93-T153 HydrophobicContact CB-CG2 4.41Å; V93-T153 HydrophobicContact CG1-CG2 4.27Å; L149-T153 WeakPolarHBondContact O-CB 3.39Å; L149-T153 PolarHBondContact O-N 3.03Å; L149-T153 PolarHBondContact O-OG1 3.46Å; A150-T153 WeakPolarHBondContact O-CB 3.21Å; A150-T153 PolarHBondContact O-N 2.84Å; I151-T153 VanDerWaalsContact C-N 3.35Å; I151-T153 PolarHBondContact O-N 3.49Å; T153-S157 WeakPolarHBondContact O-CB 3.29Å; T153-S157 PolarHBondContact O-N 3.49Å; T153-S157 PolarHBondContact O-OG 3.44Å; T153-Y274 HydrophobicContact CG2-CE2 4.45Å; T153-Y274 PolarHBondContact O-OH 3.41Å |
| 154 | L | 97.5 | Very high | 94.7 | Very high | 96 Ų | 96 | 32.1 Ų | 32.1 | 50% | 0.503 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -65.5 | -43.3 | -179.1 | -71.8 | 169.9 | 0 | 0 | 0 | 111.8 | V93 I97 A150 I151 S157 Y158 | V93-L154 HydrophobicContact CG1-CD2 3.88Å; I97-L154 HydrophobicContact CD1-CD2 4.14Å; A150-L154 WeakPolarHBondContact O-CG 3.12Å; A150-L154 PolarHBondContact O-N 2.92Å; I151-L154 PolarHBondContact O-N 3.03Å; L154-S157 PolarHBondContact O-N 3.48Å; L154-Y158 WeakPolarHBondContact O-CB 3.38Å; L154-Y158 PolarHBondContact O-N 3.32Å |
| 155 | S | 97.4 | Very high | 95 | Very high | 6 Ų | 6 | 25.3 Ų | 25.3 | 4% | 0.042 | 14% | 0.137 | C | C | . | . | H | α-helix | trans | -67.1 | -43 | 179.7 | 61.2 | 0 | 0 | 0 | 0 | 112.5 | S121 F125 I151 F152 Y158 M159 | S121-S155 VanDerWaalsContact OG-CA 3.29Å; S121-S155 WeakPolarHBondContact OG-CA 3.28Å; S121-S155 PolarHBondContact OG-O 2.69Å; F125-S155 WeakPolarHBondContact CA-OG 3.38Å; I151-S155 PolarHBondContact O-N 3.19Å; I151-S155 PolarHBondContact O-OG 3.21Å; F152-S155 PolarHBondContact O-OG 3.42Å; F152-S155 VanDerWaalsContact O-OG 3.12Å; S155-Y158 PolarHBondContact O-N 3.39Å; S155-M159 WeakPolarHBondContact O-CG 3.5Å; S155-M159 PolarHBondContact O-N 3.12Å |
| 156 | L | 96.8 | Very high | 95 | Very high | 4 Ų | 4 | 30.5 Ų | 30.5 | 2% | 0.021 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -68.8 | -38 | 174.6 | -173.7 | 61.9 | 0 | 0 | 0 | 111.9 | F125 F152 Y158 M159 T160 Y274 L275 I278 | F125-L156 HydrophobicContact CD2-CB 3.87Å; F125-L156 HydrophobicContact CD2-CD1 4.1Å; F125-L156 HydrophobicContact CD2-CG 4.44Å; F125-L156 HydrophobicContact CE2-CB 4.01Å; F125-L156 HydrophobicContact CE2-CD1 3.77Å; F125-L156 HydrophobicContact CE2-CD2 4.08Å; F125-L156 HydrophobicContact CE2-CG 4.16Å; F125-L156 HydrophobicContact CZ-CD1 4.25Å; F152-L156 WeakPolarHBondContact O-CB 3.34Å; F152-L156 PolarHBondContact O-N 2.76Å; F152-L156 VanDerWaalsContact O-N 3.08Å; L156-Y158 VanDerWaalsContact C-N 3.33Å; L156-Y158 PolarHBondContact O-N 3.48Å; L156-M159 HydrophobicContact CD1-CE 4.4Å; L156-M159 PolarHBondContact O-N 2.94Å; L156-T160 VanDerWaalsContact O-CB 3.3Å; L156-T160 WeakPolarHBondContact O-CB 3.26Å; L156-T160 PolarHBondContact O-N 3.13Å; L156-T160 PolarHBondContact O-OG1 3.34Å; L156-Y274 HydrophobicContact CB-CE1 4.25Å; L156-Y274 HydrophobicContact CD2-CD1 4.11Å; L156-Y274 HydrophobicContact CD2-CE1 3.49Å; L156-Y274 VanDerWaalsContact CD2-CE1 3.49Å; L156-Y274 HydrophobicContact CG-CE1 4.34Å; L156-L275 HydrophobicContact CD2-CD2 3.64Å; L156-I278 HydrophobicContact CD1-CG2 4.18Å; L156-I278 HydrophobicContact CD2-CB 4Å; L156-I278 HydrophobicContact CD2-CG1 4.03Å; L156-I278 HydrophobicContact CD2-CG2 3.84Å; L156-I278 HydrophobicContact CG-CG2 3.94Å |
| 157 | S | 97.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.4 | -40.1 | 176.2 | -64.4 | 0 | 0 | 0 | 0 | 111.8 | T94 I97 T153 L154 T160 G161 Y274 | T94-S157 VanDerWaalsContact CA-OG 3.3Å; T94-S157 WeakPolarHBondContact CA-OG 3.34Å; T94-S157 WeakPolarHBondContact CB-OG 3.4Å; T94-S157 PolarHBondContact OG1-OG 3.47Å; I97-S157 WeakPolarHBondContact CG2-O 3.39Å; T153-S157 WeakPolarHBondContact O-CB 3.29Å; T153-S157 PolarHBondContact O-N 3.49Å; T153-S157 PolarHBondContact O-OG 3.44Å; L154-S157 PolarHBondContact O-N 3.48Å; S157-T160 PolarHBondContact O-N 2.95Å; S157-G161 PolarHBondContact O-N 2.65Å; S157-Y274 PolarHBondContact OG-OH 3.44Å; S157-Y274 VanDerWaalsContact OG-OH 3.12Å |
| 158 | Y | 96.8 | Very high | 95.1 | Very high | 44 Ų | 44 | 27.1 Ų | 27.1 | 17% | 0.173 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -63.5 | -47.1 | 174.2 | -177.3 | -81.7 | 0 | 0 | 0 | 111.5 | F101 I111 W117 L154 S155 L156 T160 G161 M162 | F101-Y158 AromaticContact CE2-CD2 3.82Å; F101-Y158 HydrophobicContact CE2-CD2 3.82Å; F101-Y158 AromaticContact CE2-CE2 3.8Å; F101-Y158 HydrophobicContact CE2-CE2 3.8Å; F101-Y158 HydrophobicContact CE2-CG 4.36Å; F101-Y158 AromaticContact CZ-CD2 3.65Å; F101-Y158 HydrophobicContact CZ-CD2 3.65Å; F101-Y158 AromaticContact CZ-CE2 3.58Å; F101-Y158 HydrophobicContact CZ-CE2 3.58Å; I111-Y158 HydrophobicContact CG2-CE2 4.47Å; W117-Y158 HydrophobicContact CB-CE1 4.19Å; W117-Y158 WeakPolarHBondContact CB-OH 3.3Å; L154-Y158 WeakPolarHBondContact O-CB 3.38Å; L154-Y158 PolarHBondContact O-N 3.32Å; S155-Y158 PolarHBondContact O-N 3.39Å; L156-Y158 VanDerWaalsContact C-N 3.33Å; L156-Y158 PolarHBondContact O-N 3.48Å; Y158-T160 VanDerWaalsContact C-N 3.33Å; Y158-T160 PolarHBondContact O-N 2.89Å; Y158-G161 PolarHBondContact O-N 2.85Å; Y158-M162 VanDerWaalsContact O-CB 3.31Å; Y158-M162 WeakPolarHBondContact O-CB 3.5Å; Y158-M162 PolarHBondContact O-N 3.47Å |
| 159 | M | 95.9 | Very high | 95.1 | Very high | 19 Ų | 19 | 27.7 Ų | 27.7 | 9% | 0.094 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -58.7 | -45 | 175.7 | -73 | 168.7 | 52 | 0 | 0 | 112 | Y118 Y122 F125 S155 L156 M162 L163 | Y118-M159 HydrophobicContact CD2-CG 4.37Å; Y118-M159 HydrophobicContact CE2-CB 4.1Å; Y118-M159 HydrophobicContact CE2-CG 4.09Å; Y122-M159 HydrophobicContact CD2-CE 3.49Å; Y122-M159 VanDerWaalsContact CD2-CE 3.49Å; Y122-M159 HydrophobicContact CD2-SD 4.09Å; Y122-M159 HydrophobicContact CE2-CE 3.91Å; Y122-M159 HydrophobicContact CG-CE 4.44Å; F125-M159 HydrophobicContact CB-SD 3.79Å; F125-M159 HydrophobicContact CD1-CE 4.43Å; F125-M159 HydrophobicContact CD1-SD 4.37Å; F125-M159 HydrophobicContact CG-SD 4.05Å; S155-M159 WeakPolarHBondContact O-CG 3.5Å; S155-M159 PolarHBondContact O-N 3.12Å; L156-M159 HydrophobicContact CD1-CE 4.4Å; L156-M159 PolarHBondContact O-N 2.94Å; M159-M162 PolarHBondContact O-N 3.46Å; M159-L163 WeakPolarHBondContact O-CB 3.4Å; M159-L163 PolarHBondContact O-N 3.36Å |
| 160 | T | 96.3 | Very high | 95 | Very high | 3 Ų | 3 | 36.4 Ų | 36.4 | 2% | 0.018 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -66.7 | -42.4 | 179.9 | -55.1 | 0 | 0 | 0 | 0 | 111.6 | T94 V98 L156 S157 Y158 L163 S164 I278 F281 | T94-T160 HydrophobicContact CG2-CG2 4.25Å; V98-T160 HydrophobicContact CG2-CG2 3.99Å; L156-T160 VanDerWaalsContact O-CB 3.3Å; L156-T160 WeakPolarHBondContact O-CB 3.26Å; L156-T160 PolarHBondContact O-N 3.13Å; L156-T160 PolarHBondContact O-OG1 3.34Å; S157-T160 PolarHBondContact O-N 2.95Å; Y158-T160 VanDerWaalsContact C-N 3.33Å; Y158-T160 PolarHBondContact O-N 2.89Å; T160-L163 PolarHBondContact O-N 3.48Å; T160-S164 WeakPolarHBondContact O-CB 3.04Å; T160-S164 PolarHBondContact O-N 2.91Å; T160-I278 HydrophobicContact CG2-CG2 4.13Å; T160-I278 WeakPolarHBondContact OG1-CG2 3.22Å; T160-F281 HydrophobicContact CG2-CD1 3.59Å; T160-F281 HydrophobicContact CG2-CE1 3.55Å |
| 161 | G | 95.4 | Very high | 94.9 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -60.7 | -46.9 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | F101 S157 Y158 L163 S164 S165 | F101-G161 VanDerWaalsContact CD2-C 3.44Å; S157-G161 PolarHBondContact O-N 2.65Å; Y158-G161 PolarHBondContact O-N 2.85Å; G161-L163 PolarHBondContact O-N 3.07Å; G161-S164 WeakPolarHBondContact CA-OG 3.35Å; G161-S164 PolarHBondContact O-N 3.47Å; G161-S164 PolarHBondContact O-OG 3.48Å; G161-S165 PolarHBondContact O-N 3.4Å |
| 162 | M | 93.9 | Very high | 94.8 | Very high | 3 Ų | 3 | 31.4 Ų | 31.4 | 2% | 0.015 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -60.7 | -45.6 | 178.9 | -177 | 61.4 | -175 | 0 | 0 | 111 | I111 Q112 Y118 Y158 M159 S164 S165 Y166 | I111-M162 HydrophobicContact CB-SD 3.73Å; I111-M162 HydrophobicContact CD1-SD 3.67Å; I111-M162 HydrophobicContact CG1-SD 3.57Å; I111-M162 VanDerWaalsContact CG1-SD 3.57Å; I111-M162 WeakPolarHBondContact O-CE 3.11Å; Q112-M162 HydrophobicContact CG-CE 4.13Å; Y118-M162 HydrophobicContact CD2-CB 3.86Å; Y118-M162 HydrophobicContact CD2-CG 3.63Å; Y118-M162 HydrophobicContact CE2-CB 4.36Å; Y118-M162 HydrophobicContact CE2-CG 4.31Å; Y118-M162 HydrophobicContact CG-CG 4.18Å; Y158-M162 VanDerWaalsContact O-CB 3.31Å; Y158-M162 WeakPolarHBondContact O-CB 3.5Å; Y158-M162 PolarHBondContact O-N 3.47Å; M159-M162 PolarHBondContact O-N 3.46Å; M162-S164 PolarHBondContact O-N 3.2Å; M162-S165 VanDerWaalsContact O-CB 3.3Å; M162-S165 WeakPolarHBondContact O-CB 3.41Å; M162-S165 PolarHBondContact O-N 3.17Å; M162-S165 PolarHBondContact O-OG 2.71Å; M162-Y166 HydrophobicContact CE-CE2 3.66Å; M162-Y166 WeakPolarHBondContact CE-OH 3.34Å; M162-Y166 HydrophobicContact CG-CE2 4.41Å; M162-Y166 VanDerWaalsContact O-CD2 3.3Å; M162-Y166 WeakPolarHBondContact O-CD2 3.5Å; M162-Y166 HydrophobicContact SD-CE2 4.44Å |
| 163 | L | 92.6 | Very high | 94.7 | Very high | 55 Ų | 55 | 35 Ų | 35 | 29% | 0.288 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -58.4 | -47.4 | 173.5 | -179.2 | 62.6 | 0 | 0 | 0 | 111.6 | M159 T160 G161 S165 Y166 Y167 | M159-L163 WeakPolarHBondContact O-CB 3.4Å; M159-L163 PolarHBondContact O-N 3.36Å; T160-L163 PolarHBondContact O-N 3.48Å; G161-L163 PolarHBondContact O-N 3.07Å; L163-S165 PolarHBondContact O-N 3.1Å; L163-Y166 PolarHBondContact O-N 2.99Å; L163-Y167 HydrophobicContact CD1-CE2 4.04Å; L163-Y167 HydrophobicContact CG-CE2 4.21Å; L163-Y167 WeakPolarHBondContact O-CD2 3.16Å |
| 164 | S | 93.9 | Very high | 94.6 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -61.3 | -26.3 | 178.6 | 75.2 | 0 | 0 | 0 | 0 | 113.5 | T160 G161 M162 Y166 Y167 V172 | T160-S164 WeakPolarHBondContact O-CB 3.04Å; T160-S164 PolarHBondContact O-N 2.91Å; G161-S164 WeakPolarHBondContact CA-OG 3.35Å; G161-S164 PolarHBondContact O-N 3.47Å; G161-S164 PolarHBondContact O-OG 3.48Å; M162-S164 PolarHBondContact O-N 3.2Å; S164-Y166 VanDerWaalsContact C-N 3.26Å; S164-Y166 PolarHBondContact O-N 3.34Å; S164-Y167 PolarHBondContact O-N 2.59Å; S164-V172 WeakPolarHBondContact O-CG2 3.48Å |
| 165 | S | 93.6 | Very high | 94.5 | Very high | 3 Ų | 3 | 35.5 Ų | 35.5 | 2% | 0.021 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.6 | -25.5 | -177.8 | 84.1 | 0 | 0 | 0 | 0 | 114.1 | Q112 G161 M162 L163 | Q112-S165 PolarHBondContact NE2-O 3.4Å; Q112-S165 PolarHBondContact NE2-OG 2.96Å; G161-S165 PolarHBondContact O-N 3.4Å; M162-S165 VanDerWaalsContact O-CB 3.3Å; M162-S165 WeakPolarHBondContact O-CB 3.41Å; M162-S165 PolarHBondContact O-N 3.17Å; M162-S165 PolarHBondContact O-OG 2.71Å; L163-S165 PolarHBondContact O-N 3.1Å |
| 166 | Y | 91.3 | Very high | 94.4 | Very high | 112 Ų | 112 | 37.4 Ų | 37.4 | 44% | 0.439 | 18% | 0.18 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -81.4 | -17.4 | 178.1 | -68.3 | -75 | 0 | 0 | 0 | 113.3 | Q112 M162 L163 S164 R292 | Q112-Y166 HydrophobicContact CG-CE1 4.12Å; M162-Y166 HydrophobicContact CE-CE2 3.66Å; M162-Y166 WeakPolarHBondContact CE-OH 3.34Å; M162-Y166 HydrophobicContact CG-CE2 4.41Å; M162-Y166 VanDerWaalsContact O-CD2 3.3Å; M162-Y166 WeakPolarHBondContact O-CD2 3.5Å; M162-Y166 HydrophobicContact SD-CE2 4.44Å; L163-Y166 PolarHBondContact O-N 2.99Å; S164-Y166 VanDerWaalsContact C-N 3.26Å; S164-Y166 PolarHBondContact O-N 3.34Å; Y166-R292 PolarHBondContact O-N 2.71Å; Y166-R292 VanDerWaalsContact O-N 3.12Å |
| 167 | Y | 92.6 | Very high | 94.3 | Very high | 32 Ų | 32 | 38.9 Ų | 38.9 | 13% | 0.125 | 20% | 0.196 | C | C | . | . | B | Isolated β-bridge | trans | -94.1 | 155.9 | 178.8 | -66.8 | -75.6 | 0 | 0 | 0 | 111.7 | L163 S164 T169 L285 G289 | L163-Y167 HydrophobicContact CD1-CE2 4.04Å; L163-Y167 HydrophobicContact CG-CE2 4.21Å; L163-Y167 WeakPolarHBondContact O-CD2 3.16Å; S164-Y167 PolarHBondContact O-N 2.59Å; Y167-T169 PolarHBondContact O-N 3.46Å; Y167-L285 HydrophobicContact CD2-CB 4.27Å; Y167-L285 HydrophobicContact CD2-CD1 4.2Å; Y167-L285 HydrophobicContact CD2-CD2 4.28Å; Y167-L285 HydrophobicContact CE2-CB 4.05Å; Y167-L285 HydrophobicContact CE2-CD1 4.42Å; Y167-L285 HydrophobicContact CG-CD2 4.45Å; Y167-G289 VanDerWaalsContact CD1-CA 3.42Å |
| 168 | N | 92.4 | Very high | 94.3 | Very high | 42 Ų | 42 | 40.8 Ų | 40.8 | 23% | 0.225 | 21% | 0.206 | C | C | . | . | trans | -64.2 | 132.5 | 173.5 | -84.9 | -67.2 | 0 | 0 | 0 | 112.1 | K170 S171 V172 T290 E291 | N168-K170 PolarHBondContact O-N 2.69Å; N168-S171 WeakPolarHBondContact O-CA 3.38Å; N168-S171 WeakPolarHBondContact O-CB 3.21Å; N168-S171 PolarHBondContact O-N 3.48Å; N168-V172 PolarHBondContact O-N 3.38Å; N168-T290 PolarHBondContact N-O 3Å; N168-T290 PolarHBondContact ND2-O 2.87Å; N168-E291 PolarHBondContact ND2-O 3.12Å; N168-E291 VanDerWaalsContact ND2-O 3.09Å | ||
| 169 | T | 93.1 | Very high | 94.2 | Very high | 34 Ų | 34 | 39 Ų | 39 | 21% | 0.209 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -47 | -38.9 | 178.1 | -56.4 | 0 | 0 | 0 | 0 | 113.6 | T102 F103 Y167 V172 V173 | T102-T169 HydrophobicContact CG2-CG2 3.59Å; F103-T169 HydrophobicContact CD1-CG2 3.95Å; F103-T169 HydrophobicContact CE1-CG2 3.43Å; F103-T169 VanDerWaalsContact CE1-CG2 3.43Å; F103-T169 HydrophobicContact CZ-CG2 4.11Å; Y167-T169 PolarHBondContact O-N 3.46Å; T169-V172 PolarHBondContact O-N 3.1Å; T169-V173 WeakPolarHBondContact O-CG2 3.46Å; T169-V173 PolarHBondContact O-N 3.04Å |
| 170 | K | 92.8 | Very high | 94.2 | Very high | 187 Ų | 187 | 40.5 Ų | 40.5 | 81% | 0.813 | 22% | 0.215 | S | C | * | . | H | α-helix | trans | -62 | -46 | 176.8 | -62.7 | -178.3 | -177.7 | 177.8 | 0 | 111.8 | N168 M174 | N168-K170 PolarHBondContact O-N 2.69Å; K170-M174 WeakPolarHBondContact O-CB 3.44Å; K170-M174 PolarHBondContact O-N 3.04Å; K170-M174 VanDerWaalsContact O-N 3.09Å |
| 171 | S | 93.1 | Very high | 94.2 | Very high | 13 Ų | 13 | 46.1 Ų | 46.1 | 9% | 0.091 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.1 | -40.6 | 176 | -54.1 | 0 | 0 | 0 | 0 | 111.7 | N168 M174 C175 F288 T290 | N168-S171 WeakPolarHBondContact O-CA 3.38Å; N168-S171 WeakPolarHBondContact O-CB 3.21Å; N168-S171 PolarHBondContact O-N 3.48Å; S171-M174 PolarHBondContact O-N 2.98Å; S171-C175 WeakPolarHBondContact O-CB 3.3Å; S171-C175 PolarHBondContact O-N 2.85Å; S171-C175 PolarHBondContact O-SG 3.34Å; S171-F288 WeakPolarHBondContact CB-O 3.38Å; S171-F288 PolarHBondContact OG-O 2.86Å; S171-T290 PolarHBondContact OG-N 3.25Å |
| 172 | V | 95.3 | Very high | 94.3 | Very high | 1 Ų | 1 | 47.9 Ų | 47.9 | 1% | 0.006 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -59.3 | -49.5 | 177.5 | 176.4 | 0 | 0 | 0 | 0 | 111.2 | V98 T102 S164 N168 T169 M174 C175 L176 F281 L285 | V98-V172 HydrophobicContact CG1-CG1 4.05Å; T102-V172 HydrophobicContact CG2-CB 4.42Å; T102-V172 HydrophobicContact CG2-CG1 4.36Å; S164-V172 WeakPolarHBondContact O-CG2 3.48Å; N168-V172 PolarHBondContact O-N 3.38Å; T169-V172 PolarHBondContact O-N 3.1Å; V172-M174 PolarHBondContact O-N 2.8Å; V172-C175 PolarHBondContact O-N 3.21Å; V172-L176 HydrophobicContact CG1-CD1 4.3Å; V172-L176 WeakPolarHBondContact O-CG 3.43Å; V172-L176 PolarHBondContact O-N 3.48Å; V172-F281 HydrophobicContact CG1-CZ 4.28Å; V172-L285 HydrophobicContact CB-CD2 4.38Å; V172-L285 HydrophobicContact CG2-CD2 3.97Å |
| 173 | V | 94.6 | Very high | 94.3 | Very high | 74 Ų | 74 | 48.3 Ų | 48.3 | 45% | 0.448 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -64 | -39.2 | 178.2 | 174.2 | 0 | 0 | 0 | 0 | 111.7 | F103 T169 L176 G177 | F103-V173 HydrophobicContact CZ-CG2 4.01Å; T169-V173 WeakPolarHBondContact O-CG2 3.46Å; T169-V173 PolarHBondContact O-N 3.04Å; V173-L176 PolarHBondContact O-N 2.84Å; V173-G177 PolarHBondContact O-N 2.94Å; V173-G177 VanDerWaalsContact O-N 3.11Å |
| 174 | M | 94.9 | Very high | 94.4 | Very high | 113 Ų | 113 | 51 Ų | 51 | 56% | 0.557 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -60.3 | -47.7 | 173 | -177.3 | -169 | -73.5 | 0 | 0 | 111.6 | K170 S171 V172 L176 G177 I178 | K170-M174 WeakPolarHBondContact O-CB 3.44Å; K170-M174 PolarHBondContact O-N 3.04Å; K170-M174 VanDerWaalsContact O-N 3.09Å; S171-M174 PolarHBondContact O-N 2.98Å; V172-M174 PolarHBondContact O-N 2.8Å; M174-L176 PolarHBondContact O-N 2.85Å; M174-G177 PolarHBondContact O-N 3.28Å; M174-G177 VanDerWaalsContact O-N 3.16Å; M174-I178 HydrophobicContact CG-CD1 3.87Å; M174-I178 HydrophobicContact CG-CG1 4.47Å; M174-I178 WeakPolarHBondContact O-CG1 3.35Å; M174-I178 PolarHBondContact O-N 3.29Å; M174-I178 HydrophobicContact SD-CD1 4.35Å |
| 175 | C | 95.2 | Very high | 94.4 | Very high | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -65.2 | -37.6 | -179.1 | -65.4 | 0 | 0 | 0 | 0 | 112.3 | S171 V172 G177 I178 T179 F281 F284 L285 | S171-C175 WeakPolarHBondContact O-CB 3.3Å; S171-C175 PolarHBondContact O-N 2.85Å; S171-C175 PolarHBondContact O-SG 3.34Å; V172-C175 PolarHBondContact O-N 3.21Å; C175-G177 VanDerWaalsContact C-N 3.34Å; C175-I178 PolarHBondContact O-N 2.94Å; C175-T179 WeakPolarHBondContact O-CB 3.45Å; C175-T179 PolarHBondContact O-N 3.24Å; C175-T179 PolarHBondContact O-OG1 3.2Å; C175-F281 HydrophobicContact CB-CD2 4.19Å; C175-F281 HydrophobicContact CB-CE2 3.92Å; C175-F284 HydrophobicContact CB-CB 4.24Å; C175-F284 PolarHBondContact SG-O 3.44Å; C175-F284 VanDerWaalsContact SG-O 3.35Å; C175-L285 HydrophobicContact CB-CD2 3.9Å; C175-L285 HydrophobicContact CB-CG 4.33Å |
| 176 | L | 95 | Very high | 94.5 | Very high | 47 Ų | 47 | 55.9 Ų | 55.9 | 25% | 0.246 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.3 | -45.3 | 171.5 | -73.8 | 170.5 | 0 | 0 | 0 | 111.1 | L95 V98 V172 V173 M174 T179 A180 F281 | L95-L176 HydrophobicContact CD1-CD1 3.82Å; L95-L176 HydrophobicContact CD1-CD2 4.25Å; V98-L176 HydrophobicContact CG1-CD1 4.24Å; V172-L176 HydrophobicContact CG1-CD1 4.3Å; V172-L176 WeakPolarHBondContact O-CG 3.43Å; V172-L176 PolarHBondContact O-N 3.48Å; V173-L176 PolarHBondContact O-N 2.84Å; M174-L176 PolarHBondContact O-N 2.85Å; L176-T179 PolarHBondContact O-N 2.91Å; L176-A180 WeakPolarHBondContact O-CB 3.48Å; L176-A180 PolarHBondContact O-N 3.09Å; L176-F281 HydrophobicContact CB-CE2 4.43Å; L176-F281 HydrophobicContact CD2-CD2 3.85Å; L176-F281 HydrophobicContact CD2-CE1 4.49Å; L176-F281 HydrophobicContact CD2-CE2 3.49Å; L176-F281 VanDerWaalsContact CD2-CE2 3.49Å; L176-F281 HydrophobicContact CD2-CG 4.49Å; L176-F281 HydrophobicContact CD2-CZ 3.83Å; L176-F281 HydrophobicContact CG-CD2 4.27Å; L176-F281 HydrophobicContact CG-CE2 3.58Å; L176-F281 HydrophobicContact CG-CZ 4.08Å |
| 177 | G | 95.4 | Very high | 94.5 | Very high | 34 Ų | 34 | 51.6 Ų | 51.6 | 35% | 0.351 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | V173 M174 C175 A180 M181 | V173-G177 PolarHBondContact O-N 2.94Å; V173-G177 VanDerWaalsContact O-N 3.11Å; M174-G177 PolarHBondContact O-N 3.28Å; M174-G177 VanDerWaalsContact O-N 3.16Å; C175-G177 VanDerWaalsContact C-N 3.34Å; G177-A180 PolarHBondContact O-N 3.03Å; G177-M181 WeakPolarHBondContact O-CG 3.41Å; G177-M181 PolarHBondContact O-N 2.92Å |
| 178 | I | 95.8 | Very high | 94.4 | Very high | 40 Ų | 40 | 54.7 Ų | 54.7 | 21% | 0.205 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -61.9 | -46.1 | 176.9 | -64.4 | 167.9 | 0 | 0 | 0 | 110.5 | M174 C175 A180 M181 V182 F284 F288 | M174-I178 HydrophobicContact CG-CD1 3.87Å; M174-I178 HydrophobicContact CG-CG1 4.47Å; M174-I178 WeakPolarHBondContact O-CG1 3.35Å; M174-I178 PolarHBondContact O-N 3.29Å; M174-I178 HydrophobicContact SD-CD1 4.35Å; C175-I178 PolarHBondContact O-N 2.94Å; I178-A180 PolarHBondContact O-N 3.2Å; I178-M181 HydrophobicContact CG1-CE 4.39Å; I178-M181 PolarHBondContact O-N 2.8Å; I178-V182 HydrophobicContact CG2-CG2 4.31Å; I178-V182 WeakPolarHBondContact O-CG2 3.49Å; I178-V182 PolarHBondContact O-N 3.35Å; I178-F284 HydrophobicContact CG2-CD1 4.46Å; I178-F284 HydrophobicContact CG2-CD2 3.9Å; I178-F284 HydrophobicContact CG2-CE1 4.31Å; I178-F284 HydrophobicContact CG2-CE2 3.71Å; I178-F284 HydrophobicContact CG2-CG 4.28Å; I178-F284 HydrophobicContact CG2-CZ 3.95Å; I178-F288 HydrophobicContact CD1-CD2 4.11Å; I178-F288 HydrophobicContact CD1-CE2 4.21Å |
| 179 | T | 96.3 | Very high | 94.3 | Very high | 7 Ų | 7 | 56.4 Ų | 56.4 | 4% | 0.043 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -57.2 | -49.9 | 176.5 | -53.4 | 0 | 0 | 0 | 0 | 110.8 | C175 L176 M181 V182 C183 I277 I280 F281 | C175-T179 WeakPolarHBondContact O-CB 3.45Å; C175-T179 PolarHBondContact O-N 3.24Å; C175-T179 PolarHBondContact O-OG1 3.2Å; L176-T179 PolarHBondContact O-N 2.91Å; T179-M181 VanDerWaalsContact C-N 3.34Å; T179-M181 PolarHBondContact O-N 3.38Å; T179-V182 PolarHBondContact O-N 3.45Å; T179-C183 WeakPolarHBondContact O-CB 3.4Å; T179-C183 PolarHBondContact O-N 2.98Å; T179-C183 PolarHBondContact O-SG 3.02Å; T179-I277 HydrophobicContact CG2-CG2 4.16Å; T179-I280 HydrophobicContact CG2-CB 4.44Å; T179-I280 HydrophobicContact CG2-CG2 4.03Å; T179-F281 HydrophobicContact CG2-CB 4.01Å; T179-F281 WeakPolarHBondContact OG1-CA 3.16Å |
| 180 | A | 95.6 | Very high | 94.1 | Very high | 51 Ų | 51 | 55 Ų | 55 | 42% | 0.421 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -59.1 | -44.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112 | L176 G177 I178 L184 | L176-A180 WeakPolarHBondContact O-CB 3.48Å; L176-A180 PolarHBondContact O-N 3.09Å; G177-A180 PolarHBondContact O-N 3.03Å; I178-A180 PolarHBondContact O-N 3.2Å; A180-L184 VanDerWaalsContact O-CB 3.3Å; A180-L184 WeakPolarHBondContact O-CB 3.4Å; A180-L184 WeakPolarHBondContact O-CG 3.3Å; A180-L184 PolarHBondContact O-N 3.38Å |
| 181 | M | 96.5 | Very high | 93.7 | Very high | 121 Ų | 121 | 50.5 Ų | 50.5 | 60% | 0.596 | 29% | 0.288 | S | S | * | . | H | α-helix | trans | -62.3 | -48.8 | 176.1 | -70.6 | -173.3 | -64 | 0 | 0 | 112.1 | G177 I178 T179 L184 T185 | G177-M181 WeakPolarHBondContact O-CG 3.41Å; G177-M181 PolarHBondContact O-N 2.92Å; I178-M181 HydrophobicContact CG1-CE 4.39Å; I178-M181 PolarHBondContact O-N 2.8Å; T179-M181 VanDerWaalsContact C-N 3.34Å; T179-M181 PolarHBondContact O-N 3.38Å; M181-L184 PolarHBondContact O-N 2.71Å; M181-T185 WeakPolarHBondContact O-CB 3.21Å; M181-T185 PolarHBondContact O-N 2.95Å; M181-T185 PolarHBondContact O-OG1 2.87Å |
| 182 | V | 96.2 | Very high | 93.3 | Very high | 37 Ų | 37 | 57.1 Ų | 57.1 | 22% | 0.224 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -60.4 | -49.4 | 179 | 170.2 | 0 | 0 | 0 | 0 | 110.8 | I178 T179 L184 T185 V186 T243 F284 | I178-V182 HydrophobicContact CG2-CG2 4.31Å; I178-V182 WeakPolarHBondContact O-CG2 3.49Å; I178-V182 PolarHBondContact O-N 3.35Å; T179-V182 PolarHBondContact O-N 3.45Å; V182-L184 PolarHBondContact O-N 3.46Å; V182-T185 PolarHBondContact O-N 3.18Å; V182-V186 HydrophobicContact CG1-CG2 4.13Å; V182-V186 WeakPolarHBondContact O-CB 3.41Å; V182-V186 WeakPolarHBondContact O-CG2 3.42Å; V182-V186 PolarHBondContact O-N 3.44Å; V182-T243 HydrophobicContact CG1-CG2 3.92Å; V182-F284 HydrophobicContact CB-CE2 4.35Å; V182-F284 HydrophobicContact CG2-CE2 4.03Å; V182-F284 HydrophobicContact CG2-CZ 4.01Å |
| 183 | C | 95.1 | Very high | 92.6 | Very high | 11 Ų | 11 | 59.3 Ų | 59.3 | 7% | 0.074 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -63.4 | -40.2 | -179 | -64.1 | 0 | 0 | 0 | 0 | 112.3 | T179 T187 L246 I277 | T179-C183 WeakPolarHBondContact O-CB 3.4Å; T179-C183 PolarHBondContact O-N 2.98Å; T179-C183 PolarHBondContact O-SG 3.02Å; C183-T187 WeakPolarHBondContact O-CB 3.38Å; C183-T187 PolarHBondContact O-N 3.33Å; C183-T187 PolarHBondContact O-OG1 2.83Å; C183-L246 HydrophobicContact CB-CD2 3.84Å; C183-I277 HydrophobicContact CB-CG1 4.41Å |
| 184 | L | 94.3 | Very high | 91.5 | Very high | 111 Ų | 111 | 65.6 Ų | 65.6 | 58% | 0.581 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -64.5 | -47.7 | 173.7 | -73.7 | 172.1 | 0 | 0 | 0 | 111.8 | A180 M181 V182 V186 T187 L188 | A180-L184 VanDerWaalsContact O-CB 3.3Å; A180-L184 WeakPolarHBondContact O-CB 3.4Å; A180-L184 WeakPolarHBondContact O-CG 3.3Å; A180-L184 PolarHBondContact O-N 3.38Å; M181-L184 PolarHBondContact O-N 2.71Å; V182-L184 PolarHBondContact O-N 3.46Å; L184-V186 PolarHBondContact O-N 2.87Å; L184-T187 PolarHBondContact O-N 3.4Å; L184-L188 WeakPolarHBondContact O-CB 3.22Å; L184-L188 VanDerWaalsContact O-CG 3.28Å; L184-L188 WeakPolarHBondContact O-CG 3.28Å; L184-L188 PolarHBondContact O-N 3.04Å |
| 185 | T | 94.6 | Very high | 90.4 | Very high | 86 Ų | 86 | 66.5 Ų | 66.5 | 53% | 0.528 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -59.5 | -47.6 | 178.1 | -62.2 | 0 | 0 | 0 | 0 | 111.3 | M181 V182 T187 L188 V189 | M181-T185 WeakPolarHBondContact O-CB 3.21Å; M181-T185 PolarHBondContact O-N 2.95Å; M181-T185 PolarHBondContact O-OG1 2.87Å; V182-T185 PolarHBondContact O-N 3.18Å; T185-T187 PolarHBondContact O-N 3.1Å; T185-L188 PolarHBondContact O-N 3.48Å; T185-V189 HydrophobicContact CG2-CG2 4.32Å; T185-V189 WeakPolarHBondContact O-CB 3.49Å; T185-V189 VanDerWaalsContact O-CG2 3.25Å; T185-V189 WeakPolarHBondContact O-CG2 3.29Å; T185-V189 PolarHBondContact O-N 2.84Å |
| 186 | V | 93.7 | Very high | 89.3 | Confident | 21 Ų | 21 | 68 Ų | 68 | 13% | 0.127 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -64.4 | -40.5 | 179.9 | 172.4 | 0 | 0 | 0 | 0 | 111.5 | V182 L184 S190 T243 L246 A247 | V182-V186 HydrophobicContact CG1-CG2 4.13Å; V182-V186 WeakPolarHBondContact O-CB 3.41Å; V182-V186 WeakPolarHBondContact O-CG2 3.42Å; V182-V186 PolarHBondContact O-N 3.44Å; L184-V186 PolarHBondContact O-N 2.87Å; V186-S190 WeakPolarHBondContact O-CB 3.24Å; V186-S190 PolarHBondContact O-N 3.26Å; V186-S190 PolarHBondContact O-OG 3.43Å; V186-T243 HydrophobicContact CG2-CG2 3.53Å; V186-L246 HydrophobicContact CB-CD2 4.22Å; V186-L246 HydrophobicContact CG1-CB 4.24Å; V186-L246 HydrophobicContact CG1-CD2 4.07Å; V186-L246 HydrophobicContact CG1-CG 4.01Å; V186-A247 HydrophobicContact CG1-CB 3.78Å |
| 187 | T | 91.8 | Very high | 88.3 | Confident | 22 Ų | 22 | 67.1 Ų | 67.1 | 14% | 0.135 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -62.9 | -49.6 | 175.5 | -64.9 | 0 | 0 | 0 | 0 | 110.9 | Y84 C183 L184 T185 S190 F191 | Y84-T187 HydrophobicContact CE1-CG2 4.38Å; C183-T187 WeakPolarHBondContact O-CB 3.38Å; C183-T187 PolarHBondContact O-N 3.33Å; C183-T187 PolarHBondContact O-OG1 2.83Å; L184-T187 PolarHBondContact O-N 3.4Å; T185-T187 PolarHBondContact O-N 3.1Å; T187-S190 PolarHBondContact O-N 3.01Å; T187-F191 HydrophobicContact CG2-CD2 3.83Å; T187-F191 HydrophobicContact CG2-CE2 3.32Å; T187-F191 HydrophobicContact CG2-CZ 4.2Å; T187-F191 WeakPolarHBondContact O-CD2 3.39Å; T187-F191 PolarHBondContact O-N 3.33Å |
| 188 | L | 91.4 | Very high | 87.3 | Confident | 97 Ų | 97 | 65.6 Ų | 65.6 | 51% | 0.508 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -64.3 | -40.4 | 178.5 | -71.4 | 173 | 0 | 0 | 0 | 113 | L184 T185 F191 Q192 | L184-L188 WeakPolarHBondContact O-CB 3.22Å; L184-L188 VanDerWaalsContact O-CG 3.28Å; L184-L188 WeakPolarHBondContact O-CG 3.28Å; L184-L188 PolarHBondContact O-N 3.04Å; T185-L188 PolarHBondContact O-N 3.48Å; L188-F191 PolarHBondContact O-N 3.45Å; L188-Q192 WeakPolarHBondContact O-CG 3.39Å; L188-Q192 PolarHBondContact O-N 2.87Å; L188-Q192 PolarHBondContact O-NE2 3.28Å |
| 189 | V | 90.4 | Very high | 86.5 | Confident | 78 Ų | 78 | 68 Ų | 68 | 47% | 0.473 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -66.4 | -40.6 | 174.7 | 168.2 | 0 | 0 | 0 | 0 | 110.2 | T185 F191 Q192 T193 | T185-V189 HydrophobicContact CG2-CG2 4.32Å; T185-V189 WeakPolarHBondContact O-CB 3.49Å; T185-V189 VanDerWaalsContact O-CG2 3.25Å; T185-V189 WeakPolarHBondContact O-CG2 3.29Å; T185-V189 PolarHBondContact O-N 2.84Å; V189-F191 VanDerWaalsContact C-N 3.34Å; V189-F191 PolarHBondContact O-N 2.89Å; V189-Q192 PolarHBondContact O-N 2.93Å; V189-T193 WeakPolarHBondContact O-CB 3.47Å; V189-T193 VanDerWaalsContact O-CG2 3.27Å; V189-T193 WeakPolarHBondContact O-CG2 3.47Å; V189-T193 PolarHBondContact O-N 3.49Å |
| 190 | S | 88.3 | Confident | 85.7 | Confident | 3 Ų | 3 | 69.9 Ų | 69.9 | 2% | 0.021 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.9 | -41.4 | 176.3 | -65.2 | 0 | 0 | 0 | 0 | 111.8 | V186 T187 Q192 M254 | V186-S190 WeakPolarHBondContact O-CB 3.24Å; V186-S190 PolarHBondContact O-N 3.26Å; V186-S190 PolarHBondContact O-OG 3.43Å; T187-S190 PolarHBondContact O-N 3.01Å; S190-Q192 VanDerWaalsContact C-N 3.29Å; S190-Q192 PolarHBondContact O-N 3.29Å; S190-M254 WeakPolarHBondContact O-CE 3.47Å |
| 191 | F | 83.4 | Confident | 85.2 | Confident | 94 Ų | 94 | 72.1 Ų | 72.1 | 41% | 0.412 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.9 | -32.1 | 174.8 | -74.6 | -55.3 | 0 | 0 | 0 | 113.7 | Y84 T187 L188 V189 M254 | Y84-F191 AromaticContact CE2-CZ 3.86Å; Y84-F191 HydrophobicContact CE2-CZ 3.86Å; T187-F191 HydrophobicContact CG2-CD2 3.83Å; T187-F191 HydrophobicContact CG2-CE2 3.32Å; T187-F191 HydrophobicContact CG2-CZ 4.2Å; T187-F191 WeakPolarHBondContact O-CD2 3.39Å; T187-F191 PolarHBondContact O-N 3.33Å; L188-F191 PolarHBondContact O-N 3.45Å; V189-F191 VanDerWaalsContact C-N 3.34Å; V189-F191 PolarHBondContact O-N 2.89Å; F191-M254 HydrophobicContact CB-SD 4.47Å; F191-M254 HydrophobicContact CD1-CE 3.9Å; F191-M254 HydrophobicContact CD1-CG 3.86Å; F191-M254 HydrophobicContact CD1-SD 3.3Å; F191-M254 WeakPolarHBondContact CD1-SD 3.49Å; F191-M254 HydrophobicContact CE1-CE 4.29Å; F191-M254 HydrophobicContact CE1-CG 3.72Å; F191-M254 HydrophobicContact CE1-SD 3.82Å; F191-M254 HydrophobicContact CG-CE 4.43Å; F191-M254 HydrophobicContact CG-SD 4.21Å |
| 192 | Q | 86.3 | Confident | 84.7 | Confident | 151 Ų | 151 | 68.8 Ų | 68.8 | 71% | 0.706 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -96.7 | -26.2 | -175 | -69.9 | 173.3 | 75.2 | 0 | 0 | 113.9 | L188 V189 S190 K194 | L188-Q192 WeakPolarHBondContact O-CG 3.39Å; L188-Q192 PolarHBondContact O-N 2.87Å; L188-Q192 PolarHBondContact O-NE2 3.28Å; V189-Q192 PolarHBondContact O-N 2.93Å; S190-Q192 VanDerWaalsContact C-N 3.29Å; S190-Q192 PolarHBondContact O-N 3.29Å; Q192-K194 PolarHBondContact O-N 3.43Å |
| 193 | T | 80.9 | Confident | 84.4 | Confident | 47 Ų | 47 | 71.9 Ų | 71.9 | 29% | 0.288 | 39% | 0.392 | S | S | . | . | trans | -78.3 | 127 | -168.6 | -165.9 | 0 | 0 | 0 | 0 | 112.9 | V189 F195 K257 | V189-T193 WeakPolarHBondContact O-CB 3.47Å; V189-T193 VanDerWaalsContact O-CG2 3.27Å; V189-T193 WeakPolarHBondContact O-CG2 3.47Å; V189-T193 PolarHBondContact O-N 3.49Å; T193-F195 VanDerWaalsContact C-N 3.27Å; T193-F195 PolarHBondContact OG1-N 3.48Å; T193-K257 PolarHBondContact O-NZ 3.08Å | ||
| 194 | K | 70.5 | Confident | 84.1 | Confident | 207 Ų | 207 | 71.6 Ų | 71.6 | 90% | 0.9 | 39% | 0.39 | S | S | * | . | trans | -73.6 | -21.4 | 171 | -61.5 | -178 | -177.8 | 178.8 | 0 | 111.9 | Q192 | Q192-K194 PolarHBondContact O-N 3.43Š| ||
| 195 | F | 70.8 | Confident | 84 | Confident | 132 Ų | 132 | 72.3 Ų | 72.3 | 58% | 0.579 | 39% | 0.388 | S | S | * | . | S | Bend | trans | -67.2 | 132.6 | -179.5 | -176.4 | -93.3 | 0 | 0 | 0 | 111.2 | T193 V197 Q251 K257 | T193-F195 VanDerWaalsContact C-N 3.27Å; T193-F195 PolarHBondContact OG1-N 3.48Å; F195-V197 HydrophobicContact CD1-CG2 4.04Å; F195-V197 HydrophobicContact CE1-CG2 4.34Å; F195-V197 PolarHBondContact O-N 3.08Å; F195-Q251 PolarHBondContact O-OE1 2.92Å; F195-K257 PolarHBondContact O-NZ 3.48Å |
| 196 | D | 72.3 | Confident | 83.9 | Confident | 30 Ų | 30 | 72.3 Ų | 72.3 | 16% | 0.16 | 39% | 0.388 | C | S | . | . | trans | -89.8 | 96 | -176.5 | -171.1 | 9.3 | 0 | 0 | 0 | 112.6 | T198 S199 K257 | D196-T198 PolarHBondContact O-N 3.28Å; D196-T198 WeakPolarHBondContact OD1-CA 3.49Å; D196-T198 VanDerWaalsContact OD1-CB 3.31Å; D196-T198 WeakPolarHBondContact OD1-CB 3.33Å; D196-T198 PolarHBondContact OD1-N 3.01Å; D196-T198 PolarHBondContact OD1-OG1 3.01Å; D196-T198 PolarHBondContact OD2-OG1 3.16Å; D196-S199 WeakPolarHBondContact O-CB 3.39Å; D196-S199 PolarHBondContact O-N 3.16Å; D196-S199 PolarHBondContact OD1-N 2.95Å; D196-S199 PolarHBondContact OD2-OG 3.04Å; D196-K257 HydrophobicContact CB-CD 3.75Å; D196-K257 VanDerWaalsContact CG-CD 3.44Å; D196-K257 WeakPolarHBondContact OD1-CD 3.34Å | ||
| 197 | V | 74 | Confident | 83.9 | Confident | 29 Ų | 29 | 73.7 Ų | 73.7 | 18% | 0.176 | 39% | 0.393 | C | S | . | . | S | Bend | trans | -68.2 | -24.1 | 172.3 | -179.6 | 0 | 0 | 0 | 0 | 111.1 | F195 S199 C200 A247 F248 Q251 | F195-V197 HydrophobicContact CD1-CG2 4.04Å; F195-V197 HydrophobicContact CE1-CG2 4.34Å; F195-V197 PolarHBondContact O-N 3.08Å; V197-S199 VanDerWaalsContact C-N 3.27Å; V197-S199 PolarHBondContact O-N 3.38Å; V197-C200 WeakPolarHBondContact O-CB 3.24Å; V197-C200 PolarHBondContact O-N 3Å; V197-A247 HydrophobicContact CG1-CB 4.41Å; V197-F248 HydrophobicContact CG1-CB 4.23Å; V197-Q251 VanDerWaalsContact N-OE1 3.11Å |
| 198 | T | 75.8 | Confident | 83.9 | Confident | 3 Ų | 3 | 74.7 Ų | 74.7 | 2% | 0.018 | 40% | 0.4 | C | S | . | . | G | 310 helix | trans | -68.6 | -28 | 178.1 | 75.9 | 0 | 0 | 0 | 0 | 112.6 | D196 C200 Q201 F248 Q251 | D196-T198 PolarHBondContact O-N 3.28Å; D196-T198 WeakPolarHBondContact OD1-CA 3.49Å; D196-T198 VanDerWaalsContact OD1-CB 3.31Å; D196-T198 WeakPolarHBondContact OD1-CB 3.33Å; D196-T198 PolarHBondContact OD1-N 3.01Å; D196-T198 PolarHBondContact OD1-OG1 3.01Å; D196-T198 PolarHBondContact OD2-OG1 3.16Å; T198-C200 PolarHBondContact O-N 3.38Å; T198-Q201 PolarHBondContact O-N 2.89Å; T198-F248 HydrophobicContact CG2-CD2 4.2Å; T198-F248 HydrophobicContact CG2-CE2 4.22Å; T198-Q251 HydrophobicContact CG2-CB 3.89Å |
| 199 | S | 77.4 | Confident | 84 | Confident | 89 Ų | 89 | 73.6 Ų | 73.6 | 62% | 0.622 | 39% | 0.393 | S | S | * | . | G | 310 helix | trans | -63.4 | -17.6 | 170.7 | -73.4 | 0 | 0 | 0 | 0 | 113.5 | D196 V197 | D196-S199 WeakPolarHBondContact O-CB 3.39Å; D196-S199 PolarHBondContact O-N 3.16Å; D196-S199 PolarHBondContact OD1-N 2.95Å; D196-S199 PolarHBondContact OD2-OG 3.04Å; V197-S199 VanDerWaalsContact C-N 3.27Å; V197-S199 PolarHBondContact O-N 3.38Å |
| 200 | C | 79.8 | Confident | 84.2 | Confident | 47 Ų | 47 | 74 Ų | 74 | 32% | 0.318 | 40% | 0.395 | S | S | . | . | G | 310 helix | trans | -93.4 | 13.1 | 177.2 | -62.4 | 0 | 0 | 0 | 0 | 114.2 | V197 T198 G202 V203 L204 | V197-C200 WeakPolarHBondContact O-CB 3.24Å; V197-C200 PolarHBondContact O-N 3Å; T198-C200 PolarHBondContact O-N 3.38Å; C200-G202 PolarHBondContact O-N 3.33Å; C200-G202 VanDerWaalsContact O-N 3.12Å; C200-V203 WeakPolarHBondContact O-CB 3.14Å; C200-V203 PolarHBondContact O-N 2.68Å; C200-L204 PolarHBondContact O-N 3.42Å; C200-L204 VanDerWaalsContact O-N 3.13Å |
| 201 | Q | 85 | Confident | 84.4 | Confident | 99 Ų | 99 | 74.4 Ų | 74.4 | 46% | 0.463 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -48.7 | -42 | -178.1 | -170.5 | 178.9 | -25.1 | 0 | 0 | 113.7 | T198 V203 L204 F205 F248 | T198-Q201 PolarHBondContact O-N 2.89Å; Q201-V203 VanDerWaalsContact C-N 3.34Å; Q201-V203 PolarHBondContact O-N 3.03Å; Q201-L204 PolarHBondContact O-N 3.34Å; Q201-F205 WeakPolarHBondContact O-CB 3.4Å; Q201-F205 PolarHBondContact O-N 3.38Å; Q201-F248 HydrophobicContact CB-CE2 3.79Å; Q201-F248 HydrophobicContact CB-CZ 4.28Å; Q201-F248 HydrophobicContact CG-CE2 3.94Å; Q201-F248 HydrophobicContact CG-CZ 3.93Å |
| 202 | G | 87.1 | Confident | 84.9 | Confident | 50 Ų | 50 | 75.2 Ų | 75.2 | 52% | 0.515 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62.7 | -37.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | C200 F205 T206 | C200-G202 PolarHBondContact O-N 3.33Å; C200-G202 VanDerWaalsContact O-N 3.12Å; G202-F205 PolarHBondContact O-N 3.5Å; G202-T206 PolarHBondContact O-N 2.89Å; G202-T206 PolarHBondContact O-OG1 2.9Å; G202-T206 VanDerWaalsContact O-OG1 3.12Å |
| 203 | V | 89.1 | Confident | 85.2 | Confident | 102 Ų | 102 | 72 Ų | 72 | 62% | 0.618 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -69.1 | -42.9 | 177.3 | -178.5 | 0 | 0 | 0 | 0 | 110.6 | C200 Q201 F205 T206 F207 | C200-V203 WeakPolarHBondContact O-CB 3.14Å; C200-V203 PolarHBondContact O-N 2.68Å; Q201-V203 VanDerWaalsContact C-N 3.34Å; Q201-V203 PolarHBondContact O-N 3.03Å; V203-F205 VanDerWaalsContact C-N 3.33Å; V203-F205 PolarHBondContact O-N 3.22Å; V203-T206 PolarHBondContact O-N 3.4Å; V203-F207 WeakPolarHBondContact O-CB 3.48Å; V203-F207 PolarHBondContact O-N 3.37Å |
| 204 | L | 90.1 | Very high | 85.7 | Confident | 6 Ų | 6 | 71.7 Ų | 71.7 | 3% | 0.031 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -62.7 | -40.9 | 175.9 | -62.2 | 178.8 | 0 | 0 | 0 | 111.6 | C200 Q201 F207 C208 M244 F245 F248 | C200-L204 PolarHBondContact O-N 3.42Å; C200-L204 VanDerWaalsContact O-N 3.13Å; Q201-L204 PolarHBondContact O-N 3.34Å; L204-F207 PolarHBondContact O-N 3.11Å; L204-C208 WeakPolarHBondContact O-CB 3.33Å; L204-C208 PolarHBondContact O-N 2.85Å; L204-M244 HydrophobicContact CD2-CB 3.58Å; L204-M244 HydrophobicContact CD2-CG 4.42Å; L204-M244 HydrophobicContact CD2-SD 4Å; L204-F245 HydrophobicContact CB-CE1 3.88Å; L204-F245 HydrophobicContact CB-CZ 4.08Å; L204-F245 HydrophobicContact CD1-CD1 4.34Å; L204-F245 HydrophobicContact CD1-CE1 4.43Å; L204-F248 HydrophobicContact CD1-CB 3.74Å; L204-F248 HydrophobicContact CD1-CD2 3.76Å; L204-F248 HydrophobicContact CD1-CG 3.91Å |
| 205 | F | 91.1 | Very high | 86.6 | Confident | 126 Ų | 126 | 62.6 Ų | 62.6 | 55% | 0.553 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -61.9 | -48.4 | 174.3 | 179.2 | -99.6 | 0 | 0 | 0 | 112.2 | Q201 G202 V203 C208 M209 | Q201-F205 WeakPolarHBondContact O-CB 3.4Å; Q201-F205 PolarHBondContact O-N 3.38Å; G202-F205 PolarHBondContact O-N 3.5Å; V203-F205 VanDerWaalsContact C-N 3.33Å; V203-F205 PolarHBondContact O-N 3.22Å; F205-C208 PolarHBondContact O-N 3.14Å; F205-M209 HydrophobicContact CD2-CE 4.42Å; F205-M209 HydrophobicContact CE1-CG 4.16Å; F205-M209 HydrophobicContact CE2-CE 3.59Å; F205-M209 HydrophobicContact CE2-CG 4.42Å; F205-M209 HydrophobicContact CZ-CE 3.74Å; F205-M209 HydrophobicContact CZ-CG 4.1Å; F205-M209 WeakPolarHBondContact O-CG 3.47Å; F205-M209 PolarHBondContact O-N 3.16Å |
| 206 | T | 92.3 | Very high | 87.5 | Confident | 86 Ų | 86 | 61.7 Ų | 61.7 | 53% | 0.528 | 36% | 0.359 | S | S | . | . | H | α-helix | trans | -61.8 | -44.3 | 176.8 | -60.4 | 0 | 0 | 0 | 0 | 112 | G202 V203 M209 V210 | G202-T206 PolarHBondContact O-N 2.89Å; G202-T206 PolarHBondContact O-OG1 2.9Å; G202-T206 VanDerWaalsContact O-OG1 3.12Å; V203-T206 PolarHBondContact O-N 3.4Å; T206-M209 PolarHBondContact O-N 2.94Å; T206-V210 WeakPolarHBondContact O-CG2 3.49Å; T206-V210 PolarHBondContact O-N 3.06Å |
| 207 | F | 93.2 | Very high | 88.4 | Confident | 50 Ų | 50 | 64.6 Ų | 64.6 | 22% | 0.219 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -66.4 | -38.9 | 179.2 | -173.4 | -160.1 | 0 | 0 | 0 | 111.6 | V203 L204 M209 V210 M211 L237 L241 | V203-F207 WeakPolarHBondContact O-CB 3.48Å; V203-F207 PolarHBondContact O-N 3.37Å; L204-F207 PolarHBondContact O-N 3.11Å; F207-M209 PolarHBondContact O-N 2.99Å; F207-V210 PolarHBondContact O-N 3.21Å; F207-M211 HydrophobicContact CD2-CG 3.99Å; F207-M211 HydrophobicContact CE2-CG 3.74Å; F207-M211 HydrophobicContact CE2-SD 4.02Å; F207-M211 HydrophobicContact CZ-CG 4.45Å; F207-M211 WeakPolarHBondContact O-CG 3.29Å; F207-M211 PolarHBondContact O-N 2.91Å; F207-L237 HydrophobicContact CE2-CB 4.4Å; F207-L237 HydrophobicContact CZ-CB 4.13Å; F207-L237 HydrophobicContact CZ-CD2 4.11Å; F207-L241 HydrophobicContact CB-CD1 4.16Å; F207-L241 HydrophobicContact CD1-CB 4.17Å; F207-L241 HydrophobicContact CD1-CD1 3.57Å; F207-L241 HydrophobicContact CD1-CG 4.38Å; F207-L241 HydrophobicContact CE1-CB 3.8Å; F207-L241 HydrophobicContact CE1-CD1 4.12Å; F207-L241 HydrophobicContact CG-CD1 3.97Å; F207-L241 HydrophobicContact CZ-CB 4.21Å |
| 208 | C | 92.7 | Very high | 89.1 | Confident | 42 Ų | 42 | 65.6 Ų | 65.6 | 28% | 0.284 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.2 | -43.5 | 172.1 | -174.2 | 0 | 0 | 0 | 0 | 112.5 | L204 F205 V210 M211 M212 L241 F245 | L204-C208 WeakPolarHBondContact O-CB 3.33Å; L204-C208 PolarHBondContact O-N 2.85Å; F205-C208 PolarHBondContact O-N 3.14Å; C208-V210 PolarHBondContact O-N 2.96Å; C208-M211 PolarHBondContact O-N 3.46Å; C208-M212 WeakPolarHBondContact O-CB 3.35Å; C208-M212 PolarHBondContact O-N 3.19Å; C208-L241 HydrophobicContact CB-CD2 4.16Å; C208-F245 HydrophobicContact CB-CE2 3.99Å; C208-F245 HydrophobicContact CB-CZ 3.87Å |
| 209 | M | 93.4 | Very high | 89.6 | Confident | 75 Ų | 75 | 68.3 Ų | 68.3 | 37% | 0.369 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -63.4 | -39.9 | 175.6 | -72.5 | -67.9 | 154.1 | 0 | 0 | 112.6 | F205 T206 F207 M212 V213 | F205-M209 HydrophobicContact CD2-CE 4.42Å; F205-M209 HydrophobicContact CE1-CG 4.16Å; F205-M209 HydrophobicContact CE2-CE 3.59Å; F205-M209 HydrophobicContact CE2-CG 4.42Å; F205-M209 HydrophobicContact CZ-CE 3.74Å; F205-M209 HydrophobicContact CZ-CG 4.1Å; F205-M209 WeakPolarHBondContact O-CG 3.47Å; F205-M209 PolarHBondContact O-N 3.16Å; T206-M209 PolarHBondContact O-N 2.94Å; F207-M209 PolarHBondContact O-N 2.99Å; M209-M212 HydrophobicContact CE-CE 4.45Å; M209-M212 PolarHBondContact O-N 2.84Å; M209-M212 HydrophobicContact SD-CE 3.58Å; M209-M212 VanDerWaalsContact SD-CE 3.58Å; M209-V213 WeakPolarHBondContact O-CG2 3.36Å; M209-V213 PolarHBondContact O-N 3.28Å |
| 210 | V | 94.6 | Very high | 90.1 | Very high | 85 Ų | 85 | 69.1 Ų | 69.1 | 52% | 0.515 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.6 | -43.8 | 174.2 | 171.5 | 0 | 0 | 0 | 0 | 111.2 | T206 F207 C208 S214 | T206-V210 WeakPolarHBondContact O-CG2 3.49Å; T206-V210 PolarHBondContact O-N 3.06Å; F207-V210 PolarHBondContact O-N 3.21Å; C208-V210 PolarHBondContact O-N 2.96Å; V210-S214 WeakPolarHBondContact O-CB 3.18Å; V210-S214 PolarHBondContact O-N 3.45Å; V210-S214 PolarHBondContact O-OG 3.08Å |
| 211 | M | 93.1 | Very high | 90.4 | Very high | 12 Ų | 12 | 68.8 Ų | 68.8 | 6% | 0.059 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.5 | -42.4 | 175.8 | -74.2 | -60.9 | -62.4 | 0 | 0 | 111.9 | F207 C208 S214 G215 Y234 L237 L241 | F207-M211 HydrophobicContact CD2-CG 3.99Å; F207-M211 HydrophobicContact CE2-CG 3.74Å; F207-M211 HydrophobicContact CE2-SD 4.02Å; F207-M211 HydrophobicContact CZ-CG 4.45Å; F207-M211 WeakPolarHBondContact O-CG 3.29Å; F207-M211 PolarHBondContact O-N 2.91Å; C208-M211 PolarHBondContact O-N 3.46Å; M211-S214 WeakPolarHBondContact CA-OG 3.42Å; M211-S214 PolarHBondContact O-OG 3.12Å; M211-S214 VanDerWaalsContact O-OG 3.12Å; M211-G215 PolarHBondContact O-N 2.97Å; M211-Y234 HydrophobicContact CE-CD1 4.42Å; M211-Y234 HydrophobicContact CE-CD2 3.59Å; M211-Y234 HydrophobicContact CE-CE1 4.26Å; M211-Y234 HydrophobicContact CE-CE2 3.38Å; M211-Y234 HydrophobicContact CE-CG 4.11Å; M211-Y234 WeakPolarHBondContact CE-O 3.35Å; M211-Y234 WeakPolarHBondContact O-CE2 3.42Å; M211-Y234 PolarHBondContact O-OH 3.12Å; M211-Y234 HydrophobicContact SD-CD2 4.32Å; M211-Y234 HydrophobicContact SD-CE2 4.25Å; M211-L237 HydrophobicContact CE-CB 4.1Å; M211-L237 HydrophobicContact SD-CB 3.66Å; M211-L237 HydrophobicContact SD-CD1 4.48Å; M211-L241 HydrophobicContact CB-CD2 3.96Å; M211-L241 HydrophobicContact CG-CD2 3.73Å |
| 212 | M | 92.7 | Very high | 90.2 | Very high | 112 Ų | 112 | 68.4 Ų | 68.4 | 55% | 0.552 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -62.3 | -47.7 | 177.3 | -175.2 | -174.3 | 72.7 | 0 | 0 | 112.3 | C208 M209 G215 L216 | C208-M212 WeakPolarHBondContact O-CB 3.35Å; C208-M212 PolarHBondContact O-N 3.19Å; M209-M212 HydrophobicContact CE-CE 4.45Å; M209-M212 PolarHBondContact O-N 2.84Å; M209-M212 HydrophobicContact SD-CE 3.58Å; M209-M212 VanDerWaalsContact SD-CE 3.58Å; M212-G215 PolarHBondContact O-N 3.17Å; M212-L216 PolarHBondContact O-N 2.67Å |
| 213 | V | 93.4 | Very high | 90.1 | Very high | 82 Ų | 82 | 71.2 Ų | 71.2 | 50% | 0.497 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -67.6 | -43.8 | 179.7 | 174.4 | 0 | 0 | 0 | 0 | 111.2 | M209 G215 L216 V217 | M209-V213 WeakPolarHBondContact O-CG2 3.36Å; M209-V213 PolarHBondContact O-N 3.28Å; V213-G215 VanDerWaalsContact C-N 3.34Å; V213-G215 PolarHBondContact O-N 2.92Å; V213-L216 PolarHBondContact O-N 3.32Å; V213-V217 WeakPolarHBondContact O-CG2 3.42Å; V213-V217 PolarHBondContact O-N 3.48Å |
| 214 | S | 90.8 | Very high | 89.8 | Confident | 42 Ų | 42 | 76 Ų | 76 | 29% | 0.294 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -65.2 | -37.2 | 176.3 | 54.2 | 0 | 0 | 0 | 0 | 112.3 | V210 M211 V217 L218 | V210-S214 WeakPolarHBondContact O-CB 3.18Å; V210-S214 PolarHBondContact O-N 3.45Å; V210-S214 PolarHBondContact O-OG 3.08Å; M211-S214 WeakPolarHBondContact CA-OG 3.42Å; M211-S214 PolarHBondContact O-OG 3.12Å; M211-S214 VanDerWaalsContact O-OG 3.12Å; S214-V217 PolarHBondContact O-N 3.48Å; S214-L218 WeakPolarHBondContact O-CB 3.48Å; S214-L218 VanDerWaalsContact O-CG 3.26Å; S214-L218 WeakPolarHBondContact O-CG 3.23Å; S214-L218 PolarHBondContact O-N 3.01Å |
| 215 | G | 89.5 | Confident | 89.4 | Confident | 16 Ų | 16 | 77.9 Ų | 77.9 | 17% | 0.165 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -61.6 | -41.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.1 | M211 M212 V213 L218 A219 Y234 | M211-G215 PolarHBondContact O-N 2.97Å; M212-G215 PolarHBondContact O-N 3.17Å; V213-G215 VanDerWaalsContact C-N 3.34Å; V213-G215 PolarHBondContact O-N 2.92Å; G215-L218 PolarHBondContact O-N 3.16Å; G215-A219 WeakPolarHBondContact O-CB 3.41Å; G215-A219 PolarHBondContact O-N 2.93Å; G215-Y234 WeakPolarHBondContact CA-OH 3.2Å |
| 216 | L | 90.9 | Very high | 89 | Confident | 112 Ų | 112 | 78.1 Ų | 78.1 | 59% | 0.586 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -65.4 | -44.1 | 174.9 | -178.2 | 64.8 | 0 | 0 | 0 | 112 | M212 V213 L218 A219 I220 | M212-L216 PolarHBondContact O-N 2.67Å; V213-L216 PolarHBondContact O-N 3.32Å; L216-L218 VanDerWaalsContact C-N 3.34Å; L216-A219 PolarHBondContact O-N 2.71Å; L216-I220 HydrophobicContact CD1-CD1 4.22Å; L216-I220 HydrophobicContact CG-CD1 4.14Å; L216-I220 WeakPolarHBondContact O-CG1 3.4Å; L216-I220 PolarHBondContact O-N 2.93Å; L216-I220 VanDerWaalsContact O-N 3.07Å |
| 217 | V | 90.3 | Very high | 88.6 | Confident | 91 Ų | 91 | 77.2 Ų | 77.2 | 55% | 0.552 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -61.4 | -43.6 | 175.6 | 170.9 | 0 | 0 | 0 | 0 | 110.8 | V213 S214 I220 A221 | V213-V217 WeakPolarHBondContact O-CG2 3.42Å; V213-V217 PolarHBondContact O-N 3.48Å; S214-V217 PolarHBondContact O-N 3.48Å; V217-I220 PolarHBondContact O-N 2.86Å; V217-A221 VanDerWaalsContact O-CB 3.24Å; V217-A221 WeakPolarHBondContact O-CB 3.19Å; V217-A221 PolarHBondContact O-N 3.38Å |
| 218 | L | 88.1 | Confident | 88.2 | Confident | 51 Ų | 51 | 78.8 Ų | 78.8 | 27% | 0.267 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -62.1 | -46 | 175.3 | -71.9 | 172.3 | 0 | 0 | 0 | 111.6 | S214 G215 L216 I220 A221 L222 V230 Y234 | S214-L218 WeakPolarHBondContact O-CB 3.48Å; S214-L218 VanDerWaalsContact O-CG 3.26Å; S214-L218 WeakPolarHBondContact O-CG 3.23Å; S214-L218 PolarHBondContact O-N 3.01Å; G215-L218 PolarHBondContact O-N 3.16Å; L216-L218 VanDerWaalsContact C-N 3.34Å; L218-I220 VanDerWaalsContact C-N 3.26Å; L218-I220 PolarHBondContact O-N 3.44Å; L218-A221 CarbonylContact O-C 3.59Å; L218-A221 PolarHBondContact O-N 3.49Å; L218-L222 WeakPolarHBondContact O-CG 3.17Å; L218-L222 PolarHBondContact O-N 3.3Å; L218-V230 HydrophobicContact CD1-CG1 4.3Å; L218-V230 HydrophobicContact CD2-CG1 3.59Å; L218-Y234 HydrophobicContact CD1-CD1 4.49Å; L218-Y234 HydrophobicContact CD1-CD2 3.72Å; L218-Y234 HydrophobicContact CD1-CE2 4.33Å; L218-Y234 HydrophobicContact CD1-CG 3.81Å |
| 219 | A | 86.4 | Confident | 87.8 | Confident | 59 Ų | 59 | 85.6 Ų | 85.6 | 49% | 0.488 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -57.7 | -38.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | G215 L216 | G215-A219 WeakPolarHBondContact O-CB 3.41Å; G215-A219 PolarHBondContact O-N 2.93Å; L216-A219 PolarHBondContact O-N 2.71Å |
| 220 | I | 88.3 | Confident | 87.6 | Confident | 106 Ų | 106 | 83.9 Ų | 83.9 | 54% | 0.544 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -75.9 | -31.6 | 175.4 | -63.8 | 166.4 | 0 | 0 | 0 | 111.7 | L216 V217 L218 P223 Y224 | L216-I220 HydrophobicContact CD1-CD1 4.22Å; L216-I220 HydrophobicContact CG-CD1 4.14Å; L216-I220 WeakPolarHBondContact O-CG1 3.4Å; L216-I220 PolarHBondContact O-N 2.93Å; L216-I220 VanDerWaalsContact O-N 3.07Å; V217-I220 PolarHBondContact O-N 2.86Å; L218-I220 VanDerWaalsContact C-N 3.26Å; L218-I220 PolarHBondContact O-N 3.44Å; I220-P223 WeakPolarHBondContact O-CD 3.39Å; I220-Y224 WeakPolarHBondContact O-CD2 3.31Å; I220-Y224 WeakPolarHBondContact O-CE2 3.35Å |
| 221 | A | 86.4 | Confident | 87.2 | Confident | 41 Ų | 41 | 83 Ų | 83 | 34% | 0.339 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -79.3 | -26.7 | -179.8 | 0 | 0 | 0 | 0 | 0 | 114 | V217 L218 P223 Y224 G225 | V217-A221 VanDerWaalsContact O-CB 3.24Å; V217-A221 WeakPolarHBondContact O-CB 3.19Å; V217-A221 PolarHBondContact O-N 3.38Å; L218-A221 CarbonylContact O-C 3.59Å; L218-A221 PolarHBondContact O-N 3.49Å; A221-P223 VanDerWaalsContact C-CD 3.44Å; A221-Y224 WeakPolarHBondContact O-CB 3.25Å; A221-Y224 PolarHBondContact O-N 2.98Å; A221-G225 PolarHBondContact O-N 3.37Å |
| 222 | L | 81.8 | Confident | 87 | Confident | 90 Ų | 90 | 83.7 Ų | 83.7 | 47% | 0.471 | 46% | 0.462 | S | S | . | . | G | 310 helix | trans | -48.6 | -43.9 | -177.2 | -82.8 | 173.5 | 0 | 0 | 0 | 114.7 | L218 Y224 G225 Y226 | L218-L222 WeakPolarHBondContact O-CG 3.17Å; L218-L222 PolarHBondContact O-N 3.3Å; L222-Y224 PolarHBondContact O-N 2.86Å; L222-G225 PolarHBondContact O-N 3.47Å; L222-Y226 HydrophobicContact CD2-CD2 3.7Å; L222-Y226 HydrophobicContact CD2-CE2 4.3Å |
| 223 | P | 83.4 | Confident | 86.9 | Confident | 109 Ų | 109 | 82 Ų | 82 | 71% | 0.708 | 46% | 0.457 | S | S | * | . | G | 310 helix | trans | -64.9 | -19.2 | 177.4 | -21.9 | 35 | 0 | 0 | 0 | 114.7 | I220 A221 | I220-P223 WeakPolarHBondContact O-CD 3.39Å; A221-P223 VanDerWaalsContact C-CD 3.44Å |
| 224 | Y | 83.3 | Confident | 86.9 | Confident | 204 Ų | 204 | 80.7 Ų | 80.7 | 80% | 0.8 | 44% | 0.444 | S | S | * | . | G | 310 helix | trans | -95.6 | -13 | -177.3 | -58.4 | -81.7 | 0 | 0 | 0 | 113.3 | I220 A221 L222 | I220-Y224 WeakPolarHBondContact O-CD2 3.31Å; I220-Y224 WeakPolarHBondContact O-CE2 3.35Å; A221-Y224 WeakPolarHBondContact O-CB 3.25Å; A221-Y224 PolarHBondContact O-N 2.98Å; L222-Y224 PolarHBondContact O-N 2.86Å |
| 225 | G | 81.3 | Confident | 87 | Confident | 45 Ų | 45 | 78.7 Ų | 78.7 | 46% | 0.464 | 43% | 0.43 | S | S | . | . | trans | 160.4 | 124.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | A221 L222 | A221-G225 PolarHBondContact O-N 3.37Å; L222-G225 PolarHBondContact O-N 3.47Å | ||
| 226 | Y | 82.3 | Confident | 87.2 | Confident | 130 Ų | 130 | 80.2 Ų | 80.2 | 51% | 0.51 | 44% | 0.441 | S | S | . | . | trans | -81.9 | 128.1 | 174.5 | -177.2 | -106.3 | 0 | 0 | 0 | 111.3 | L222 P228 H231 | L222-Y226 HydrophobicContact CD2-CD2 3.7Å; L222-Y226 HydrophobicContact CD2-CE2 4.3Å; Y226-P228 HydrophobicContact CD1-CG 3.94Å; Y226-P228 HydrophobicContact CE1-CB 3.95Å; Y226-P228 HydrophobicContact CE1-CG 3.67Å; Y226-H231 HydrophobicContact CE2-CB 4.09Å; Y226-H231 PolarHBondContact OH-ND1 3.49Å | ||
| 227 | V | 85.2 | Confident | 87.4 | Confident | 67 Ų | 67 | 78.1 Ų | 78.1 | 41% | 0.406 | 43% | 0.43 | S | S | . | . | trans | -120.2 | 100.6 | 178.7 | -173.2 | 0 | 0 | 0 | 0 | 109.4 | W229 V230 H231 | V227-W229 VanDerWaalsContact C-N 3.33Å; V227-W229 VanDerWaalsContact CG1-CD1 3.41Å; V227-W229 HydrophobicContact CG1-CD2 4.4Å; V227-W229 HydrophobicContact CG1-CG 4.13Å; V227-W229 PolarHBondContact O-N 3.03Å; V227-V230 HydrophobicContact CB-CB 4.33Å; V227-V230 HydrophobicContact CB-CG2 4Å; V227-V230 HydrophobicContact CG1-CB 4.35Å; V227-V230 HydrophobicContact CG1-CG2 3.64Å; V227-V230 PolarHBondContact O-N 2.87Å; V227-V230 VanDerWaalsContact O-N 3.15Å; V227-H231 PolarHBondContact O-N 3.02Å | ||
| 228 | P | 83.6 | Confident | 87.6 | Confident | 84 Ų | 84 | 73.8 Ų | 73.8 | 55% | 0.545 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -58.1 | -39.3 | -169.8 | -24 | 29.4 | 0 | 0 | 0 | 114.3 | Y226 V230 H231 G232 | Y226-P228 HydrophobicContact CD1-CG 3.94Å; Y226-P228 HydrophobicContact CE1-CB 3.95Å; Y226-P228 HydrophobicContact CE1-CG 3.67Å; P228-V230 VanDerWaalsContact C-N 3.34Å; P228-V230 PolarHBondContact O-N 3.27Å; P228-H231 PolarHBondContact O-N 3.48Å; P228-G232 PolarHBondContact O-N 2.96Å |
| 229 | W | 86 | Confident | 87.9 | Confident | 185 Ų | 185 | 71.6 Ų | 71.6 | 70% | 0.701 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -67.9 | -33.3 | -177.9 | 72.8 | -100.2 | 0 | 0 | 0 | 112.6 | V227 G232 V233 | V227-W229 VanDerWaalsContact C-N 3.33Å; V227-W229 VanDerWaalsContact CG1-CD1 3.41Å; V227-W229 HydrophobicContact CG1-CD2 4.4Å; V227-W229 HydrophobicContact CG1-CG 4.13Å; V227-W229 PolarHBondContact O-N 3.03Å; W229-G232 PolarHBondContact O-N 2.81Å; W229-V233 HydrophobicContact CE3-CG2 4.25Å; W229-V233 WeakPolarHBondContact O-CG2 3.21Å; W229-V233 PolarHBondContact O-N 2.87Å |
| 230 | V | 87.6 | Confident | 88.3 | Confident | 39 Ų | 39 | 72.9 Ų | 72.9 | 24% | 0.236 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -69.6 | -41.9 | 177.2 | -178 | 0 | 0 | 0 | 0 | 110.2 | L218 V227 P228 G232 V233 Y234 | L218-V230 HydrophobicContact CD1-CG1 4.3Å; L218-V230 HydrophobicContact CD2-CG1 3.59Å; V227-V230 HydrophobicContact CB-CB 4.33Å; V227-V230 HydrophobicContact CB-CG2 4Å; V227-V230 HydrophobicContact CG1-CB 4.35Å; V227-V230 HydrophobicContact CG1-CG2 3.64Å; V227-V230 PolarHBondContact O-N 2.87Å; V227-V230 VanDerWaalsContact O-N 3.15Å; P228-V230 VanDerWaalsContact C-N 3.34Å; P228-V230 PolarHBondContact O-N 3.27Å; V230-G232 VanDerWaalsContact C-N 3.35Å; V230-G232 PolarHBondContact O-N 2.92Å; V230-V233 PolarHBondContact O-N 3.38Å; V230-Y234 WeakPolarHBondContact O-CB 3.24Å; V230-Y234 PolarHBondContact O-N 3.26Å |
| 231 | H | 86.5 | Confident | 88.6 | Confident | 66 Ų | 66 | 68 Ų | 68 | 31% | 0.306 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -60.4 | -44.1 | 174.4 | -171.3 | -102.2 | 0 | 0 | 0 | 111.5 | Y226 V227 P228 Y234 G235 S286 | Y226-H231 HydrophobicContact CE2-CB 4.09Å; Y226-H231 PolarHBondContact OH-ND1 3.49Å; V227-H231 PolarHBondContact O-N 3.02Å; P228-H231 PolarHBondContact O-N 3.48Å; H231-Y234 PolarHBondContact O-N 3.15Å; H231-G235 PolarHBondContact O-N 3.39Å; H231-S286 PolarHBondContact CE1-OG 3.26Å |
| 232 | G | 88.6 | Confident | 89.1 | Confident | 26 Ų | 26 | 67.8 Ų | 67.8 | 27% | 0.268 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -61.7 | -46.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 113.5 | P228 W229 V230 Y234 G235 A236 L287 | P228-G232 PolarHBondContact O-N 2.96Å; W229-G232 PolarHBondContact O-N 2.81Å; V230-G232 VanDerWaalsContact C-N 3.35Å; V230-G232 PolarHBondContact O-N 2.92Å; G232-Y234 PolarHBondContact O-N 2.96Å; G232-G235 PolarHBondContact O-N 3.44Å; G232-A236 PolarHBondContact O-N 3.26Å; G232-L287 VanDerWaalsContact O-CD2 3.23Å; G232-L287 WeakPolarHBondContact O-CD2 3.41Å |
| 233 | V | 91.8 | Very high | 89.7 | Confident | 76 Ų | 76 | 64.8 Ų | 64.8 | 46% | 0.461 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -62.3 | -43.7 | 176.6 | 169.6 | 0 | 0 | 0 | 0 | 111.3 | W229 V230 G235 A236 L237 | W229-V233 HydrophobicContact CE3-CG2 4.25Å; W229-V233 WeakPolarHBondContact O-CG2 3.21Å; W229-V233 PolarHBondContact O-N 2.87Å; V230-V233 PolarHBondContact O-N 3.38Å; V233-G235 VanDerWaalsContact C-N 3.32Å; V233-G235 PolarHBondContact O-N 2.95Å; V233-A236 PolarHBondContact O-N 3.42Å; V233-L237 HydrophobicContact CG1-CD1 3.93Å; V233-L237 HydrophobicContact CG1-CG 4.4Å; V233-L237 WeakPolarHBondContact O-CG 3.5Å; V233-L237 PolarHBondContact O-N 3.36Å |
| 234 | Y | 92.8 | Very high | 90.1 | Very high | 56 Ų | 56 | 63.3 Ų | 63.3 | 22% | 0.22 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -60.4 | -42.4 | 174.7 | -176.6 | -95.2 | 0 | 0 | 0 | 111.6 | M211 G215 L218 V230 H231 G232 A236 L237 G238 F283 | M211-Y234 HydrophobicContact CE-CD1 4.42Å; M211-Y234 HydrophobicContact CE-CD2 3.59Å; M211-Y234 HydrophobicContact CE-CE1 4.26Å; M211-Y234 HydrophobicContact CE-CE2 3.38Å; M211-Y234 HydrophobicContact CE-CG 4.11Å; M211-Y234 WeakPolarHBondContact CE-O 3.35Å; M211-Y234 WeakPolarHBondContact O-CE2 3.42Å; M211-Y234 PolarHBondContact O-OH 3.12Å; M211-Y234 HydrophobicContact SD-CD2 4.32Å; M211-Y234 HydrophobicContact SD-CE2 4.25Å; G215-Y234 WeakPolarHBondContact CA-OH 3.2Å; L218-Y234 HydrophobicContact CD1-CD1 4.49Å; L218-Y234 HydrophobicContact CD1-CD2 3.72Å; L218-Y234 HydrophobicContact CD1-CE2 4.33Å; L218-Y234 HydrophobicContact CD1-CG 3.81Å; V230-Y234 WeakPolarHBondContact O-CB 3.24Å; V230-Y234 PolarHBondContact O-N 3.26Å; H231-Y234 PolarHBondContact O-N 3.15Å; G232-Y234 PolarHBondContact O-N 2.96Å; Y234-A236 PolarHBondContact O-N 3.35Å; Y234-L237 PolarHBondContact O-N 3.09Å; Y234-G238 PolarHBondContact O-N 3.4Å; Y234-F283 HydrophobicContact CD1-CE1 4.3Å; Y234-F283 AromaticContact CE1-CE1 3.95Å; Y234-F283 HydrophobicContact CE1-CE1 3.95Å |
| 235 | G | 92.3 | Very high | 90.6 | Very high | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -59.5 | -44.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | H231 G232 V233 G238 A239 | H231-G235 PolarHBondContact O-N 3.39Å; G232-G235 PolarHBondContact O-N 3.44Å; V233-G235 VanDerWaalsContact C-N 3.32Å; V233-G235 PolarHBondContact O-N 2.95Å; G235-G238 PolarHBondContact O-N 3.12Å; G235-A239 WeakPolarHBondContact O-CB 3.42Å; G235-A239 PolarHBondContact O-N 3.21Å |
| 236 | A | 94 | Very high | 91.3 | Very high | 47 Ų | 47 | 53.3 Ų | 53.3 | 39% | 0.388 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66.3 | -43.2 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G232 V233 Y234 G238 L240 L287 | G232-A236 PolarHBondContact O-N 3.26Å; V233-A236 PolarHBondContact O-N 3.42Å; Y234-A236 PolarHBondContact O-N 3.35Å; A236-G238 VanDerWaalsContact C-N 3.35Å; A236-L240 WeakPolarHBondContact O-CB 3.45Å; A236-L240 PolarHBondContact O-N 3.45Å; A236-L287 HydrophobicContact CB-CD1 4.43Å; A236-L287 HydrophobicContact CB-CD2 4.21Å |
| 237 | L | 95.2 | Very high | 91.8 | Very high | 69 Ų | 69 | 47.8 Ų | 47.8 | 36% | 0.361 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -66.6 | -36.8 | 176 | -67.5 | 174.3 | 0 | 0 | 0 | 111.8 | F207 M211 V233 Y234 L240 L241 | F207-L237 HydrophobicContact CE2-CB 4.4Å; F207-L237 HydrophobicContact CZ-CB 4.13Å; F207-L237 HydrophobicContact CZ-CD2 4.11Å; M211-L237 HydrophobicContact CE-CB 4.1Å; M211-L237 HydrophobicContact SD-CB 3.66Å; M211-L237 HydrophobicContact SD-CD1 4.48Å; V233-L237 HydrophobicContact CG1-CD1 3.93Å; V233-L237 HydrophobicContact CG1-CG 4.4Å; V233-L237 WeakPolarHBondContact O-CG 3.5Å; V233-L237 PolarHBondContact O-N 3.36Å; Y234-L237 PolarHBondContact O-N 3.09Å; L237-L240 PolarHBondContact O-N 2.61Å; L237-L241 VanDerWaalsContact O-CB 3.31Å; L237-L241 WeakPolarHBondContact O-CB 3.39Å; L237-L241 PolarHBondContact O-N 3.17Å |
| 238 | G | 94.7 | Very high | 92.1 | Very high | 0 Ų | 0 | 45.5 Ų | 45.5 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.3 | -49.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | Y234 G235 A236 L240 L241 F242 F283 | Y234-G238 PolarHBondContact O-N 3.4Å; G235-G238 PolarHBondContact O-N 3.12Å; A236-G238 VanDerWaalsContact C-N 3.35Å; G238-L240 VanDerWaalsContact C-N 3.29Å; G238-L240 PolarHBondContact O-N 2.89Å; G238-L241 PolarHBondContact O-N 2.9Å; G238-F242 WeakPolarHBondContact O-CD2 3.32Å; G238-F242 PolarHBondContact O-N 3.5Å; G238-F283 VanDerWaalsContact C-CD2 3.47Å |
| 239 | A | 95.4 | Very high | 92.4 | Very high | 5 Ų | 5 | 42.2 Ų | 42.2 | 4% | 0.041 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -57.2 | -43.5 | 175 | 0 | 0 | 0 | 0 | 0 | 111.5 | G235 T243 F283 F284 L287 | G235-A239 WeakPolarHBondContact O-CB 3.42Å; G235-A239 PolarHBondContact O-N 3.21Å; A239-T243 VanDerWaalsContact O-CB 3.24Å; A239-T243 WeakPolarHBondContact O-CB 3.45Å; A239-T243 PolarHBondContact O-N 2.62Å; A239-T243 PolarHBondContact O-OG1 3.22Å; A239-F283 HydrophobicContact CB-CB 3.83Å; A239-F284 HydrophobicContact CB-CD1 4.24Å; A239-F284 HydrophobicContact CB-CE1 3.89Å; A239-F284 HydrophobicContact CB-CZ 4.36Å; A239-L287 HydrophobicContact CB-CD1 4.48Å |
| 240 | L | 94.8 | Very high | 92.7 | Very high | 85 Ų | 85 | 33.4 Ų | 33.4 | 45% | 0.445 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -63.3 | -47.4 | 176.7 | -178.1 | 66.1 | 0 | 0 | 0 | 112.1 | A236 L237 G238 T243 M244 | A236-L240 WeakPolarHBondContact O-CB 3.45Å; A236-L240 PolarHBondContact O-N 3.45Å; L237-L240 PolarHBondContact O-N 2.61Å; G238-L240 VanDerWaalsContact C-N 3.29Å; G238-L240 PolarHBondContact O-N 2.89Å; L240-T243 WeakPolarHBondContact O-CB 3.43Å; L240-T243 PolarHBondContact O-N 2.87Å; L240-M244 HydrophobicContact CD1-CE 3.98Å; L240-M244 HydrophobicContact CD2-CE 4.26Å; L240-M244 HydrophobicContact CG-CE 3.96Å; L240-M244 WeakPolarHBondContact O-CG 3.4Å; L240-M244 PolarHBondContact O-N 3.47Å |
| 241 | L | 94.8 | Very high | 92.7 | Very high | 3 Ų | 3 | 31.8 Ų | 31.8 | 2% | 0.016 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -59.1 | -51.4 | 179.4 | 173.6 | 63.6 | 0 | 0 | 0 | 111.6 | F207 C208 M211 L237 G238 T243 M244 F245 | F207-L241 HydrophobicContact CB-CD1 4.16Å; F207-L241 HydrophobicContact CD1-CB 4.17Å; F207-L241 HydrophobicContact CD1-CD1 3.57Å; F207-L241 HydrophobicContact CD1-CG 4.38Å; F207-L241 HydrophobicContact CE1-CB 3.8Å; F207-L241 HydrophobicContact CE1-CD1 4.12Å; F207-L241 HydrophobicContact CG-CD1 3.97Å; F207-L241 HydrophobicContact CZ-CB 4.21Å; C208-L241 HydrophobicContact CB-CD2 4.16Å; M211-L241 HydrophobicContact CB-CD2 3.96Å; M211-L241 HydrophobicContact CG-CD2 3.73Å; L237-L241 VanDerWaalsContact O-CB 3.31Å; L237-L241 WeakPolarHBondContact O-CB 3.39Å; L237-L241 PolarHBondContact O-N 3.17Å; G238-L241 PolarHBondContact O-N 2.9Å; L241-T243 VanDerWaalsContact C-N 3.28Å; L241-T243 PolarHBondContact O-N 3.07Å; L241-M244 WeakPolarHBondContact O-CA 3.48Å; L241-M244 WeakPolarHBondContact O-CB 3.16Å; L241-M244 PolarHBondContact O-N 2.86Å; L241-F245 HydrophobicContact CD1-CD2 3.9Å; L241-F245 HydrophobicContact CD1-CE2 3.48Å; L241-F245 VanDerWaalsContact CD1-CE2 3.48Å; L241-F245 HydrophobicContact CD1-CZ 4.26Å; L241-F245 HydrophobicContact CD2-CE2 4.14Å; L241-F245 HydrophobicContact CG-CD2 3.89Å; L241-F245 HydrophobicContact CG-CE2 3.7Å; L241-F245 PolarHBondContact O-N 2.9Å |
| 242 | F | 95.3 | Very high | 92.6 | Very high | 38 Ų | 38 | 29.8 Ų | 29.8 | 17% | 0.167 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -69.3 | -27 | 179.4 | -79.4 | -81.6 | 0 | 0 | 0 | 112.7 | G238 M244 F245 L246 D276 Y279 I280 F283 | G238-F242 WeakPolarHBondContact O-CD2 3.32Å; G238-F242 PolarHBondContact O-N 3.5Å; F242-M244 VanDerWaalsContact C-N 3.32Å; F242-M244 PolarHBondContact O-N 3.48Å; F242-F245 HydrophobicContact CD1-CD2 4.39Å; F242-F245 PolarHBondContact O-N 3.22Å; F242-L246 WeakPolarHBondContact O-CB 3.34Å; F242-L246 PolarHBondContact O-N 2.74Å; F242-D276 HydrophobicContact CD1-CB 4.49Å; F242-D276 WeakPolarHBondContact CD1-OD1 3.48Å; F242-Y279 HydrophobicContact CD1-CD2 4.01Å; F242-Y279 HydrophobicContact CD1-CG 4.25Å; F242-Y279 AromaticContact CE1-CD2 3.37Å; F242-Y279 HydrophobicContact CE1-CD2 3.37Å; F242-Y279 HydrophobicContact CE1-CE2 4.17Å; F242-Y279 AromaticContact CE1-CG 3.86Å; F242-Y279 HydrophobicContact CE1-CG 3.86Å; F242-Y279 HydrophobicContact CE2-CD2 4.44Å; F242-Y279 HydrophobicContact CE2-CG 4.2Å; F242-Y279 AromaticContact CZ-CD2 3.62Å; F242-Y279 HydrophobicContact CZ-CD2 3.62Å; F242-Y279 HydrophobicContact CZ-CE2 4.23Å; F242-Y279 AromaticContact CZ-CG 3.82Å; F242-Y279 HydrophobicContact CZ-CG 3.82Å; F242-I280 HydrophobicContact CB-CG1 3.74Å; F242-F283 HydrophobicContact CD2-CD2 4.02Å; F242-F283 AromaticContact CD2-CE2 3.49Å; F242-F283 HydrophobicContact CD2-CE2 3.49Å; F242-F283 VanDerWaalsContact CD2-CE2 3.49Å; F242-F283 AromaticContact CE2-CE2 3.61Å; F242-F283 HydrophobicContact CE2-CE2 3.61Å; F242-F283 HydrophobicContact CE2-CZ 4.36Å |
| 243 | T | 95.1 | Very high | 92.4 | Very high | 27 Ų | 27 | 28.7 Ų | 28.7 | 17% | 0.166 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -64.4 | -35.8 | 168.3 | -60.9 | 0 | 0 | 0 | 0 | 111.9 | V182 V186 A239 L240 L241 A247 | V182-T243 HydrophobicContact CG1-CG2 3.92Å; V186-T243 HydrophobicContact CG2-CG2 3.53Å; A239-T243 VanDerWaalsContact O-CB 3.24Å; A239-T243 WeakPolarHBondContact O-CB 3.45Å; A239-T243 PolarHBondContact O-N 2.62Å; A239-T243 PolarHBondContact O-OG1 3.22Å; L240-T243 WeakPolarHBondContact O-CB 3.43Å; L240-T243 PolarHBondContact O-N 2.87Å; L241-T243 VanDerWaalsContact C-N 3.28Å; L241-T243 PolarHBondContact O-N 3.07Å; T243-A247 PolarHBondContact O-N 3.46Å |
| 244 | M | 92.9 | Very high | 91.7 | Very high | 78 Ų | 78 | 26 Ų | 26 | 38% | 0.384 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -73.8 | -36.9 | 173.2 | -64.6 | -176 | -176.7 | 0 | 0 | 112.7 | L204 L240 L241 F242 A247 F248 | L204-M244 HydrophobicContact CD2-CB 3.58Å; L204-M244 HydrophobicContact CD2-CG 4.42Å; L204-M244 HydrophobicContact CD2-SD 4Å; L240-M244 HydrophobicContact CD1-CE 3.98Å; L240-M244 HydrophobicContact CD2-CE 4.26Å; L240-M244 HydrophobicContact CG-CE 3.96Å; L240-M244 WeakPolarHBondContact O-CG 3.4Å; L240-M244 PolarHBondContact O-N 3.47Å; L241-M244 WeakPolarHBondContact O-CA 3.48Å; L241-M244 WeakPolarHBondContact O-CB 3.16Å; L241-M244 PolarHBondContact O-N 2.86Å; F242-M244 VanDerWaalsContact C-N 3.32Å; F242-M244 PolarHBondContact O-N 3.48Å; M244-A247 WeakPolarHBondContact O-CB 3.35Å; M244-A247 PolarHBondContact O-N 3.25Å; M244-F248 PolarHBondContact O-N 2.98Å |
| 245 | F | 93.8 | Very high | 90.3 | Very high | 39 Ų | 39 | 23.7 Ų | 23.7 | 17% | 0.171 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61.8 | -43.5 | 171.3 | -80.8 | -61.1 | 0 | 0 | 0 | 111.5 | L204 C208 L241 F242 A247 F248 D249 D276 | L204-F245 HydrophobicContact CB-CE1 3.88Å; L204-F245 HydrophobicContact CB-CZ 4.08Å; L204-F245 HydrophobicContact CD1-CD1 4.34Å; L204-F245 HydrophobicContact CD1-CE1 4.43Å; C208-F245 HydrophobicContact CB-CE2 3.99Å; C208-F245 HydrophobicContact CB-CZ 3.87Å; L241-F245 HydrophobicContact CD1-CD2 3.9Å; L241-F245 HydrophobicContact CD1-CE2 3.48Å; L241-F245 VanDerWaalsContact CD1-CE2 3.48Å; L241-F245 HydrophobicContact CD1-CZ 4.26Å; L241-F245 HydrophobicContact CD2-CE2 4.14Å; L241-F245 HydrophobicContact CG-CD2 3.89Å; L241-F245 HydrophobicContact CG-CE2 3.7Å; L241-F245 PolarHBondContact O-N 2.9Å; F242-F245 HydrophobicContact CD1-CD2 4.39Å; F242-F245 PolarHBondContact O-N 3.22Å; F245-A247 PolarHBondContact O-N 3.41Å; F245-F248 CarbonylContact O-C 3.54Å; F245-F248 WeakPolarHBondContact O-CA 3.38Å; F245-F248 WeakPolarHBondContact O-CB 3.43Å; F245-F248 PolarHBondContact O-N 2.87Å; F245-D249 PolarHBondContact O-N 2.75Å; F245-D276 WeakPolarHBondContact CB-OD1 3.26Å; F245-D276 WeakPolarHBondContact CB-OD2 3.36Å |
| 246 | L | 94.6 | Very high | 88.4 | Confident | 0 Ų | 0 | 29.1 Ų | 29.1 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -57.3 | -39.4 | 175.9 | -178.2 | 63.2 | 0 | 0 | 0 | 111.9 | C183 V186 F242 T250 I273 D276 I277 I280 | C183-L246 HydrophobicContact CB-CD2 3.84Å; V186-L246 HydrophobicContact CB-CD2 4.22Å; V186-L246 HydrophobicContact CG1-CB 4.24Å; V186-L246 HydrophobicContact CG1-CD2 4.07Å; V186-L246 HydrophobicContact CG1-CG 4.01Å; F242-L246 WeakPolarHBondContact O-CB 3.34Å; F242-L246 PolarHBondContact O-N 2.74Å; L246-T250 WeakPolarHBondContact O-CB 3.2Å; L246-T250 PolarHBondContact O-N 2.85Å; L246-T250 PolarHBondContact O-OG1 2.88Å; L246-I273 HydrophobicContact CD1-CG2 3.81Å; L246-D276 VanDerWaalsContact CA-OD2 3.25Å; L246-D276 WeakPolarHBondContact CA-OD2 3.47Å; L246-D276 HydrophobicContact CB-CB 4.07Å; L246-D276 HydrophobicContact CD1-CB 4.31Å; L246-D276 PolarHBondContact N-OD2 2.97Å; L246-I277 HydrophobicContact CD1-CD1 4.4Å; L246-I277 HydrophobicContact CD1-CG1 4.04Å; L246-I277 HydrophobicContact CD2-CG1 4.39Å; L246-I280 HydrophobicContact CB-CD1 4.26Å; L246-I280 HydrophobicContact CD2-CD1 3.94Å |
| 247 | A | 92.5 | Very high | 86.5 | Confident | 13 Ų | 13 | 29.1 Ų | 29.1 | 11% | 0.107 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -67.7 | -40 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | V186 V197 T243 M244 F245 Q251 | V186-A247 HydrophobicContact CG1-CB 3.78Å; V197-A247 HydrophobicContact CG1-CB 4.41Å; T243-A247 PolarHBondContact O-N 3.46Å; M244-A247 WeakPolarHBondContact O-CB 3.35Å; M244-A247 PolarHBondContact O-N 3.25Å; F245-A247 PolarHBondContact O-N 3.41Å; A247-Q251 WeakPolarHBondContact O-CB 3.22Å; A247-Q251 WeakPolarHBondContact O-CG 3.24Å; A247-Q251 PolarHBondContact O-N 3.14Å; A247-Q251 VanDerWaalsContact O-N 3.12Å; A247-Q251 PolarHBondContact O-NE2 3.34Å |
| 248 | F | 91.1 | Very high | 83.9 | Confident | 19 Ų | 19 | 36.5 Ų | 36.5 | 8% | 0.083 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64 | -54.4 | 176.6 | 175.8 | -86.5 | 0 | 0 | 0 | 111.5 | V197 T198 Q201 L204 M244 F245 T250 Q251 L252 | V197-F248 HydrophobicContact CG1-CB 4.23Å; T198-F248 HydrophobicContact CG2-CD2 4.2Å; T198-F248 HydrophobicContact CG2-CE2 4.22Å; Q201-F248 HydrophobicContact CB-CE2 3.79Å; Q201-F248 HydrophobicContact CB-CZ 4.28Å; Q201-F248 HydrophobicContact CG-CE2 3.94Å; Q201-F248 HydrophobicContact CG-CZ 3.93Å; L204-F248 HydrophobicContact CD1-CB 3.74Å; L204-F248 HydrophobicContact CD1-CD2 3.76Å; L204-F248 HydrophobicContact CD1-CG 3.91Å; M244-F248 PolarHBondContact O-N 2.98Å; F245-F248 CarbonylContact O-C 3.54Å; F245-F248 WeakPolarHBondContact O-CA 3.38Å; F245-F248 WeakPolarHBondContact O-CB 3.43Å; F245-F248 PolarHBondContact O-N 2.87Å; F248-T250 PolarHBondContact O-N 3.47Å; F248-Q251 CarbonylContact O-C 3.59Å; F248-Q251 PolarHBondContact O-N 2.91Å; F248-Q251 VanDerWaalsContact O-N 3.1Å; F248-L252 HydrophobicContact CE1-CD2 4.14Å; F248-L252 WeakPolarHBondContact O-CB 3.25Å; F248-L252 PolarHBondContact O-N 3.38Å |
| 249 | D | 91.7 | Very high | 81.7 | Confident | 16 Ų | 16 | 42.7 Ų | 42.7 | 9% | 0.086 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -69.9 | -34.1 | -176.6 | -83.3 | -30.1 | 0 | 0 | 0 | 112.2 | F245 Q251 L252 L253 N272 I273 | F245-D249 PolarHBondContact O-N 2.75Å; D249-Q251 VanDerWaalsContact C-N 3.32Å; D249-Q251 PolarHBondContact O-N 3.06Å; D249-L252 PolarHBondContact O-N 3Å; D249-L253 VanDerWaalsContact O-CB 3.28Å; D249-L253 WeakPolarHBondContact O-CB 3.41Å; D249-L253 PolarHBondContact O-N 2.75Å; D249-N272 WeakPolarHBondContact OD2-CB 3.5Å; D249-I273 HydrophobicContact CB-CG1 3.85Å |
| 250 | T | 90.4 | Very high | 79.8 | Confident | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.6 | -41.2 | 169.6 | -61.6 | 0 | 0 | 0 | 0 | 111.1 | Y84 L246 F248 L253 M254 | Y84-T250 WeakPolarHBondContact OH-CG2 3.4Å; L246-T250 WeakPolarHBondContact O-CB 3.2Å; L246-T250 PolarHBondContact O-N 2.85Å; L246-T250 PolarHBondContact O-OG1 2.88Å; F248-T250 PolarHBondContact O-N 3.47Å; T250-L253 PolarHBondContact O-N 3.11Å; T250-M254 HydrophobicContact CG2-CE 3.74Å; T250-M254 WeakPolarHBondContact O-CE 3.38Å; T250-M254 PolarHBondContact O-N 3.04Å; T250-M254 VanDerWaalsContact O-N 3.11Å |
| 251 | Q | 88.5 | Confident | 78.2 | Confident | 5 Ų | 5 | 44.3 Ų | 44.3 | 2% | 0.023 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -71 | -35.5 | 177.2 | -74.2 | 176.5 | 47.5 | 0 | 0 | 113.3 | F195 V197 T198 A247 F248 D249 M254 G255 | F195-Q251 PolarHBondContact O-OE1 2.92Å; V197-Q251 VanDerWaalsContact N-OE1 3.11Å; T198-Q251 HydrophobicContact CG2-CB 3.89Å; A247-Q251 WeakPolarHBondContact O-CB 3.22Å; A247-Q251 WeakPolarHBondContact O-CG 3.24Å; A247-Q251 PolarHBondContact O-N 3.14Å; A247-Q251 VanDerWaalsContact O-N 3.12Å; A247-Q251 PolarHBondContact O-NE2 3.34Å; F248-Q251 CarbonylContact O-C 3.59Å; F248-Q251 PolarHBondContact O-N 2.91Å; F248-Q251 VanDerWaalsContact O-N 3.1Å; D249-Q251 VanDerWaalsContact C-N 3.32Å; D249-Q251 PolarHBondContact O-N 3.06Å; Q251-M254 HydrophobicContact CB-CE 4.48Å; Q251-M254 HydrophobicContact CG-CE 3.91Å; Q251-M254 PolarHBondContact O-N 3.44Å; Q251-G255 PolarHBondContact O-N 3.26Å |
| 252 | L | 84.4 | Confident | 76.7 | Confident | 24 Ų | 24 | 46.5 Ų | 46.5 | 13% | 0.126 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.5 | -42.9 | 173.3 | -177.5 | 61.7 | 0 | 0 | 0 | 111.3 | F248 D249 M254 G255 I261 | F248-L252 HydrophobicContact CE1-CD2 4.14Å; F248-L252 WeakPolarHBondContact O-CB 3.25Å; F248-L252 PolarHBondContact O-N 3.38Å; D249-L252 PolarHBondContact O-N 3Å; L252-M254 VanDerWaalsContact C-N 3.3Å; L252-M254 PolarHBondContact O-N 3.36Å; L252-G255 PolarHBondContact O-N 3.33Å; L252-I261 HydrophobicContact CD1-CG1 4.44Å; L252-I261 HydrophobicContact CD2-CD1 3.73Å; L252-I261 HydrophobicContact CD2-CG1 4.14Å; L252-I261 HydrophobicContact CG-CD1 3.91Å; L252-I261 HydrophobicContact CG-CG1 4.02Å |
| 253 | L | 84.8 | Confident | 75 | Confident | 3 Ų | 3 | 48 Ų | 48 | 2% | 0.016 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -60.1 | -38.6 | 174 | -179.4 | 74.5 | 0 | 0 | 0 | 112.3 | F79 I80 V83 Y84 D249 T250 G255 A269 I273 | F79-L253 HydrophobicContact CD1-CD1 4.23Å; F79-L253 HydrophobicContact CE1-CD1 3.37Å; F79-L253 HydrophobicContact CE1-CG 4.31Å; F79-L253 HydrophobicContact CZ-CD1 3.72Å; I80-L253 HydrophobicContact CG1-CG 4.3Å; V83-L253 HydrophobicContact CB-CD1 3.9Å; V83-L253 HydrophobicContact CB-CD2 4.31Å; V83-L253 HydrophobicContact CG1-CD1 3.82Å; V83-L253 HydrophobicContact CG1-CD2 3.85Å; V83-L253 HydrophobicContact CG2-CD1 3.71Å; Y84-L253 HydrophobicContact CD2-CD2 4.08Å; Y84-L253 HydrophobicContact CE2-CD2 3.5Å; Y84-L253 VanDerWaalsContact CE2-CD2 3.5Å; D249-L253 VanDerWaalsContact O-CB 3.28Å; D249-L253 WeakPolarHBondContact O-CB 3.41Å; D249-L253 PolarHBondContact O-N 2.75Å; T250-L253 PolarHBondContact O-N 3.11Å; L253-G255 VanDerWaalsContact C-N 3.26Å; L253-G255 PolarHBondContact O-N 2.81Å; L253-A269 HydrophobicContact CD1-CB 3.8Å; L253-I273 HydrophobicContact CB-CD1 4.37Å; L253-I273 HydrophobicContact CD2-CD1 3.85Å |
| 254 | M | 75.9 | Confident | 73.5 | Confident | 19 Ų | 19 | 52 Ų | 52 | 9% | 0.094 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -68.6 | -19.9 | 178.4 | -86.1 | -173 | -94 | 0 | 0 | 114.7 | R76 S190 F191 T250 Q251 L252 N256 | R76-M254 WeakPolarHBondContact CD-O 3.26Å; R76-M254 PolarHBondContact NE-O 3.2Å; S190-M254 WeakPolarHBondContact O-CE 3.47Å; F191-M254 HydrophobicContact CB-SD 4.47Å; F191-M254 HydrophobicContact CD1-CE 3.9Å; F191-M254 HydrophobicContact CD1-CG 3.86Å; F191-M254 HydrophobicContact CD1-SD 3.3Å; F191-M254 WeakPolarHBondContact CD1-SD 3.49Å; F191-M254 HydrophobicContact CE1-CE 4.29Å; F191-M254 HydrophobicContact CE1-CG 3.72Å; F191-M254 HydrophobicContact CE1-SD 3.82Å; F191-M254 HydrophobicContact CG-CE 4.43Å; F191-M254 HydrophobicContact CG-SD 4.21Å; T250-M254 HydrophobicContact CG2-CE 3.74Å; T250-M254 WeakPolarHBondContact O-CE 3.38Å; T250-M254 PolarHBondContact O-N 3.04Å; T250-M254 VanDerWaalsContact O-N 3.11Å; Q251-M254 HydrophobicContact CB-CE 4.48Å; Q251-M254 HydrophobicContact CG-CE 3.91Å; Q251-M254 PolarHBondContact O-N 3.44Å; L252-M254 VanDerWaalsContact C-N 3.3Å; L252-M254 PolarHBondContact O-N 3.36Å; M254-N256 PolarHBondContact O-N 2.93Å; M254-N256 VanDerWaalsContact O-N 3.08Å |
| 255 | G | 63.3 | Low | 72.9 | Confident | 8 Ų | 8 | 49.8 Ų | 49.8 | 8% | 0.082 | 25% | 0.245 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 54.8 | 28.9 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | R76 Q251 L252 L253 K257 | R76-G255 PolarHBondContact NH1-O 2.81Å; Q251-G255 PolarHBondContact O-N 3.26Å; L252-G255 PolarHBondContact O-N 3.33Å; L253-G255 VanDerWaalsContact C-N 3.26Å; L253-G255 PolarHBondContact O-N 2.81Å; G255-K257 VanDerWaalsContact C-N 3.34Å |
| 256 | N | 54.2 | Low | 72.4 | Confident | 114 Ų | 114 | 48.8 Ų | 48.8 | 61% | 0.61 | 24% | 0.24 | S | C | * | . | trans | -92.2 | 4.7 | -173.7 | -140.7 | 32.4 | 0 | 0 | 0 | 113 | R76 M254 | R76-N256 PolarHBondContact NH2-OD1 3.29Å; R76-N256 VanDerWaalsContact NH2-OD1 3.16Å; M254-N256 PolarHBondContact O-N 2.93Å; M254-N256 VanDerWaalsContact O-N 3.08Å | ||
| 257 | K | 52.6 | Low | 72.1 | Confident | 47 Ų | 47 | 48.9 Ų | 48.9 | 20% | 0.204 | 24% | 0.241 | C | C | . | . | S | Bend | trans | -145.3 | -168 | -167.1 | -55.2 | -174.4 | -172 | 164.3 | 0 | 109.9 | T193 F195 D196 G255 Y259 | T193-K257 PolarHBondContact O-NZ 3.08Å; F195-K257 PolarHBondContact O-NZ 3.48Å; D196-K257 HydrophobicContact CB-CD 3.75Å; D196-K257 VanDerWaalsContact CG-CD 3.44Å; D196-K257 WeakPolarHBondContact OD1-CD 3.34Å; G255-K257 VanDerWaalsContact C-N 3.34Å; K257-Y259 PolarHBondContact O-N 3.19Å |
| 258 | R | 42.1 | Very low | 72 | Confident | 223 Ų | 223 | 50.7 Ų | 50.7 | 84% | 0.842 | 25% | 0.246 | S | C | * | . | S | Bend | trans | -59 | -18.7 | -167.7 | -71.3 | -68.6 | -165.8 | 175.6 | 3.9 | 116.3 | ||
| 259 | Y | 47.9 | Very low | 72 | Confident | 131 Ų | 131 | 49.9 Ų | 49.9 | 51% | 0.514 | 24% | 0.244 | S | C | . | . | trans | -122.8 | 132.5 | -178.7 | -59.8 | -81.2 | 0 | 0 | 0 | 110.5 | K257 | K257-Y259 PolarHBondContact O-N 3.19Š| ||
| 260 | T | 55.3 | Low | 72.1 | Confident | 98 Ų | 98 | 49.1 Ų | 49.1 | 60% | 0.601 | 24% | 0.239 | S | C | * | . | trans | -128.6 | 119.4 | 178.2 | 53.9 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 261 | I | 60.8 | Low | 72.2 | Confident | 26 Ų | 26 | 49.2 Ų | 49.2 | 13% | 0.133 | 24% | 0.24 | C | C | . | . | trans | -65.9 | 135.4 | 168.8 | -90.6 | 176.1 | 0 | 0 | 0 | 109.4 | F79 L252 E265 F268 A269 | F79-I261 HydrophobicContact CE1-CG2 4.39Å; F79-I261 HydrophobicContact CE2-CG2 4.34Å; F79-I261 HydrophobicContact CZ-CG2 3.61Å; L252-I261 HydrophobicContact CD1-CG1 4.44Å; L252-I261 HydrophobicContact CD2-CD1 3.73Å; L252-I261 HydrophobicContact CD2-CG1 4.14Å; L252-I261 HydrophobicContact CG-CD1 3.91Å; L252-I261 HydrophobicContact CG-CG1 4.02Å; I261-E265 HydrophobicContact CG2-CB 4.14Å; I261-F268 HydrophobicContact CD1-CD1 4.33Å; I261-A269 HydrophobicContact CD1-CB 3.97Å | ||
| 262 | S | 63.9 | Low | 72.5 | Confident | 49 Ų | 49 | 50.1 Ų | 50.1 | 34% | 0.343 | 25% | 0.245 | S | C | . | . | trans | -63.6 | 140.7 | 172.2 | 176.1 | 0 | 0 | 0 | 0 | 110 | E264 E265 | S262-E264 PolarHBondContact O-N 3.37Å; S262-E265 PolarHBondContact O-N 2.98Å | ||
| 263 | P | 59.9 | Low | 73 | Confident | 69 Ų | 69 | 49 Ų | 49 | 45% | 0.448 | 24% | 0.239 | S | C | . | . | G | 310 helix | trans | -53.8 | -23.4 | 177.1 | -27.9 | 35.9 | 0 | 0 | 0 | 114.8 | I75 F79 E265 | I75-P263 HydrophobicContact CG2-CG 4.34Å; F79-P263 HydrophobicContact CD2-CB 4.07Å; P263-E265 VanDerWaalsContact C-N 3.25Å; P263-E265 PolarHBondContact O-N 3.03Å |
| 264 | E | 62.8 | Low | 73.6 | Confident | 112 Ų | 112 | 48.9 Ų | 48.9 | 52% | 0.523 | 24% | 0.238 | S | C | . | . | G | 310 helix | trans | -65.2 | -22.9 | 174.6 | -62.1 | 180 | -175 | 0 | 0 | 113.8 | R140 S262 | R140-E264 IonicContact NH1-OE2 3.6Å; S262-E264 PolarHBondContact O-N 3.37Å |
| 265 | E | 79.7 | Confident | 74.6 | Confident | 31 Ų | 31 | 48.5 Ų | 48.5 | 15% | 0.145 | 24% | 0.237 | C | C | . | . | G | 310 helix | trans | -102.9 | 23.8 | -173.9 | -49.2 | -155.2 | 119.9 | 0 | 0 | 113.2 | R139 R140 I261 S262 P263 V267 F268 A269 | R139-E265 IonicContact CZ-OE1 3.58Å; R139-E265 IonicContact NE-OE1 3.58Å; R139-E265 IonicContact NH2-OE1 2.74Å; R139-E265 PolarHBondContact NH2-OE1 2.93Å; R140-E265 IonicContact CZ-OE1 3.42Å; R140-E265 IonicContact NE-OE1 3.29Å; R140-E265 PolarHBondContact NE-OE1 2.91Å; R140-E265 IonicContact NH2-OE1 2.74Å; R140-E265 PolarHBondContact NH2-OE1 3.49Å; I261-E265 HydrophobicContact CG2-CB 4.14Å; S262-E265 PolarHBondContact O-N 2.98Å; P263-E265 VanDerWaalsContact C-N 3.25Å; P263-E265 PolarHBondContact O-N 3.03Å; E265-V267 PolarHBondContact O-N 3.45Å; E265-V267 VanDerWaalsContact O-N 3.07Å; E265-F268 HydrophobicContact CB-CB 4.33Å; E265-F268 WeakPolarHBondContact O-CB 3.42Å; E265-F268 PolarHBondContact O-N 3.02Å; E265-A269 PolarHBondContact O-N 3.32Å; E265-A269 VanDerWaalsContact O-N 3.17Å |
| 266 | Y | 84.6 | Confident | 76.1 | Confident | 18 Ų | 18 | 48.5 Ų | 48.5 | 7% | 0.071 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -50.3 | -35 | 175.3 | 72.1 | -87.5 | 0 | 0 | 0 | 112.6 | K82 I86 N145 L146 A269 T270 | K82-Y266 HydrophobicContact CD-CD2 4.22Å; K82-Y266 HydrophobicContact CD-CE2 4.45Å; K82-Y266 HydrophobicContact CD-CG 4.29Å; I86-Y266 HydrophobicContact CD1-CD2 3.65Å; I86-Y266 HydrophobicContact CD1-CE2 3.59Å; N145-Y266 PolarHBondContact ND2-OH 2.95Å; N145-Y266 VanDerWaalsContact ND2-OH 3.1Å; L146-Y266 HydrophobicContact CD2-CE2 4.24Å; Y266-A269 PolarHBondContact O-N 2.91Å; Y266-T270 WeakPolarHBondContact O-CB 3.44Å; Y266-T270 PolarHBondContact O-N 3.25Å; Y266-T270 PolarHBondContact O-OG1 2.91Å |
| 267 | V | 88.2 | Confident | 78.2 | Confident | 1 Ų | 1 | 44 Ų | 44 | 1% | 0.006 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -65.8 | -38.2 | 176.9 | 175.8 | 0 | 0 | 0 | 0 | 112.3 | L132 R139 N145 L149 E265 L271 | L132-V267 HydrophobicContact CD2-CG1 4.01Å; R139-V267 HydrophobicContact CG-CB 4.31Å; R139-V267 HydrophobicContact CG-CG1 4.4Å; N145-V267 HydrophobicContact CB-CG2 4.08Å; L149-V267 HydrophobicContact CB-CG1 4.29Å; L149-V267 HydrophobicContact CD1-CG1 4.17Å; L149-V267 HydrophobicContact CD2-CG1 4.3Å; L149-V267 HydrophobicContact CG-CG1 4.5Å; E265-V267 PolarHBondContact O-N 3.45Å; E265-V267 VanDerWaalsContact O-N 3.07Å; V267-L271 WeakPolarHBondContact O-CB 3.32Å; V267-L271 PolarHBondContact O-N 3.39Å |
| 268 | F | 89.3 | Confident | 80.3 | Confident | 51 Ų | 51 | 42.1 Ų | 42.1 | 22% | 0.224 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -67.9 | -46.5 | 176.5 | -173.1 | -109.9 | 0 | 0 | 0 | 111.1 | V133 I261 E265 T270 L271 N272 | V133-F268 HydrophobicContact CG1-CE2 4.49Å; V133-F268 HydrophobicContact CG2-CE2 4.27Å; I261-F268 HydrophobicContact CD1-CD1 4.33Å; E265-F268 HydrophobicContact CB-CB 4.33Å; E265-F268 WeakPolarHBondContact O-CB 3.42Å; E265-F268 PolarHBondContact O-N 3.02Å; F268-T270 PolarHBondContact O-N 2.84Å; F268-L271 PolarHBondContact O-N 2.88Å; F268-N272 VanDerWaalsContact CE1-ND2 3.33Å; F268-N272 WeakPolarHBondContact CE1-ND2 3.3Å; F268-N272 WeakPolarHBondContact CZ-ND2 3Å; F268-N272 PolarHBondContact O-N 2.97Å |
| 269 | A | 91 | Very high | 82.9 | Confident | 3 Ų | 3 | 35 Ų | 35 | 3% | 0.025 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.6 | -41.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L253 I261 E265 Y266 I273 | L253-A269 HydrophobicContact CD1-CB 3.8Å; I261-A269 HydrophobicContact CD1-CB 3.97Å; E265-A269 PolarHBondContact O-N 3.32Å; E265-A269 VanDerWaalsContact O-N 3.17Å; Y266-A269 PolarHBondContact O-N 2.91Å; A269-I273 WeakPolarHBondContact O-CD1 3.33Å; A269-I273 VanDerWaalsContact O-CG1 3.29Å; A269-I273 WeakPolarHBondContact O-CG1 3.4Å; A269-I273 PolarHBondContact O-N 3.45Å |
| 270 | T | 93.5 | Very high | 85.2 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -63.7 | -43.3 | 175.2 | -44.9 | 0 | 0 | 0 | 0 | 110.8 | V83 I86 L87 Y266 F268 Y274 | V83-T270 HydrophobicContact CG1-CG2 4.5Å; I86-T270 HydrophobicContact CB-CG2 4.01Å; I86-T270 HydrophobicContact CG2-CG2 3.83Å; L87-T270 HydrophobicContact CB-CG2 4.02Å; Y266-T270 WeakPolarHBondContact O-CB 3.44Å; Y266-T270 PolarHBondContact O-N 3.25Å; Y266-T270 PolarHBondContact O-OG1 2.91Å; F268-T270 PolarHBondContact O-N 2.84Å; T270-Y274 VanDerWaalsContact O-CB 3.24Å; T270-Y274 WeakPolarHBondContact O-CB 3.36Å; T270-Y274 PolarHBondContact O-N 3.29Å |
| 271 | L | 93.8 | Very high | 87.2 | Confident | 1 Ų | 1 | 24.4 Ų | 24.4 | 1% | 0.005 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -60.9 | -47.3 | -178.6 | 176.2 | 147.6 | 0 | 0 | 0 | 112.5 | Y129 L132 L149 F152 V267 F268 Y274 L275 | Y129-L271 HydrophobicContact CD2-CD1 4.49Å; Y129-L271 HydrophobicContact CD2-CD2 4.04Å; Y129-L271 HydrophobicContact CE2-CD2 3.83Å; L132-L271 HydrophobicContact CB-CD1 3.76Å; L132-L271 HydrophobicContact CD1-CD1 3.51Å; L132-L271 HydrophobicContact CG-CD1 4.25Å; L149-L271 HydrophobicContact CD1-CB 4.27Å; F152-L271 HydrophobicContact CD1-CD1 4.1Å; F152-L271 HydrophobicContact CD1-CG 4.41Å; F152-L271 HydrophobicContact CD2-CD1 4.4Å; F152-L271 HydrophobicContact CE1-CB 4.41Å; F152-L271 HydrophobicContact CE1-CD1 3.77Å; F152-L271 HydrophobicContact CE1-CG 3.64Å; F152-L271 HydrophobicContact CE2-CD1 4.1Å; F152-L271 HydrophobicContact CE2-CG 4.38Å; F152-L271 HydrophobicContact CG-CD1 4.39Å; F152-L271 HydrophobicContact CZ-CD1 3.77Å; F152-L271 HydrophobicContact CZ-CD2 4.31Å; F152-L271 HydrophobicContact CZ-CG 3.62Å; V267-L271 WeakPolarHBondContact O-CB 3.32Å; V267-L271 PolarHBondContact O-N 3.39Å; F268-L271 PolarHBondContact O-N 2.88Å; L271-Y274 PolarHBondContact O-N 3.25Å; L271-L275 HydrophobicContact CD2-CD1 3.83Å; L271-L275 WeakPolarHBondContact O-CG 3.48Å; L271-L275 PolarHBondContact O-N 3.22Å |
| 272 | N | 93.9 | Very high | 88.8 | Confident | 24 Ų | 24 | 24.3 Ų | 24.3 | 13% | 0.128 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -68.8 | -47 | -178.8 | -59.7 | -15.3 | 0 | 0 | 0 | 111.6 | D249 F268 Y274 L275 D276 | D249-N272 WeakPolarHBondContact OD2-CB 3.5Å; F268-N272 VanDerWaalsContact CE1-ND2 3.33Å; F268-N272 WeakPolarHBondContact CE1-ND2 3.3Å; F268-N272 WeakPolarHBondContact CZ-ND2 3Å; F268-N272 PolarHBondContact O-N 2.97Å; N272-Y274 PolarHBondContact O-N 3.1Å; N272-L275 WeakPolarHBondContact O-CA 3.41Å; N272-L275 WeakPolarHBondContact O-CB 3.37Å; N272-L275 PolarHBondContact O-N 3.09Å; N272-D276 PolarHBondContact O-N 3.41Å |
| 273 | I | 95.4 | Very high | 90.3 | Very high | 1 Ų | 1 | 23.5 Ų | 23.5 | 1% | 0.005 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -58.8 | -37.6 | 177.7 | -64.7 | 171.3 | 0 | 0 | 0 | 111 | L87 L246 D249 L253 A269 I277 | L87-I273 HydrophobicContact CD1-CG2 4.08Å; L87-I273 HydrophobicContact CD2-CG2 3.49Å; L87-I273 VanDerWaalsContact CD2-CG2 3.49Å; L87-I273 HydrophobicContact CG-CG2 4.44Å; L246-I273 HydrophobicContact CD1-CG2 3.81Å; D249-I273 HydrophobicContact CB-CG1 3.85Å; L253-I273 HydrophobicContact CB-CD1 4.37Å; L253-I273 HydrophobicContact CD2-CD1 3.85Å; A269-I273 WeakPolarHBondContact O-CD1 3.33Å; A269-I273 VanDerWaalsContact O-CG1 3.29Å; A269-I273 WeakPolarHBondContact O-CG1 3.4Å; A269-I273 PolarHBondContact O-N 3.45Å; I273-I277 HydrophobicContact CG2-CD1 4.13Å; I273-I277 VanDerWaalsContact O-CG1 3.28Å; I273-I277 WeakPolarHBondContact O-CG1 3.47Å; I273-I277 PolarHBondContact O-N 2.74Å |
| 274 | Y | 97.1 | Very high | 92 | Very high | 0 Ų | 0 | 21.2 Ų | 21.2 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -65.9 | -45.4 | 173.7 | 172.6 | -107.3 | 0 | 0 | 0 | 112.2 | L87 Q90 L91 T94 F152 T153 L156 S157 T270 L271 N272 D276 I277 I278 | L87-Y274 HydrophobicContact CD1-CD2 4.44Å; Q90-Y274 HydrophobicContact CB-CD2 3.66Å; Q90-Y274 HydrophobicContact CB-CE2 3.73Å; Q90-Y274 HydrophobicContact CB-CG 4.36Å; L91-Y274 HydrophobicContact CD2-CD2 4.03Å; L91-Y274 HydrophobicContact CD2-CE2 4.32Å; T94-Y274 WeakPolarHBondContact OG1-CE2 3.45Å; T94-Y274 PolarHBondContact OG1-OH 3.29Å; F152-Y274 HydrophobicContact CD1-CD1 4.48Å; F152-Y274 HydrophobicContact CD1-CE1 4.42Å; F152-Y274 AromaticContact CE1-CD1 3.68Å; F152-Y274 HydrophobicContact CE1-CD1 3.68Å; F152-Y274 AromaticContact CE1-CE1 3.92Å; F152-Y274 HydrophobicContact CE1-CE1 3.92Å; F152-Y274 HydrophobicContact CZ-CD1 4.38Å; T153-Y274 HydrophobicContact CG2-CE2 4.45Å; T153-Y274 PolarHBondContact O-OH 3.41Å; L156-Y274 HydrophobicContact CB-CE1 4.25Å; L156-Y274 HydrophobicContact CD2-CD1 4.11Å; L156-Y274 HydrophobicContact CD2-CE1 3.49Å; L156-Y274 VanDerWaalsContact CD2-CE1 3.49Å; L156-Y274 HydrophobicContact CG-CE1 4.34Å; S157-Y274 PolarHBondContact OG-OH 3.44Å; S157-Y274 VanDerWaalsContact OG-OH 3.12Å; T270-Y274 VanDerWaalsContact O-CB 3.24Å; T270-Y274 WeakPolarHBondContact O-CB 3.36Å; T270-Y274 PolarHBondContact O-N 3.29Å; L271-Y274 PolarHBondContact O-N 3.25Å; N272-Y274 PolarHBondContact O-N 3.1Å; Y274-D276 VanDerWaalsContact C-N 3.34Å; Y274-D276 PolarHBondContact O-N 2.88Å; Y274-I277 PolarHBondContact O-N 3.16Å; Y274-I278 HydrophobicContact CD2-CG1 4.18Å; Y274-I278 HydrophobicContact CE1-CG1 4.39Å; Y274-I278 HydrophobicContact CE2-CD1 4.08Å; Y274-I278 HydrophobicContact CE2-CG1 3.79Å; Y274-I278 WeakPolarHBondContact O-CG1 3.39Å; Y274-I278 PolarHBondContact O-N 2.76Å; Y274-I278 VanDerWaalsContact O-N 3.09Å |
| 275 | L | 96.4 | Very high | 93.4 | Very high | 12 Ų | 12 | 15.9 Ų | 15.9 | 6% | 0.063 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -56.7 | -47.5 | 174.9 | -75.7 | 175.4 | 0 | 0 | 0 | 111.7 | F125 Y129 F152 L156 L271 N272 I277 I278 Y279 | F125-L275 HydrophobicContact CE2-CD2 3.91Å; F125-L275 HydrophobicContact CZ-CD2 3.91Å; Y129-L275 HydrophobicContact CD2-CD1 4Å; Y129-L275 HydrophobicContact CE2-CD1 3.51Å; F152-L275 HydrophobicContact CE2-CD2 4.23Å; F152-L275 HydrophobicContact CZ-CD1 4.16Å; F152-L275 HydrophobicContact CZ-CD2 3.65Å; F152-L275 HydrophobicContact CZ-CG 3.82Å; L156-L275 HydrophobicContact CD2-CD2 3.64Å; L271-L275 HydrophobicContact CD2-CD1 3.83Å; L271-L275 WeakPolarHBondContact O-CG 3.48Å; L271-L275 PolarHBondContact O-N 3.22Å; N272-L275 WeakPolarHBondContact O-CA 3.41Å; N272-L275 WeakPolarHBondContact O-CB 3.37Å; N272-L275 PolarHBondContact O-N 3.09Å; L275-I277 VanDerWaalsContact C-N 3.33Å; L275-I277 PolarHBondContact O-N 3.26Å; L275-I278 PolarHBondContact O-N 3.18Å; L275-Y279 HydrophobicContact CB-CD2 4.16Å; L275-Y279 HydrophobicContact CB-CE2 4.13Å; L275-Y279 HydrophobicContact CD2-CE2 3.88Å; L275-Y279 HydrophobicContact CG-CE2 4.48Å; L275-Y279 WeakPolarHBondContact O-CD2 3.4Å; L275-Y279 PolarHBondContact O-N 2.93Å |
| 276 | D | 96.6 | Very high | 94 | Very high | 7 Ų | 7 | 15.6 Ų | 15.6 | 4% | 0.037 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -56.8 | -47.6 | -179.9 | -69.6 | -18.5 | 0 | 0 | 0 | 111.6 | F242 F245 L246 N272 Y274 I278 Y279 I280 | F242-D276 HydrophobicContact CD1-CB 4.49Å; F242-D276 WeakPolarHBondContact CD1-OD1 3.48Å; F245-D276 WeakPolarHBondContact CB-OD1 3.26Å; F245-D276 WeakPolarHBondContact CB-OD2 3.36Å; L246-D276 VanDerWaalsContact CA-OD2 3.25Å; L246-D276 WeakPolarHBondContact CA-OD2 3.47Å; L246-D276 HydrophobicContact CB-CB 4.07Å; L246-D276 HydrophobicContact CD1-CB 4.31Å; L246-D276 PolarHBondContact N-OD2 2.97Å; N272-D276 PolarHBondContact O-N 3.41Å; Y274-D276 VanDerWaalsContact C-N 3.34Å; Y274-D276 PolarHBondContact O-N 2.88Å; D276-I278 VanDerWaalsContact C-N 3.34Å; D276-I278 PolarHBondContact O-N 3.26Å; D276-Y279 PolarHBondContact O-N 2.94Å; D276-I280 WeakPolarHBondContact O-CB 3.12Å; D276-I280 WeakPolarHBondContact O-CD1 3.39Å; D276-I280 WeakPolarHBondContact O-CG1 3.27Å; D276-I280 PolarHBondContact O-N 2.99Å |
| 277 | I | 96.9 | Very high | 94.2 | Very high | 21 Ų | 21 | 17.4 Ų | 17.4 | 11% | 0.108 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -63 | -41.3 | -180 | -64.1 | 169.5 | 0 | 0 | 0 | 111.2 | L87 L91 T179 C183 L246 I273 Y274 L275 F281 | L87-I277 HydrophobicContact CD1-CD1 4.32Å; L87-I277 HydrophobicContact CD2-CD1 4.22Å; L91-I277 HydrophobicContact CD1-CD1 3.92Å; L91-I277 HydrophobicContact CD2-CB 4.21Å; L91-I277 HydrophobicContact CD2-CD1 4.37Å; L91-I277 HydrophobicContact CD2-CG2 3.63Å; T179-I277 HydrophobicContact CG2-CG2 4.16Å; C183-I277 HydrophobicContact CB-CG1 4.41Å; L246-I277 HydrophobicContact CD1-CD1 4.4Å; L246-I277 HydrophobicContact CD1-CG1 4.04Å; L246-I277 HydrophobicContact CD2-CG1 4.39Å; I273-I277 HydrophobicContact CG2-CD1 4.13Å; I273-I277 VanDerWaalsContact O-CG1 3.28Å; I273-I277 WeakPolarHBondContact O-CG1 3.47Å; I273-I277 PolarHBondContact O-N 2.74Å; Y274-I277 PolarHBondContact O-N 3.16Å; L275-I277 VanDerWaalsContact C-N 3.33Å; L275-I277 PolarHBondContact O-N 3.26Å; I277-F281 PolarHBondContact O-N 2.73Å |
| 278 | I | 97.4 | Very high | 94.3 | Very high | 7 Ų | 7 | 22 Ų | 22 | 4% | 0.036 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -70.8 | -36.2 | 178.5 | -63.1 | -50.9 | 0 | 0 | 0 | 112.3 | L91 T94 L156 T160 Y274 L275 D276 F281 S282 | L91-I278 HydrophobicContact CD2-CD1 4.4Å; T94-I278 HydrophobicContact CG2-CD1 3.63Å; L156-I278 HydrophobicContact CD1-CG2 4.18Å; L156-I278 HydrophobicContact CD2-CB 4Å; L156-I278 HydrophobicContact CD2-CG1 4.03Å; L156-I278 HydrophobicContact CD2-CG2 3.84Å; L156-I278 HydrophobicContact CG-CG2 3.94Å; T160-I278 HydrophobicContact CG2-CG2 4.13Å; T160-I278 WeakPolarHBondContact OG1-CG2 3.22Å; Y274-I278 HydrophobicContact CD2-CG1 4.18Å; Y274-I278 HydrophobicContact CE1-CG1 4.39Å; Y274-I278 HydrophobicContact CE2-CD1 4.08Å; Y274-I278 HydrophobicContact CE2-CG1 3.79Å; Y274-I278 WeakPolarHBondContact O-CG1 3.39Å; Y274-I278 PolarHBondContact O-N 2.76Å; Y274-I278 VanDerWaalsContact O-N 3.09Å; L275-I278 PolarHBondContact O-N 3.18Å; D276-I278 VanDerWaalsContact C-N 3.34Å; D276-I278 PolarHBondContact O-N 3.26Å; I278-F281 PolarHBondContact O-N 3.14Å; I278-S282 WeakPolarHBondContact O-CB 3.48Å; I278-S282 PolarHBondContact O-N 2.87Å; I278-S282 PolarHBondContact O-OG 3.2Å |
| 279 | Y | 95.9 | Very high | 94.2 | Very high | 74 Ų | 74 | 20.4 Ų | 20.4 | 29% | 0.29 | 11% | 0.105 | S | C | . | . | H | α-helix | trans | -71.7 | -40.6 | 174.9 | -74.4 | -56.6 | 0 | 0 | 0 | 112.1 | F242 L275 D276 F281 S282 F283 | F242-Y279 HydrophobicContact CD1-CD2 4.01Å; F242-Y279 HydrophobicContact CD1-CG 4.25Å; F242-Y279 AromaticContact CE1-CD2 3.37Å; F242-Y279 HydrophobicContact CE1-CD2 3.37Å; F242-Y279 HydrophobicContact CE1-CE2 4.17Å; F242-Y279 AromaticContact CE1-CG 3.86Å; F242-Y279 HydrophobicContact CE1-CG 3.86Å; F242-Y279 HydrophobicContact CE2-CD2 4.44Å; F242-Y279 HydrophobicContact CE2-CG 4.2Å; F242-Y279 AromaticContact CZ-CD2 3.62Å; F242-Y279 HydrophobicContact CZ-CD2 3.62Å; F242-Y279 HydrophobicContact CZ-CE2 4.23Å; F242-Y279 AromaticContact CZ-CG 3.82Å; F242-Y279 HydrophobicContact CZ-CG 3.82Å; L275-Y279 HydrophobicContact CB-CD2 4.16Å; L275-Y279 HydrophobicContact CB-CE2 4.13Å; L275-Y279 HydrophobicContact CD2-CE2 3.88Å; L275-Y279 HydrophobicContact CG-CE2 4.48Å; L275-Y279 WeakPolarHBondContact O-CD2 3.4Å; L275-Y279 PolarHBondContact O-N 2.93Å; D276-Y279 PolarHBondContact O-N 2.94Å; Y279-F281 VanDerWaalsContact C-N 3.3Å; Y279-F281 PolarHBondContact O-N 3.45Å; Y279-S282 PolarHBondContact O-N 3.06Å; Y279-S282 VanDerWaalsContact O-N 3.13Å; Y279-F283 WeakPolarHBondContact O-CD2 3.44Å; Y279-F283 PolarHBondContact O-N 2.91Å |
| 280 | I | 96.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -54.8 | -48.1 | 170.9 | -68.5 | 162.7 | 0 | 0 | 0 | 110 | T179 F242 L246 D276 S282 F283 F284 | T179-I280 HydrophobicContact CG2-CB 4.44Å; T179-I280 HydrophobicContact CG2-CG2 4.03Å; F242-I280 HydrophobicContact CB-CG1 3.74Å; L246-I280 HydrophobicContact CB-CD1 4.26Å; L246-I280 HydrophobicContact CD2-CD1 3.94Å; D276-I280 WeakPolarHBondContact O-CB 3.12Å; D276-I280 WeakPolarHBondContact O-CD1 3.39Å; D276-I280 WeakPolarHBondContact O-CG1 3.27Å; D276-I280 PolarHBondContact O-N 2.99Å; I280-S282 PolarHBondContact O-N 3.23Å; I280-F283 PolarHBondContact O-N 2.85Å; I280-F284 HydrophobicContact CG2-CD2 3.66Å; I280-F284 HydrophobicContact CG2-CE2 3.29Å; I280-F284 HydrophobicContact CG2-CZ 4.11Å; I280-F284 WeakPolarHBondContact O-CD2 3.49Å; I280-F284 PolarHBondContact O-N 3.4Å |
| 281 | F | 97.1 | Very high | 93.2 | Very high | 6 Ų | 6 | 31.4 Ų | 31.4 | 3% | 0.026 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.9 | -45.9 | 175.3 | 172.9 | -114.6 | 0 | 0 | 0 | 112.6 | V98 T160 V172 C175 L176 T179 I277 I278 Y279 F283 F284 L285 | V98-F281 HydrophobicContact CG1-CZ 4.42Å; T160-F281 HydrophobicContact CG2-CD1 3.59Å; T160-F281 HydrophobicContact CG2-CE1 3.55Å; V172-F281 HydrophobicContact CG1-CZ 4.28Å; C175-F281 HydrophobicContact CB-CD2 4.19Å; C175-F281 HydrophobicContact CB-CE2 3.92Å; L176-F281 HydrophobicContact CB-CE2 4.43Å; L176-F281 HydrophobicContact CD2-CD2 3.85Å; L176-F281 HydrophobicContact CD2-CE1 4.49Å; L176-F281 HydrophobicContact CD2-CE2 3.49Å; L176-F281 VanDerWaalsContact CD2-CE2 3.49Å; L176-F281 HydrophobicContact CD2-CG 4.49Å; L176-F281 HydrophobicContact CD2-CZ 3.83Å; L176-F281 HydrophobicContact CG-CD2 4.27Å; L176-F281 HydrophobicContact CG-CE2 3.58Å; L176-F281 HydrophobicContact CG-CZ 4.08Å; T179-F281 HydrophobicContact CG2-CB 4.01Å; T179-F281 WeakPolarHBondContact OG1-CA 3.16Å; I277-F281 PolarHBondContact O-N 2.73Å; I278-F281 PolarHBondContact O-N 3.14Å; Y279-F281 VanDerWaalsContact C-N 3.3Å; Y279-F281 PolarHBondContact O-N 3.45Å; F281-F283 VanDerWaalsContact C-N 3.34Å; F281-F283 PolarHBondContact O-N 3.47Å; F281-F284 PolarHBondContact O-N 3.02Å; F281-L285 HydrophobicContact CD1-CD1 4.18Å; F281-L285 HydrophobicContact CD2-CG 4.38Å; F281-L285 HydrophobicContact CE1-CD1 3.49Å; F281-L285 VanDerWaalsContact CE1-CD1 3.49Å; F281-L285 HydrophobicContact CE1-CG 4.11Å; F281-L285 HydrophobicContact CE2-CD1 4.12Å; F281-L285 HydrophobicContact CE2-CD2 4.07Å; F281-L285 HydrophobicContact CE2-CG 3.85Å; F281-L285 HydrophobicContact CZ-CD1 3.47Å; F281-L285 VanDerWaalsContact CZ-CD1 3.47Å; F281-L285 HydrophobicContact CZ-CD2 4.02Å; F281-L285 HydrophobicContact CZ-CG 3.73Å; F281-L285 PolarHBondContact O-N 3.14Å |
| 282 | S | 94.9 | Very high | 92 | Very high | 24 Ų | 24 | 36 Ų | 36 | 17% | 0.168 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.5 | -37 | -179.3 | -58 | 0 | 0 | 0 | 0 | 112.3 | I278 Y279 I280 L285 S286 | I278-S282 WeakPolarHBondContact O-CB 3.48Å; I278-S282 PolarHBondContact O-N 2.87Å; I278-S282 PolarHBondContact O-OG 3.2Å; Y279-S282 PolarHBondContact O-N 3.06Å; Y279-S282 VanDerWaalsContact O-N 3.13Å; I280-S282 PolarHBondContact O-N 3.23Å; S282-L285 PolarHBondContact O-N 2.92Å; S282-S286 PolarHBondContact O-N 2.99Å |
| 283 | F | 95.4 | Very high | 90.5 | Very high | 31 Ų | 31 | 41.2 Ų | 41.2 | 14% | 0.136 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -72.4 | -36.2 | 174 | -75.1 | -61.6 | 0 | 0 | 0 | 112.7 | Y234 G238 A239 F242 Y279 I280 F281 S286 L287 | Y234-F283 HydrophobicContact CD1-CE1 4.3Å; Y234-F283 AromaticContact CE1-CE1 3.95Å; Y234-F283 HydrophobicContact CE1-CE1 3.95Å; G238-F283 VanDerWaalsContact C-CD2 3.47Å; A239-F283 HydrophobicContact CB-CB 3.83Å; F242-F283 HydrophobicContact CD2-CD2 4.02Å; F242-F283 AromaticContact CD2-CE2 3.49Å; F242-F283 HydrophobicContact CD2-CE2 3.49Å; F242-F283 VanDerWaalsContact CD2-CE2 3.49Å; F242-F283 AromaticContact CE2-CE2 3.61Å; F242-F283 HydrophobicContact CE2-CE2 3.61Å; F242-F283 HydrophobicContact CE2-CZ 4.36Å; Y279-F283 WeakPolarHBondContact O-CD2 3.44Å; Y279-F283 PolarHBondContact O-N 2.91Å; I280-F283 PolarHBondContact O-N 2.85Å; F281-F283 VanDerWaalsContact C-N 3.34Å; F281-F283 PolarHBondContact O-N 3.47Å; F283-S286 WeakPolarHBondContact O-CB 3.29Å; F283-S286 PolarHBondContact O-N 3.14Å; F283-L287 WeakPolarHBondContact O-CG 3.34Å; F283-L287 PolarHBondContact O-N 3.13Å |
| 284 | F | 94.9 | Very high | 88.2 | Confident | 21 Ų | 21 | 50.8 Ų | 50.8 | 9% | 0.092 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -67.2 | -36.1 | 171.2 | -71.5 | -38.3 | 0 | 0 | 0 | 112.7 | C175 I178 V182 A239 I280 F281 S286 L287 F288 | C175-F284 HydrophobicContact CB-CB 4.24Å; C175-F284 PolarHBondContact SG-O 3.44Å; C175-F284 VanDerWaalsContact SG-O 3.35Å; I178-F284 HydrophobicContact CG2-CD1 4.46Å; I178-F284 HydrophobicContact CG2-CD2 3.9Å; I178-F284 HydrophobicContact CG2-CE1 4.31Å; I178-F284 HydrophobicContact CG2-CE2 3.71Å; I178-F284 HydrophobicContact CG2-CG 4.28Å; I178-F284 HydrophobicContact CG2-CZ 3.95Å; V182-F284 HydrophobicContact CB-CE2 4.35Å; V182-F284 HydrophobicContact CG2-CE2 4.03Å; V182-F284 HydrophobicContact CG2-CZ 4.01Å; A239-F284 HydrophobicContact CB-CD1 4.24Å; A239-F284 HydrophobicContact CB-CE1 3.89Å; A239-F284 HydrophobicContact CB-CZ 4.36Å; I280-F284 HydrophobicContact CG2-CD2 3.66Å; I280-F284 HydrophobicContact CG2-CE2 3.29Å; I280-F284 HydrophobicContact CG2-CZ 4.11Å; I280-F284 WeakPolarHBondContact O-CD2 3.49Å; I280-F284 PolarHBondContact O-N 3.4Å; F281-F284 PolarHBondContact O-N 3.02Å; F284-S286 VanDerWaalsContact C-N 3.34Å; F284-L287 HydrophobicContact CD1-CD1 4.09Å; F284-L287 PolarHBondContact O-N 3.12Å; F284-F288 HydrophobicContact CB-CD2 4.26Å; F284-F288 HydrophobicContact CD1-CD2 4.17Å; F284-F288 AromaticContact CD1-CE2 3.69Å; F284-F288 HydrophobicContact CD1-CE2 3.69Å; F284-F288 HydrophobicContact CE1-CE2 4.28Å; F284-F288 HydrophobicContact CG-CE2 4.42Å; F284-F288 PolarHBondContact O-N 2.9Å |
| 285 | L | 92.9 | Very high | 87.8 | Confident | 0 Ų | 0 | 53.3 Ų | 53.3 | 0% | 0 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -60 | -43 | 168 | -77 | -178 | 0 | 0 | 0 | 111.6 | Y167 V172 C175 F281 S282 L287 G289 | Y167-L285 HydrophobicContact CD2-CB 4.27Å; Y167-L285 HydrophobicContact CD2-CD1 4.2Å; Y167-L285 HydrophobicContact CD2-CD2 4.28Å; Y167-L285 HydrophobicContact CE2-CB 4.05Å; Y167-L285 HydrophobicContact CE2-CD1 4.42Å; Y167-L285 HydrophobicContact CG-CD2 4.45Å; V172-L285 HydrophobicContact CB-CD2 4.38Å; V172-L285 HydrophobicContact CG2-CD2 3.97Å; C175-L285 HydrophobicContact CB-CD2 3.9Å; C175-L285 HydrophobicContact CB-CG 4.33Å; F281-L285 HydrophobicContact CD1-CD1 4.18Å; F281-L285 HydrophobicContact CD2-CG 4.38Å; F281-L285 HydrophobicContact CE1-CD1 3.49Å; F281-L285 VanDerWaalsContact CE1-CD1 3.49Å; F281-L285 HydrophobicContact CE1-CG 4.11Å; F281-L285 HydrophobicContact CE2-CD1 4.12Å; F281-L285 HydrophobicContact CE2-CD2 4.07Å; F281-L285 HydrophobicContact CE2-CG 3.85Å; F281-L285 HydrophobicContact CZ-CD1 3.47Å; F281-L285 VanDerWaalsContact CZ-CD1 3.47Å; F281-L285 HydrophobicContact CZ-CD2 4.02Å; F281-L285 HydrophobicContact CZ-CG 3.73Å; F281-L285 PolarHBondContact O-N 3.14Å; S282-L285 PolarHBondContact O-N 2.92Å; L285-L287 VanDerWaalsContact C-N 3.26Å; L285-L287 PolarHBondContact O-N 3.47Å; L285-G289 WeakPolarHBondContact O-CA 3.44Å; L285-G289 PolarHBondContact O-N 3.37Å |
| 286 | S | 90.9 | Very high | 87.4 | Confident | 26 Ų | 26 | 55.5 Ų | 55.5 | 18% | 0.182 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -63.2 | -29.5 | 176.7 | 179.3 | 0 | 0 | 0 | 0 | 113.5 | H231 S282 F283 F284 | H231-S286 PolarHBondContact CE1-OG 3.26Å; S282-S286 PolarHBondContact O-N 2.99Å; F283-S286 WeakPolarHBondContact O-CB 3.29Å; F283-S286 PolarHBondContact O-N 3.14Å; F284-S286 VanDerWaalsContact C-N 3.34Å |
| 287 | L | 90.2 | Very high | 86.8 | Confident | 55 Ų | 55 | 58.2 Ų | 58.2 | 29% | 0.288 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -86.8 | -46.1 | -179.7 | -77 | 168.7 | 0 | 0 | 0 | 114.8 | G232 A236 A239 F283 F284 L285 | G232-L287 VanDerWaalsContact O-CD2 3.23Å; G232-L287 WeakPolarHBondContact O-CD2 3.41Å; A236-L287 HydrophobicContact CB-CD1 4.43Å; A236-L287 HydrophobicContact CB-CD2 4.21Å; A239-L287 HydrophobicContact CB-CD1 4.48Å; F283-L287 WeakPolarHBondContact O-CG 3.34Å; F283-L287 PolarHBondContact O-N 3.13Å; F284-L287 HydrophobicContact CD1-CD1 4.09Å; F284-L287 PolarHBondContact O-N 3.12Å; L285-L287 VanDerWaalsContact C-N 3.26Å; L285-L287 PolarHBondContact O-N 3.47Å |
| 288 | F | 90.6 | Very high | 86.2 | Confident | 97 Ų | 97 | 60.4 Ų | 60.4 | 43% | 0.425 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -114.7 | -4.7 | -170.4 | -52.7 | -61.1 | 0 | 0 | 0 | 112.9 | S171 I178 F284 T290 | S171-F288 WeakPolarHBondContact CB-O 3.38Å; S171-F288 PolarHBondContact OG-O 2.86Å; I178-F288 HydrophobicContact CD1-CD2 4.11Å; I178-F288 HydrophobicContact CD1-CE2 4.21Å; F284-F288 HydrophobicContact CB-CD2 4.26Å; F284-F288 HydrophobicContact CD1-CD2 4.17Å; F284-F288 AromaticContact CD1-CE2 3.69Å; F284-F288 HydrophobicContact CD1-CE2 3.69Å; F284-F288 HydrophobicContact CE1-CE2 4.28Å; F284-F288 HydrophobicContact CG-CE2 4.42Å; F284-F288 PolarHBondContact O-N 2.9Å; F288-T290 PolarHBondContact O-N 2.81Å |
| 289 | G | 86.8 | Confident | 85.5 | Confident | 18 Ų | 18 | 63.7 Ų | 63.7 | 19% | 0.186 | 33% | 0.33 | C | S | . | . | trans | -68.7 | 114.2 | 172.4 | 0 | 0 | 0 | 0 | 0 | 111 | Y167 L285 | Y167-G289 VanDerWaalsContact CD1-CA 3.42Å; L285-G289 WeakPolarHBondContact O-CA 3.44Å; L285-G289 PolarHBondContact O-N 3.37Å | ||
| 290 | T | 84.6 | Confident | 84.9 | Confident | 88 Ų | 88 | 63 Ų | 63 | 54% | 0.54 | 33% | 0.333 | S | S | . | . | trans | -83.6 | 116.9 | 164.5 | -46.3 | 0 | 0 | 0 | 0 | 107.6 | N168 S171 F288 | N168-T290 PolarHBondContact N-O 3Å; N168-T290 PolarHBondContact ND2-O 2.87Å; S171-T290 PolarHBondContact OG-N 3.25Å; F288-T290 PolarHBondContact O-N 2.81Å | ||
| 291 | E | 79.4 | Confident | 84 | Confident | 147 Ų | 147 | 67.5 Ų | 67.5 | 69% | 0.687 | 36% | 0.356 | S | S | * | . | B | Isolated β-bridge | trans | -51.5 | 142.7 | 172 | -67.3 | -168.2 | 165.5 | 0 | 0 | 110.4 | N168 T293 | N168-E291 PolarHBondContact ND2-O 3.12Å; N168-E291 VanDerWaalsContact ND2-O 3.09Å; E291-T293 PolarHBondContact O-N 3.21Å |
| 292 | R | 68.2 | Low | 83 | Confident | 98 Ų | 98 | 72.2 Ų | 72.2 | 37% | 0.37 | 38% | 0.382 | S | S | . | . | trans | -81.8 | 100.2 | 178.9 | -171.1 | 179.8 | -177 | 99.4 | -10.8 | 109.9 | Y166 N294 | Y166-R292 PolarHBondContact O-N 2.71Å; Y166-R292 VanDerWaalsContact O-N 3.12Å; R292-N294 PolarHBondContact O-N 2.9Å | ||
| 293 | T | 61.5 | Low | 82 | Confident | 133 Ų | 133 | 76.3 Ų | 76.3 | 82% | 0.816 | 40% | 0.4 | S | S | * | . | trans | -61.3 | 117.8 | 159.1 | 1.4 | 0 | 0 | 0 | 0 | 108.6 | E291 | E291-T293 PolarHBondContact O-N 3.21Š| ||
| 294 | N | 48.6 | Very low | 80.8 | Confident | 201 Ų | 201 | 80.4 Ų | 80.4 | 100% | 1.075 | 42% | 0.424 | S | S | * | . | trans | -81.8 | 0 | 167.6 | -72.8 | -38.7 | 0 | 0 | 0 | 110.3 | R292 | R292-N294 PolarHBondContact O-N 2.9Š|
Retrieved 294 of 294 residues in 843.5 ms
(Link to these results)